A0A3Q0KR68_SCHMA Loading...

Septate junction protein

AlphaFold DB , UniProt , Accession A0A3Q0KR68, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,370 aa.

						>A0A3Q0KR68_SCHMA|A0A3Q0KR68
MKNYLCLLSILLSVNHALTQECDYFPYIPLGMTDRYNGIKDSQITASSSFSDQTMPYYGRLHISDAYLFNQDLQGAGAWISLDQDDKQWIQIDLLKRKVIQSIATQGRQGARQWIQDYYIYYTDSNEPIHWSIIKDDLGQPLLFDGNVDDNTVKFNNFTYPIVARYIRLNPQRWNNLISMRMELFGCDYRPFVAYMDGTSWIDLRLDLPGRATQTYVDEISFRFRTKEINGLILYGDSSQGDYLCVELYRGRLRVRVNLGTVPLSNEPTDNIVDAGSLLDDDQWHDVQIIREEKNLNISVDRIKVWRNISAIFVHMNMNRNLSIGGLPDYSNRRGISVNQNFIGCLEEFIFNGVHIIRDAQRSLMKLPQLLSDNQLEIPWEELLGYPKRSSFIWWGPPITQEKLNITGLTISGSGILGTECPSTVIDNTVLTFPDIQQYIVFLKIERNGGTNILQFEFDFRTLNKGGILFYHTVDKDNNYISFGMEDESGHLALEIILPGVYIIKYTVRNKDSAAINGTFADGLWHSVKFSMSQNLVILIIDNIKYTTVQNMTLPLYFDKVSYIGGGRPQRYSFQGCLRQIRINGIDVEWDKLDPATRHRSIINGSCMIQDRCNPNPCKHEAPCSQTGSTFYCDCTNTGYAGAVCHQSEYFTSCSEAGLFYALQQSTINITIDMDGSGVLEPIEVTCDFTDPNTVMTMLHHDAPDDVVVDGYQAPGSYRRKLNYGRADRETLGELVRRSIECDQSLTYQCWNAKLLQLPAGGGTTYENRAWGWWVSQDGRPQFYWGGGVPGLQKCACGVEGTCTGDSLTCNCDSDGSTTPPLVDTGLLQFKDHLPVMEVRFGDTGGINDDKRAIYRVGPLRCYGDTLFDNTVTFRKLDANLELPPLYSEFAFDMSFIFRTTITDAVIMQNNGRASKQFFEVRIRNGNSLRVAFNVGNGIQLTEVTTAHWLNDNRWHVVRFERNRKETRLIVDTQEPAVIIESSQRSFSVANNLEYSAAFTDGYVGCLSNLLINGVVQDMRGLVERGIYTYGLSAGCKPKCASNPCLNRGECVEYYSHYFCECGLTPYRGFICGRQIGGTFNSGPMVKIFLDRPKDRLGTVEEYIQVGFKTKSKRGILMEMRGEGESNYIIVKVNNNGGITIEFDVGFKRYEVTTNYDVDLTNDQHHMVYAWRTDLGTKWHLKVDDYNEVVEDFSNLLSPTADVRLDDPYVLYMGRNDTMQPADGFDGCIYAAQWNNIFPLHLIYEEPRNASVEMLPADSVREDLCGFIEILPEEEPVEIRPSPAIPTNITFPEITDDAEREKRIIAGVVSGVILILSVIILVLFCRHFTFEQGDYRTREAKGASRMKTADMAIQYGRTGQPEVQGKEWWI
					

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	33.1	Very low	37.4	Very low	243 Å²	243	151.3 Å²	151.3	100%	1.197	77%	0.772	S	S	*	*				0	20.2	0	-95.1	179.8	177.1	0	0	114.9
2	K	33.7	Very low	37.1	Very low	202 Å²	202	151.7 Å²	151.7	88%	0.878	78%	0.776	S	S	*	*			trans	-131.8	7.6	174.3	-101	-176.2	176.6	-177.6	0	116
3	N	38.7	Very low	36.6	Very low	150 Å²	150	147.7 Å²	147.7	80%	0.802	77%	0.77	S	S	*	*	S	Bend	trans	-119	16.5	-176.6	-72.8	4.9	0	0	0	114.9
4	Y	41.4	Very low	36.2	Very low	202 Å²	202	145.8 Å²	145.8	79%	0.792	77%	0.767	S	S	*	*	S	Bend	trans	-106.2	14.9	-179.6	-81.9	-76.7	0	0	0	114.7
5	L	39.9	Very low	35.8	Very low	157 Å²	157	144.7 Å²	144.7	82%	0.822	76%	0.762	S	S	*	*	S	Bend	trans	-108.8	-0.8	-178.6	-93.6	146	0	0	0	115.1
6	C	38.5	Very low	35.5	Very low	102 Å²	102	146.9 Å²	146.9	69%	0.689	77%	0.766	S	S	*	*	S	Bend	trans	-98.5	-5	176.3	-88	0	0	0	0	115.3
7	L	37.5	Very low	35.4	Very low	130 Å²	130	143.6 Å²	143.6	68%	0.681	77%	0.766	S	S	*	*	S	Bend	trans	-95.5	-12.1	179.7	-92.2	149.7	0	0	0	113.8
8	L	38.2	Very low	35.3	Very low	132 Å²	132	144.7 Å²	144.7	69%	0.691	77%	0.771	S	S	*	*	S	Bend	trans	-98.7	-13.6	-177.4	-105.5	128.7	0	0	0	114.7
9	S	39.2	Very low	35.2	Very low	79 Å²	79	141.9 Å²	141.9	55%	0.552	76%	0.76	S	S	*	*	S	Bend	trans	-86.3	-14.7	175	49	0	0	0	0	113.9	L11	S9-L11 VanDerWaalsContact C-N 3.33Å
10	I	36.2	Very low	35.2	Very low	120 Å²	120	140.9 Å²	140.9	62%	0.615	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-16	178.7	-60.4	174.9	0	0	0	111.7
11	L	34.6	Very low	35.4	Very low	147 Å²	147	137.7 Å²	137.7	77%	0.77	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	2.4	-176.5	-83.2	159.8	0	0	0	115.4	S9	S9-L11 VanDerWaalsContact C-N 3.33Å
12	L	34.4	Very low	35.9	Very low	156 Å²	156	127.8 Å²	127.8	82%	0.817	69%	0.685	S	S	*	*	S	Bend	trans	-122.3	13.1	-176.9	-82.1	162.6	0	0	0	115.6
13	S	30.9	Very low	36.4	Very low	100 Å²	100	124.6 Å²	124.6	70%	0.699	68%	0.678	S	S	*	*			trans	-139	57.1	171.4	66.3	0	0	0	0	112.2
14	V	30.6	Very low	36.2	Very low	121 Å²	121	127.1 Å²	127.1	73%	0.733	68%	0.678	S	S	*	*			trans	-120.8	78.4	162	-174.9	0	0	0	0	106.5
15	N	30.7	Very low	36.3	Very low	129 Å²	129	126 Å²	126	69%	0.69	68%	0.677	S	S	*	*			trans	-158.9	53.9	167.9	-99.7	-16.5	0	0	0	109.3
16	H	30.2	Very low	36.9	Very low	180 Å²	180	123.1 Å²	123.1	83%	0.833	67%	0.668	S	S	*	*			trans	-131.7	91.2	162.8	-86.4	-6.3	0	0	0	108	L18	H16-L18 PolarHBondContact O-N 2.66Å
17	A	33.4	Very low	38.1	Very low	92 Å²	92	123.9 Å²	123.9	76%	0.76	66%	0.657	S	S	*	*			trans	-63.1	102.7	160.6	0	0	0	0	0	107.2	T19	A17-T19 PolarHBondContact O-N 3.03Å
18	L	34	Very low	40.1	Very low	162 Å²	162	120.5 Å²	120.5	85%	0.848	64%	0.639	S	S	*	*			trans	-65.4	111.7	170.2	-82.5	151.5	0	0	0	108.1	H16 Q20	H16-L18 PolarHBondContact O-N 2.66Å; L18-Q20 PolarHBondContact O-N 3.14Å
19	T	32.9	Very low	42.4	Very low	93 Å²	93	117.4 Å²	117.4	57%	0.571	63%	0.627	S	S	*	*			trans	-78	104.6	169.1	53.9	0	0	0	0	108.3	A17	A17-T19 PolarHBondContact O-N 3.03Å
20	Q	36	Very low	44.8	Very low	121 Å²	121	114.5 Å²	114.5	57%	0.565	61%	0.605	S	S	*	*			trans	-109.5	129.4	-180	-165.4	168.2	-6.9	0	0	109.5	L18 I28	L18-Q20 PolarHBondContact O-N 3.14Å; Q20-I28 HydrophobicContact CB-CD1 4.44Å
21	E	39.9	Very low	47.2	Very low	73 Å²	73	109.1 Å²	109.1	34%	0.341	58%	0.58	S	S	.	*			trans	-73.6	155.2	-179.2	-77.9	172.3	174.6	0	0	112.6	D23 P387	E21-D23 VanDerWaalsContact C-N 3.29Å; E21-D23 PolarHBondContact O-N 3.3Å; E21-D23 VanDerWaalsContact O-N 3.16Å; E21-P387 WeakPolarHBondContact OE2-CB 3.42Å; E21-P387 WeakPolarHBondContact OE2-CD 3.07Å; E21-P387 VanDerWaalsContact OE2-CG 3.32Å; E21-P387 WeakPolarHBondContact OE2-CG 3.2Å
22	C	42.1	Very low	49.7	Very low	35 Å²	35	102.1 Å²	102.1	24%	0.236	54%	0.543	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	11.3	-167.7	-83	0	0	0	0	116.8	C187	C22-C187 HydrophobicContact CB-CB 4.15Å; C22-C187 WeakPolarHBondContact CB-SG 3.16Å; C22-C187 PolarHBondContact N-SG 2.8Å; C22-C187 VanDerWaalsContact N-SG 3.4Å; C22-C187 WeakPolarHBondContact SG-CB 3.26Å; C22-C187 CovalentContact SG-SG 2Å; C22-C187 PolarHBondContact SG-SG 2.84Å
23	D	44.8	Very low	52	Low	136 Å²	136	98.4 Å²	98.4	73%	0.727	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-27.2	-165.1	-80.7	-7.1	0	0	0	115.4	E21	E21-D23 VanDerWaalsContact C-N 3.29Å; E21-D23 PolarHBondContact O-N 3.3Å; E21-D23 VanDerWaalsContact O-N 3.16Å
24	Y	35.5	Very low	54.2	Low	203 Å²	203	96.7 Å²	96.7	80%	0.796	51%	0.509	S	S	*	.	S	Bend	trans	-157.4	117.9	175.8	-88.6	-88.2	0	0	0	112.4
25	F	43	Very low	55.8	Low	178 Å²	178	96.6 Å²	96.6	78%	0.781	50%	0.496	S	S	*	.	S	Bend	trans	73.9	162.2	173.9	-72.4	-88.1	0	0	0	119.8
26	P	52.7	Low	57.5	Low	97 Å²	97	99.8 Å²	99.8	63%	0.63	50%	0.5	S	S	*	.				-88.3	166.1	-82.5	37.3	-24	0	0	0	112.5	I28	P26-I28 VanDerWaalsContact O-CG1 3.26Å; P26-I28 WeakPolarHBondContact O-CG1 3.26Å; P26-I28 PolarHBondContact O-N 2.76Å
27	Y	64.2	Low	59.5	Low	118 Å²	118	96.3 Å²	96.3	46%	0.463	49%	0.487	S	S	.	.			trans	-29.5	97.9	178.4	-54.4	-77.8	0	0	0	114.4	P29 S102 N157 F185	Y27-P29 WeakPolarHBondContact O-CD 3.45Å; Y27-S102 WeakPolarHBondContact CD1-OG 3.18Å; Y27-N157 WeakPolarHBondContact CE1-OD1 3.44Å; Y27-N157 PolarHBondContact OH-ND2 2.86Å; Y27-F185 HydrophobicContact CD1-CB 4.42Å; Y27-F185 WeakPolarHBondContact O-CD1 3.49Å
28	I	78.7	Confident	61.8	Low	59 Å²	59	93 Å²	93	30%	0.303	46%	0.462	S	S	.	.			trans	-85.4	116	-178.1	-56.3	177.6	0	0	0	108	Q20 P26 L30 F185 G186	Q20-I28 HydrophobicContact CB-CD1 4.44Å; P26-I28 VanDerWaalsContact O-CG1 3.26Å; P26-I28 WeakPolarHBondContact O-CG1 3.26Å; P26-I28 PolarHBondContact O-N 2.76Å; I28-L30 PolarHBondContact O-N 3.15Å; I28-F185 CarbonylContact O-C 3.41Å; I28-F185 WeakPolarHBondContact O-CA 3.36Å; I28-G186 WeakPolarHBondContact CB-O 3.43Å; I28-G186 PolarHBondContact O-N 2.9Å
29	P	86.5	Confident	64.5	Low	67 Å²	67	85.5 Å²	85.5	44%	0.435	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-62.6	132	176.1	25.6	-32.7	0	0	0	109.9	Y27 G31 E183 L184 F185	Y27-P29 WeakPolarHBondContact O-CD 3.45Å; P29-G31 PolarHBondContact O-N 3.16Å; P29-E183 HydrophobicContact CB-CG 3.95Å; P29-L184 CarbonylContact C-O 3.59Å; P29-L184 WeakPolarHBondContact CA-O 3.46Å; P29-F185 HydrophobicContact CB-CD1 4.11Å; P29-F185 HydrophobicContact CB-CE1 3.93Å
30	L	89.2	Confident	67.3	Low	17 Å²	17	86.7 Å²	86.7	9%	0.089	42%	0.42	C	S	.	.			trans	-75	-11.5	177.6	-66.6	-174.9	0	0	0	112.4	I28 I39 L94 K98 I100 L184 G186	I28-L30 PolarHBondContact O-N 3.15Å; L30-I39 HydrophobicContact CB-CD1 4.26Å; L30-L94 HydrophobicContact CD1-CD1 4.27Å; L30-L94 HydrophobicContact CD1-CD2 4.09Å; L30-K98 HydrophobicContact CD1-CD 3.88Å; L30-K98 HydrophobicContact CD2-CD 3.82Å; L30-K98 HydrophobicContact CG-CD 4.41Å; L30-I100 HydrophobicContact CD1-CG1 4.32Å; L30-L184 HydrophobicContact CB-CB 4.2Å; L30-L184 HydrophobicContact CD1-CB 3.85Å; L30-L184 HydrophobicContact CD1-CD1 4.43Å; L30-L184 HydrophobicContact CG-CB 4.22Å; L30-L184 PolarHBondContact N-O 2.82Å; L30-G186 WeakPolarHBondContact CD2-O 3.39Å
31	G	86.8	Confident	69.9	Low	8 Å²	8	83 Å²	83	8%	0.082	40%	0.404	C	S	.	.	S	Bend	trans	109.4	36.8	164.1	0	0	0	0	0	114.1	P29 T33 D34 I39 E183	P29-G31 PolarHBondContact O-N 3.16Å; G31-T33 VanDerWaalsContact C-N 3.28Å; G31-D34 PolarHBondContact O-N 3.12Å; G31-I39 PolarHBondContact O-N 3.16Å; G31-E183 PolarHBondContact N-OE1 2.76Å
32	M	86.3	Confident	72.3	Confident	0 Å²	0	84.5 Å²	84.5	0%	0	42%	0.422	C	S	.	.	S	Bend	trans	-64.2	-34.9	165.8	-71.4	-69.9	-76.1	0	0	111.3	I39 I44 R60 I92 M182 E183	M32-I39 HydrophobicContact CG-CD1 3.76Å; M32-I39 HydrophobicContact SD-CB 4.09Å; M32-I39 HydrophobicContact SD-CD1 3.74Å; M32-I39 HydrophobicContact SD-CG2 3.89Å; M32-I44 HydrophobicContact CE-CD1 3.66Å; M32-I44 HydrophobicContact CE-CG1 4.27Å; M32-I44 HydrophobicContact SD-CD1 3.75Å; M32-I44 HydrophobicContact SD-CG1 4.15Å; M32-R60 HydrophobicContact CE-CG 4.12Å; M32-R60 WeakPolarHBondContact O-CD 3.3Å; M32-R60 WeakPolarHBondContact O-CG 3.46Å; M32-R60 PolarHBondContact O-NH1 3.46Å; M32-I92 HydrophobicContact CE-CD1 3.78Å; M32-I92 HydrophobicContact CE-CG1 4.28Å; M32-I92 HydrophobicContact CG-CD1 4.06Å; M32-I92 HydrophobicContact SD-CD1 3.42Å; M32-I92 WeakPolarHBondContact SD-CD1 3.31Å; M32-I92 HydrophobicContact SD-CG1 3.95Å; M32-M182 WeakPolarHBondContact CB-O 3.45Å; M32-M182 HydrophobicContact CE-CG 3.86Å; M32-E183 WeakPolarHBondContact CA-OE2 3.46Å; M32-E183 HydrophobicContact CB-CB 4.44Å; M32-E183 WeakPolarHBondContact CB-OE1 3.38Å; M32-E183 WeakPolarHBondContact CB-OE2 3.23Å; M32-E183 WeakPolarHBondContact CG-OE1 3.17Å; M32-E183 VanDerWaalsContact N-CD 3.32Å; M32-E183 PolarHBondContact N-OE1 2.8Å; M32-E183 PolarHBondContact N-OE2 2.83Å
33	T	83	Confident	74.8	Confident	77 Å²	77	83.6 Å²	83.6	47%	0.472	42%	0.415	S	S	.	.	S	Bend	trans	-78.7	-25.6	176.7	57.5	0	0	0	0	113.6	G31 R35 L61 E183	G31-T33 VanDerWaalsContact C-N 3.28Å; T33-R35 PolarHBondContact O-N 2.85Å; T33-L61 HydrophobicContact CG2-CB 3.98Å; T33-L61 WeakPolarHBondContact CG2-O 3.29Å; T33-E183 PolarHBondContact N-OE2 2.8Å; T33-E183 PolarHBondContact OG1-OE2 3.08Å
34	D	77.4	Confident	77.2	Confident	64 Å²	64	77.4 Å²	77.4	34%	0.342	38%	0.382	S	S	.	.			trans	-88.6	84	176	-170.4	-15.4	0	0	0	110.9	G31 Y36 N37 G38	G31-D34 PolarHBondContact O-N 3.12Å; D34-Y36 PolarHBondContact O-N 2.97Å; D34-Y36 VanDerWaalsContact O-N 3.13Å; D34-Y36 PolarHBondContact OD1-N 2.87Å; D34-Y36 VanDerWaalsContact OD1-N 3.17Å; D34-N37 PolarHBondContact OD1-N 3.46Å; D34-N37 WeakPolarHBondContact OD2-CB 3.25Å; D34-G38 WeakPolarHBondContact O-CA 3.11Å; D34-G38 PolarHBondContact O-N 2.96Å
35	R	65.4	Low	80.1	Confident	120 Å²	120	70.6 Å²	70.6	45%	0.453	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.1	-178.6	-166.2	177.4	-176.2	-166.8	1	113.8	T33 D41	T33-R35 PolarHBondContact O-N 2.85Å; R35-D41 IonicContact CZ-OD1 3.61Å; R35-D41 IonicContact CZ-OD2 3.9Å; R35-D41 VanDerWaalsContact CZ-OD2 3.22Å; R35-D41 IonicContact NE-OD1 3.93Å; R35-D41 PolarHBondContact NE-OD1 3.19Å; R35-D41 VanDerWaalsContact NE-OD1 3.15Å; R35-D41 IonicContact NE-OD2 2.78Å; R35-D41 PolarHBondContact NE-OD2 3.2Å; R35-D41 IonicContact NH2-OD2 3.71Å; R35-D41 PolarHBondContact NH2-OD2 3.23Å
36	Y	66	Low	82.6	Confident	196 Å²	196	63.1 Å²	63.1	77%	0.769	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-43.5	-173.1	-64.3	-74.7	0	0	0	113	D34	D34-Y36 PolarHBondContact O-N 2.97Å; D34-Y36 VanDerWaalsContact O-N 3.13Å; D34-Y36 PolarHBondContact OD1-N 2.87Å; D34-Y36 VanDerWaalsContact OD1-N 3.17Å
37	N	72	Confident	84.6	Confident	107 Å²	107	60.5 Å²	60.5	57%	0.572	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	-10.8	-178.3	-51.3	-52.9	0	0	0	113.8	D34	D34-N37 PolarHBondContact OD1-N 3.46Å; D34-N37 WeakPolarHBondContact OD2-CB 3.25Å
38	G	82.7	Confident	86.1	Confident	21 Å²	21	55.8 Å²	55.8	22%	0.216	30%	0.3	C	S	.	.	S	Bend	trans	-96.8	-132.6	178.4	0	0	0	0	0	113.4	D34 K40	D34-G38 WeakPolarHBondContact O-CA 3.11Å; D34-G38 PolarHBondContact O-N 2.96Å; G38-K40 PolarHBondContact O-N 3.14Å
39	I	90.6	Very high	86.8	Confident	5 Å²	5	54.7 Å²	54.7	3%	0.026	30%	0.298	C	S	.	.	S	Bend	trans	-78.4	116.2	-178.6	-64.5	164.8	0	0	0	109	L30 G31 M32 Q43 I44 R60 I92 L94	L30-I39 HydrophobicContact CB-CD1 4.26Å; G31-I39 PolarHBondContact O-N 3.16Å; M32-I39 HydrophobicContact CG-CD1 3.76Å; M32-I39 HydrophobicContact SD-CB 4.09Å; M32-I39 HydrophobicContact SD-CD1 3.74Å; M32-I39 HydrophobicContact SD-CG2 3.89Å; I39-Q43 HydrophobicContact CG2-CB 3.78Å; I39-I44 HydrophobicContact CG2-CD1 4.18Å; I39-I44 HydrophobicContact CG2-CG1 3.81Å; I39-R60 VanDerWaalsContact O-CZ 3.26Å; I39-R60 PolarHBondContact O-NH1 3.21Å; I39-R60 PolarHBondContact O-NH2 3.45Å; I39-I92 HydrophobicContact CD1-CG2 3.9Å; I39-I92 HydrophobicContact CG1-CG2 4.44Å; I39-I92 HydrophobicContact CG2-CG2 3.86Å; I39-L94 HydrophobicContact CD1-CD2 3.96Å; I39-L94 HydrophobicContact CG1-CD2 4.44Å
40	K	90.7	Very high	87	Confident	118 Å²	118	57.4 Å²	57.4	51%	0.513	30%	0.303	S	S	.	.			trans	-73.9	158.2	-179.6	-61.6	177.2	-178.1	176.3	0	111.9	G38 S42 Q43	G38-K40 PolarHBondContact O-N 3.14Å; K40-S42 PolarHBondContact O-N 3.43Å; K40-Q43 HydrophobicContact CB-CG 4.46Å; K40-Q43 VanDerWaalsContact O-CB 3.32Å; K40-Q43 WeakPolarHBondContact O-CB 3.18Å; K40-Q43 PolarHBondContact O-N 3.23Å
41	D	89.9	Confident	87.1	Confident	44 Å²	44	58.8 Å²	58.8	24%	0.235	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-58.4	-35.9	179.4	-63.7	-13.4	0	0	0	112.6	R35 Q43 I44 Y57 R60	R35-D41 IonicContact CZ-OD1 3.61Å; R35-D41 IonicContact CZ-OD2 3.9Å; R35-D41 VanDerWaalsContact CZ-OD2 3.22Å; R35-D41 IonicContact NE-OD1 3.93Å; R35-D41 PolarHBondContact NE-OD1 3.19Å; R35-D41 VanDerWaalsContact NE-OD1 3.15Å; R35-D41 IonicContact NE-OD2 2.78Å; R35-D41 PolarHBondContact NE-OD2 3.2Å; R35-D41 IonicContact NH2-OD2 3.71Å; R35-D41 PolarHBondContact NH2-OD2 3.23Å; D41-Q43 PolarHBondContact O-N 3.4Å; D41-I44 PolarHBondContact O-N 2.66Å; D41-I44 VanDerWaalsContact O-N 3.09Å; D41-Y57 HydrophobicContact CB-CD1 4.21Å; D41-Y57 HydrophobicContact CB-CG 4.05Å; D41-R60 IonicContact OD1-CZ 2.81Å; D41-R60 IonicContact OD1-NE 2.67Å; D41-R60 IonicContact OD1-NH2 3.39Å; D41-R60 PolarHBondContact OD1-NH2 2.83Å
42	S	91.6	Very high	87	Confident	104 Å²	104	64.4 Å²	64.4	73%	0.727	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-65.6	-15.6	177.3	60.6	0	0	0	0	114	K40	K40-S42 PolarHBondContact O-N 3.43Å
43	Q	94.7	Very high	87	Confident	16 Å²	16	68.8 Å²	68.8	8%	0.075	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-87.6	-11.8	176.8	-67.9	171	-105.7	0	0	112.2	I39 K40 D41 I92 D93 L95	I39-Q43 HydrophobicContact CG2-CB 3.78Å; K40-Q43 HydrophobicContact CB-CG 4.46Å; K40-Q43 VanDerWaalsContact O-CB 3.32Å; K40-Q43 WeakPolarHBondContact O-CB 3.18Å; K40-Q43 PolarHBondContact O-N 3.23Å; D41-Q43 PolarHBondContact O-N 3.4Å; Q43-I92 CarbonylContact O-C 3.58Å; Q43-I92 WeakPolarHBondContact O-CA 3.07Å; Q43-D93 VanDerWaalsContact CB-O 3.32Å; Q43-D93 WeakPolarHBondContact CB-O 3.36Å; Q43-D93 WeakPolarHBondContact CG-O 3.37Å; Q43-D93 PolarHBondContact NE2-O 2.99Å; Q43-D93 PolarHBondContact O-N 2.87Å; Q43-L95 HydrophobicContact CG-CD1 4.27Å; Q43-L95 HydrophobicContact CG-CD2 4.25Å; Q43-L95 HydrophobicContact CG-CG 4.18Å
44	I	95.1	Very high	87.4	Confident	7 Å²	7	65.4 Å²	65.4	4%	0.036	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	117.7	-175.6	-47.5	168.7	0	0	0	109.1	M32 I39 D41 P56 R60 I90 Q91 I92	M32-I44 HydrophobicContact CE-CD1 3.66Å; M32-I44 HydrophobicContact CE-CG1 4.27Å; M32-I44 HydrophobicContact SD-CD1 3.75Å; M32-I44 HydrophobicContact SD-CG1 4.15Å; I39-I44 HydrophobicContact CG2-CD1 4.18Å; I39-I44 HydrophobicContact CG2-CG1 3.81Å; D41-I44 PolarHBondContact O-N 2.66Å; D41-I44 VanDerWaalsContact O-N 3.09Å; I44-P56 HydrophobicContact CB-CB 4.5Å; I44-P56 HydrophobicContact CG2-CB 3.78Å; I44-P56 WeakPolarHBondContact CG2-O 3.4Å; I44-R60 HydrophobicContact CD1-CG 4.37Å; I44-R60 VanDerWaalsContact CD1-CZ 3.44Å; I44-I90 HydrophobicContact CG2-CD1 4.14Å; I44-I90 HydrophobicContact CG2-CG1 4.2Å; I44-Q91 WeakPolarHBondContact CA-O 3.3Å; I44-I92 HydrophobicContact CG1-CG1 4.49Å
45	T	95.8	Very high	88.2	Confident	59 Å²	59	64.9 Å²	64.9	36%	0.362	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	163.4	-178.6	55.1	0	0	0	0	110.3	I90 Q91	T45-I90 CarbonylContact O-C 3.56Å; T45-Q91 PolarHBondContact N-O 2.79Å; T45-Q91 PolarHBondContact O-N 2.81Å
46	A	96.3	Very high	89.6	Confident	22 Å²	22	59.6 Å²	59.6	18%	0.182	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	162.5	174.6	0	0	0	0	0	110.9	S48 P56 W79 W89 I90	A46-S48 VanDerWaalsContact C-N 3.3Å; A46-S48 PolarHBondContact O-N 3.42Å; A46-P56 HydrophobicContact CB-CB 3.98Å; A46-P56 HydrophobicContact CB-CG 3.41Å; A46-P56 VanDerWaalsContact CB-CG 3.41Å; A46-W79 HydrophobicContact CB-CZ2 4Å; A46-W89 VanDerWaalsContact C-CH2 3.45Å; A46-W89 CarbonylContact C-O 3.54Å; A46-W89 VanDerWaalsContact CA-O 3.22Å; A46-W89 WeakPolarHBondContact CA-O 3.33Å; A46-W89 VanDerWaalsContact CB-O 3.22Å; A46-W89 WeakPolarHBondContact CB-O 3.27Å; A46-I90 HydrophobicContact CB-CB 4.41Å
47	S	94.3	Very high	90.8	Very high	42 Å²	42	53 Å²	53	29%	0.294	29%	0.294	S	S	.	.	S	Bend	trans	-49.7	-48	168.1	46.9	0	0	0	0	113.1	Q88 W89	S47-Q88 WeakPolarHBondContact OG-CA 3.27Å; S47-Q88 PolarHBondContact OG-OE1 2.86Å; S47-Q88 VanDerWaalsContact OG-OE1 3.1Å; S47-W89 PolarHBondContact N-O 3.16Å; S47-W89 PolarHBondContact OG-N 2.96Å; S47-W89 PolarHBondContact OG-O 3.05Å
48	S	95.1	Very high	91.8	Very high	18 Å²	18	49.3 Å²	49.3	13%	0.126	27%	0.272	C	S	.	.			trans	-157.6	164	-179.2	71.8	0	0	0	0	110.6	A46 W79 L82 Q88	A46-S48 VanDerWaalsContact C-N 3.3Å; A46-S48 PolarHBondContact O-N 3.42Å; S48-W79 PolarHBondContact O-NE1 3.28Å; S48-L82 PolarHBondContact OG-N 2.87Å; S48-Q88 PolarHBondContact OG-OE1 2.97Å
49	S	93.7	Very high	92.3	Very high	37 Å²	37	48.3 Å²	48.3	26%	0.259	26%	0.262	S	S	.	.			trans	-137.4	135.1	172.3	51.3	0	0	0	0	110	S51 M55 I80	S49-S51 VanDerWaalsContact C-N 3.32Å; S49-S51 PolarHBondContact O-N 2.72Å; S49-M55 PolarHBondContact OG-SD 3.12Å; S49-I80 WeakPolarHBondContact CA-O 3.37Å
50	F	90.9	Very high	92.4	Very high	123 Å²	123	48.5 Å²	48.5	54%	0.539	26%	0.262	S	S	.	.	S	Bend	trans	-63.4	-36.5	-178.8	-171.9	-92.5	0	0	0	112.9	T54 I80 L82	F50-T54 PolarHBondContact N-OG1 2.62Å; F50-I80 HydrophobicContact CB-CB 4.23Å; F50-I80 HydrophobicContact CB-CG2 4.15Å; F50-I80 PolarHBondContact N-O 3.44Å; F50-L82 HydrophobicContact CD2-CD1 4.28Å
51	S	90	Very high	92.5	Very high	46 Å²	46	43.3 Å²	43.3	32%	0.322	24%	0.24	S	C	.	.	S	Bend	trans	-158.2	175.3	172.6	69.2	0	0	0	0	112	S49 Q53 T54 M55	S49-S51 VanDerWaalsContact C-N 3.32Å; S49-S51 PolarHBondContact O-N 2.72Å; S51-Q53 PolarHBondContact O-N 3.19Å; S51-Q53 VanDerWaalsContact O-N 3.11Å; S51-Q53 PolarHBondContact OG-N 3.33Å; S51-T54 PolarHBondContact N-OG1 2.68Å; S51-T54 PolarHBondContact O-N 3.12Å; S51-T54 PolarHBondContact O-OG1 3.09Å; S51-T54 VanDerWaalsContact O-OG1 3.12Å; S51-M55 PolarHBondContact O-N 3.34Å
52	D	85.4	Confident	92.4	Very high	126 Å²	126	46.8 Å²	46.8	67%	0.674	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-57.8	-22.8	172.8	-63.9	-23.5	0	0	0	113	M55 Y58	D52-M55 VanDerWaalsContact O-CG 3.26Å; D52-M55 WeakPolarHBondContact O-CG 3.33Å; D52-Y58 WeakPolarHBondContact O-CE2 3.37Å
53	Q	86.5	Confident	92	Very high	93 Å²	93	44.1 Å²	44.1	44%	0.435	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-85.5	-9.1	177.8	-61.6	-170.8	-13.7	0	0	113.7	S51 Y58 Q74 A76	S51-Q53 PolarHBondContact O-N 3.19Å; S51-Q53 VanDerWaalsContact O-N 3.11Å; S51-Q53 PolarHBondContact OG-N 3.33Å; Q53-Y58 VanDerWaalsContact O-CD2 3.31Å; Q53-Y58 WeakPolarHBondContact O-CD2 3.26Å; Q53-Y58 WeakPolarHBondContact O-CE2 3.3Å; Q53-Q74 HydrophobicContact CG-CB 4.41Å; Q53-A76 HydrophobicContact CB-CB 4.37Å; Q53-A76 WeakPolarHBondContact O-CB 3.38Å; Q53-A76 PolarHBondContact O-N 2.67Å
54	T	92	Very high	90.7	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.031	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-122.6	22.3	-177.9	66.6	0	0	0	0	111.3	F50 S51 A76 I80	F50-T54 PolarHBondContact N-OG1 2.62Å; S51-T54 PolarHBondContact N-OG1 2.68Å; S51-T54 PolarHBondContact O-N 3.12Å; S51-T54 PolarHBondContact O-OG1 3.09Å; S51-T54 VanDerWaalsContact O-OG1 3.12Å; T54-A76 HydrophobicContact CG2-CB 3.69Å; T54-I80 HydrophobicContact CG2-CB 3.93Å; T54-I80 HydrophobicContact CG2-CD1 3.56Å; T54-I80 HydrophobicContact CG2-CG1 3.68Å; T54-I80 PolarHBondContact O-N 2.75Å
55	M	93.7	Very high	89	Confident	53 Å²	53	47 Å²	47	26%	0.261	25%	0.251	S	S	.	.			trans	-55.9	158.2	176.7	-70.8	-65.5	-82.3	0	0	112.1	S49 S51 D52 Y57 Y58	S49-M55 PolarHBondContact OG-SD 3.12Å; S51-M55 PolarHBondContact O-N 3.34Å; D52-M55 VanDerWaalsContact O-CG 3.26Å; D52-M55 WeakPolarHBondContact O-CG 3.33Å; M55-Y57 HydrophobicContact CB-CD1 3.82Å; M55-Y57 HydrophobicContact CB-CE1 3.28Å; M55-Y57 HydrophobicContact CB-CE2 4.18Å; M55-Y57 HydrophobicContact CB-CG 4.45Å; M55-Y57 VanDerWaalsContact CB-CZ 3.47Å; M55-Y57 HydrophobicContact CE-CE1 4.37Å; M55-Y57 HydrophobicContact CG-CE1 3.9Å; M55-Y57 PolarHBondContact O-N 2.79Å; M55-Y57 VanDerWaalsContact O-N 3.1Å; M55-Y58 HydrophobicContact CB-CD2 4.04Å; M55-Y58 HydrophobicContact CB-CE2 4.17Å; M55-Y58 WeakPolarHBondContact O-CB 3.44Å; M55-Y58 PolarHBondContact O-N 2.82Å
56	P	94.5	Very high	87.2	Confident	10 Å²	10	45.1 Å²	45.1	7%	0.065	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-58	-32	-172.2	-26.7	37.5	0	0	0	114.1	I44 A46 Y58 G59 I90	I44-P56 HydrophobicContact CB-CB 4.5Å; I44-P56 HydrophobicContact CG2-CB 3.78Å; I44-P56 WeakPolarHBondContact CG2-O 3.4Å; A46-P56 HydrophobicContact CB-CB 3.98Å; A46-P56 HydrophobicContact CB-CG 3.41Å; A46-P56 VanDerWaalsContact CB-CG 3.41Å; P56-Y58 PolarHBondContact O-N 2.65Å; P56-G59 WeakPolarHBondContact O-CA 3.28Å; P56-G59 PolarHBondContact O-N 3Å; P56-I90 HydrophobicContact CB-CD1 4.29Å; P56-I90 HydrophobicContact CB-CG1 4.47Å
57	Y	91.6	Very high	85.1	Confident	56 Å²	56	50.5 Å²	50.5	22%	0.22	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-71	-9.3	178.1	57.2	-100.8	0	0	0	114.5	D41 M55 G59 R60	D41-Y57 HydrophobicContact CB-CD1 4.21Å; D41-Y57 HydrophobicContact CB-CG 4.05Å; M55-Y57 HydrophobicContact CB-CD1 3.82Å; M55-Y57 HydrophobicContact CB-CE1 3.28Å; M55-Y57 HydrophobicContact CB-CE2 4.18Å; M55-Y57 HydrophobicContact CB-CG 4.45Å; M55-Y57 VanDerWaalsContact CB-CZ 3.47Å; M55-Y57 HydrophobicContact CE-CE1 4.37Å; M55-Y57 HydrophobicContact CG-CE1 3.9Å; M55-Y57 PolarHBondContact O-N 2.79Å; M55-Y57 VanDerWaalsContact O-N 3.1Å; Y57-G59 VanDerWaalsContact C-N 3.27Å; Y57-R60 VanDerWaalsContact O-CD 3.31Å; Y57-R60 WeakPolarHBondContact O-CD 3.24Å; Y57-R60 WeakPolarHBondContact O-CG 3.44Å; Y57-R60 PolarHBondContact O-NE 3.42Å
58	Y	91.9	Very high	82.9	Confident	30 Å²	30	54.5 Å²	54.5	12%	0.118	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-83.1	-2.2	163.9	-62.1	-74.4	0	0	0	112.5	D52 Q53 M55 P56 R60 I63 Q74 A78 W79	D52-Y58 WeakPolarHBondContact O-CE2 3.37Å; Q53-Y58 VanDerWaalsContact O-CD2 3.31Å; Q53-Y58 WeakPolarHBondContact O-CD2 3.26Å; Q53-Y58 WeakPolarHBondContact O-CE2 3.3Å; M55-Y58 HydrophobicContact CB-CD2 4.04Å; M55-Y58 HydrophobicContact CB-CE2 4.17Å; M55-Y58 WeakPolarHBondContact O-CB 3.44Å; M55-Y58 PolarHBondContact O-N 2.82Å; P56-Y58 PolarHBondContact O-N 2.65Å; Y58-R60 PolarHBondContact O-N 3.11Å; Y58-R60 VanDerWaalsContact O-N 3.15Å; Y58-I63 HydrophobicContact CD1-CD1 4.01Å; Y58-I63 WeakPolarHBondContact O-CG2 3.41Å; Y58-Q74 WeakPolarHBondContact CE1-O 3.32Å; Y58-Q74 VanDerWaalsContact CZ-O 3.29Å; Y58-Q74 PolarHBondContact OH-O 2.89Å; Y58-A78 CarbonylContact O-C 3.56Å; Y58-A78 WeakPolarHBondContact O-CA 3.45Å; Y58-W79 PolarHBondContact O-N 3.24Å
59	G	93.6	Very high	80.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.302	C	S	.	.			trans	-79.8	27.6	174.3	0	0	0	0	0	114.1	P56 Y57 M180 R181 M182	P56-G59 WeakPolarHBondContact O-CA 3.28Å; P56-G59 PolarHBondContact O-N 3Å; Y57-G59 VanDerWaalsContact C-N 3.27Å; G59-M180 WeakPolarHBondContact CA-O 3.29Å; G59-R181 CarbonylContact O-C 3.59Å; G59-R181 WeakPolarHBondContact O-CA 3.3Å; G59-M182 PolarHBondContact O-N 3.13Å
60	R	93.2	Very high	78.6	Confident	9 Å²	9	62.7 Å²	62.7	3%	0.034	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-89.6	139	-178.9	-64.2	170.1	-178	-80.7	2.8	110.7	M32 I39 D41 I44 Y57 Y58 I63 R181	M32-R60 HydrophobicContact CE-CG 4.12Å; M32-R60 WeakPolarHBondContact O-CD 3.3Å; M32-R60 WeakPolarHBondContact O-CG 3.46Å; M32-R60 PolarHBondContact O-NH1 3.46Å; I39-R60 VanDerWaalsContact O-CZ 3.26Å; I39-R60 PolarHBondContact O-NH1 3.21Å; I39-R60 PolarHBondContact O-NH2 3.45Å; D41-R60 IonicContact OD1-CZ 2.81Å; D41-R60 IonicContact OD1-NE 2.67Å; D41-R60 IonicContact OD1-NH2 3.39Å; D41-R60 PolarHBondContact OD1-NH2 2.83Å; I44-R60 HydrophobicContact CD1-CG 4.37Å; I44-R60 VanDerWaalsContact CD1-CZ 3.44Å; Y57-R60 VanDerWaalsContact O-CD 3.31Å; Y57-R60 WeakPolarHBondContact O-CD 3.24Å; Y57-R60 WeakPolarHBondContact O-CG 3.44Å; Y57-R60 PolarHBondContact O-NE 3.42Å; Y58-R60 PolarHBondContact O-N 3.11Å; Y58-R60 VanDerWaalsContact O-N 3.15Å; R60-I63 HydrophobicContact CB-CB 4.35Å; R60-I63 WeakPolarHBondContact O-CB 3.4Å; R60-I63 WeakPolarHBondContact O-CG2 3.22Å; R60-I63 PolarHBondContact O-N 2.97Å; R60-R181 WeakPolarHBondContact O-CB 3.49Å; R60-R181 WeakPolarHBondContact O-CG 3.49Å
61	L	92	Very high	76.9	Confident	10 Å²	10	63.6 Å²	63.6	5%	0.052	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	144.2	177.7	-164	70.8	0	0	0	111.8	T33 I63 A104 Q106 V153 M182 E183	T33-L61 HydrophobicContact CG2-CB 3.98Å; T33-L61 WeakPolarHBondContact CG2-O 3.29Å; L61-I63 PolarHBondContact O-N 3.12Å; L61-A104 HydrophobicContact CD1-CB 4.21Å; L61-A104 HydrophobicContact CD2-CB 3.89Å; L61-Q106 HydrophobicContact CD1-CB 3.63Å; L61-V153 HydrophobicContact CD1-CG1 4Å; L61-V153 HydrophobicContact CD1-CG2 4.02Å; L61-V153 HydrophobicContact CD2-CG1 4.26Å; L61-V153 HydrophobicContact CG-CG2 4.49Å; L61-M182 PolarHBondContact N-O 2.79Å; L61-E183 HydrophobicContact CB-CB 3.82Å; L61-E183 HydrophobicContact CD2-CB 3.8Å; L61-E183 HydrophobicContact CG-CB 4.4Å
62	H	88.3	Confident	75.3	Confident	117 Å²	117	68.1 Å²	68.1	54%	0.542	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	2.4	179.5	-57.7	-59.2	0	0	0	116.5	S64 V153	H62-S64 PolarHBondContact O-N 2.83Å; H62-V153 VanDerWaalsContact CE1-CG2 3.45Å; H62-V153 WeakPolarHBondContact CE1-CG2 3.44Å
63	I	83.5	Confident	73.7	Confident	47 Å²	47	66.7 Å²	66.7	24%	0.241	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-63.1	127.7	174.5	-159.1	174.1	0	0	0	108.2	Y58 R60 L61 G77 R181	Y58-I63 HydrophobicContact CD1-CD1 4.01Å; Y58-I63 WeakPolarHBondContact O-CG2 3.41Å; R60-I63 HydrophobicContact CB-CB 4.35Å; R60-I63 WeakPolarHBondContact O-CB 3.4Å; R60-I63 WeakPolarHBondContact O-CG2 3.22Å; R60-I63 PolarHBondContact O-N 2.97Å; L61-I63 PolarHBondContact O-N 3.12Å; I63-G77 WeakPolarHBondContact CG2-O 3.43Å; I63-R181 HydrophobicContact CG2-CG 3.96Å; I63-R181 WeakPolarHBondContact O-CD 3.32Å; I63-R181 PolarHBondContact O-NH1 3.05Å
64	S	68.2	Low	72.5	Confident	38 Å²	38	68.8 Å²	68.8	27%	0.266	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-93.8	160.4	176.7	51.8	0	0	0	0	109.8	H62 A66 F69	H62-S64 PolarHBondContact O-N 2.83Å; S64-A66 PolarHBondContact O-N 2.94Å; S64-A66 VanDerWaalsContact O-N 3.1Å; S64-F69 WeakPolarHBondContact OG-CE2 3.44Å
65	D	59.2	Low	71.3	Confident	46 Å²	46	68.7 Å²	68.7	25%	0.246	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-57.7	118	167.7	-170.6	-29.8	0	0	0	108.3	Y67 L68	D65-Y67 PolarHBondContact O-N 2.87Å; D65-Y67 WeakPolarHBondContact OD1-CB 3.42Å; D65-Y67 PolarHBondContact OD1-N 2.96Å; D65-L68 HydrophobicContact CB-CD1 4.07Å; D65-L68 HydrophobicContact CB-CG 4.21Å; D65-L68 WeakPolarHBondContact O-CB 2.95Å; D65-L68 PolarHBondContact O-N 3.11Å; D65-L68 VanDerWaalsContact O-N 3.07Å
66	A	57.1	Low	70.4	Confident	19 Å²	19	66.5 Å²	66.5	16%	0.157	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-66.4	-23	-174	0	0	0	0	0	111.3	S64 L68 F69 N70 L73 G75	S64-A66 PolarHBondContact O-N 2.94Å; S64-A66 VanDerWaalsContact O-N 3.1Å; A66-L68 PolarHBondContact O-N 2.66Å; A66-F69 PolarHBondContact O-N 2.86Å; A66-F69 VanDerWaalsContact O-N 3.1Å; A66-N70 PolarHBondContact O-N 3.15Å; A66-N70 VanDerWaalsContact O-O 3.04Å; A66-L73 HydrophobicContact CB-CB 3.48Å; A66-L73 VanDerWaalsContact CB-CB 3.48Å; A66-L73 HydrophobicContact CB-CD1 4.4Å; A66-G75 PolarHBondContact N-O 2.97Å; A66-G75 VanDerWaalsContact N-O 3.16Å
67	Y	52.3	Low	70	Confident	136 Å²	136	66.2 Å²	66.2	53%	0.533	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-63.1	-25.1	175.1	-159.1	-97.7	0	0	0	113	D65 F69 Q71	D65-Y67 PolarHBondContact O-N 2.87Å; D65-Y67 WeakPolarHBondContact OD1-CB 3.42Å; D65-Y67 PolarHBondContact OD1-N 2.96Å; Y67-F69 VanDerWaalsContact C-N 3.28Å; Y67-F69 PolarHBondContact O-N 2.87Å; Y67-Q71 HydrophobicContact CE1-CG 4.34Å; Y67-Q71 HydrophobicContact CE2-CB 4.1Å; Y67-Q71 HydrophobicContact CE2-CG 4.05Å
68	L	48.6	Very low	70.1	Confident	125 Å²	125	63.5 Å²	63.5	65%	0.654	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-69.7	-24.1	176	-70.2	169.3	0	0	0	113	D65 A66	D65-L68 HydrophobicContact CB-CD1 4.07Å; D65-L68 HydrophobicContact CB-CG 4.21Å; D65-L68 WeakPolarHBondContact O-CB 2.95Å; D65-L68 PolarHBondContact O-N 3.11Å; D65-L68 VanDerWaalsContact O-N 3.07Å; A66-L68 PolarHBondContact O-N 2.66Å
69	F	48.6	Very low	70.3	Confident	160 Å²	160	62.1 Å²	62.1	70%	0.702	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-27.8	-174.8	-62.3	-83.5	0	0	0	113	S64 A66 Y67	S64-F69 WeakPolarHBondContact OG-CE2 3.44Å; A66-F69 PolarHBondContact O-N 2.86Å; A66-F69 VanDerWaalsContact O-N 3.1Å; Y67-F69 VanDerWaalsContact C-N 3.28Å; Y67-F69 PolarHBondContact O-N 2.87Å
70	N	48.9	Very low	70.5	Confident	68 Å²	68	62.3 Å²	62.3	36%	0.364	31%	0.309	S	S	.	.			trans	-155.2	119.8	175	-173	-5.9	0	0	0	110.4	A66 D72 L73	A66-N70 PolarHBondContact O-N 3.15Å; A66-N70 VanDerWaalsContact O-O 3.04Å; N70-D72 PolarHBondContact O-N 2.8Å; N70-D72 VanDerWaalsContact O-N 3.14Å; N70-D72 WeakPolarHBondContact OD1-CB 3.49Å; N70-D72 PolarHBondContact OD1-N 3.13Å; N70-L73 HydrophobicContact CB-CB 4.25Å; N70-L73 HydrophobicContact CB-CD1 3.74Å; N70-L73 HydrophobicContact CB-CG 3.9Å; N70-L73 PolarHBondContact O-N 2.61Å
71	Q	56.1	Low	70.6	Confident	141 Å²	141	61.9 Å²	61.9	66%	0.659	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-19.3	177.7	-69.4	-173.5	-14.6	0	0	113.4	Y67	Y67-Q71 HydrophobicContact CE1-CG 4.34Å; Y67-Q71 HydrophobicContact CE2-CB 4.1Å; Y67-Q71 HydrophobicContact CE2-CG 4.05Å
72	D	56.6	Low	70.8	Confident	141 Å²	141	65.8 Å²	65.8	75%	0.754	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-15.3	175.7	-63.6	-32.8	0	0	0	113.2	N70	N70-D72 PolarHBondContact O-N 2.8Å; N70-D72 VanDerWaalsContact O-N 3.14Å; N70-D72 WeakPolarHBondContact OD1-CB 3.49Å; N70-D72 PolarHBondContact OD1-N 3.13Å
73	L	52.1	Low	70.9	Confident	96 Å²	96	64.3 Å²	64.3	50%	0.503	32%	0.324	S	S	.	.			trans	-89.1	114.9	177.9	-70.1	171.3	0	0	0	110.2	A66 N70	A66-L73 HydrophobicContact CB-CB 3.48Å; A66-L73 VanDerWaalsContact CB-CB 3.48Å; A66-L73 HydrophobicContact CB-CD1 4.4Å; N70-L73 HydrophobicContact CB-CB 4.25Å; N70-L73 HydrophobicContact CB-CD1 3.74Å; N70-L73 HydrophobicContact CB-CG 3.9Å; N70-L73 PolarHBondContact O-N 2.61Å
74	Q	60.7	Low	71.3	Confident	137 Å²	137	65.1 Å²	65.1	64%	0.64	33%	0.327	S	S	*	.			trans	-81.5	127	176	-62.4	175.6	-2	0	0	108.9	Q53 Y58	Q53-Q74 HydrophobicContact CG-CB 4.41Å; Y58-Q74 WeakPolarHBondContact CE1-O 3.32Å; Y58-Q74 VanDerWaalsContact CZ-O 3.29Å; Y58-Q74 PolarHBondContact OH-O 2.89Å
75	G	65.9	Low	72	Confident	3 Å²	3	65.9 Å²	65.9	3%	0.031	33%	0.328	C	S	.	.			trans	161.5	116.2	174.3	0	0	0	0	0	113.9	A66 G77	A66-G75 PolarHBondContact N-O 2.97Å; A66-G75 VanDerWaalsContact N-O 3.16Å; G75-G77 PolarHBondContact O-N 3.43Å
76	A	74.8	Confident	73.1	Confident	7 Å²	7	67.6 Å²	67.6	6%	0.058	34%	0.337	C	S	.	.			trans	-72.1	2.2	-174.4	0	0	0	0	0	115.1	Q53 T54 A78 R108	Q53-A76 HydrophobicContact CB-CB 4.37Å; Q53-A76 WeakPolarHBondContact O-CB 3.38Å; Q53-A76 PolarHBondContact O-N 2.67Å; T54-A76 HydrophobicContact CG2-CB 3.69Å; A76-A78 PolarHBondContact O-N 3.35Å; A76-R108 PolarHBondContact O-NE 2.77Å
77	G	87.8	Confident	74.4	Confident	4 Å²	4	73.7 Å²	73.7	4%	0.041	36%	0.361	C	S	.	.	S	Bend	trans	77.9	10.1	177.6	0	0	0	0	0	116	I63 G75 R181	I63-G77 WeakPolarHBondContact CG2-O 3.43Å; G75-G77 PolarHBondContact O-N 3.43Å; G77-R181 VanDerWaalsContact O-CD 3.3Å; G77-R181 WeakPolarHBondContact O-CD 3.22Å
78	A	93.3	Very high	76.5	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.338	C	S	.	.	S	Bend	trans	-161.3	160	173.4	0	0	0	0	0	111	Y58 A76 R108 R181	Y58-A78 CarbonylContact O-C 3.56Å; Y58-A78 WeakPolarHBondContact O-CA 3.45Å; A76-A78 PolarHBondContact O-N 3.35Å; A78-R108 HydrophobicContact CB-CB 3.73Å; A78-R108 HydrophobicContact CB-CG 3.77Å; A78-R181 HydrophobicContact CB-CG 4.19Å
79	W	95.9	Very high	78.8	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	138.6	158.9	167	64.1	0	0	0	108.8	A46 S48 Y58 Q88 W89 I90 P171 I178 S179 M180	A46-W79 HydrophobicContact CB-CZ2 4Å; S48-W79 PolarHBondContact O-NE1 3.28Å; Y58-W79 PolarHBondContact O-N 3.24Å; W79-Q88 HydrophobicContact CH2-CB 4.36Å; W79-W89 WeakPolarHBondContact CZ2-O 3.11Å; W79-I90 HydrophobicContact CB-CD1 3.85Å; W79-I90 HydrophobicContact CD2-CB 3.96Å; W79-I90 HydrophobicContact CD2-CD1 4.02Å; W79-I90 HydrophobicContact CD2-CG1 4.49Å; W79-I90 HydrophobicContact CD2-CG2 4.44Å; W79-I90 HydrophobicContact CE3-CB 3.71Å; W79-I90 HydrophobicContact CE3-CD1 4.08Å; W79-I90 HydrophobicContact CE3-CG1 4.49Å; W79-I90 HydrophobicContact CE3-CG2 3.69Å; W79-I90 HydrophobicContact CG-CD1 3.91Å; W79-I90 HydrophobicContact CH2-CB 4.2Å; W79-I90 HydrophobicContact CH2-CG2 4.31Å; W79-I90 HydrophobicContact CZ2-CB 4.4Å; W79-I90 HydrophobicContact CZ3-CB 3.85Å; W79-I90 HydrophobicContact CZ3-CG2 3.63Å; W79-P171 HydrophobicContact CH2-CG 4.42Å; W79-P171 HydrophobicContact CZ3-CG 4.2Å; W79-I178 HydrophobicContact CH2-CG2 3.85Å; W79-I178 HydrophobicContact CZ3-CG2 3.87Å; W79-S179 VanDerWaalsContact O-CA 3.25Å; W79-S179 WeakPolarHBondContact O-CA 2.88Å; W79-M180 HydrophobicContact CE3-CG 3.42Å; W79-M180 VanDerWaalsContact CE3-CG 3.42Å; W79-M180 HydrophobicContact CE3-SD 3.82Å; W79-M180 HydrophobicContact CZ3-CG 3.75Å; W79-M180 HydrophobicContact CZ3-SD 3.61Å; W79-M180 PolarHBondContact N-O 2.58Å; W79-M180 PolarHBondContact O-N 3.27Å; W79-M180 VanDerWaalsContact O-N 3.09Å
80	I	96.9	Very high	81.1	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	126.1	173.8	-48	-174.2	0	0	0	108.1	S49 F50 T54 R108 L177 I178 S179	S49-I80 WeakPolarHBondContact CA-O 3.37Å; F50-I80 HydrophobicContact CB-CB 4.23Å; F50-I80 HydrophobicContact CB-CG2 4.15Å; F50-I80 PolarHBondContact N-O 3.44Å; T54-I80 HydrophobicContact CG2-CB 3.93Å; T54-I80 HydrophobicContact CG2-CD1 3.56Å; T54-I80 HydrophobicContact CG2-CG1 3.68Å; T54-I80 PolarHBondContact O-N 2.75Å; I80-R108 VanDerWaalsContact CD1-NH1 3.34Å; I80-L177 HydrophobicContact CG2-CB 4.36Å; I80-L177 HydrophobicContact CG2-CD1 4.26Å; I80-I178 WeakPolarHBondContact CA-O 3.1Å; I80-S179 WeakPolarHBondContact CG1-OG 3.37Å
81	S	96.5	Very high	83.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.269	C	S	.	.			trans	-69.7	151.5	175.9	69.3	0	0	0	0	111.4	D83 Q84 I178	S81-D83 WeakPolarHBondContact CB-O 3.15Å; S81-D83 PolarHBondContact OG-O 3.01Å; S81-Q84 PolarHBondContact O-NE2 2.91Å; S81-Q84 PolarHBondContact OG-NE2 2.82Å; S81-I178 PolarHBondContact N-O 3.43Å; S81-I178 WeakPolarHBondContact OG-CB 3.13Å
82	L	95.3	Very high	85.2	Confident	92 Å²	92	47.6 Å²	47.6	48%	0.482	24%	0.238	S	C	.	.	S	Bend	trans	-71.8	-58.3	171.7	178.9	63.5	0	0	0	109.8	S48 F50	S48-L82 PolarHBondContact OG-N 2.87Å; F50-L82 HydrophobicContact CD2-CD1 4.28Å
83	D	91.4	Very high	87.1	Confident	86 Å²	86	42.1 Å²	42.1	46%	0.46	21%	0.208	S	C	.	.	S	Bend	trans	-81.9	142.1	178.2	-58.5	-56	0	0	0	109.6	S81 Q88	S81-D83 WeakPolarHBondContact CB-O 3.15Å; S81-D83 PolarHBondContact OG-O 3.01Å; D83-Q88 WeakPolarHBondContact O-CG 3.23Å
84	Q	91.9	Very high	89.1	Confident	64 Å²	64	37.9 Å²	37.9	30%	0.299	19%	0.186	S	C	.	.			trans	-109.9	61.8	-177.1	-59	-59.9	-53.5	0	0	109.6	S81 W174 L177	S81-Q84 PolarHBondContact O-NE2 2.91Å; S81-Q84 PolarHBondContact OG-NE2 2.82Å; Q84-W174 HydrophobicContact CB-CZ2 4.36Å; Q84-W174 WeakPolarHBondContact O-CZ2 3.44Å; Q84-L177 HydrophobicContact CG-CD2 3.86Å
85	D	81.9	Confident	90.6	Very high	55 Å²	55	36.1 Å²	36.1	29%	0.294	18%	0.181	S	C	.	.	S	Bend	trans	-127.2	172	177.8	71.1	15.2	0	0	0	111.7	K87 Q88 I178	D85-K87 PolarHBondContact O-N 3Å; D85-K87 WeakPolarHBondContact OD1-CB 3.33Å; D85-K87 PolarHBondContact OD1-N 2.74Å; D85-K87 VanDerWaalsContact OD1-N 3.08Å; D85-Q88 WeakPolarHBondContact O-CG 3.38Å; D85-Q88 PolarHBondContact OD1-NE2 3.38Å; D85-I178 WeakPolarHBondContact O-CD1 3.4Å
86	D	81.7	Confident	91.7	Very high	81 Å²	81	40.8 Å²	40.8	43%	0.433	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	5	-177.7	61.6	-13.8	0	0	0	113.9	N170 Q172	D86-N170 PolarHBondContact O-ND2 2.93Å; D86-Q172 PolarHBondContact O-NE2 2.89Å
87	K	86.2	Confident	92.4	Very high	148 Å²	148	43.4 Å²	43.4	64%	0.643	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100	-5	-179.9	-59.5	170.6	-172.6	166.4	0	112.3	D85	D85-K87 PolarHBondContact O-N 3Å; D85-K87 WeakPolarHBondContact OD1-CB 3.33Å; D85-K87 PolarHBondContact OD1-N 2.74Å; D85-K87 VanDerWaalsContact OD1-N 3.08Å
88	Q	95.3	Very high	92.6	Very high	11 Å²	11	44.6 Å²	44.6	5%	0.051	21%	0.213	C	C	.	.			trans	-71.9	151.3	179.1	-56.6	-50.6	-65.2	0	0	111.5	S47 S48 W79 D83 D85 N170 P171 I178	S47-Q88 WeakPolarHBondContact OG-CA 3.27Å; S47-Q88 PolarHBondContact OG-OE1 2.86Å; S47-Q88 VanDerWaalsContact OG-OE1 3.1Å; S48-Q88 PolarHBondContact OG-OE1 2.97Å; W79-Q88 HydrophobicContact CH2-CB 4.36Å; D83-Q88 WeakPolarHBondContact O-CG 3.23Å; D85-Q88 WeakPolarHBondContact O-CG 3.38Å; D85-Q88 PolarHBondContact OD1-NE2 3.38Å; Q88-N170 WeakPolarHBondContact O-CA 3.15Å; Q88-N170 PolarHBondContact O-ND2 2.78Å; Q88-P171 VanDerWaalsContact O-CD 3.24Å; Q88-P171 WeakPolarHBondContact O-CD 3.23Å; Q88-I178 HydrophobicContact CB-CD1 3.97Å; Q88-I178 HydrophobicContact CG-CD1 3.79Å
89	W	96.3	Very high	92.4	Very high	54 Å²	54	45.7 Å²	45.7	21%	0.205	22%	0.219	C	C	.	.			trans	-157.8	156.7	178.6	55.6	-99.5	0	0	0	112.6	A46 S47 W79 Q91 R168 L169 N170	A46-W89 VanDerWaalsContact C-CH2 3.45Å; A46-W89 CarbonylContact C-O 3.54Å; A46-W89 VanDerWaalsContact CA-O 3.22Å; A46-W89 WeakPolarHBondContact CA-O 3.33Å; A46-W89 VanDerWaalsContact CB-O 3.22Å; A46-W89 WeakPolarHBondContact CB-O 3.27Å; S47-W89 PolarHBondContact N-O 3.16Å; S47-W89 PolarHBondContact OG-N 2.96Å; S47-W89 PolarHBondContact OG-O 3.05Å; W79-W89 WeakPolarHBondContact CZ2-O 3.11Å; W89-Q91 HydrophobicContact CE3-CB 3.68Å; W89-Q91 HydrophobicContact CZ3-CB 3.57Å; W89-R168 HydrophobicContact CB-CG 3.49Å; W89-R168 VanDerWaalsContact CB-CG 3.49Å; W89-R168 HydrophobicContact CD2-CG 4.21Å; W89-R168 VanDerWaalsContact CD2-NE 3.28Å; W89-R168 VanDerWaalsContact CE2-NH2 3.3Å; W89-R168 HydrophobicContact CE3-CG 4.22Å; W89-R168 VanDerWaalsContact CG-CD 3.48Å; W89-R168 HydrophobicContact CG-CG 3.93Å; W89-R168 VanDerWaalsContact CZ2-NH2 3.29Å; W89-L169 CarbonylContact C-O 3.53Å; W89-L169 WeakPolarHBondContact CA-O 3.49Å; W89-L169 WeakPolarHBondContact CB-O 3.31Å; W89-N170 HydrophobicContact CB-CB 4.44Å
90	I	97.2	Very high	92.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	140.9	168	177.7	165.4	0	0	0	108.5	I44 T45 A46 P56 W79 R168 L169 M180 M182	I44-I90 HydrophobicContact CG2-CD1 4.14Å; I44-I90 HydrophobicContact CG2-CG1 4.2Å; T45-I90 CarbonylContact O-C 3.56Å; A46-I90 HydrophobicContact CB-CB 4.41Å; P56-I90 HydrophobicContact CB-CD1 4.29Å; P56-I90 HydrophobicContact CB-CG1 4.47Å; W79-I90 HydrophobicContact CB-CD1 3.85Å; W79-I90 HydrophobicContact CD2-CB 3.96Å; W79-I90 HydrophobicContact CD2-CD1 4.02Å; W79-I90 HydrophobicContact CD2-CG1 4.49Å; W79-I90 HydrophobicContact CD2-CG2 4.44Å; W79-I90 HydrophobicContact CE3-CB 3.71Å; W79-I90 HydrophobicContact CE3-CD1 4.08Å; W79-I90 HydrophobicContact CE3-CG1 4.49Å; W79-I90 HydrophobicContact CE3-CG2 3.69Å; W79-I90 HydrophobicContact CG-CD1 3.91Å; W79-I90 HydrophobicContact CH2-CB 4.2Å; W79-I90 HydrophobicContact CH2-CG2 4.31Å; W79-I90 HydrophobicContact CZ2-CB 4.4Å; W79-I90 HydrophobicContact CZ3-CB 3.85Å; W79-I90 HydrophobicContact CZ3-CG2 3.63Å; I90-R168 CarbonylContact O-C 3.57Å; I90-R168 VanDerWaalsContact O-CA 3.25Å; I90-R168 WeakPolarHBondContact O-CA 3.28Å; I90-L169 HydrophobicContact CG2-CB 4.12Å; I90-L169 PolarHBondContact N-O 2.87Å; I90-L169 PolarHBondContact O-N 2.87Å; I90-M180 HydrophobicContact CG2-CE 4.19Å; I90-M180 HydrophobicContact CG2-CG 4.5Å; I90-M180 HydrophobicContact CG2-SD 3.58Å; I90-M180 VanDerWaalsContact CG2-SD 3.58Å; I90-M182 HydrophobicContact CB-CE 4.25Å; I90-M182 HydrophobicContact CD1-CE 4.22Å; I90-M182 HydrophobicContact CG1-CE 4.08Å; I90-M182 HydrophobicContact CG2-CE 3.25Å
91	Q	95.5	Very high	91.9	Very high	15 Å²	15	48 Å²	48	7%	0.07	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	146.6	-166.7	173.9	-179.6	-50	0	0	111.6	I44 T45 W89 W131 I167 R168	I44-Q91 WeakPolarHBondContact CA-O 3.3Å; T45-Q91 PolarHBondContact N-O 2.79Å; T45-Q91 PolarHBondContact O-N 2.81Å; W89-Q91 HydrophobicContact CE3-CB 3.68Å; W89-Q91 HydrophobicContact CZ3-CB 3.57Å; Q91-W131 HydrophobicContact CG-CH2 3.99Å; Q91-I167 CarbonylContact C-O 3.58Å; Q91-I167 WeakPolarHBondContact CA-O 3.33Å; Q91-R168 HydrophobicContact CB-CB 4.25Å; Q91-R168 HydrophobicContact CG-CB 4.49Å
92	I	96.1	Very high	91.7	Very high	1 Å²	1	48 Å²	48	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129	176.1	-60.9	161.4	0	0	0	109.5	M32 I39 Q43 I44 L94 Y166 I167 M182 L184	M32-I92 HydrophobicContact CE-CD1 3.78Å; M32-I92 HydrophobicContact CE-CG1 4.28Å; M32-I92 HydrophobicContact CG-CD1 4.06Å; M32-I92 HydrophobicContact SD-CD1 3.42Å; M32-I92 WeakPolarHBondContact SD-CD1 3.31Å; M32-I92 HydrophobicContact SD-CG1 3.95Å; I39-I92 HydrophobicContact CD1-CG2 3.9Å; I39-I92 HydrophobicContact CG1-CG2 4.44Å; I39-I92 HydrophobicContact CG2-CG2 3.86Å; Q43-I92 CarbonylContact O-C 3.58Å; Q43-I92 WeakPolarHBondContact O-CA 3.07Å; I44-I92 HydrophobicContact CG1-CG1 4.49Å; I92-L94 HydrophobicContact CG2-CD2 3.78Å; I92-L94 HydrophobicContact CG2-CG 4.3Å; I92-Y166 WeakPolarHBondContact O-CA 3.01Å; I92-I167 HydrophobicContact CB-CG2 4.04Å; I92-I167 PolarHBondContact N-O 3.06Å; I92-I167 PolarHBondContact O-N 2.67Å; I92-I167 VanDerWaalsContact O-N 3.1Å; I92-M182 HydrophobicContact CD1-CG 4.43Å; I92-M182 HydrophobicContact CD1-SD 3.57Å; I92-M182 VanDerWaalsContact CD1-SD 3.57Å; I92-L184 HydrophobicContact CB-CD1 4.41Å; I92-L184 HydrophobicContact CD1-CD1 3.56Å; I92-L184 HydrophobicContact CD1-CG 3.98Å; I92-L184 HydrophobicContact CG2-CD1 4.37Å
93	D	95.6	Very high	91.7	Very high	26 Å²	26	43.6 Å²	43.6	14%	0.139	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	110	164.8	-173.7	-7.5	0	0	0	109.6	Q43 L95 R165 Y166	Q43-D93 VanDerWaalsContact CB-O 3.32Å; Q43-D93 WeakPolarHBondContact CB-O 3.36Å; Q43-D93 WeakPolarHBondContact CG-O 3.37Å; Q43-D93 PolarHBondContact NE2-O 2.99Å; Q43-D93 PolarHBondContact O-N 2.87Å; D93-L95 PolarHBondContact O-N 3.34Å; D93-L95 WeakPolarHBondContact OD1-CA 3.29Å; D93-L95 PolarHBondContact OD1-N 2.96Å; D93-R165 IonicContact OD1-NE 3.47Å; D93-R165 PolarHBondContact OD1-NE 3.28Å; D93-R165 IonicContact OD1-NH2 2.63Å; D93-R165 IonicContact OD2-NH2 2.68Å; D93-Y166 HydrophobicContact CB-CD1 3.78Å; D93-Y166 HydrophobicContact CB-CE1 3.4Å; D93-Y166 VanDerWaalsContact CG-CZ 3.43Å; D93-Y166 VanDerWaalsContact OD2-CE1 3.24Å; D93-Y166 WeakPolarHBondContact OD2-CE1 3.23Å; D93-Y166 VanDerWaalsContact OD2-CZ 3.31Å; D93-Y166 PolarHBondContact OD2-OH 2.63Å
94	L	94.5	Very high	91.8	Very high	7 Å²	7	39.5 Å²	39.5	4%	0.037	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-1.3	179.1	-60.2	169.7	0	0	0	113	L30 I39 I92 K96 K98 I100 R165 L184	L30-L94 HydrophobicContact CD1-CD1 4.27Å; L30-L94 HydrophobicContact CD1-CD2 4.09Å; I39-L94 HydrophobicContact CD1-CD2 3.96Å; I39-L94 HydrophobicContact CG1-CD2 4.44Å; I92-L94 HydrophobicContact CG2-CD2 3.78Å; I92-L94 HydrophobicContact CG2-CG 4.3Å; L94-K96 PolarHBondContact O-N 3.32Å; L94-K98 HydrophobicContact CB-CD 4.06Å; L94-K98 HydrophobicContact CD1-CB 4.1Å; L94-K98 HydrophobicContact CD1-CD 4.11Å; L94-K98 HydrophobicContact CD2-CD 4.23Å; L94-K98 HydrophobicContact CG-CD 4.36Å; L94-I100 HydrophobicContact CD1-CD1 3.87Å; L94-I100 HydrophobicContact CD1-CG1 4.37Å; L94-R165 WeakPolarHBondContact CB-O 3.47Å; L94-R165 WeakPolarHBondContact CG-O 3.38Å; L94-R165 PolarHBondContact N-O 3.41Å; L94-L184 HydrophobicContact CD2-CD1 4.06Å
95	L	92	Very high	92	Very high	100 Å²	100	36.5 Å²	36.5	52%	0.524	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	64.6	-25.2	-177.9	-55.7	173.3	0	0	0	115.3	Q43 D93	Q43-L95 HydrophobicContact CG-CD1 4.27Å; Q43-L95 HydrophobicContact CG-CD2 4.25Å; Q43-L95 HydrophobicContact CG-CG 4.18Å; D93-L95 PolarHBondContact O-N 3.34Å; D93-L95 WeakPolarHBondContact OD1-CA 3.29Å; D93-L95 PolarHBondContact OD1-N 2.96Å
96	K	89.5	Confident	92.6	Very high	102 Å²	102	34 Å²	34	44%	0.443	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	160.4	177	60	-177.3	-180	172.4	0	109.8	L94 K98 D188	L94-K96 PolarHBondContact O-N 3.32Å; K96-K98 PolarHBondContact O-N 2.88Å; K96-D188 WeakPolarHBondContact CE-OD1 3.27Å; K96-D188 IonicContact NZ-OD1 2.74Å; K96-D188 PolarHBondContact NZ-OD1 2.82Å; K96-D188 IonicContact NZ-OD2 3.69Å; K96-D188 PolarHBondContact NZ-OD2 2.86Å
97	R	89.6	Confident	93.2	Very high	62 Å²	62	30.2 Å²	30.2	23%	0.234	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	131.1	177.4	-60.4	-172.8	-67.1	168.8	0.9	110.2	D124 V163 Y189 E347	R97-D124 HydrophobicContact CG-CB 4.42Å; R97-V163 HydrophobicContact CB-CG1 4.27Å; R97-Y189 HydrophobicContact CB-CD1 4.4Å; R97-Y189 PolarHBondContact O-N 2.81Å; R97-Y189 VanDerWaalsContact O-N 3.16Å; R97-E347 IonicContact CZ-OE1 3.64Å; R97-E347 VanDerWaalsContact CZ-OE1 3.28Å; R97-E347 IonicContact NH1-OE1 3.16Å; R97-E347 PolarHBondContact NH1-OE1 3.36Å; R97-E347 IonicContact NH1-OE2 3.42Å; R97-E347 PolarHBondContact NH1-OE2 2.82Å; R97-E347 IonicContact NH2-OE1 3.53Å; R97-E347 PolarHBondContact NH2-OE1 2.92Å
98	K	91.2	Very high	93.5	Very high	29 Å²	29	25.6 Å²	25.6	13%	0.126	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	147.6	178.5	-72.7	-176.5	174.3	-83.1	0	109.5	L30 L94 K96 V163 A164 C187 D188	L30-K98 HydrophobicContact CD1-CD 3.88Å; L30-K98 HydrophobicContact CD2-CD 3.82Å; L30-K98 HydrophobicContact CG-CD 4.41Å; L94-K98 HydrophobicContact CB-CD 4.06Å; L94-K98 HydrophobicContact CD1-CB 4.1Å; L94-K98 HydrophobicContact CD1-CD 4.11Å; L94-K98 HydrophobicContact CD2-CD 4.23Å; L94-K98 HydrophobicContact CG-CD 4.36Å; K96-K98 PolarHBondContact O-N 2.88Å; K98-V163 WeakPolarHBondContact O-CA 3.42Å; K98-A164 PolarHBondContact N-O 2.85Å; K98-A164 PolarHBondContact O-N 3.18Å; K98-C187 CarbonylContact C-O 3.6Å; K98-C187 WeakPolarHBondContact CA-O 3.36Å; K98-C187 WeakPolarHBondContact CB-O 3.46Å; K98-D188 IonicContact NZ-OD1 3.85Å; K98-D188 PolarHBondContact NZ-OD1 3.2Å
99	V	90.5	Very high	93.2	Very high	22 Å²	22	29.3 Å²	29.3	13%	0.133	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	125.3	166.1	-177.7	0	0	0	0	106.9	Q101 P161 I162 G186 C187 Y189	V99-Q101 HydrophobicContact CG1-CG 4.39Å; V99-P161 HydrophobicContact CG1-CB 3.55Å; V99-I162 CarbonylContact C-O 3.51Å; V99-I162 WeakPolarHBondContact CA-O 3.32Å; V99-G186 CarbonylContact O-C 3.59Å; V99-G186 WeakPolarHBondContact O-CA 3.47Å; V99-C187 PolarHBondContact N-O 2.87Å; V99-C187 PolarHBondContact O-N 2.85Å; V99-Y189 HydrophobicContact CG2-CD2 3.4Å; V99-Y189 HydrophobicContact CG2-CE2 4.22Å; V99-Y189 HydrophobicContact CG2-CG 3.96Å
100	I	92.3	Very high	92.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.9	175.7	-49.3	176.9	0	0	0	107.7	L30 L94 F158 P161 I162 A164 I167	L30-I100 HydrophobicContact CD1-CG1 4.32Å; L94-I100 HydrophobicContact CD1-CD1 3.87Å; L94-I100 HydrophobicContact CD1-CG1 4.37Å; I100-F158 HydrophobicContact CB-CE2 4.23Å; I100-F158 HydrophobicContact CG2-CE2 3.73Å; I100-F158 WeakPolarHBondContact O-CD2 3.46Å; I100-P161 CarbonylContact O-C 3.58Å; I100-P161 VanDerWaalsContact O-CA 3.26Å; I100-P161 WeakPolarHBondContact O-CA 3.29Å; I100-I162 HydrophobicContact CB-CD1 4.42Å; I100-I162 HydrophobicContact CB-CG1 3.87Å; I100-I162 HydrophobicContact CD1-CD1 4.32Å; I100-I162 HydrophobicContact CG1-CG1 4.47Å; I100-I162 PolarHBondContact N-O 3.04Å; I100-I162 PolarHBondContact O-N 3.29Å; I100-A164 HydrophobicContact CD1-CB 3.79Å; I100-I167 HydrophobicContact CD1-CB 4.2Å; I100-I167 HydrophobicContact CD1-CD1 3.66Å; I100-I167 HydrophobicContact CD1-CG2 4.29Å
101	Q	89.7	Confident	92.2	Very high	53 Å²	53	31.4 Å²	31.4	25%	0.248	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-32.1	-175.1	-65.3	178.3	-31.3	0	0	112.3	V99 F158 P161 F185	V99-Q101 HydrophobicContact CG1-CG 4.39Å; Q101-F158 PolarHBondContact O-N 3.2Å; Q101-P161 HydrophobicContact CG-CB 4.12Å; Q101-P161 HydrophobicContact CG-CG 4.11Å; Q101-F185 PolarHBondContact N-O 3.46Å
102	S	91.6	Very high	91.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	168.8	179.1	70	0	0	0	0	112.5	Y27 N156 N157 F185	Y27-S102 WeakPolarHBondContact CD1-OG 3.18Å; S102-N156 VanDerWaalsContact CA-O 3.27Å; S102-N156 WeakPolarHBondContact CA-O 3.34Å; S102-N156 VanDerWaalsContact CB-O 3.25Å; S102-N156 WeakPolarHBondContact CB-O 3.35Å; S102-N157 WeakPolarHBondContact CB-OD1 3.33Å; S102-F185 PolarHBondContact N-O 2.86Å; S102-F185 PolarHBondContact O-N 2.9Å; S102-F185 WeakPolarHBondContact OG-CB 3.27Å; S102-F185 WeakPolarHBondContact OG-CD2 3.38Å
103	I	94.9	Very high	91.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	143.2	176.3	-172.6	160.4	0	0	0	110.5	Y118 I120 F155 N156 F158 L169 M182 E183 L184	I103-Y118 WeakPolarHBondContact CG2-OH 3.45Å; I103-I120 HydrophobicContact CG2-CD1 3.99Å; I103-F155 WeakPolarHBondContact O-CA 3.23Å; I103-N156 HydrophobicContact CG2-CB 3.9Å; I103-N156 PolarHBondContact N-O 2.82Å; I103-N156 PolarHBondContact O-N 2.9Å; I103-F158 HydrophobicContact CG2-CE1 4.17Å; I103-F158 HydrophobicContact CG2-CZ 4.28Å; I103-L169 HydrophobicContact CD1-CD1 3.29Å; I103-L169 HydrophobicContact CD1-CD2 3.39Å; I103-L169 HydrophobicContact CD1-CG 3.89Å; I103-L169 HydrophobicContact CG1-CD2 4.45Å; I103-M182 HydrophobicContact CD1-SD 4.39Å; I103-E183 WeakPolarHBondContact CA-O 3.32Å; I103-E183 WeakPolarHBondContact CG1-O 3.48Å; I103-L184 HydrophobicContact CB-CD2 4.4Å; I103-L184 HydrophobicContact CD1-CD2 3.65Å; I103-L184 HydrophobicContact CG1-CD2 3.97Å
104	A	94.6	Very high	91.7	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	138.5	167.5	0	0	0	0	0	110.1	L61 V153 K154 F155 M182 E183 F185	L61-A104 HydrophobicContact CD1-CB 4.21Å; L61-A104 HydrophobicContact CD2-CB 3.89Å; A104-V153 HydrophobicContact CB-CG1 3.71Å; A104-K154 CarbonylContact C-O 3.58Å; A104-K154 VanDerWaalsContact CA-O 3.27Å; A104-K154 WeakPolarHBondContact CA-O 3.27Å; A104-F155 HydrophobicContact CB-CD1 4.06Å; A104-F155 HydrophobicContact CB-CE1 3.9Å; A104-F155 HydrophobicContact CB-CG 4.45Å; A104-F155 HydrophobicContact CB-CZ 4.13Å; A104-M182 CarbonylContact O-C 3.5Å; A104-M182 WeakPolarHBondContact O-CA 3Å; A104-M182 WeakPolarHBondContact O-CB 3.29Å; A104-E183 HydrophobicContact CB-CB 4.39Å; A104-E183 PolarHBondContact N-O 2.95Å; A104-E183 PolarHBondContact O-N 2.87Å; A104-F185 HydrophobicContact CB-CE2 3.65Å; A104-F185 HydrophobicContact CB-CZ 4.22Å
105	T	96.3	Very high	91.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	149.7	173.1	56	0	0	0	0	110.9	I115 Y118 N147 V153 K154 L169 M180 R181	T105-I115 HydrophobicContact CG2-CD1 4.46Å; T105-Y118 HydrophobicContact CG2-CE1 3.86Å; T105-Y118 HydrophobicContact CG2-CE2 4.46Å; T105-Y118 WeakPolarHBondContact CG2-OH 3.42Å; T105-N147 PolarHBondContact O-ND2 3.08Å; T105-V153 WeakPolarHBondContact O-CA 3.33Å; T105-K154 PolarHBondContact N-O 3.1Å; T105-K154 PolarHBondContact O-N 3.16Å; T105-L169 HydrophobicContact CG2-CD2 3.86Å; T105-M180 HydrophobicContact CG2-CE 4.13Å; T105-R181 CarbonylContact C-O 3.55Å; T105-R181 VanDerWaalsContact CA-O 3.29Å; T105-R181 WeakPolarHBondContact CA-O 3.45Å
106	Q	94.9	Very high	91.4	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.019	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	140.2	-179.9	-166.3	-171.5	26.1	0	0	109.6	L61 N147 N151 V153 M180 R181	L61-Q106 HydrophobicContact CD1-CB 3.63Å; Q106-N147 WeakPolarHBondContact CA-ND2 3.43Å; Q106-N147 WeakPolarHBondContact CA-OD1 3.07Å; Q106-N147 PolarHBondContact N-OD1 2.78Å; Q106-N151 PolarHBondContact NE2-O 3Å; Q106-N151 PolarHBondContact NE2-OD1 3.42Å; Q106-V153 HydrophobicContact CB-CG2 4.38Å; Q106-V153 HydrophobicContact CG-CG2 4.14Å; Q106-M180 CarbonylContact O-C 3.46Å; Q106-M180 WeakPolarHBondContact O-CA 3.2Å; Q106-R181 HydrophobicContact CB-CB 4.13Å; Q106-R181 VanDerWaalsContact CG-NH2 3.33Å; Q106-R181 PolarHBondContact N-O 2.89Å; Q106-R181 PolarHBondContact O-N 3.05Å
107	G	93.9	Very high	91.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.			trans	-69.2	-176.4	176.2	0	0	0	0	0	113.4	N147 D150 R181	G107-N147 PolarHBondContact N-OD1 2.86Å; G107-D150 CarbonylContact C-O 3.54Å; G107-D150 VanDerWaalsContact O-O 3.04Å; G107-R181 PolarHBondContact O-NE 3.07Å; G107-R181 PolarHBondContact O-NH2 3.11Å
108	R	93	Very high	91.2	Very high	52 Å²	52	30.6 Å²	30.6	20%	0.196	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-91.4	108.2	176.3	-178.4	-175.6	174.3	-158	-3.9	111.6	A76 A78 I80 G110 A111 Q113 D150	A76-R108 PolarHBondContact O-NE 2.77Å; A78-R108 HydrophobicContact CB-CB 3.73Å; A78-R108 HydrophobicContact CB-CG 3.77Å; I80-R108 VanDerWaalsContact CD1-NH1 3.34Å; R108-G110 PolarHBondContact O-N 3.05Å; R108-A111 HydrophobicContact CB-CB 4.3Å; R108-A111 HydrophobicContact CG-CB 3.91Å; R108-A111 PolarHBondContact O-N 2.98Å; R108-Q113 HydrophobicContact CB-CB 4.33Å; R108-Q113 PolarHBondContact N-O 2.83Å; R108-Q113 VanDerWaalsContact NH1-OE1 3.07Å; R108-D150 CarbonylContact C-O 3.55Å; R108-D150 VanDerWaalsContact C-O 3.24Å; R108-D150 PolarHBondContact N-O 3Å; R108-D150 WeakPolarHBondContact O-CB 3.37Å
109	Q	87.4	Confident	91.3	Very high	89 Å²	89	30.8 Å²	30.8	42%	0.416	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	125.1	-176.6	-173.2	177.8	8.6	0	0	113	A111 D150 N151	Q109-A111 VanDerWaalsContact C-N 3.27Å; Q109-A111 PolarHBondContact O-N 3.14Å; Q109-D150 WeakPolarHBondContact CA-O 3.16Å; Q109-D150 PolarHBondContact N-O 3.21Å; Q109-D150 VanDerWaalsContact N-O 3.1Å; Q109-N151 HydrophobicContact CG-CB 4.45Å
110	G	86.5	Confident	91.5	Very high	70 Å²	70	29.8 Å²	29.8	72%	0.722	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.5	-5.5	173.5	0	0	0	0	0	115.2	R108 D150	R108-G110 PolarHBondContact O-N 3.05Å; G110-D150 WeakPolarHBondContact CA-OD2 3.49Å; G110-D150 PolarHBondContact N-OD2 3.09Å
111	A	86.4	Confident	91.6	Very high	27 Å²	27	33.1 Å²	33.1	22%	0.223	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-8.7	-179.1	0	0	0	0	0	113.4	R108 Q109 Q113 D150	R108-A111 HydrophobicContact CB-CB 4.3Å; R108-A111 HydrophobicContact CG-CB 3.91Å; R108-A111 PolarHBondContact O-N 2.98Å; Q109-A111 VanDerWaalsContact C-N 3.27Å; Q109-A111 PolarHBondContact O-N 3.14Å; A111-Q113 VanDerWaalsContact C-N 3.25Å; A111-Q113 HydrophobicContact CB-CB 4.36Å; A111-Q113 HydrophobicContact CB-CG 4.08Å; A111-Q113 PolarHBondContact O-N 3.37Å; A111-D150 PolarHBondContact N-OD2 2.59Å
112	R	90.3	Very high	91.8	Very high	172 Å²	172	31 Å²	31	65%	0.649	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	43.5	-169	-56.8	-179.6	70.4	-175.9	2.5	112.5	W114 D150 N175 N176	R112-W114 VanDerWaalsContact C-CE3 3.45Å; R112-W114 VanDerWaalsContact C-CZ3 3.42Å; R112-W114 HydrophobicContact CB-CZ3 3.91Å; R112-D150 PolarHBondContact N-OD2 2.94Å; R112-D150 VanDerWaalsContact N-OD2 3.14Å; R112-N175 PolarHBondContact O-ND2 3.02Å; R112-N176 PolarHBondContact O-ND2 2.66Å
113	Q	94	Very high	91.7	Very high	27 Å²	27	31.3 Å²	31.3	13%	0.126	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-125.2	125.9	180	-66.9	163.5	-1.7	0	0	109.3	R108 A111 N175 N176 L177 S179	R108-Q113 HydrophobicContact CB-CB 4.33Å; R108-Q113 PolarHBondContact N-O 2.83Å; R108-Q113 VanDerWaalsContact NH1-OE1 3.07Å; A111-Q113 VanDerWaalsContact C-N 3.25Å; A111-Q113 HydrophobicContact CB-CB 4.36Å; A111-Q113 HydrophobicContact CB-CG 4.08Å; A111-Q113 PolarHBondContact O-N 3.37Å; Q113-N175 WeakPolarHBondContact CA-O 3.28Å; Q113-N176 HydrophobicContact CG-CB 3.93Å; Q113-L177 HydrophobicContact CG-CB 4.19Å; Q113-S179 WeakPolarHBondContact CB-OG 3.45Å; Q113-S179 PolarHBondContact OE1-OG 3.3Å
114	W	93.8	Very high	91.4	Very high	24 Å²	24	32.3 Å²	32.3	9%	0.091	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	155.8	-179	62.8	90	0	0	0	111.8	R112 N147 V148 D149 D150 W174 N175 S179	R112-W114 VanDerWaalsContact C-CE3 3.45Å; R112-W114 VanDerWaalsContact C-CZ3 3.42Å; R112-W114 HydrophobicContact CB-CZ3 3.91Å; W114-N147 HydrophobicContact CB-CB 4.04Å; W114-N147 HydrophobicContact CG-CB 4.15Å; W114-N147 PolarHBondContact NE1-O 3.31Å; W114-N147 VanDerWaalsContact NE1-O 3.08Å; W114-V148 VanDerWaalsContact CZ2-O 3.22Å; W114-V148 WeakPolarHBondContact CZ2-O 3.36Å; W114-D149 WeakPolarHBondContact CB-O 3.18Å; W114-D149 VanDerWaalsContact CE3-C 3.47Å; W114-D149 VanDerWaalsContact CG-O 3.24Å; W114-D150 HydrophobicContact CE3-CB 3.87Å; W114-D150 HydrophobicContact CZ3-CB 4.21Å; W114-W174 CarbonylContact O-C 3.52Å; W114-W174 VanDerWaalsContact O-CA 3.22Å; W114-W174 WeakPolarHBondContact O-CA 3.45Å; W114-W174 VanDerWaalsContact O-CB 3.28Å; W114-W174 WeakPolarHBondContact O-CB 3.09Å; W114-N175 HydrophobicContact CD2-CB 3.74Å; W114-N175 VanDerWaalsContact CE2-CB 3.4Å; W114-N175 HydrophobicContact CE3-CB 4.18Å; W114-N175 HydrophobicContact CG-CB 4.28Å; W114-N175 HydrophobicContact CH2-CB 4.02Å; W114-N175 VanDerWaalsContact CH2-ND2 3.33Å; W114-N175 WeakPolarHBondContact CH2-ND2 3.15Å; W114-N175 HydrophobicContact CZ2-CB 3.56Å; W114-N175 HydrophobicContact CZ3-CB 4.31Å; W114-N175 WeakPolarHBondContact CZ3-ND2 3.27Å; W114-N175 PolarHBondContact N-O 2.84Å; W114-N175 PolarHBondContact O-N 3.04Å; W114-S179 WeakPolarHBondContact CA-O 3.43Å
115	I	93.9	Very high	90.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	138.5	169.1	65	166.8	0	0	0	110.1	T105 Y118 N147 P171 W174 I178 S179 M180	T105-I115 HydrophobicContact CG2-CD1 4.46Å; I115-Y118 HydrophobicContact CD1-CD1 3.51Å; I115-Y118 HydrophobicContact CD1-CE1 4.12Å; I115-Y118 HydrophobicContact CD1-CG 3.91Å; I115-Y118 HydrophobicContact CG1-CD1 4.43Å; I115-N147 PolarHBondContact O-N 3.21Å; I115-P171 HydrophobicContact CB-CB 4.43Å; I115-P171 HydrophobicContact CG2-CB 3.74Å; I115-P171 HydrophobicContact CG2-CG 3.8Å; I115-W174 HydrophobicContact CG2-CB 4.5Å; I115-I178 HydrophobicContact CG2-CG2 4.2Å; I115-S179 PolarHBondContact N-O 3.26Å; I115-M180 HydrophobicContact CD1-CB 4.24Å; I115-M180 HydrophobicContact CD1-CE 3.67Å; I115-M180 HydrophobicContact CD1-SD 3.78Å; I115-M180 HydrophobicContact CG1-CB 4.18Å; I115-M180 HydrophobicContact CG2-CB 4.25Å; I115-M180 HydrophobicContact CG2-SD 4.4Å
116	Q	84.8	Confident	90.3	Very high	58 Å²	58	37.4 Å²	37.4	27%	0.271	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-37.8	178.1	-63.9	-174.8	-65.2	0	0	111.6	G146 R173	Q116-G146 WeakPolarHBondContact O-CA 3.33Å; Q116-G146 PolarHBondContact O-N 3.45Å; Q116-R173 HydrophobicContact CB-CB 4.19Å; Q116-R173 PolarHBondContact N-O 2.99Å
117	D	84.3	Confident	89.5	Confident	16 Å²	16	42.4 Å²	42.4	9%	0.086	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	145	-178.1	-37.4	-13.3	0	0	0	109	L143 F144 Q172 R173 R985	D117-L143 HydrophobicContact CB-CD1 3.86Å; D117-L143 HydrophobicContact CB-CD2 3.91Å; D117-L143 HydrophobicContact CB-CG 3.89Å; D117-F144 CarbonylContact C-O 3.56Å; D117-F144 VanDerWaalsContact CA-O 3.3Å; D117-F144 WeakPolarHBondContact CA-O 3.42Å; D117-Q172 HydrophobicContact CB-CB 4.49Å; D117-Q172 PolarHBondContact O-N 3.5Å; D117-R173 HydrophobicContact CB-CB 4.25Å; D117-R173 PolarHBondContact N-O 3.36Å; D117-R173 PolarHBondContact O-N 3.33Å; D117-R173 IonicContact OD1-NH1 3.09Å; D117-R173 PolarHBondContact OD1-NH1 2.98Å; D117-R173 VanDerWaalsContact OD2-CD 3.28Å; D117-R173 WeakPolarHBondContact OD2-CD 3.21Å; D117-R173 IonicContact OD2-CZ 3.83Å; D117-R173 IonicContact OD2-NE 3.62Å; D117-R173 IonicContact OD2-NH1 3.91Å; D117-R173 PolarHBondContact OD2-NH1 3.19Å; D117-R985 IonicContact OD2-NH1 2.86Å; D117-R985 PolarHBondContact OD2-NH1 2.92Å
118	Y	91.7	Very high	88.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	152.5	179.4	63.2	-83.8	0	0	0	114.2	I103 T105 I115 I120 F144 N156 L169 N170	I103-Y118 WeakPolarHBondContact CG2-OH 3.45Å; T105-Y118 HydrophobicContact CG2-CE1 3.86Å; T105-Y118 HydrophobicContact CG2-CE2 4.46Å; T105-Y118 WeakPolarHBondContact CG2-OH 3.42Å; I115-Y118 HydrophobicContact CD1-CD1 3.51Å; I115-Y118 HydrophobicContact CD1-CE1 4.12Å; I115-Y118 HydrophobicContact CD1-CG 3.91Å; I115-Y118 HydrophobicContact CG1-CD1 4.43Å; Y118-I120 HydrophobicContact CD2-CG1 3.95Å; Y118-I120 HydrophobicContact CE2-CD1 3.85Å; Y118-I120 HydrophobicContact CE2-CG1 3.69Å; Y118-F144 HydrophobicContact CD1-CB 4.24Å; Y118-F144 WeakPolarHBondContact CD1-O 3.44Å; Y118-F144 HydrophobicContact CD2-CB 4.16Å; Y118-F144 HydrophobicContact CE1-CB 3.87Å; Y118-F144 HydrophobicContact CE2-CB 3.79Å; Y118-F144 HydrophobicContact CE2-CD2 4.43Å; Y118-F144 HydrophobicContact CE2-CG 4.24Å; Y118-F144 HydrophobicContact CG-CB 4.39Å; Y118-F144 PolarHBondContact N-O 2.98Å; Y118-F144 PolarHBondContact O-N 2.91Å; Y118-N156 PolarHBondContact OH-ND2 2.81Å; Y118-L169 HydrophobicContact CD2-CB 4.27Å; Y118-L169 HydrophobicContact CD2-CD2 3.65Å; Y118-L169 HydrophobicContact CD2-CG 3.66Å; Y118-L169 HydrophobicContact CE2-CD2 3.39Å; Y118-L169 HydrophobicContact CE2-CG 3.71Å; Y118-L169 HydrophobicContact CG-CD2 4.42Å; Y118-N170 CarbonylContact C-O 3.49Å; Y118-N170 VanDerWaalsContact CA-O 3.31Å; Y118-N170 WeakPolarHBondContact CA-O 3.43Å; Y118-N170 WeakPolarHBondContact CB-O 3.27Å
119	Y	91.8	Very high	87.9	Confident	33 Å²	33	45.1 Å²	45.1	13%	0.129	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	153.6	168.8	-69.4	-57.8	0	0	0	111.5	I133 P141 L142 L143 L169 N170 Q172	Y119-I133 HydrophobicContact CD1-CD1 4Å; Y119-I133 HydrophobicContact CG-CD1 3.92Å; Y119-P141 HydrophobicContact CD1-CB 3.85Å; Y119-P141 HydrophobicContact CE1-CB 3.48Å; Y119-P141 VanDerWaalsContact CE1-CB 3.48Å; Y119-P141 WeakPolarHBondContact CE1-O 2.97Å; Y119-L142 WeakPolarHBondContact CD1-O 3.24Å; Y119-L143 HydrophobicContact CD1-CB 4.39Å; Y119-L143 HydrophobicContact CD1-CD1 4.1Å; Y119-L143 HydrophobicContact CD2-CD1 4.45Å; Y119-L143 HydrophobicContact CE1-CB 3.77Å; Y119-L143 HydrophobicContact CE1-CD1 3.83Å; Y119-L143 HydrophobicContact CE1-CG 4.41Å; Y119-L143 HydrophobicContact CE2-CD1 4.21Å; Y119-L143 HydrophobicContact CG-CD1 4.38Å; Y119-L169 WeakPolarHBondContact O-CA 3.38Å; Y119-N170 PolarHBondContact N-O 3.1Å; Y119-N170 PolarHBondContact O-N 2.93Å; Y119-Q172 HydrophobicContact CD2-CG 3.44Å; Y119-Q172 VanDerWaalsContact CD2-CG 3.44Å; Y119-Q172 HydrophobicContact CE2-CG 3.54Å; Y119-Q172 HydrophobicContact CG-CG 4.29Å
120	I	95.1	Very high	87.2	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.2	173	-58.4	178.7	0	0	0	109.3	I103 Y118 I133 I134 F144 F158 I167 R168 L169	I103-I120 HydrophobicContact CG2-CD1 3.99Å; Y118-I120 HydrophobicContact CD2-CG1 3.95Å; Y118-I120 HydrophobicContact CE2-CD1 3.85Å; Y118-I120 HydrophobicContact CE2-CG1 3.69Å; I120-I133 WeakPolarHBondContact O-CA 3.25Å; I120-I134 HydrophobicContact CB-CD1 3.78Å; I120-I134 HydrophobicContact CB-CG1 4.05Å; I120-I134 HydrophobicContact CD1-CD1 4.11Å; I120-I134 HydrophobicContact CG2-CD1 3.67Å; I120-I134 HydrophobicContact CG2-CG1 4.06Å; I120-I134 PolarHBondContact O-N 2.84Å; I120-F144 HydrophobicContact CB-CD2 4.41Å; I120-F144 HydrophobicContact CB-CE2 4.02Å; I120-F144 HydrophobicContact CD1-CD1 4.47Å; I120-F144 HydrophobicContact CD1-CD2 3.67Å; I120-F144 HydrophobicContact CD1-CE1 4.32Å; I120-F144 HydrophobicContact CD1-CE2 3.49Å; I120-F144 VanDerWaalsContact CD1-CE2 3.49Å; I120-F144 HydrophobicContact CD1-CG 4.15Å; I120-F144 HydrophobicContact CD1-CZ 3.82Å; I120-F144 HydrophobicContact CG1-CD2 3.68Å; I120-F144 HydrophobicContact CG1-CE2 3.68Å; I120-F144 HydrophobicContact CG1-CG 4.49Å; I120-F144 HydrophobicContact CG1-CZ 4.49Å; I120-F158 HydrophobicContact CD1-CE1 3.54Å; I120-F158 HydrophobicContact CD1-CZ 3.64Å; I120-I167 HydrophobicContact CG2-CD1 3.72Å; I120-I167 HydrophobicContact CG2-CG1 3.75Å; I120-R168 WeakPolarHBondContact CA-O 3.33Å; I120-L169 HydrophobicContact CG1-CD1 4.26Å; I120-L169 HydrophobicContact CG1-CG 4.27Å
121	Y	94.2	Very high	87.1	Confident	70 Å²	70	40.6 Å²	40.6	28%	0.275	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	143.3	169.5	-62.8	-97.8	0	0	0	109.2	W131 S132 I133 I167 R168 N170	Y121-W131 HydrophobicContact CD1-CB 4.17Å; Y121-S132 CarbonylContact C-O 3.52Å; Y121-S132 WeakPolarHBondContact CA-O 3.44Å; Y121-I133 HydrophobicContact CD1-CB 4.04Å; Y121-I133 HydrophobicContact CD1-CD1 4.34Å; Y121-I133 HydrophobicContact CD1-CG1 4.36Å; Y121-I133 HydrophobicContact CE1-CB 4.07Å; Y121-I133 HydrophobicContact CE1-CD1 3.75Å; Y121-I133 HydrophobicContact CE1-CG1 4.24Å; Y121-I133 HydrophobicContact CE2-CD1 4.11Å; Y121-I167 CarbonylContact O-C 3.37Å; Y121-I167 WeakPolarHBondContact O-CA 3.41Å; Y121-R168 PolarHBondContact N-O 3.11Å; Y121-R168 PolarHBondContact O-N 2.91Å; Y121-N170 HydrophobicContact CD2-CB 3.96Å; Y121-N170 HydrophobicContact CE2-CB 3.64Å
122	Y	94.1	Very high	87	Confident	10 Å²	10	40.7 Å²	40.7	4%	0.039	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	160.1	178.3	71.6	-80.5	0	0	0	111.4	S132 I134 I162 V163 A164 Y166 R302	Y122-S132 PolarHBondContact N-O 3.35Å; Y122-S132 PolarHBondContact O-N 3.05Å; Y122-I134 HydrophobicContact CD1-CG1 3.8Å; Y122-I134 HydrophobicContact CE1-CG1 3.86Å; Y122-I162 HydrophobicContact CD1-CD1 3.88Å; Y122-I162 HydrophobicContact CD2-CB 4.23Å; Y122-I162 HydrophobicContact CD2-CD1 4.01Å; Y122-I162 HydrophobicContact CE1-CG2 4.18Å; Y122-I162 HydrophobicContact CE2-CB 4.11Å; Y122-I162 HydrophobicContact CE2-CG2 4.37Å; Y122-I162 HydrophobicContact CG-CD1 3.59Å; Y122-V163 WeakPolarHBondContact CD2-O 3.47Å; Y122-A164 HydrophobicContact CD2-CB 4.12Å; Y122-A164 HydrophobicContact CG-CB 4.48Å; Y122-Y166 CarbonylContact C-O 3.6Å; Y122-Y166 VanDerWaalsContact CA-O 3.22Å; Y122-Y166 WeakPolarHBondContact CA-O 3.37Å; Y122-R302 VanDerWaalsContact OH-CZ 3.27Å; Y122-R302 PolarHBondContact OH-NH1 3.02Å; Y122-R302 PolarHBondContact OH-NH2 3.32Å
123	T	90.5	Very high	86.8	Confident	6 Å²	6	33.6 Å²	33.6	4%	0.037	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	144.1	171	-176.6	0	0	0	0	111	S125 P128 H130 W131 R165 Y166	T123-S125 PolarHBondContact OG1-N 2.98Å; T123-S125 PolarHBondContact OG1-OG 3.06Å; T123-P128 HydrophobicContact CG2-CB 4.33Å; T123-H130 WeakPolarHBondContact CB-O 3.27Å; T123-H130 PolarHBondContact OG1-O 2.99Å; T123-W131 HydrophobicContact CG2-CD2 4.27Å; T123-W131 HydrophobicContact CG2-CE3 4.12Å; T123-W131 HydrophobicContact CG2-CZ3 4.27Å; T123-R165 PolarHBondContact O-N 3.46Å; T123-Y166 HydrophobicContact CG2-CD2 4.08Å; T123-Y166 HydrophobicContact CG2-CG 4.34Å; T123-Y166 PolarHBondContact N-O 3.29Å; T123-Y166 PolarHBondContact O-N 3.48Å
124	D	88.4	Confident	86.5	Confident	21 Å²	21	32.7 Å²	32.7	11%	0.112	16%	0.161	C	C	.	.			trans	-97.5	0.3	176.5	67	0.7	0	0	0	113.1	R97 V163 R223 W284	R97-D124 HydrophobicContact CG-CB 4.42Å; D124-V163 HydrophobicContact CB-CG1 4.19Å; D124-R223 IonicContact OD2-CZ 2.76Å; D124-R223 IonicContact OD2-NH1 2.71Å; D124-R223 PolarHBondContact OD2-NH1 3.01Å; D124-R223 IonicContact OD2-NH2 3.81Å; D124-R223 PolarHBondContact OD2-NH2 3.35Å; D124-W284 VanDerWaalsContact CG-CD1 3.47Å; D124-W284 VanDerWaalsContact OD2-CB 3.26Å; D124-W284 WeakPolarHBondContact OD2-CB 3.2Å; D124-W284 VanDerWaalsContact OD2-CG 3.28Å
125	S	83.7	Confident	85.8	Confident	12 Å²	12	34.6 Å²	34.6	8%	0.084	17%	0.17	C	C	.	.	S	Bend	trans	-65.9	156.2	174.5	62.8	0	0	0	0	111.7	T123 E127	T123-S125 PolarHBondContact OG1-N 2.98Å; T123-S125 PolarHBondContact OG1-OG 3.06Å; S125-E127 PolarHBondContact O-N 3.46Å; S125-E127 PolarHBondContact OG-O 2.02Å
126	N	83.1	Confident	84.6	Confident	95 Å²	95	35 Å²	35	51%	0.508	17%	0.172	S	C	.	.	S	Bend	trans	-71.5	-20	176.5	-77.4	-32.1	0	0	0	113.5	R165 Y166	N126-R165 VanDerWaalsContact CA-NH1 3.28Å; N126-R165 VanDerWaalsContact O-CZ 3.26Å; N126-R165 PolarHBondContact O-NH1 3.4Å; N126-R165 VanDerWaalsContact O-NH1 3.15Å; N126-R165 PolarHBondContact O-NH2 3.43Å; N126-R165 PolarHBondContact OD1-NH1 2.99Å; N126-Y166 PolarHBondContact O-OH 2.91Å
127	E	79	Confident	83.8	Confident	109 Å²	109	35 Å²	35	51%	0.509	18%	0.175	S	C	.	.	S	Bend	trans	-126.8	130.5	177	-62.6	-172.4	174.6	0	0	109.2	S125 I129	S125-E127 PolarHBondContact O-N 3.46Å; S125-E127 PolarHBondContact OG-O 2.02Å; E127-I129 HydrophobicContact CB-CD1 3.81Å; E127-I129 HydrophobicContact CB-CG1 4.01Å; E127-I129 PolarHBondContact O-N 2.7Å; E127-I129 WeakPolarHBondContact OE2-CD1 3.37Å
128	P	81.2	Confident	82.6	Confident	46 Å²	46	38 Å²	38	30%	0.299	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	61.7	-170.6	32.5	-35.2	0	0	0	113	T123 W131 Y166	T123-P128 HydrophobicContact CG2-CB 4.33Å; P128-W131 HydrophobicContact CB-CH2 4.3Å; P128-W131 HydrophobicContact CB-CZ2 3.57Å; P128-W131 PolarHBondContact O-NE1 3.46Å; P128-Y166 HydrophobicContact CB-CD1 3.82Å; P128-Y166 HydrophobicContact CB-CD2 3.81Å; P128-Y166 HydrophobicContact CB-CE1 4.13Å; P128-Y166 HydrophobicContact CB-CE2 4.14Å; P128-Y166 HydrophobicContact CB-CG 3.66Å; P128-Y166 HydrophobicContact CG-CD1 4.02Å; P128-Y166 HydrophobicContact CG-CD2 4.38Å; P128-Y166 HydrophobicContact CG-CE1 3.84Å; P128-Y166 HydrophobicContact CG-CE2 4.24Å; P128-Y166 HydrophobicContact CG-CG 4.29Å
129	I	71	Confident	81.5	Confident	62 Å²	62	38.3 Å²	38.3	32%	0.318	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-53.9	-173.6	-57.4	171.3	0	0	0	110	E127 I426	E127-I129 HydrophobicContact CB-CD1 3.81Å; E127-I129 HydrophobicContact CB-CG1 4.01Å; E127-I129 PolarHBondContact O-N 2.7Å; E127-I129 WeakPolarHBondContact OE2-CD1 3.37Å; I129-I426 HydrophobicContact CD1-CD1 3.17Å; I129-I426 HydrophobicContact CD1-CG1 3.52Å
130	H	73.8	Confident	79.9	Confident	27 Å²	27	38 Å²	38	13%	0.125	19%	0.193	C	C	.	.	S	Bend	trans	-94.8	127.8	175.7	-52.2	-41.5	0	0	0	109.5	T123 Q283 G605 S606	T123-H130 WeakPolarHBondContact CB-O 3.27Å; T123-H130 PolarHBondContact OG1-O 2.99Å; H130-Q283 HydrophobicContact CB-CG 4.46Å; H130-Q283 VanDerWaalsContact CB-NE2 3.34Å; H130-G605 PolarHBondContact CE1-O 3.09Å; H130-S606 WeakPolarHBondContact CE1-CB 3.37Å; H130-S606 PolarHBondContact CE1-OG 3.42Å; H130-S606 VanDerWaalsContact CE1-OG 3.25Å; H130-S606 WeakPolarHBondContact ND1-CB 3.42Å; H130-S606 PolarHBondContact ND1-OG 3.4Å; H130-S606 VanDerWaalsContact ND1-OG 3.14Å
131	W	83.1	Confident	78.8	Confident	37 Å²	37	39.6 Å²	39.6	14%	0.14	20%	0.204	C	C	.	.			trans	-118.5	123	-177.4	-70.8	88.2	0	0	0	109.5	Q91 Y121 T123 P128 R168	Q91-W131 HydrophobicContact CG-CH2 3.99Å; Y121-W131 HydrophobicContact CD1-CB 4.17Å; T123-W131 HydrophobicContact CG2-CD2 4.27Å; T123-W131 HydrophobicContact CG2-CE3 4.12Å; T123-W131 HydrophobicContact CG2-CZ3 4.27Å; P128-W131 HydrophobicContact CB-CH2 4.3Å; P128-W131 HydrophobicContact CB-CZ2 3.57Å; P128-W131 PolarHBondContact O-NE1 3.46Å; W131-R168 HydrophobicContact CE3-CB 4.42Å; W131-R168 HydrophobicContact CH2-CB 3.79Å; W131-R168 HydrophobicContact CZ3-CB 3.7Å
132	S	85.4	Confident	78	Confident	30 Å²	30	38 Å²	38	21%	0.21	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	145.2	162	-68.1	0	0	0	0	108.6	Y121 Y122	Y121-S132 CarbonylContact C-O 3.52Å; Y121-S132 WeakPolarHBondContact CA-O 3.44Å; Y122-S132 PolarHBondContact N-O 3.35Å; Y122-S132 PolarHBondContact O-N 3.05Å
133	I	86.7	Confident	77.2	Confident	23 Å²	23	38.5 Å²	38.5	12%	0.118	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	140.6	168.2	-171.6	158.9	0	0	0	107.6	Y119 I120 Y121 K135 P141	Y119-I133 HydrophobicContact CD1-CD1 4Å; Y119-I133 HydrophobicContact CG-CD1 3.92Å; I120-I133 WeakPolarHBondContact O-CA 3.25Å; Y121-I133 HydrophobicContact CD1-CB 4.04Å; Y121-I133 HydrophobicContact CD1-CD1 4.34Å; Y121-I133 HydrophobicContact CD1-CG1 4.36Å; Y121-I133 HydrophobicContact CE1-CB 4.07Å; Y121-I133 HydrophobicContact CE1-CD1 3.75Å; Y121-I133 HydrophobicContact CE1-CG1 4.24Å; Y121-I133 HydrophobicContact CE2-CD1 4.11Å; I133-K135 HydrophobicContact CG2-CG 4.1Å; I133-K135 PolarHBondContact O-N 3.15Å; I133-P141 HydrophobicContact CD1-CB 3.51Å; I133-P141 HydrophobicContact CD1-CG 3.88Å; I133-P141 HydrophobicContact CG1-CB 4.08Å; I133-P141 HydrophobicContact CG1-CG 4.49Å; I133-P141 HydrophobicContact CG2-CG 4.09Å
134	I	87.4	Confident	77	Confident	7 Å²	7	38.7 Å²	38.7	4%	0.036	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-62.4	127.5	172	-59.5	-173.7	0	0	0	107.6	I120 Y122 L142 F144 F158 I162	I120-I134 HydrophobicContact CB-CD1 3.78Å; I120-I134 HydrophobicContact CB-CG1 4.05Å; I120-I134 HydrophobicContact CD1-CD1 4.11Å; I120-I134 HydrophobicContact CG2-CD1 3.67Å; I120-I134 HydrophobicContact CG2-CG1 4.06Å; I120-I134 PolarHBondContact O-N 2.84Å; Y122-I134 HydrophobicContact CD1-CG1 3.8Å; Y122-I134 HydrophobicContact CE1-CG1 3.86Å; I134-L142 HydrophobicContact CG2-CB 4.26Å; I134-L142 HydrophobicContact CG2-CD2 4.2Å; I134-L142 PolarHBondContact O-N 2.97Å; I134-F144 HydrophobicContact CB-CE2 4.15Å; I134-F144 HydrophobicContact CB-CZ 4.33Å; I134-F144 HydrophobicContact CD1-CE2 4.19Å; I134-F144 HydrophobicContact CD1-CZ 4Å; I134-F144 HydrophobicContact CG2-CE2 4.25Å; I134-F144 HydrophobicContact CG2-CZ 3.99Å; I134-F158 HydrophobicContact CD1-CD1 4.06Å; I134-F158 HydrophobicContact CD1-CD2 4.31Å; I134-F158 HydrophobicContact CD1-CE1 3.73Å; I134-F158 HydrophobicContact CD1-CE2 3.98Å; I134-F158 HydrophobicContact CD1-CG 4.36Å; I134-F158 HydrophobicContact CD1-CZ 3.69Å; I134-I162 HydrophobicContact CD1-CD1 3.96Å; I134-I162 HydrophobicContact CD1-CG2 4.25Å; I134-I162 HydrophobicContact CG1-CD1 4.39Å; I134-I162 HydrophobicContact CG1-CG2 4.3Å
135	K	79.5	Confident	76.7	Confident	64 Å²	64	41 Å²	41	28%	0.278	22%	0.215	S	C	.	.	B	Isolated β-bridge	trans	-113.4	153.5	-179.8	-66	166.8	-173.4	175	0	110.8	I133 G139 Q140 I303	I133-K135 HydrophobicContact CG2-CG 4.1Å; I133-K135 PolarHBondContact O-N 3.15Å; K135-G139 WeakPolarHBondContact CD-O 3.27Å; K135-Q140 CarbonylContact C-O 3.57Å; K135-Q140 WeakPolarHBondContact CA-O 3.44Å; K135-Q140 WeakPolarHBondContact CB-O 3.4Å; K135-I303 HydrophobicContact CD-CD1 3.98Å; K135-I303 HydrophobicContact CD-CG1 4.46Å
136	D	68.8	Low	76.9	Confident	9 Å²	9	40.6 Å²	40.6	5%	0.048	21%	0.214	C	C	.	.			trans	-71.4	175.6	164.8	70.1	7	0	0	0	111.5	L138 G139 Q140 F890 R964	D136-L138 PolarHBondContact O-N 2.89Å; D136-L138 VanDerWaalsContact OD1-CA 3.3Å; D136-L138 WeakPolarHBondContact OD1-CA 3.47Å; D136-L138 WeakPolarHBondContact OD1-CB 3.49Å; D136-L138 PolarHBondContact OD1-N 2.86Å; D136-G139 PolarHBondContact O-N 3.04Å; D136-G139 PolarHBondContact OD1-N 2.84Å; D136-Q140 PolarHBondContact N-O 2.98Å; D136-Q140 PolarHBondContact OD1-N 2.94Å; D136-F890 HydrophobicContact CB-CE2 4.13Å; D136-F890 WeakPolarHBondContact OD2-CD2 3.1Å; D136-F890 WeakPolarHBondContact OD2-CE2 3.05Å; D136-F890 WeakPolarHBondContact OD2-CZ 3.45Å; D136-R964 IonicContact OD2-NH2 3.52Å
137	D	67.5	Low	77.3	Confident	59 Å²	59	36.3 Å²	36.3	32%	0.316	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-11.5	178.6	-73.4	2.1	0	0	0	113.3	R302 K304	D137-R302 WeakPolarHBondContact CA-O 3.13Å; D137-K304 HydrophobicContact CB-CD 4.3Å; D137-K304 PolarHBondContact O-N 3.39Å; D137-K304 IonicContact OD1-NZ 2.72Å; D137-K304 WeakPolarHBondContact OD2-CE 3.42Å; D137-K304 IonicContact OD2-NZ 2.79Å; D137-K304 PolarHBondContact OD2-NZ 3.25Å
138	L	59.6	Low	77.6	Confident	78 Å²	78	36.3 Å²	36.3	41%	0.408	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	8	-179.3	-57.8	169.6	0	0	0	112.8	D136 R964	D136-L138 PolarHBondContact O-N 2.89Å; D136-L138 VanDerWaalsContact OD1-CA 3.3Å; D136-L138 WeakPolarHBondContact OD1-CA 3.47Å; D136-L138 WeakPolarHBondContact OD1-CB 3.49Å; D136-L138 PolarHBondContact OD1-N 2.86Å; L138-R964 VanDerWaalsContact CD1-NH2 3.28Å
139	G	66.9	Low	77.8	Confident	7 Å²	7	36.5 Å²	36.5	7%	0.072	20%	0.196	C	C	.	.	S	Bend	trans	82.1	9.4	176	0	0	0	0	0	117	K135 D136	K135-G139 WeakPolarHBondContact CD-O 3.27Å; D136-G139 PolarHBondContact O-N 3.04Å; D136-G139 PolarHBondContact OD1-N 2.84Å
140	Q	59.5	Low	78.7	Confident	26 Å²	26	35 Å²	35	12%	0.121	19%	0.189	C	C	.	.	S	Bend	trans	-91.1	142.5	177.8	-63.2	-58	-49.3	0	0	112	K135 D136 L142 R964	K135-Q140 CarbonylContact C-O 3.57Å; K135-Q140 WeakPolarHBondContact CA-O 3.44Å; K135-Q140 WeakPolarHBondContact CB-O 3.4Å; D136-Q140 PolarHBondContact N-O 2.98Å; D136-Q140 PolarHBondContact OD1-N 2.94Å; Q140-L142 PolarHBondContact O-N 3.45Å; Q140-R964 VanDerWaalsContact CG-CZ 3.44Å
141	P	71.8	Confident	79.3	Confident	34 Å²	34	36.9 Å²	36.9	22%	0.221	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-44.3	114.9	166	-34	41	0	0	0	112.7	Y119 I133 L143	Y119-P141 HydrophobicContact CD1-CB 3.85Å; Y119-P141 HydrophobicContact CE1-CB 3.48Å; Y119-P141 VanDerWaalsContact CE1-CB 3.48Å; Y119-P141 WeakPolarHBondContact CE1-O 2.97Å; I133-P141 HydrophobicContact CD1-CB 3.51Å; I133-P141 HydrophobicContact CD1-CG 3.88Å; I133-P141 HydrophobicContact CG1-CB 4.08Å; I133-P141 HydrophobicContact CG1-CG 4.49Å; I133-P141 HydrophobicContact CG2-CG 4.09Å; P141-L143 PolarHBondContact O-N 3.35Å
142	L	76.9	Confident	79.6	Confident	35 Å²	35	38.9 Å²	38.9	18%	0.183	22%	0.216	C	C	.	.			trans	-74.5	114.7	178.1	-178.2	59.5	0	0	0	109.1	Y119 I134 Q140 F144	Y119-L142 WeakPolarHBondContact CD1-O 3.24Å; I134-L142 HydrophobicContact CG2-CB 4.26Å; I134-L142 HydrophobicContact CG2-CD2 4.2Å; I134-L142 PolarHBondContact O-N 2.97Å; Q140-L142 PolarHBondContact O-N 3.45Å; L142-F144 HydrophobicContact CB-CE2 4.19Å; L142-F144 HydrophobicContact CB-CZ 4.44Å; L142-F144 HydrophobicContact CD2-CE1 3.79Å; L142-F144 HydrophobicContact CD2-CE2 4.09Å; L142-F144 HydrophobicContact CD2-CZ 3.52Å; L142-F144 HydrophobicContact CG-CD2 4.47Å; L142-F144 HydrophobicContact CG-CE1 4.3Å; L142-F144 HydrophobicContact CG-CE2 4.04Å; L142-F144 HydrophobicContact CG-CZ 3.97Å; L142-F144 WeakPolarHBondContact O-CD2 3.36Å
143	L	77.3	Confident	79.9	Confident	21 Å²	21	39.1 Å²	39.1	11%	0.11	22%	0.216	C	C	.	.			trans	-85.6	114.6	175.3	-174.2	67.1	0	0	0	109	D117 Y119 P141 Q172	D117-L143 HydrophobicContact CB-CD1 3.86Å; D117-L143 HydrophobicContact CB-CD2 3.91Å; D117-L143 HydrophobicContact CB-CG 3.89Å; Y119-L143 HydrophobicContact CD1-CB 4.39Å; Y119-L143 HydrophobicContact CD1-CD1 4.1Å; Y119-L143 HydrophobicContact CD2-CD1 4.45Å; Y119-L143 HydrophobicContact CE1-CB 3.77Å; Y119-L143 HydrophobicContact CE1-CD1 3.83Å; Y119-L143 HydrophobicContact CE1-CG 4.41Å; Y119-L143 HydrophobicContact CE2-CD1 4.21Å; Y119-L143 HydrophobicContact CG-CD1 4.38Å; P141-L143 PolarHBondContact O-N 3.35Å; L143-Q172 HydrophobicContact CD1-CB 3.89Å; L143-Q172 HydrophobicContact CD1-CG 3.75Å
144	F	86	Confident	80	Confident	11 Å²	11	41.3 Å²	41.3	5%	0.048	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	133.8	-178.5	-68.8	-89.1	0	0	0	111.3	D117 Y118 I120 I134 L142 G146 N156 F158	D117-F144 CarbonylContact C-O 3.56Å; D117-F144 VanDerWaalsContact CA-O 3.3Å; D117-F144 WeakPolarHBondContact CA-O 3.42Å; Y118-F144 HydrophobicContact CD1-CB 4.24Å; Y118-F144 WeakPolarHBondContact CD1-O 3.44Å; Y118-F144 HydrophobicContact CD2-CB 4.16Å; Y118-F144 HydrophobicContact CE1-CB 3.87Å; Y118-F144 HydrophobicContact CE2-CB 3.79Å; Y118-F144 HydrophobicContact CE2-CD2 4.43Å; Y118-F144 HydrophobicContact CE2-CG 4.24Å; Y118-F144 HydrophobicContact CG-CB 4.39Å; Y118-F144 PolarHBondContact N-O 2.98Å; Y118-F144 PolarHBondContact O-N 2.91Å; I120-F144 HydrophobicContact CB-CD2 4.41Å; I120-F144 HydrophobicContact CB-CE2 4.02Å; I120-F144 HydrophobicContact CD1-CD1 4.47Å; I120-F144 HydrophobicContact CD1-CD2 3.67Å; I120-F144 HydrophobicContact CD1-CE1 4.32Å; I120-F144 HydrophobicContact CD1-CE2 3.49Å; I120-F144 VanDerWaalsContact CD1-CE2 3.49Å; I120-F144 HydrophobicContact CD1-CG 4.15Å; I120-F144 HydrophobicContact CD1-CZ 3.82Å; I120-F144 HydrophobicContact CG1-CD2 3.68Å; I120-F144 HydrophobicContact CG1-CE2 3.68Å; I120-F144 HydrophobicContact CG1-CG 4.49Å; I120-F144 HydrophobicContact CG1-CZ 4.49Å; I134-F144 HydrophobicContact CB-CE2 4.15Å; I134-F144 HydrophobicContact CB-CZ 4.33Å; I134-F144 HydrophobicContact CD1-CE2 4.19Å; I134-F144 HydrophobicContact CD1-CZ 4Å; I134-F144 HydrophobicContact CG2-CE2 4.25Å; I134-F144 HydrophobicContact CG2-CZ 3.99Å; L142-F144 HydrophobicContact CB-CE2 4.19Å; L142-F144 HydrophobicContact CB-CZ 4.44Å; L142-F144 HydrophobicContact CD2-CE1 3.79Å; L142-F144 HydrophobicContact CD2-CE2 4.09Å; L142-F144 HydrophobicContact CD2-CZ 3.52Å; L142-F144 HydrophobicContact CG-CD2 4.47Å; L142-F144 HydrophobicContact CG-CE1 4.3Å; L142-F144 HydrophobicContact CG-CE2 4.04Å; L142-F144 HydrophobicContact CG-CZ 3.97Å; L142-F144 WeakPolarHBondContact O-CD2 3.36Å; F144-G146 PolarHBondContact O-N 3.5Å; F144-N156 HydrophobicContact CD1-CB 3.75Å; F144-N156 HydrophobicContact CE1-CB 4.29Å; F144-F158 AromaticContact CE1-CD1 3.78Å; F144-F158 HydrophobicContact CE1-CD1 3.78Å; F144-F158 AromaticContact CE1-CE1 3.75Å; F144-F158 HydrophobicContact CE1-CE1 3.75Å; F144-F158 AromaticContact CZ-CD1 3.78Å; F144-F158 HydrophobicContact CZ-CD1 3.78Å; F144-F158 AromaticContact CZ-CE1 3.66Å; F144-F158 HydrophobicContact CZ-CE1 3.66Å
145	D	83.5	Confident	80.1	Confident	68 Å²	68	45.8 Å²	45.8	36%	0.364	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	122.4	168.7	-67.5	-30.7	0	0	0	109.9	K154 N156	D145-K154 VanDerWaalsContact O-CE 3.29Å; D145-K154 WeakPolarHBondContact O-CE 3.02Å; D145-K154 WeakPolarHBondContact O-CG 3.1Å; D145-N156 PolarHBondContact O-ND2 2.86Å
146	G	87.4	Confident	80.6	Confident	5 Å²	5	43.7 Å²	43.7	5%	0.052	24%	0.236	C	C	.	.			trans	-87.5	-136.9	170	0	0	0	0	0	112.4	Q116 F144 K154	Q116-G146 WeakPolarHBondContact O-CA 3.33Å; Q116-G146 PolarHBondContact O-N 3.45Å; F144-G146 PolarHBondContact O-N 3.5Å; G146-K154 VanDerWaalsContact O-CG 3.24Å; G146-K154 WeakPolarHBondContact O-CG 3.38Å
147	N	91.4	Very high	81.4	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.027	26%	0.256	C	S	.	.			trans	-94.1	154.8	-170.7	-56.6	105.2	0	0	0	112.1	T105 Q106 G107 W114 I115 D149 T152	T105-N147 PolarHBondContact O-ND2 3.08Å; Q106-N147 WeakPolarHBondContact CA-ND2 3.43Å; Q106-N147 WeakPolarHBondContact CA-OD1 3.07Å; Q106-N147 PolarHBondContact N-OD1 2.78Å; G107-N147 PolarHBondContact N-OD1 2.86Å; W114-N147 HydrophobicContact CB-CB 4.04Å; W114-N147 HydrophobicContact CG-CB 4.15Å; W114-N147 PolarHBondContact NE1-O 3.31Å; W114-N147 VanDerWaalsContact NE1-O 3.08Å; I115-N147 PolarHBondContact O-N 3.21Å; N147-D149 WeakPolarHBondContact CB-O 3.38Å; N147-T152 PolarHBondContact ND2-O 2.96Å
148	V	85.7	Confident	82.2	Confident	108 Å²	108	45.4 Å²	45.4	66%	0.655	25%	0.245	S	C	*	.	S	Bend	trans	-106.6	-10.4	173.2	-64	0	0	0	0	112.5	W114	W114-V148 VanDerWaalsContact CZ2-O 3.22Å; W114-V148 WeakPolarHBondContact CZ2-O 3.36Å
149	D	85.7	Confident	83.1	Confident	50 Å²	50	47.2 Å²	47.2	27%	0.267	26%	0.259	S	S	.	.	S	Bend	trans	-145.7	-173	179	67.7	26.4	0	0	0	110.6	W114 N147 N151 T152	W114-D149 WeakPolarHBondContact CB-O 3.18Å; W114-D149 VanDerWaalsContact CE3-C 3.47Å; W114-D149 VanDerWaalsContact CG-O 3.24Å; N147-D149 WeakPolarHBondContact CB-O 3.38Å; D149-N151 PolarHBondContact OD1-N 3.36Å; D149-T152 WeakPolarHBondContact OD1-CA 3.09Å; D149-T152 WeakPolarHBondContact OD1-CB 3Å; D149-T152 PolarHBondContact OD1-N 2.98Å; D149-T152 PolarHBondContact OD1-OG1 3.04Å; D149-T152 VanDerWaalsContact OD2-CB 3.25Å; D149-T152 WeakPolarHBondContact OD2-CB 3.29Å; D149-T152 PolarHBondContact OD2-OG1 2.77Å
150	D	88.1	Confident	83.8	Confident	32 Å²	32	49.9 Å²	49.9	17%	0.171	27%	0.267	C	S	.	.	S	Bend	trans	-95.8	-0	-173.6	73.4	-6.8	0	0	0	115	G107 R108 Q109 G110 A111 R112 W114 R181	G107-D150 CarbonylContact C-O 3.54Å; G107-D150 VanDerWaalsContact O-O 3.04Å; R108-D150 CarbonylContact C-O 3.55Å; R108-D150 VanDerWaalsContact C-O 3.24Å; R108-D150 PolarHBondContact N-O 3Å; R108-D150 WeakPolarHBondContact O-CB 3.37Å; Q109-D150 WeakPolarHBondContact CA-O 3.16Å; Q109-D150 PolarHBondContact N-O 3.21Å; Q109-D150 VanDerWaalsContact N-O 3.1Å; G110-D150 WeakPolarHBondContact CA-OD2 3.49Å; G110-D150 PolarHBondContact N-OD2 3.09Å; A111-D150 PolarHBondContact N-OD2 2.59Å; R112-D150 PolarHBondContact N-OD2 2.94Å; R112-D150 VanDerWaalsContact N-OD2 3.14Å; W114-D150 HydrophobicContact CE3-CB 3.87Å; W114-D150 HydrophobicContact CZ3-CB 4.21Å; D150-R181 PolarHBondContact O-NH2 3.42Å
151	N	87.7	Confident	85.1	Confident	65 Å²	65	51.8 Å²	51.8	35%	0.348	28%	0.282	S	S	.	.	S	Bend	trans	-147.4	-11.7	-172.5	-157	45.6	0	0	0	116.6	Q106 Q109 D149 R181	Q106-N151 PolarHBondContact NE2-O 3Å; Q106-N151 PolarHBondContact NE2-OD1 3.42Å; Q109-N151 HydrophobicContact CG-CB 4.45Å; D149-N151 PolarHBondContact OD1-N 3.36Å; N151-R181 PolarHBondContact OD1-NH2 2.65Å; N151-R181 VanDerWaalsContact OD1-NH2 3.08Å
152	T	88.7	Confident	86	Confident	79 Å²	79	50.1 Å²	50.1	49%	0.485	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-78.1	135.2	173.6	-60.9	0	0	0	0	109.9	N147 D149	N147-T152 PolarHBondContact ND2-O 2.96Å; D149-T152 WeakPolarHBondContact OD1-CA 3.09Å; D149-T152 WeakPolarHBondContact OD1-CB 3Å; D149-T152 PolarHBondContact OD1-N 2.98Å; D149-T152 PolarHBondContact OD1-OG1 3.04Å; D149-T152 VanDerWaalsContact OD2-CB 3.25Å; D149-T152 WeakPolarHBondContact OD2-CB 3.29Å; D149-T152 PolarHBondContact OD2-OG1 2.77Å
153	V	91.1	Very high	86.7	Confident	35 Å²	35	49 Å²	49	21%	0.212	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-80.9	124.9	176.4	-178.7	0	0	0	0	109.7	L61 H62 A104 T105 Q106 F155	L61-V153 HydrophobicContact CD1-CG1 4Å; L61-V153 HydrophobicContact CD1-CG2 4.02Å; L61-V153 HydrophobicContact CD2-CG1 4.26Å; L61-V153 HydrophobicContact CG-CG2 4.49Å; H62-V153 VanDerWaalsContact CE1-CG2 3.45Å; H62-V153 WeakPolarHBondContact CE1-CG2 3.44Å; A104-V153 HydrophobicContact CB-CG1 3.71Å; T105-V153 WeakPolarHBondContact O-CA 3.33Å; Q106-V153 HydrophobicContact CB-CG2 4.38Å; Q106-V153 HydrophobicContact CG-CG2 4.14Å; V153-F155 HydrophobicContact CB-CE2 4.31Å; V153-F155 HydrophobicContact CG1-CD2 3.86Å; V153-F155 HydrophobicContact CG1-CE2 3.51Å; V153-F155 HydrophobicContact CG1-CZ 4.16Å
154	K	90.4	Very high	87.5	Confident	70 Å²	70	48 Å²	48	30%	0.304	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	121.5	170.9	174	73.3	177.3	-170.6	0	109.1	A104 T105 D145 G146 N156	A104-K154 CarbonylContact C-O 3.58Å; A104-K154 VanDerWaalsContact CA-O 3.27Å; A104-K154 WeakPolarHBondContact CA-O 3.27Å; T105-K154 PolarHBondContact N-O 3.1Å; T105-K154 PolarHBondContact O-N 3.16Å; D145-K154 VanDerWaalsContact O-CE 3.29Å; D145-K154 WeakPolarHBondContact O-CE 3.02Å; D145-K154 WeakPolarHBondContact O-CG 3.1Å; G146-K154 VanDerWaalsContact O-CG 3.24Å; G146-K154 WeakPolarHBondContact O-CG 3.38Å; K154-N156 WeakPolarHBondContact CE-OD1 3.41Å
155	F	89.7	Confident	87.9	Confident	101 Å²	101	49.3 Å²	49.3	44%	0.443	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	136.9	170.2	-76.8	-95.2	0	0	0	110.5	I103 A104 V153 F185	I103-F155 WeakPolarHBondContact O-CA 3.23Å; A104-F155 HydrophobicContact CB-CD1 4.06Å; A104-F155 HydrophobicContact CB-CE1 3.9Å; A104-F155 HydrophobicContact CB-CG 4.45Å; A104-F155 HydrophobicContact CB-CZ 4.13Å; V153-F155 HydrophobicContact CB-CE2 4.31Å; V153-F155 HydrophobicContact CG1-CD2 3.86Å; V153-F155 HydrophobicContact CG1-CE2 3.51Å; V153-F155 HydrophobicContact CG1-CZ 4.16Å; F155-F185 HydrophobicContact CD1-CE2 4.09Å; F155-F185 HydrophobicContact CE1-CD2 4.3Å; F155-F185 HydrophobicContact CE1-CE1 4.32Å; F155-F185 AromaticContact CE1-CE2 3.5Å; F155-F185 HydrophobicContact CE1-CE2 3.5Å; F155-F185 VanDerWaalsContact CE1-CE2 3.5Å; F155-F185 AromaticContact CE1-CZ 3.51Å; F155-F185 HydrophobicContact CE1-CZ 3.51Å; F155-F185 HydrophobicContact CZ-CE2 4.42Å; F155-F185 HydrophobicContact CZ-CZ 4.11Å
156	N	89.3	Confident	88.4	Confident	20 Å²	20	47 Å²	47	11%	0.107	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	115.6	169.4	-72.9	-48.5	0	0	0	109	S102 I103 Y118 F144 D145 K154	S102-N156 VanDerWaalsContact CA-O 3.27Å; S102-N156 WeakPolarHBondContact CA-O 3.34Å; S102-N156 VanDerWaalsContact CB-O 3.25Å; S102-N156 WeakPolarHBondContact CB-O 3.35Å; I103-N156 HydrophobicContact CG2-CB 3.9Å; I103-N156 PolarHBondContact N-O 2.82Å; I103-N156 PolarHBondContact O-N 2.9Å; Y118-N156 PolarHBondContact OH-ND2 2.81Å; F144-N156 HydrophobicContact CD1-CB 3.75Å; F144-N156 HydrophobicContact CE1-CB 4.29Å; D145-N156 PolarHBondContact O-ND2 2.86Å; K154-N156 WeakPolarHBondContact CE-OD1 3.41Å
157	N	85.1	Confident	88.8	Confident	85 Å²	85	46.8 Å²	46.8	46%	0.455	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	136.6	176.5	-61.5	-25.8	0	0	0	109.2	Y27 S102	Y27-N157 WeakPolarHBondContact CE1-OD1 3.44Å; Y27-N157 PolarHBondContact OH-ND2 2.86Å; S102-N157 WeakPolarHBondContact CB-OD1 3.33Å
158	F	85.1	Confident	89.1	Confident	19 Å²	19	48.9 Å²	48.9	8%	0.083	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	130.1	174.3	-52.4	-31.2	0	0	0	109.2	I100 Q101 I103 I120 I134 F144 Y160 I162	I100-F158 HydrophobicContact CB-CE2 4.23Å; I100-F158 HydrophobicContact CG2-CE2 3.73Å; I100-F158 WeakPolarHBondContact O-CD2 3.46Å; Q101-F158 PolarHBondContact O-N 3.2Å; I103-F158 HydrophobicContact CG2-CE1 4.17Å; I103-F158 HydrophobicContact CG2-CZ 4.28Å; I120-F158 HydrophobicContact CD1-CE1 3.54Å; I120-F158 HydrophobicContact CD1-CZ 3.64Å; I134-F158 HydrophobicContact CD1-CD1 4.06Å; I134-F158 HydrophobicContact CD1-CD2 4.31Å; I134-F158 HydrophobicContact CD1-CE1 3.73Å; I134-F158 HydrophobicContact CD1-CE2 3.98Å; I134-F158 HydrophobicContact CD1-CG 4.36Å; I134-F158 HydrophobicContact CD1-CZ 3.69Å; F144-F158 AromaticContact CE1-CD1 3.78Å; F144-F158 HydrophobicContact CE1-CD1 3.78Å; F144-F158 AromaticContact CE1-CE1 3.75Å; F144-F158 HydrophobicContact CE1-CE1 3.75Å; F144-F158 AromaticContact CZ-CD1 3.78Å; F144-F158 HydrophobicContact CZ-CD1 3.78Å; F144-F158 AromaticContact CZ-CE1 3.66Å; F144-F158 HydrophobicContact CZ-CE1 3.66Å; F158-Y160 VanDerWaalsContact CB-O 3.26Å; F158-Y160 WeakPolarHBondContact CB-O 3.38Å; F158-Y160 PolarHBondContact O-N 3.03Å; F158-I162 HydrophobicContact CD2-CG1 4.13Å; F158-I162 HydrophobicContact CE2-CD1 4.03Å; F158-I162 HydrophobicContact CE2-CG1 3.95Å
159	T	77	Confident	89.6	Confident	115 Å²	115	43.8 Å²	43.8	71%	0.706	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-54.5	-37.7	171.5	-48.7	0	0	0	0	110.8
160	Y	81.8	Confident	90	Very high	64 Å²	64	41.9 Å²	41.9	25%	0.251	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121	172.9	-63.6	-77.8	0	0	0	109.2	F158 R302 K304	F158-Y160 VanDerWaalsContact CB-O 3.26Å; F158-Y160 WeakPolarHBondContact CB-O 3.38Å; F158-Y160 PolarHBondContact O-N 3.03Å; Y160-R302 HydrophobicContact CD2-CB 4.04Å; Y160-R302 HydrophobicContact CD2-CG 3.77Å; Y160-R302 HydrophobicContact CG-CG 3.82Å; Y160-K304 WeakPolarHBondContact OH-CE 3.22Å; Y160-K304 PolarHBondContact OH-NZ 3.14Å
161	P	87.4	Confident	90.4	Very high	65 Å²	65	40.3 Å²	40.3	42%	0.422	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	146.2	172.1	-23.8	34	0	0	0	111.4	V99 I100 Q101	V99-P161 HydrophobicContact CG1-CB 3.55Å; I100-P161 CarbonylContact O-C 3.58Å; I100-P161 VanDerWaalsContact O-CA 3.26Å; I100-P161 WeakPolarHBondContact O-CA 3.29Å; Q101-P161 HydrophobicContact CG-CB 4.12Å; Q101-P161 HydrophobicContact CG-CG 4.11Å
162	I	90.7	Very high	90.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	148.8	178	59.1	167.2	0	0	0	110.7	V99 I100 Y122 I134 F158 A164 I167	V99-I162 CarbonylContact C-O 3.51Å; V99-I162 WeakPolarHBondContact CA-O 3.32Å; I100-I162 HydrophobicContact CB-CD1 4.42Å; I100-I162 HydrophobicContact CB-CG1 3.87Å; I100-I162 HydrophobicContact CD1-CD1 4.32Å; I100-I162 HydrophobicContact CG1-CG1 4.47Å; I100-I162 PolarHBondContact N-O 3.04Å; I100-I162 PolarHBondContact O-N 3.29Å; Y122-I162 HydrophobicContact CD1-CD1 3.88Å; Y122-I162 HydrophobicContact CD2-CB 4.23Å; Y122-I162 HydrophobicContact CD2-CD1 4.01Å; Y122-I162 HydrophobicContact CE1-CG2 4.18Å; Y122-I162 HydrophobicContact CE2-CB 4.11Å; Y122-I162 HydrophobicContact CE2-CG2 4.37Å; Y122-I162 HydrophobicContact CG-CD1 3.59Å; I134-I162 HydrophobicContact CD1-CD1 3.96Å; I134-I162 HydrophobicContact CD1-CG2 4.25Å; I134-I162 HydrophobicContact CG1-CD1 4.39Å; I134-I162 HydrophobicContact CG1-CG2 4.3Å; F158-I162 HydrophobicContact CD2-CG1 4.13Å; F158-I162 HydrophobicContact CE2-CD1 4.03Å; F158-I162 HydrophobicContact CE2-CG1 3.95Å; I162-A164 HydrophobicContact CD1-CB 4.42Å; I162-I167 HydrophobicContact CD1-CD1 4.25Å
163	V	91.6	Very high	90.2	Very high	10 Å²	10	38.5 Å²	38.5	6%	0.061	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	122.8	167.6	-179	0	0	0	0	108.3	R97 K98 Y122 D124 Y189	R97-V163 HydrophobicContact CB-CG1 4.27Å; K98-V163 WeakPolarHBondContact O-CA 3.42Å; Y122-V163 WeakPolarHBondContact CD2-O 3.47Å; D124-V163 HydrophobicContact CB-CG1 4.19Å; V163-Y189 HydrophobicContact CB-CD1 4.39Å; V163-Y189 HydrophobicContact CB-CE1 4.44Å; V163-Y189 HydrophobicContact CG1-CD1 3.41Å; V163-Y189 VanDerWaalsContact CG1-CD1 3.41Å; V163-Y189 HydrophobicContact CG1-CE1 3.75Å; V163-Y189 HydrophobicContact CG1-CG 4.02Å; V163-Y189 HydrophobicContact CG2-CD1 4.02Å; V163-Y189 HydrophobicContact CG2-CD2 4.23Å; V163-Y189 HydrophobicContact CG2-CE1 3.85Å; V163-Y189 HydrophobicContact CG2-CE2 4.08Å; V163-Y189 HydrophobicContact CG2-CG 4.19Å
164	A	93.6	Very high	90.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	146.8	-178.8	0	0	0	0	0	112.1	K98 I100 Y122 I162	K98-A164 PolarHBondContact N-O 2.85Å; K98-A164 PolarHBondContact O-N 3.18Å; I100-A164 HydrophobicContact CD1-CB 3.79Å; Y122-A164 HydrophobicContact CD2-CB 4.12Å; Y122-A164 HydrophobicContact CG-CB 4.48Å; I162-A164 HydrophobicContact CD1-CB 4.42Å
165	R	93.8	Very high	90.1	Very high	40 Å²	40	38.3 Å²	38.3	15%	0.151	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-43	160.1	175.5	176.9	167.5	179.8	-11.8	110	D93 L94 T123 N126	D93-R165 IonicContact OD1-NE 3.47Å; D93-R165 PolarHBondContact OD1-NE 3.28Å; D93-R165 IonicContact OD1-NH2 2.63Å; D93-R165 IonicContact OD2-NH2 2.68Å; L94-R165 WeakPolarHBondContact CB-O 3.47Å; L94-R165 WeakPolarHBondContact CG-O 3.38Å; L94-R165 PolarHBondContact N-O 3.41Å; T123-R165 PolarHBondContact O-N 3.46Å; N126-R165 VanDerWaalsContact CA-NH1 3.28Å; N126-R165 VanDerWaalsContact O-CZ 3.26Å; N126-R165 PolarHBondContact O-NH1 3.4Å; N126-R165 VanDerWaalsContact O-NH1 3.15Å; N126-R165 PolarHBondContact O-NH2 3.43Å; N126-R165 PolarHBondContact OD1-NH1 2.99Å
166	Y	95.2	Very high	90.2	Very high	18 Å²	18	38.7 Å²	38.7	7%	0.071	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	139.1	175.3	-63	-91	0	0	0	110	I92 D93 Y122 T123 N126 P128	I92-Y166 WeakPolarHBondContact O-CA 3.01Å; D93-Y166 HydrophobicContact CB-CD1 3.78Å; D93-Y166 HydrophobicContact CB-CE1 3.4Å; D93-Y166 VanDerWaalsContact CG-CZ 3.43Å; D93-Y166 VanDerWaalsContact OD2-CE1 3.24Å; D93-Y166 WeakPolarHBondContact OD2-CE1 3.23Å; D93-Y166 VanDerWaalsContact OD2-CZ 3.31Å; D93-Y166 PolarHBondContact OD2-OH 2.63Å; Y122-Y166 CarbonylContact C-O 3.6Å; Y122-Y166 VanDerWaalsContact CA-O 3.22Å; Y122-Y166 WeakPolarHBondContact CA-O 3.37Å; T123-Y166 HydrophobicContact CG2-CD2 4.08Å; T123-Y166 HydrophobicContact CG2-CG 4.34Å; T123-Y166 PolarHBondContact N-O 3.29Å; T123-Y166 PolarHBondContact O-N 3.48Å; N126-Y166 PolarHBondContact O-OH 2.91Å; P128-Y166 HydrophobicContact CB-CD1 3.82Å; P128-Y166 HydrophobicContact CB-CD2 3.81Å; P128-Y166 HydrophobicContact CB-CE1 4.13Å; P128-Y166 HydrophobicContact CB-CE2 4.14Å; P128-Y166 HydrophobicContact CB-CG 3.66Å; P128-Y166 HydrophobicContact CG-CD1 4.02Å; P128-Y166 HydrophobicContact CG-CD2 4.38Å; P128-Y166 HydrophobicContact CG-CE1 3.84Å; P128-Y166 HydrophobicContact CG-CE2 4.24Å; P128-Y166 HydrophobicContact CG-CG 4.29Å
167	I	96.6	Very high	90.5	Very high	1 Å²	1	40 Å²	40	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	141.8	173.1	-173.5	166.8	0	0	0	109.5	Q91 I92 I100 I120 Y121 I162 L169 L184	Q91-I167 CarbonylContact C-O 3.58Å; Q91-I167 WeakPolarHBondContact CA-O 3.33Å; I92-I167 HydrophobicContact CB-CG2 4.04Å; I92-I167 PolarHBondContact N-O 3.06Å; I92-I167 PolarHBondContact O-N 2.67Å; I92-I167 VanDerWaalsContact O-N 3.1Å; I100-I167 HydrophobicContact CD1-CB 4.2Å; I100-I167 HydrophobicContact CD1-CD1 3.66Å; I100-I167 HydrophobicContact CD1-CG2 4.29Å; I120-I167 HydrophobicContact CG2-CD1 3.72Å; I120-I167 HydrophobicContact CG2-CG1 3.75Å; Y121-I167 CarbonylContact O-C 3.37Å; Y121-I167 WeakPolarHBondContact O-CA 3.41Å; I162-I167 HydrophobicContact CD1-CD1 4.25Å; I167-L169 HydrophobicContact CG1-CD1 4.45Å; I167-L184 HydrophobicContact CD1-CD2 3.94Å; I167-L184 HydrophobicContact CG2-CD1 3.5Å; I167-L184 VanDerWaalsContact CG2-CD1 3.5Å; I167-L184 HydrophobicContact CG2-CD2 4.23Å; I167-L184 HydrophobicContact CG2-CG 4.49Å
168	R	96	Very high	91	Very high	49 Å²	49	36 Å²	36	19%	0.185	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	130.6	-174.7	173.1	-171.8	-73.3	-167.2	0.1	110	W89 I90 Q91 I120 Y121 W131	W89-R168 HydrophobicContact CB-CG 3.49Å; W89-R168 VanDerWaalsContact CB-CG 3.49Å; W89-R168 HydrophobicContact CD2-CG 4.21Å; W89-R168 VanDerWaalsContact CD2-NE 3.28Å; W89-R168 VanDerWaalsContact CE2-NH2 3.3Å; W89-R168 HydrophobicContact CE3-CG 4.22Å; W89-R168 VanDerWaalsContact CG-CD 3.48Å; W89-R168 HydrophobicContact CG-CG 3.93Å; W89-R168 VanDerWaalsContact CZ2-NH2 3.29Å; I90-R168 CarbonylContact O-C 3.57Å; I90-R168 VanDerWaalsContact O-CA 3.25Å; I90-R168 WeakPolarHBondContact O-CA 3.28Å; Q91-R168 HydrophobicContact CB-CB 4.25Å; Q91-R168 HydrophobicContact CG-CB 4.49Å; I120-R168 WeakPolarHBondContact CA-O 3.33Å; Y121-R168 PolarHBondContact N-O 3.11Å; Y121-R168 PolarHBondContact O-N 2.91Å; W131-R168 HydrophobicContact CE3-CB 4.42Å; W131-R168 HydrophobicContact CH2-CB 3.79Å; W131-R168 HydrophobicContact CZ3-CB 3.7Å
169	L	97.2	Very high	91.5	Very high	1 Å²	1	35 Å²	35	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129.4	170.5	-87.3	66.5	0	0	0	108.6	W89 I90 I103 T105 Y118 Y119 I120 I167 M180 M182	W89-L169 CarbonylContact C-O 3.53Å; W89-L169 WeakPolarHBondContact CA-O 3.49Å; W89-L169 WeakPolarHBondContact CB-O 3.31Å; I90-L169 HydrophobicContact CG2-CB 4.12Å; I90-L169 PolarHBondContact N-O 2.87Å; I90-L169 PolarHBondContact O-N 2.87Å; I103-L169 HydrophobicContact CD1-CD1 3.29Å; I103-L169 HydrophobicContact CD1-CD2 3.39Å; I103-L169 HydrophobicContact CD1-CG 3.89Å; I103-L169 HydrophobicContact CG1-CD2 4.45Å; T105-L169 HydrophobicContact CG2-CD2 3.86Å; Y118-L169 HydrophobicContact CD2-CB 4.27Å; Y118-L169 HydrophobicContact CD2-CD2 3.65Å; Y118-L169 HydrophobicContact CD2-CG 3.66Å; Y118-L169 HydrophobicContact CE2-CD2 3.39Å; Y118-L169 HydrophobicContact CE2-CG 3.71Å; Y118-L169 HydrophobicContact CG-CD2 4.42Å; Y119-L169 WeakPolarHBondContact O-CA 3.38Å; I120-L169 HydrophobicContact CG1-CD1 4.26Å; I120-L169 HydrophobicContact CG1-CG 4.27Å; I167-L169 HydrophobicContact CG1-CD1 4.45Å; L169-M180 HydrophobicContact CB-CE 4.25Å; L169-M180 HydrophobicContact CD2-CE 3.52Å; L169-M182 HydrophobicContact CB-CE 4Å; L169-M182 HydrophobicContact CD1-CE 4.09Å; L169-M182 HydrophobicContact CD1-SD 4.27Å; L169-M182 HydrophobicContact CD2-CE 3.83Å; L169-M182 HydrophobicContact CD2-SD 4.42Å; L169-M182 HydrophobicContact CG-CE 4.16Å
170	N	94.4	Very high	92.4	Very high	10 Å²	10	29.6 Å²	29.6	5%	0.053	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	99.9	-178.2	165.9	-117.2	0	0	0	109.2	D86 Q88 W89 Y118 Y119 Y121 Q172	D86-N170 PolarHBondContact O-ND2 2.93Å; Q88-N170 WeakPolarHBondContact O-CA 3.15Å; Q88-N170 PolarHBondContact O-ND2 2.78Å; W89-N170 HydrophobicContact CB-CB 4.44Å; Y118-N170 CarbonylContact C-O 3.49Å; Y118-N170 VanDerWaalsContact CA-O 3.31Å; Y118-N170 WeakPolarHBondContact CA-O 3.43Å; Y118-N170 WeakPolarHBondContact CB-O 3.27Å; Y119-N170 PolarHBondContact N-O 3.1Å; Y119-N170 PolarHBondContact O-N 2.93Å; Y121-N170 HydrophobicContact CD2-CB 3.96Å; Y121-N170 HydrophobicContact CE2-CB 3.64Å; N170-Q172 PolarHBondContact OD1-NE2 2.87Å
171	P	95.1	Very high	93	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	136.1	179.5	-27.4	39.5	0	0	0	112.6	W79 Q88 I115 W174 I178 M180	W79-P171 HydrophobicContact CH2-CG 4.42Å; W79-P171 HydrophobicContact CZ3-CG 4.2Å; Q88-P171 VanDerWaalsContact O-CD 3.24Å; Q88-P171 WeakPolarHBondContact O-CD 3.23Å; I115-P171 HydrophobicContact CB-CB 4.43Å; I115-P171 HydrophobicContact CG2-CB 3.74Å; I115-P171 HydrophobicContact CG2-CG 3.8Å; P171-W174 HydrophobicContact CB-CE3 4.33Å; P171-I178 HydrophobicContact CB-CG1 4.44Å; P171-I178 HydrophobicContact CB-CG2 3.86Å; P171-I178 HydrophobicContact CG-CG2 3.61Å; P171-M180 HydrophobicContact CG-SD 4.24Å
172	Q	86.9	Confident	93.4	Very high	29 Å²	29	23.6 Å²	23.6	14%	0.136	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	-32.4	-177.9	-70.6	-62.2	-53.6	0	0	112.3	D86 D117 Y119 L143 N170	D86-Q172 PolarHBondContact O-NE2 2.89Å; D117-Q172 HydrophobicContact CB-CB 4.49Å; D117-Q172 PolarHBondContact O-N 3.5Å; Y119-Q172 HydrophobicContact CD2-CG 3.44Å; Y119-Q172 VanDerWaalsContact CD2-CG 3.44Å; Y119-Q172 HydrophobicContact CE2-CG 3.54Å; Y119-Q172 HydrophobicContact CG-CG 4.29Å; L143-Q172 HydrophobicContact CD1-CB 3.89Å; L143-Q172 HydrophobicContact CD1-CG 3.75Å; N170-Q172 PolarHBondContact OD1-NE2 2.87Å
173	R	85.2	Confident	93.5	Very high	76 Å²	76	23.7 Å²	23.7	29%	0.287	11%	0.108	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	149.3	172.6	-76.7	-179.8	53.3	-133.2	10	109.7	Q116 D117 G936	Q116-R173 HydrophobicContact CB-CB 4.19Å; Q116-R173 PolarHBondContact N-O 2.99Å; D117-R173 HydrophobicContact CB-CB 4.25Å; D117-R173 PolarHBondContact N-O 3.36Å; D117-R173 PolarHBondContact O-N 3.33Å; D117-R173 IonicContact OD1-NH1 3.09Å; D117-R173 PolarHBondContact OD1-NH1 2.98Å; D117-R173 VanDerWaalsContact OD2-CD 3.28Å; D117-R173 WeakPolarHBondContact OD2-CD 3.21Å; D117-R173 IonicContact OD2-CZ 3.83Å; D117-R173 IonicContact OD2-NE 3.62Å; D117-R173 IonicContact OD2-NH1 3.91Å; D117-R173 PolarHBondContact OD2-NH1 3.19Å; R173-G936 VanDerWaalsContact CZ-O 3.3Å; R173-G936 PolarHBondContact NE-O 2.87Å
174	W	92.2	Very high	93.7	Very high	58 Å²	58	23.2 Å²	23.2	22%	0.22	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	157.5	-176.4	53.4	92.4	0	0	0	111.2	Q84 W114 I115 P171 I178	Q84-W174 HydrophobicContact CB-CZ2 4.36Å; Q84-W174 WeakPolarHBondContact O-CZ2 3.44Å; W114-W174 CarbonylContact O-C 3.52Å; W114-W174 VanDerWaalsContact O-CA 3.22Å; W114-W174 WeakPolarHBondContact O-CA 3.45Å; W114-W174 VanDerWaalsContact O-CB 3.28Å; W114-W174 WeakPolarHBondContact O-CB 3.09Å; I115-W174 HydrophobicContact CG2-CB 4.5Å; P171-W174 HydrophobicContact CB-CE3 4.33Å; W174-I178 HydrophobicContact CB-CG1 4.29Å; W174-I178 HydrophobicContact CD2-CB 4.49Å; W174-I178 HydrophobicContact CD2-CD1 3.9Å; W174-I178 HydrophobicContact CD2-CG1 3.21Å; W174-I178 VanDerWaalsContact CE2-CG1 3.47Å; W174-I178 HydrophobicContact CE3-CD1 3.8Å; W174-I178 HydrophobicContact CE3-CG1 3.47Å; W174-I178 VanDerWaalsContact CE3-CG1 3.47Å; W174-I178 HydrophobicContact CG-CB 4.47Å; W174-I178 HydrophobicContact CG-CG1 3.57Å; W174-I178 HydrophobicContact CH2-CD1 3.77Å; W174-I178 HydrophobicContact CH2-CG1 4.21Å; W174-I178 HydrophobicContact CZ2-CD1 3.85Å; W174-I178 HydrophobicContact CZ2-CG1 3.98Å; W174-I178 HydrophobicContact CZ3-CD1 3.73Å; W174-I178 HydrophobicContact CZ3-CG1 3.96Å
175	N	88.2	Confident	93.6	Very high	44 Å²	44	24 Å²	24	24%	0.235	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	126.6	170.3	-175.5	78.1	0	0	0	110	R112 Q113 W114 L177	R112-N175 PolarHBondContact O-ND2 3.02Å; Q113-N175 WeakPolarHBondContact CA-O 3.28Å; W114-N175 HydrophobicContact CD2-CB 3.74Å; W114-N175 VanDerWaalsContact CE2-CB 3.4Å; W114-N175 HydrophobicContact CE3-CB 4.18Å; W114-N175 HydrophobicContact CG-CB 4.28Å; W114-N175 HydrophobicContact CH2-CB 4.02Å; W114-N175 VanDerWaalsContact CH2-ND2 3.33Å; W114-N175 WeakPolarHBondContact CH2-ND2 3.15Å; W114-N175 HydrophobicContact CZ2-CB 3.56Å; W114-N175 HydrophobicContact CZ3-CB 4.31Å; W114-N175 WeakPolarHBondContact CZ3-ND2 3.27Å; W114-N175 PolarHBondContact N-O 2.84Å; W114-N175 PolarHBondContact O-N 3.04Å; N175-L177 VanDerWaalsContact C-N 3.31Å; N175-L177 PolarHBondContact O-N 3.06Å
176	N	92.1	Very high	93.3	Very high	108 Å²	108	22.1 Å²	22.1	58%	0.578	10%	0.102	S	C	*	.	S	Bend	trans	62.3	-72.8	-177	-69	-29.4	0	0	0	115	R112 Q113	R112-N176 PolarHBondContact O-ND2 2.66Å; Q113-N176 HydrophobicContact CG-CB 3.93Å
177	L	94.5	Very high	92.8	Very high	48 Å²	48	21.7 Å²	21.7	25%	0.251	10%	0.101	S	C	.	.	S	Bend	trans	-134.3	151.9	178.5	-64.3	178.4	0	0	0	109.6	I80 Q84 Q113 N175 S179	I80-L177 HydrophobicContact CG2-CB 4.36Å; I80-L177 HydrophobicContact CG2-CD1 4.26Å; Q84-L177 HydrophobicContact CG-CD2 3.86Å; Q113-L177 HydrophobicContact CG-CB 4.19Å; N175-L177 VanDerWaalsContact C-N 3.31Å; N175-L177 PolarHBondContact O-N 3.06Å; L177-S179 VanDerWaalsContact C-N 3.3Å; L177-S179 PolarHBondContact O-N 2.82Å
178	I	96.6	Very high	92.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.107	C	C	.	.			trans	-64.6	94.3	167.2	-60.6	171.7	0	0	0	107.5	W79 I80 S81 D85 Q88 I115 P171 W174	W79-I178 HydrophobicContact CH2-CG2 3.85Å; W79-I178 HydrophobicContact CZ3-CG2 3.87Å; I80-I178 WeakPolarHBondContact CA-O 3.1Å; S81-I178 PolarHBondContact N-O 3.43Å; S81-I178 WeakPolarHBondContact OG-CB 3.13Å; D85-I178 WeakPolarHBondContact O-CD1 3.4Å; Q88-I178 HydrophobicContact CB-CD1 3.97Å; Q88-I178 HydrophobicContact CG-CD1 3.79Å; I115-I178 HydrophobicContact CG2-CG2 4.2Å; P171-I178 HydrophobicContact CB-CG1 4.44Å; P171-I178 HydrophobicContact CB-CG2 3.86Å; P171-I178 HydrophobicContact CG-CG2 3.61Å; W174-I178 HydrophobicContact CB-CG1 4.29Å; W174-I178 HydrophobicContact CD2-CB 4.49Å; W174-I178 HydrophobicContact CD2-CD1 3.9Å; W174-I178 HydrophobicContact CD2-CG1 3.21Å; W174-I178 VanDerWaalsContact CE2-CG1 3.47Å; W174-I178 HydrophobicContact CE3-CD1 3.8Å; W174-I178 HydrophobicContact CE3-CG1 3.47Å; W174-I178 VanDerWaalsContact CE3-CG1 3.47Å; W174-I178 HydrophobicContact CG-CB 4.47Å; W174-I178 HydrophobicContact CG-CG1 3.57Å; W174-I178 HydrophobicContact CH2-CD1 3.77Å; W174-I178 HydrophobicContact CH2-CG1 4.21Å; W174-I178 HydrophobicContact CZ2-CD1 3.85Å; W174-I178 HydrophobicContact CZ2-CG1 3.98Å; W174-I178 HydrophobicContact CZ3-CD1 3.73Å; W174-I178 HydrophobicContact CZ3-CG1 3.96Å
179	S	95.5	Very high	91.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	133	177.3	-57.6	0	0	0	0	109.3	W79 I80 Q113 W114 I115 L177	W79-S179 VanDerWaalsContact O-CA 3.25Å; W79-S179 WeakPolarHBondContact O-CA 2.88Å; I80-S179 WeakPolarHBondContact CG1-OG 3.37Å; Q113-S179 WeakPolarHBondContact CB-OG 3.45Å; Q113-S179 PolarHBondContact OE1-OG 3.3Å; W114-S179 WeakPolarHBondContact CA-O 3.43Å; I115-S179 PolarHBondContact N-O 3.26Å; L177-S179 VanDerWaalsContact C-N 3.3Å; L177-S179 PolarHBondContact O-N 2.82Å
180	M	94.8	Very high	91	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	159.1	179.6	59.7	177.2	-55.8	0	0	114	G59 W79 I90 T105 Q106 I115 L169 P171 M182	G59-M180 WeakPolarHBondContact CA-O 3.29Å; W79-M180 HydrophobicContact CE3-CG 3.42Å; W79-M180 VanDerWaalsContact CE3-CG 3.42Å; W79-M180 HydrophobicContact CE3-SD 3.82Å; W79-M180 HydrophobicContact CZ3-CG 3.75Å; W79-M180 HydrophobicContact CZ3-SD 3.61Å; W79-M180 PolarHBondContact N-O 2.58Å; W79-M180 PolarHBondContact O-N 3.27Å; W79-M180 VanDerWaalsContact O-N 3.09Å; I90-M180 HydrophobicContact CG2-CE 4.19Å; I90-M180 HydrophobicContact CG2-CG 4.5Å; I90-M180 HydrophobicContact CG2-SD 3.58Å; I90-M180 VanDerWaalsContact CG2-SD 3.58Å; T105-M180 HydrophobicContact CG2-CE 4.13Å; Q106-M180 CarbonylContact O-C 3.46Å; Q106-M180 WeakPolarHBondContact O-CA 3.2Å; I115-M180 HydrophobicContact CD1-CB 4.24Å; I115-M180 HydrophobicContact CD1-CE 3.67Å; I115-M180 HydrophobicContact CD1-SD 3.78Å; I115-M180 HydrophobicContact CG1-CB 4.18Å; I115-M180 HydrophobicContact CG2-CB 4.25Å; I115-M180 HydrophobicContact CG2-SD 4.4Å; L169-M180 HydrophobicContact CB-CE 4.25Å; L169-M180 HydrophobicContact CD2-CE 3.52Å; P171-M180 HydrophobicContact CG-SD 4.24Å; M180-M182 HydrophobicContact CE-CB 4.33Å; M180-M182 HydrophobicContact CE-CE 3.58Å; M180-M182 HydrophobicContact SD-CE 4.43Å
181	R	95.3	Very high	90.7	Very high	1 Å²	1	29.7 Å²	29.7	0%	0.004	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	144.4	170.7	-66.7	178.2	-75.9	-175.7	1.2	108.4	G59 R60 I63 G77 A78 T105 Q106 G107 D150 N151	G59-R181 CarbonylContact O-C 3.59Å; G59-R181 WeakPolarHBondContact O-CA 3.3Å; R60-R181 WeakPolarHBondContact O-CB 3.49Å; R60-R181 WeakPolarHBondContact O-CG 3.49Å; I63-R181 HydrophobicContact CG2-CG 3.96Å; I63-R181 WeakPolarHBondContact O-CD 3.32Å; I63-R181 PolarHBondContact O-NH1 3.05Å; G77-R181 VanDerWaalsContact O-CD 3.3Å; G77-R181 WeakPolarHBondContact O-CD 3.22Å; A78-R181 HydrophobicContact CB-CG 4.19Å; T105-R181 CarbonylContact C-O 3.55Å; T105-R181 VanDerWaalsContact CA-O 3.29Å; T105-R181 WeakPolarHBondContact CA-O 3.45Å; Q106-R181 HydrophobicContact CB-CB 4.13Å; Q106-R181 VanDerWaalsContact CG-NH2 3.33Å; Q106-R181 PolarHBondContact N-O 2.89Å; Q106-R181 PolarHBondContact O-N 3.05Å; G107-R181 PolarHBondContact O-NE 3.07Å; G107-R181 PolarHBondContact O-NH2 3.11Å; D150-R181 PolarHBondContact O-NH2 3.42Å; N151-R181 PolarHBondContact OD1-NH2 2.65Å; N151-R181 VanDerWaalsContact OD1-NH2 3.08Å
182	M	95.5	Very high	90.4	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	161	-178.3	73.4	166.3	81.6	0	0	115	M32 G59 L61 I90 I92 I103 A104 L169 M180	M32-M182 WeakPolarHBondContact CB-O 3.45Å; M32-M182 HydrophobicContact CE-CG 3.86Å; G59-M182 PolarHBondContact O-N 3.13Å; L61-M182 PolarHBondContact N-O 2.79Å; I90-M182 HydrophobicContact CB-CE 4.25Å; I90-M182 HydrophobicContact CD1-CE 4.22Å; I90-M182 HydrophobicContact CG1-CE 4.08Å; I90-M182 HydrophobicContact CG2-CE 3.25Å; I92-M182 HydrophobicContact CD1-CG 4.43Å; I92-M182 HydrophobicContact CD1-SD 3.57Å; I92-M182 VanDerWaalsContact CD1-SD 3.57Å; I103-M182 HydrophobicContact CD1-SD 4.39Å; A104-M182 CarbonylContact O-C 3.5Å; A104-M182 WeakPolarHBondContact O-CA 3Å; A104-M182 WeakPolarHBondContact O-CB 3.29Å; L169-M182 HydrophobicContact CB-CE 4Å; L169-M182 HydrophobicContact CD1-CE 4.09Å; L169-M182 HydrophobicContact CD1-SD 4.27Å; L169-M182 HydrophobicContact CD2-CE 3.83Å; L169-M182 HydrophobicContact CD2-SD 4.42Å; L169-M182 HydrophobicContact CG-CE 4.16Å; M180-M182 HydrophobicContact CE-CB 4.33Å; M180-M182 HydrophobicContact CE-CE 3.58Å; M180-M182 HydrophobicContact SD-CE 4.43Å
183	E	94.1	Very high	90.6	Very high	2 Å²	2	31 Å²	31	1%	0.009	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	146	166.3	179.5	60.6	-89.5	0	0	109.7	P29 G31 M32 T33 L61 I103 A104 F185	P29-E183 HydrophobicContact CB-CG 3.95Å; G31-E183 PolarHBondContact N-OE1 2.76Å; M32-E183 WeakPolarHBondContact CA-OE2 3.46Å; M32-E183 HydrophobicContact CB-CB 4.44Å; M32-E183 WeakPolarHBondContact CB-OE1 3.38Å; M32-E183 WeakPolarHBondContact CB-OE2 3.23Å; M32-E183 WeakPolarHBondContact CG-OE1 3.17Å; M32-E183 VanDerWaalsContact N-CD 3.32Å; M32-E183 PolarHBondContact N-OE1 2.8Å; M32-E183 PolarHBondContact N-OE2 2.83Å; T33-E183 PolarHBondContact N-OE2 2.8Å; T33-E183 PolarHBondContact OG1-OE2 3.08Å; L61-E183 HydrophobicContact CB-CB 3.82Å; L61-E183 HydrophobicContact CD2-CB 3.8Å; L61-E183 HydrophobicContact CG-CB 4.4Å; I103-E183 WeakPolarHBondContact CA-O 3.32Å; I103-E183 WeakPolarHBondContact CG1-O 3.48Å; A104-E183 HydrophobicContact CB-CB 4.39Å; A104-E183 PolarHBondContact N-O 2.95Å; A104-E183 PolarHBondContact O-N 2.87Å; E183-F185 HydrophobicContact CB-CE2 4.08Å; E183-F185 HydrophobicContact CB-CZ 4.07Å; E183-F185 HydrophobicContact CG-CE1 4.05Å; E183-F185 HydrophobicContact CG-CE2 3.89Å; E183-F185 HydrophobicContact CG-CZ 3.59Å
184	L	94.2	Very high	91	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	143.3	177	-60.1	174	0	0	0	109.7	P29 L30 I92 L94 I103 I167	P29-L184 CarbonylContact C-O 3.59Å; P29-L184 WeakPolarHBondContact CA-O 3.46Å; L30-L184 HydrophobicContact CB-CB 4.2Å; L30-L184 HydrophobicContact CD1-CB 3.85Å; L30-L184 HydrophobicContact CD1-CD1 4.43Å; L30-L184 HydrophobicContact CG-CB 4.22Å; L30-L184 PolarHBondContact N-O 2.82Å; I92-L184 HydrophobicContact CB-CD1 4.41Å; I92-L184 HydrophobicContact CD1-CD1 3.56Å; I92-L184 HydrophobicContact CD1-CG 3.98Å; I92-L184 HydrophobicContact CG2-CD1 4.37Å; L94-L184 HydrophobicContact CD2-CD1 4.06Å; I103-L184 HydrophobicContact CB-CD2 4.4Å; I103-L184 HydrophobicContact CD1-CD2 3.65Å; I103-L184 HydrophobicContact CG1-CD2 3.97Å; I167-L184 HydrophobicContact CD1-CD2 3.94Å; I167-L184 HydrophobicContact CG2-CD1 3.5Å; I167-L184 VanDerWaalsContact CG2-CD1 3.5Å; I167-L184 HydrophobicContact CG2-CD2 4.23Å; I167-L184 HydrophobicContact CG2-CG 4.49Å
185	F	91.6	Very high	91.1	Very high	17 Å²	17	28.4 Å²	28.4	8%	0.075	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	135.3	178.3	-56.2	-92.7	0	0	0	111.6	Y27 I28 P29 Q101 S102 A104 F155 E183	Y27-F185 HydrophobicContact CD1-CB 4.42Å; Y27-F185 WeakPolarHBondContact O-CD1 3.49Å; I28-F185 CarbonylContact O-C 3.41Å; I28-F185 WeakPolarHBondContact O-CA 3.36Å; P29-F185 HydrophobicContact CB-CD1 4.11Å; P29-F185 HydrophobicContact CB-CE1 3.93Å; Q101-F185 PolarHBondContact N-O 3.46Å; S102-F185 PolarHBondContact N-O 2.86Å; S102-F185 PolarHBondContact O-N 2.9Å; S102-F185 WeakPolarHBondContact OG-CB 3.27Å; S102-F185 WeakPolarHBondContact OG-CD2 3.38Å; A104-F185 HydrophobicContact CB-CE2 3.65Å; A104-F185 HydrophobicContact CB-CZ 4.22Å; F155-F185 HydrophobicContact CD1-CE2 4.09Å; F155-F185 HydrophobicContact CE1-CD2 4.3Å; F155-F185 HydrophobicContact CE1-CE1 4.32Å; F155-F185 AromaticContact CE1-CE2 3.5Å; F155-F185 HydrophobicContact CE1-CE2 3.5Å; F155-F185 VanDerWaalsContact CE1-CE2 3.5Å; F155-F185 AromaticContact CE1-CZ 3.51Å; F155-F185 HydrophobicContact CE1-CZ 3.51Å; F155-F185 HydrophobicContact CZ-CE2 4.42Å; F155-F185 HydrophobicContact CZ-CZ 4.11Å; E183-F185 HydrophobicContact CB-CE2 4.08Å; E183-F185 HydrophobicContact CB-CZ 4.07Å; E183-F185 HydrophobicContact CG-CE1 4.05Å; E183-F185 HydrophobicContact CG-CE2 3.89Å; E183-F185 HydrophobicContact CG-CZ 3.59Å
186	G	88.6	Confident	91.3	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.01	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.8	-159.1	-176.4	0	0	0	0	0	114.1	I28 L30 V99	I28-G186 WeakPolarHBondContact CB-O 3.43Å; I28-G186 PolarHBondContact O-N 2.9Å; L30-G186 WeakPolarHBondContact CD2-O 3.39Å; V99-G186 CarbonylContact O-C 3.59Å; V99-G186 WeakPolarHBondContact O-CA 3.47Å
187	C	83.6	Confident	91.3	Very high	8 Å²	8	24.4 Å²	24.4	5%	0.054	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	176.3	-178.7	71.5	0	0	0	0	113	C22 K98 V99	C22-C187 HydrophobicContact CB-CB 4.15Å; C22-C187 WeakPolarHBondContact CB-SG 3.16Å; C22-C187 PolarHBondContact N-SG 2.8Å; C22-C187 VanDerWaalsContact N-SG 3.4Å; C22-C187 WeakPolarHBondContact SG-CB 3.26Å; C22-C187 CovalentContact SG-SG 2Å; C22-C187 PolarHBondContact SG-SG 2.84Å; K98-C187 CarbonylContact C-O 3.6Å; K98-C187 WeakPolarHBondContact CA-O 3.36Å; K98-C187 WeakPolarHBondContact CB-O 3.46Å; V99-C187 PolarHBondContact N-O 2.87Å; V99-C187 PolarHBondContact O-N 2.85Å
188	D	83.5	Confident	91.2	Very high	27 Å²	27	22.9 Å²	22.9	14%	0.144	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	134.9	173.3	-71.1	-13	0	0	0	111.4	K96 K98	K96-D188 WeakPolarHBondContact CE-OD1 3.27Å; K96-D188 IonicContact NZ-OD1 2.74Å; K96-D188 PolarHBondContact NZ-OD1 2.82Å; K96-D188 IonicContact NZ-OD2 3.69Å; K96-D188 PolarHBondContact NZ-OD2 2.86Å; K98-D188 IonicContact NZ-OD1 3.85Å; K98-D188 PolarHBondContact NZ-OD1 3.2Å
189	Y	87	Confident	91	Very high	41 Å²	41	26.3 Å²	26.3	16%	0.161	13%	0.128	C	C	.	.			trans	-95.8	121.7	175.8	-171.9	-125.8	0	0	0	110.6	R97 V99 V163 P191 R223	R97-Y189 HydrophobicContact CB-CD1 4.4Å; R97-Y189 PolarHBondContact O-N 2.81Å; R97-Y189 VanDerWaalsContact O-N 3.16Å; V99-Y189 HydrophobicContact CG2-CD2 3.4Å; V99-Y189 HydrophobicContact CG2-CE2 4.22Å; V99-Y189 HydrophobicContact CG2-CG 3.96Å; V163-Y189 HydrophobicContact CB-CD1 4.39Å; V163-Y189 HydrophobicContact CB-CE1 4.44Å; V163-Y189 HydrophobicContact CG1-CD1 3.41Å; V163-Y189 VanDerWaalsContact CG1-CD1 3.41Å; V163-Y189 HydrophobicContact CG1-CE1 3.75Å; V163-Y189 HydrophobicContact CG1-CG 4.02Å; V163-Y189 HydrophobicContact CG2-CD1 4.02Å; V163-Y189 HydrophobicContact CG2-CD2 4.23Å; V163-Y189 HydrophobicContact CG2-CE1 3.85Å; V163-Y189 HydrophobicContact CG2-CE2 4.08Å; V163-Y189 HydrophobicContact CG2-CG 4.19Å; Y189-P191 HydrophobicContact CD1-CB 4.43Å; Y189-P191 HydrophobicContact CD1-CG 3.87Å; Y189-P191 HydrophobicContact CE1-CB 3.72Å; Y189-P191 HydrophobicContact CE1-CG 3.47Å; Y189-P191 VanDerWaalsContact CE1-CG 3.47Å; Y189-P191 HydrophobicContact CE2-CB 4.31Å; Y189-R223 WeakPolarHBondContact OH-CD 3.46Å
190	R	83	Confident	90.8	Very high	138 Å²	138	26.3 Å²	26.3	52%	0.521	13%	0.128	S	C	.	.			trans	-128.5	74.6	-178.2	-64.2	-177.8	-178.9	-178.2	0.4	111.1
191	P	87.2	Confident	90.8	Very high	24 Å²	24	27.6 Å²	27.6	16%	0.156	13%	0.133	C	C	.	.			trans	-81.1	152.3	-175.2	33.8	-36.3	0	0	0	112.9	Y189 V193 E347 E348	Y189-P191 HydrophobicContact CD1-CB 4.43Å; Y189-P191 HydrophobicContact CD1-CG 3.87Å; Y189-P191 HydrophobicContact CE1-CB 3.72Å; Y189-P191 HydrophobicContact CE1-CG 3.47Å; Y189-P191 VanDerWaalsContact CE1-CG 3.47Å; Y189-P191 HydrophobicContact CE2-CB 4.31Å; P191-V193 HydrophobicContact CG-CG2 4.28Å; P191-E347 HydrophobicContact CB-CB 4.39Å; P191-E347 HydrophobicContact CB-CG 3.92Å; P191-E347 HydrophobicContact CG-CG 4.07Å; P191-E347 WeakPolarHBondContact CG-OE1 3.47Å; P191-E348 VanDerWaalsContact CA-OE1 3.27Å; P191-E348 WeakPolarHBondContact CA-OE1 3.4Å; P191-E348 HydrophobicContact CB-CG 3.88Å
192	F	87.9	Confident	90.8	Very high	44 Å²	44	27.5 Å²	27.5	19%	0.193	13%	0.133	C	C	.	.			trans	-80.4	119.1	161.5	-74.5	-88.2	0	0	0	110.1	E347 E348 I357 R358	F192-E347 WeakPolarHBondContact O-CA 3.29Å; F192-E348 WeakPolarHBondContact CD2-OE1 3.28Å; F192-E348 PolarHBondContact N-OE1 2.65Å; F192-E348 PolarHBondContact O-N 2.82Å; F192-E348 VanDerWaalsContact O-N 3.08Å; F192-I357 HydrophobicContact CB-CB 4.31Å; F192-I357 HydrophobicContact CB-CG2 3.92Å; F192-R358 HydrophobicContact CB-CB 4.28Å; F192-R358 HydrophobicContact CD1-CB 3.94Å; F192-R358 HydrophobicContact CD1-CG 4.08Å; F192-R358 HydrophobicContact CD2-CB 3.75Å; F192-R358 HydrophobicContact CD2-CG 3.88Å; F192-R358 HydrophobicContact CE1-CB 4.2Å; F192-R358 HydrophobicContact CE1-CG 3.81Å; F192-R358 HydrophobicContact CE2-CB 4.03Å; F192-R358 HydrophobicContact CE2-CG 3.6Å; F192-R358 HydrophobicContact CG-CB 3.7Å; F192-R358 HydrophobicContact CG-CG 4.11Å; F192-R358 HydrophobicContact CZ-CB 4.25Å; F192-R358 HydrophobicContact CZ-CG 3.56Å
193	V	92.1	Very high	90.6	Very high	12 Å²	12	28.2 Å²	28.2	7%	0.073	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	137.3	-174.4	-174.8	0	0	0	0	110.6	P191 L346 E347 Q361 C421	P191-V193 HydrophobicContact CG-CG2 4.28Å; V193-L346 CarbonylContact C-O 3.57Å; V193-L346 WeakPolarHBondContact CA-O 3.46Å; V193-E347 HydrophobicContact CB-CG 4.36Å; V193-E347 HydrophobicContact CG1-CG 4.43Å; V193-E347 HydrophobicContact CG2-CG 3.71Å; V193-Q361 PolarHBondContact O-NE2 2.57Å; V193-C421 HydrophobicContact CG1-CB 4.06Å
194	A	93.4	Very high	90.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	112.6	170.1	0	0	0	0	0	110.1	M196 C345 L346 I357 L417 G418	A194-M196 HydrophobicContact CB-CE 4.11Å; A194-C345 WeakPolarHBondContact O-CA 3.44Å; A194-L346 HydrophobicContact CB-CB 4.43Å; A194-L346 PolarHBondContact N-O 3.34Å; A194-L346 PolarHBondContact O-N 3.08Å; A194-I357 HydrophobicContact CB-CD1 3.76Å; A194-I357 HydrophobicContact CB-CG1 3.87Å; A194-I357 HydrophobicContact CB-CG2 3.88Å; A194-L417 HydrophobicContact CB-CD1 3.97Å; A194-L417 HydrophobicContact CB-CD2 3.66Å; A194-L417 HydrophobicContact CB-CG 3.86Å; A194-G418 CarbonylContact C-O 3.56Å; A194-G418 WeakPolarHBondContact CA-O 3.27Å
195	Y	94.3	Very high	90	Very high	80 Å²	80	33.9 Å²	33.9	31%	0.314	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	118.9	167.2	176.5	-103.3	0	0	0	109.8	D197 G418 P422	Y195-D197 HydrophobicContact CE1-CB 3.97Å; Y195-G418 PolarHBondContact N-O 3.48Å; Y195-G418 PolarHBondContact O-N 3.12Å; Y195-P422 HydrophobicContact CD2-CG 4.11Å; Y195-P422 HydrophobicContact CE2-CG 3.89Å
196	M	93.5	Very high	89.6	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	123.1	176	-56.9	-63.1	-171.6	0	0	108.7	A194 I202 F342 I343 G344 L346 L417	A194-M196 HydrophobicContact CB-CE 4.11Å; M196-I202 HydrophobicContact CE-CD1 3.97Å; M196-I202 HydrophobicContact CE-CG1 4.18Å; M196-F342 HydrophobicContact CB-CD1 3.98Å; M196-F342 VanDerWaalsContact CB-O 3.31Å; M196-F342 WeakPolarHBondContact CB-O 3.43Å; M196-F342 HydrophobicContact CG-CD1 4.07Å; M196-I343 CarbonylContact O-C 3.57Å; M196-I343 WeakPolarHBondContact O-CA 3.48Å; M196-G344 PolarHBondContact N-O 2.87Å; M196-G344 PolarHBondContact O-N 3.39Å; M196-L346 HydrophobicContact CE-CD1 3.8Å; M196-L346 HydrophobicContact CG-CD1 4.16Å; M196-L417 HydrophobicContact CE-CD1 3.84Å; M196-L417 HydrophobicContact SD-CD1 3.57Å; M196-L417 VanDerWaalsContact SD-CD1 3.57Å
197	D	91.9	Very high	89	Confident	67 Å²	67	38.4 Å²	38.4	36%	0.358	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	9.4	180	68.3	-7.5	0	0	0	113.1	Y195 T199 S200	Y195-D197 HydrophobicContact CE1-CB 3.97Å; D197-T199 VanDerWaalsContact C-N 3.27Å; D197-T199 VanDerWaalsContact CG-OG1 3.25Å; D197-T199 PolarHBondContact O-N 3.04Å; D197-T199 WeakPolarHBondContact OD1-CA 3.41Å; D197-T199 WeakPolarHBondContact OD1-CB 3.32Å; D197-T199 PolarHBondContact OD1-N 3.38Å; D197-T199 PolarHBondContact OD1-OG1 2.95Å; D197-T199 PolarHBondContact OD2-OG1 2.9Å; D197-T199 VanDerWaalsContact OD2-OG1 3.07Å; D197-S200 PolarHBondContact OD1-N 2.75Å; D197-S200 VanDerWaalsContact OD1-N 3.14Å
198	G	92.6	Very high	88.4	Confident	17 Å²	17	39.9 Å²	39.9	18%	0.175	19%	0.19	C	C	.	.	S	Bend	trans	82.3	-7.4	-173.4	0	0	0	0	0	114.6	N341 F342	G198-N341 VanDerWaalsContact O-CB 3.28Å; G198-N341 WeakPolarHBondContact O-CB 3.48Å; G198-N341 PolarHBondContact O-ND2 2.72Å; G198-F342 PolarHBondContact N-O 3.09Å
199	T	92.2	Very high	87.6	Confident	72 Å²	72	44.7 Å²	44.7	44%	0.442	22%	0.223	S	C	.	.	S	Bend	trans	-107.7	-29.1	179.7	78.1	0	0	0	0	113.4	D197 W201 G413	D197-T199 VanDerWaalsContact C-N 3.27Å; D197-T199 VanDerWaalsContact CG-OG1 3.25Å; D197-T199 PolarHBondContact O-N 3.04Å; D197-T199 WeakPolarHBondContact OD1-CA 3.41Å; D197-T199 WeakPolarHBondContact OD1-CB 3.32Å; D197-T199 PolarHBondContact OD1-N 3.38Å; D197-T199 PolarHBondContact OD1-OG1 2.95Å; D197-T199 PolarHBondContact OD2-OG1 2.9Å; D197-T199 VanDerWaalsContact OD2-OG1 3.07Å; T199-W201 VanDerWaalsContact O-CE3 3.31Å; T199-W201 WeakPolarHBondContact O-CZ3 3.48Å; T199-G413 WeakPolarHBondContact O-CA 3.05Å
200	S	91.4	Very high	86.5	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.			trans	-97.4	145.6	176	-65.5	0	0	0	0	112.2	D197 S412 S414 I416	D197-S200 PolarHBondContact OD1-N 2.75Å; D197-S200 VanDerWaalsContact OD1-N 3.14Å; S200-S412 WeakPolarHBondContact CA-O 3.35Å; S200-S414 PolarHBondContact OG-OG 2.78Å; S200-I416 WeakPolarHBondContact CB-O 3.12Å; S200-I416 PolarHBondContact OG-O 3.12Å
201	W	93.8	Very high	86	Confident	26 Å²	26	43 Å²	43	10%	0.098	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	164.3	170.1	63.7	93.2	0	0	0	110.1	T199 D203 I324 P328 S412	T199-W201 VanDerWaalsContact O-CE3 3.31Å; T199-W201 WeakPolarHBondContact O-CZ3 3.48Å; W201-D203 PolarHBondContact NE1-OD1 3.41Å; W201-D203 PolarHBondContact NE1-OD2 3.03Å; W201-I324 CarbonylContact C-O 3.48Å; W201-I324 WeakPolarHBondContact CA-O 3.06Å; W201-I324 VanDerWaalsContact CB-O 3.29Å; W201-I324 WeakPolarHBondContact CB-O 3.06Å; W201-P328 HydrophobicContact CH2-CB 3.65Å; W201-P328 HydrophobicContact CH2-CG 4.43Å; W201-P328 HydrophobicContact CZ2-CB 3.6Å; W201-P328 HydrophobicContact CZ2-CG 3.9Å; W201-S412 PolarHBondContact N-O 2.96Å; W201-S412 PolarHBondContact O-N 3.48Å
202	I	94.3	Very high	85.2	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.8	178.6	-56.8	166.9	0	0	0	108.3	M196 S323 I324 I356 A360 L409 I411 L417	M196-I202 HydrophobicContact CE-CD1 3.97Å; M196-I202 HydrophobicContact CE-CG1 4.18Å; I202-S323 CarbonylContact O-C 3.52Å; I202-S323 WeakPolarHBondContact O-CA 3.3Å; I202-I324 HydrophobicContact CB-CB 4.27Å; I202-I324 HydrophobicContact CB-CD1 4.47Å; I202-I324 PolarHBondContact N-O 2.64Å; I202-I324 WeakPolarHBondContact O-CD1 3.15Å; I202-I324 PolarHBondContact O-N 3.2Å; I202-I356 HydrophobicContact CB-CG2 4.37Å; I202-I356 HydrophobicContact CD1-CG2 4.17Å; I202-I356 HydrophobicContact CG2-CG2 3.78Å; I202-A360 HydrophobicContact CD1-CB 3.99Å; I202-A360 HydrophobicContact CG1-CB 4.29Å; I202-A360 HydrophobicContact CG2-CB 3.88Å; I202-L409 HydrophobicContact CG2-CD2 3.69Å; I202-I411 HydrophobicContact CG1-CG1 4.42Å; I202-L417 HydrophobicContact CD1-CD1 4.42Å; I202-L417 HydrophobicContact CD1-CD2 4.05Å; I202-L417 HydrophobicContact CG1-CD1 4.43Å
203	D	92.5	Very high	84.8	Confident	16 Å²	16	45.1 Å²	45.1	9%	0.086	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	130.8	172.2	-69.4	-50.2	0	0	0	110.3	W201 N321 S323 L409 T410 S412	W201-D203 PolarHBondContact NE1-OD1 3.41Å; W201-D203 PolarHBondContact NE1-OD2 3.03Å; D203-N321 HydrophobicContact CB-CB 4.47Å; D203-S323 WeakPolarHBondContact OD1-CB 3.48Å; D203-S323 PolarHBondContact OD1-OG 2.69Å; D203-L409 WeakPolarHBondContact O-CA 2.99Å; D203-T410 PolarHBondContact N-O 3.42Å; D203-T410 PolarHBondContact O-N 3.37Å; D203-S412 WeakPolarHBondContact OD2-CB 3.31Å; D203-S412 PolarHBondContact OD2-OG 2.65Å
204	L	89.7	Confident	84.3	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.6	176.5	174.3	68.9	0	0	0	110.1	L206 R211 N321 L322 I324 F351 I356 G408 L409	L204-L206 HydrophobicContact CD2-CD2 3.9Å; L204-L206 HydrophobicContact CG-CD2 4.21Å; L204-R211 VanDerWaalsContact CD1-CZ 3.41Å; L204-N321 WeakPolarHBondContact O-CA 3.1Å; L204-L322 HydrophobicContact CB-CB 4.26Å; L204-L322 HydrophobicContact CD2-CD2 4.04Å; L204-L322 PolarHBondContact N-O 2.98Å; L204-L322 PolarHBondContact O-N 2.91Å; L204-I324 HydrophobicContact CB-CD1 4.42Å; L204-F351 HydrophobicContact CD2-CD1 4.42Å; L204-I356 HydrophobicContact CD2-CD1 4.24Å; L204-G408 CarbonylContact C-O 3.53Å; L204-G408 WeakPolarHBondContact CA-O 3.45Å; L204-L409 HydrophobicContact CB-CD2 4.09Å; L204-L409 HydrophobicContact CD1-CD1 4.29Å; L204-L409 HydrophobicContact CD1-CD2 3.8Å; L204-L409 HydrophobicContact CD1-CG 3.73Å
205	R	86.7	Confident	84.1	Confident	120 Å²	120	50.2 Å²	50.2	45%	0.453	29%	0.29	S	S	.	.			trans	-79.6	122.1	167.8	-83.2	-172.3	-122.6	-179.9	-0.3	111	D207 L208 R211 N321 G408	R205-D207 WeakPolarHBondContact CB-OD1 3.42Å; R205-L208 HydrophobicContact CB-CD1 4.17Å; R205-L208 HydrophobicContact CB-CG 4.38Å; R205-R211 PolarHBondContact O-NH1 3.46Å; R205-N321 VanDerWaalsContact CG-OD1 3.27Å; R205-N321 WeakPolarHBondContact CG-OD1 3.17Å; R205-G408 PolarHBondContact N-O 2.67Å
206	L	82.1	Confident	83.8	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.016	30%	0.303	C	S	.	.	S	Bend	trans	-89.7	-17.4	179	-62.8	177.2	0	0	0	113.3	L204 L208 R211 T213 M318 L322 F351	L204-L206 HydrophobicContact CD2-CD2 3.9Å; L204-L206 HydrophobicContact CG-CD2 4.21Å; L206-L208 PolarHBondContact O-N 2.77Å; L206-R211 WeakPolarHBondContact O-CB 3.12Å; L206-T213 HydrophobicContact CB-CG2 4.01Å; L206-T213 WeakPolarHBondContact O-CG2 3.36Å; L206-M318 HydrophobicContact CD1-CB 3.57Å; L206-M318 HydrophobicContact CD1-CE 3.9Å; L206-M318 HydrophobicContact CD1-SD 4.39Å; L206-L322 HydrophobicContact CD1-CB 4.25Å; L206-L322 HydrophobicContact CG-CB 4.35Å; L206-F351 HydrophobicContact CD2-CE1 4.06Å
207	D	75.2	Confident	83.6	Confident	110 Å²	110	56.3 Å²	56.3	59%	0.588	32%	0.319	S	S	*	.	S	Bend	trans	-77	15.9	-178.6	67.6	-33.6	0	0	0	114.3	R205	R205-D207 WeakPolarHBondContact CB-OD1 3.42Å
208	L	72.8	Confident	83.5	Confident	39 Å²	39	53.2 Å²	53.2	20%	0.204	30%	0.303	C	S	.	.	S	Bend	trans	-99.1	149.5	-178.6	-69.1	175.2	0	0	0	112.4	R205 L206 G210 R211 T407 G408	R205-L208 HydrophobicContact CB-CD1 4.17Å; R205-L208 HydrophobicContact CB-CG 4.38Å; L206-L208 PolarHBondContact O-N 2.77Å; L208-G210 PolarHBondContact O-N 3.43Å; L208-R211 PolarHBondContact O-N 3.29Å; L208-R211 VanDerWaalsContact O-N 3.12Å; L208-T407 VanDerWaalsContact CD1-C 3.41Å; L208-T407 VanDerWaalsContact CD1-O 3.27Å; L208-T407 WeakPolarHBondContact CD1-O 3.3Å; L208-G408 VanDerWaalsContact CD1-CA 3.43Å
209	P	64.9	Low	83.5	Confident	129 Å²	129	56.6 Å²	56.6	84%	0.838	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	132.4	-179.5	-25.5	33.8	0	0	0	113.1
210	G	65	Low	83.6	Confident	90 Å²	90	53.3 Å²	53.3	93%	0.928	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	-4.2	-178	0	0	0	0	0	114.9	L208	L208-G210 PolarHBondContact O-N 3.43Å
211	R	72.3	Confident	83.7	Confident	53 Å²	53	54.5 Å²	54.5	20%	0.2	30%	0.302	C	S	.	.			trans	-112.5	133.8	172.5	-62.3	176.8	-176.8	150.6	3.7	109.2	L204 R205 L206 L208 T407	L204-R211 VanDerWaalsContact CD1-CZ 3.41Å; R205-R211 PolarHBondContact O-NH1 3.46Å; L206-R211 WeakPolarHBondContact O-CB 3.12Å; L208-R211 PolarHBondContact O-N 3.29Å; L208-R211 VanDerWaalsContact O-N 3.12Å; R211-T407 PolarHBondContact NH1-O 3.34Å; R211-T407 PolarHBondContact NH2-O 3.25Å
212	A	70.3	Confident	83.8	Confident	56 Å²	56	53.6 Å²	53.6	46%	0.463	30%	0.299	S	S	.	.			trans	-90.2	125.4	179.3	0	0	0	0	0	109.9	Q214 T215	A212-Q214 VanDerWaalsContact C-N 3.34Å; A212-T215 HydrophobicContact CB-CG2 3.83Å
213	T	79.5	Confident	83.9	Confident	56 Å²	56	54.3 Å²	54.3	34%	0.344	30%	0.302	S	S	.	.	S	Bend	trans	-85.5	-12.3	170.6	52.1	0	0	0	0	112.4	L206 N317 M318	L206-T213 HydrophobicContact CB-CG2 4.01Å; L206-T213 WeakPolarHBondContact O-CG2 3.36Å; T213-N317 CarbonylContact O-C 3.6Å; T213-N317 VanDerWaalsContact O-CA 3.29Å; T213-N317 WeakPolarHBondContact O-CA 3.24Å; T213-M318 WeakPolarHBondContact CB-O 3.14Å; T213-M318 PolarHBondContact O-N 3.28Å
214	Q	82.5	Confident	84.1	Confident	110 Å²	110	53.5 Å²	53.5	51%	0.514	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	119.7	174.3	178.9	175.1	50.7	0	0	108.7	A212 H315 M316 N317	A212-Q214 VanDerWaalsContact C-N 3.34Å; Q214-H315 HydrophobicContact CG-CB 3.86Å; Q214-M316 WeakPolarHBondContact CA-O 3.47Å; Q214-N317 VanDerWaalsContact CG-OD1 3.24Å; Q214-N317 WeakPolarHBondContact CG-OD1 3.24Å; Q214-N317 PolarHBondContact NE2-OD1 3.36Å; Q214-N317 VanDerWaalsContact NE2-OD1 3.17Å
215	T	87.8	Confident	84.2	Confident	9 Å²	9	54.4 Å²	54.4	6%	0.055	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.6	-174.9	54.6	0	0	0	0	112	A212 V217 D218 R291 H315 M316	A212-T215 HydrophobicContact CB-CG2 3.83Å; T215-V217 WeakPolarHBondContact CB-O 3.31Å; T215-D218 VanDerWaalsContact CB-OD1 3.24Å; T215-D218 WeakPolarHBondContact CB-OD1 3.28Å; T215-D218 WeakPolarHBondContact CG2-OD1 3.49Å; T215-D218 PolarHBondContact OG1-OD1 3.36Å; T215-D218 PolarHBondContact OG1-OD2 3.07Å; T215-R291 PolarHBondContact O-NH2 3.43Å; T215-R291 PolarHBondContact OG1-NH2 3.31Å; T215-H315 CarbonylContact O-C 3.54Å; T215-H315 VanDerWaalsContact O-CA 3.28Å; T215-H315 WeakPolarHBondContact O-CA 3.43Å; T215-M316 PolarHBondContact N-O 3.32Å; T215-M316 PolarHBondContact O-N 3.2Å
216	Y	88	Confident	84.6	Confident	150 Å²	150	48.9 Å²	48.9	59%	0.588	28%	0.28	S	S	*	.	S	Bend	trans	-99.9	-27.8	168.2	54.8	-84.6	0	0	0	111.2	E293	Y216-E293 PolarHBondContact O-N 3.48Å
217	V	90.1	Very high	85	Confident	58 Å²	58	54.2 Å²	54.2	35%	0.352	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	137.8	168.8	178.9	0	0	0	0	110.1	T215 R291 E292	T215-V217 WeakPolarHBondContact CB-O 3.31Å; V217-R291 CarbonylContact C-O 3.47Å; V217-R291 WeakPolarHBondContact CA-O 3.17Å; V217-R291 WeakPolarHBondContact CG1-O 3.48Å; V217-E292 HydrophobicContact CG1-CG 4.29Å; V217-E292 HydrophobicContact CG2-CB 4.45Å; V217-E292 HydrophobicContact CG2-CG 4Å
218	D	90.6	Very high	85.9	Confident	3 Å²	3	53 Å²	53	2%	0.016	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	134.3	167	-57.3	-76.3	0	0	0	110.8	T215 I290 R291 M316 N352	T215-D218 VanDerWaalsContact CB-OD1 3.24Å; T215-D218 WeakPolarHBondContact CB-OD1 3.28Å; T215-D218 WeakPolarHBondContact CG2-OD1 3.49Å; T215-D218 PolarHBondContact OG1-OD1 3.36Å; T215-D218 PolarHBondContact OG1-OD2 3.07Å; D218-I290 CarbonylContact O-C 3.55Å; D218-I290 WeakPolarHBondContact O-CA 3.4Å; D218-R291 HydrophobicContact CB-CB 4.42Å; D218-R291 PolarHBondContact N-O 3.41Å; D218-R291 PolarHBondContact O-N 2.98Å; D218-R291 IonicContact OD2-CZ 3.5Å; D218-R291 IonicContact OD2-NE 3.08Å; D218-R291 PolarHBondContact OD2-NE 3.13Å; D218-R291 IonicContact OD2-NH2 3.31Å; D218-R291 PolarHBondContact OD2-NH2 3.28Å; D218-M316 HydrophobicContact CB-CE 4.22Å; D218-M316 WeakPolarHBondContact OD1-CE 3.28Å; D218-M316 WeakPolarHBondContact OD2-CE 3.23Å; D218-N352 WeakPolarHBondContact CA-OD1 3.23Å; D218-N352 PolarHBondContact OD1-ND2 2.9Å
219	E	91.1	Very high	86.9	Confident	88 Å²	88	53.7 Å²	53.7	41%	0.411	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125.7	174.5	-178.2	175.4	-164.9	0	0	109.8	Q288 I289 I290 N352	E219-Q288 PolarHBondContact OE1-NE2 2.69Å; E219-I289 WeakPolarHBondContact CA-O 3.29Å; E219-I290 HydrophobicContact CG-CG1 4.3Å; E219-N352 PolarHBondContact N-OD1 2.83Å; E219-N352 PolarHBondContact O-N 3.46Å; E219-N352 PolarHBondContact O-OD1 2.58Å
220	I	94.5	Very high	88.4	Confident	2 Å²	2	49 Å²	49	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	124.7	-178.6	-42.3	179	0	0	0	106.9	F222 L234 L244 Q288 I289 F349 I350 F351	I220-F222 HydrophobicContact CG2-CD1 4.18Å; I220-F222 HydrophobicContact CG2-CE1 4.33Å; I220-L234 HydrophobicContact CD1-CD2 3.68Å; I220-L234 HydrophobicContact CG2-CD2 4.26Å; I220-L244 HydrophobicContact CD1-CD2 3.6Å; I220-Q288 CarbonylContact O-C 3.54Å; I220-Q288 WeakPolarHBondContact O-CA 3.2Å; I220-I289 HydrophobicContact CB-CB 4.17Å; I220-I289 PolarHBondContact N-O 3.27Å; I220-I289 PolarHBondContact O-N 2.59Å; I220-F349 HydrophobicContact CG2-CE1 3.99Å; I220-F349 HydrophobicContact CG2-CZ 4.15Å; I220-I350 WeakPolarHBondContact CA-O 3.46Å; I220-F351 HydrophobicContact CD1-CD2 4.03Å; I220-F351 HydrophobicContact CD1-CE2 4.07Å; I220-F351 HydrophobicContact CG1-CD2 3.83Å; I220-F351 HydrophobicContact CG1-CE2 4.15Å
221	S	94.3	Very high	89.9	Confident	26 Å²	26	44.8 Å²	44.8	18%	0.182	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	140	175.1	57.6	0	0	0	0	110.3	V287 F349 I350	S221-V287 VanDerWaalsContact CA-O 3.25Å; S221-V287 WeakPolarHBondContact CA-O 3.39Å; S221-F349 CarbonylContact O-C 3.32Å; S221-I350 PolarHBondContact N-O 3.41Å; S221-I350 PolarHBondContact O-N 2.83Å
222	F	96.2	Very high	91.1	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.026	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	160.7	177.9	59.6	-85.5	0	0	0	109.1	I220 F224 I233 V246 L253 V287 L346 F349	I220-F222 HydrophobicContact CG2-CD1 4.18Å; I220-F222 HydrophobicContact CG2-CE1 4.33Å; F222-F224 HydrophobicContact CD2-CB 4.14Å; F222-F224 HydrophobicContact CD2-CD1 4.22Å; F222-F224 HydrophobicContact CE2-CB 4.14Å; F222-F224 AromaticContact CE2-CD1 3.68Å; F222-F224 HydrophobicContact CE2-CD1 3.68Å; F222-F224 HydrophobicContact CE2-CE1 4.5Å; F222-F224 HydrophobicContact CE2-CG 4.24Å; F222-I233 HydrophobicContact CE1-CG2 4.38Å; F222-I233 HydrophobicContact CE2-CD1 4.21Å; F222-I233 HydrophobicContact CE2-CG2 3.88Å; F222-I233 HydrophobicContact CZ-CD1 4.36Å; F222-I233 HydrophobicContact CZ-CG2 3.76Å; F222-V246 HydrophobicContact CZ-CG1 4.21Å; F222-L253 HydrophobicContact CZ-CD1 4.36Å; F222-V287 HydrophobicContact CD1-CB 4.14Å; F222-V287 HydrophobicContact CD1-CG1 4.17Å; F222-V287 HydrophobicContact CD2-CB 4.18Å; F222-V287 HydrophobicContact CD2-CG2 4.35Å; F222-V287 HydrophobicContact CE1-CB 3.86Å; F222-V287 HydrophobicContact CE1-CG1 3.52Å; F222-V287 HydrophobicContact CE2-CB 3.9Å; F222-V287 HydrophobicContact CE2-CG1 4.27Å; F222-V287 HydrophobicContact CE2-CG2 3.81Å; F222-V287 HydrophobicContact CG-CB 4.29Å; F222-V287 HydrophobicContact CZ-CB 3.73Å; F222-V287 HydrophobicContact CZ-CG1 3.58Å; F222-V287 HydrophobicContact CZ-CG2 3.91Å; F222-V287 PolarHBondContact N-O 2.68Å; F222-V287 WeakPolarHBondContact O-CA 3.43Å; F222-V287 WeakPolarHBondContact O-CB 3.4Å; F222-V287 PolarHBondContact O-N 2.69Å; F222-L346 HydrophobicContact CD2-CD2 4.21Å; F222-F349 HydrophobicContact CB-CB 4.09Å; F222-F349 HydrophobicContact CB-CD2 3.49Å; F222-F349 VanDerWaalsContact CB-CD2 3.49Å; F222-F349 HydrophobicContact CB-CE2 4.02Å; F222-F349 HydrophobicContact CB-CG 3.85Å; F222-F349 AromaticContact CD1-CD2 3.99Å; F222-F349 HydrophobicContact CD1-CD2 3.99Å; F222-F349 AromaticContact CD1-CE2 3.59Å; F222-F349 HydrophobicContact CD1-CE2 3.59Å; F222-F349 AromaticContact CD1-CZ 3.92Å; F222-F349 HydrophobicContact CD1-CZ 3.92Å; F222-F349 HydrophobicContact CD2-CD2 4.23Å; F222-F349 HydrophobicContact CD2-CE2 4.17Å; F222-F349 HydrophobicContact CE1-CE2 4.03Å; F222-F349 HydrophobicContact CE1-CZ 4.25Å; F222-F349 AromaticContact CG-CD2 3.67Å; F222-F349 HydrophobicContact CG-CD2 3.67Å; F222-F349 AromaticContact CG-CE2 3.68Å; F222-F349 HydrophobicContact CG-CE2 3.68Å; F222-F349 HydrophobicContact CG-CG 4.41Å; F222-F349 HydrophobicContact CG-CZ 4.43Å; F222-F349 HydrophobicContact CZ-CE2 4.48Å
223	R	95.3	Very high	92.5	Very high	15 Å²	15	39.7 Å²	39.7	6%	0.057	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	144.7	163.2	-48.7	176.7	74.3	-139.1	3.6	109	D124 Y189 W284 H285 D286 L346 E347	D124-R223 IonicContact OD2-CZ 2.76Å; D124-R223 IonicContact OD2-NH1 2.71Å; D124-R223 PolarHBondContact OD2-NH1 3.01Å; D124-R223 IonicContact OD2-NH2 3.81Å; D124-R223 PolarHBondContact OD2-NH2 3.35Å; Y189-R223 WeakPolarHBondContact OH-CD 3.46Å; R223-W284 HydrophobicContact CB-CE3 3.89Å; R223-W284 HydrophobicContact CB-CZ3 4.27Å; R223-W284 VanDerWaalsContact NH2-CB 3.29Å; R223-H285 CarbonylContact C-O 3.24Å; R223-H285 WeakPolarHBondContact CA-O 3.49Å; R223-H285 WeakPolarHBondContact CB-O 3.09Å; R223-D286 WeakPolarHBondContact CD-OD1 3.44Å; R223-D286 WeakPolarHBondContact CG-OD1 3.16Å; R223-D286 IonicContact CZ-OD1 3.17Å; R223-D286 IonicContact NE-OD1 2.86Å; R223-D286 PolarHBondContact NE-OD1 3.34Å; R223-D286 IonicContact NH2-OD1 2.65Å; R223-L346 CarbonylContact O-C 3.55Å; R223-L346 WeakPolarHBondContact O-CA 3.45Å; R223-E347 HydrophobicContact CB-CB 3.96Å; R223-E347 PolarHBondContact N-O 3.02Å; R223-E347 IonicContact NH1-OE2 2.66Å; R223-E347 PolarHBondContact NH1-OE2 2.8Å; R223-E347 PolarHBondContact O-N 2.59Å
224	F	96.5	Very high	93.3	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	159.6	174.5	78.7	-83.9	0	0	0	112.1	F222 T226 L248 L279 W284 H285 V287 F342 C345 L346	F222-F224 HydrophobicContact CD2-CB 4.14Å; F222-F224 HydrophobicContact CD2-CD1 4.22Å; F222-F224 HydrophobicContact CE2-CB 4.14Å; F222-F224 AromaticContact CE2-CD1 3.68Å; F222-F224 HydrophobicContact CE2-CD1 3.68Å; F222-F224 HydrophobicContact CE2-CE1 4.5Å; F222-F224 HydrophobicContact CE2-CG 4.24Å; F224-T226 HydrophobicContact CD2-CG2 4.11Å; F224-T226 HydrophobicContact CE2-CG2 4.03Å; F224-L248 HydrophobicContact CE2-CD1 4.28Å; F224-L248 HydrophobicContact CE2-CD2 4.49Å; F224-L248 HydrophobicContact CZ-CD1 4.26Å; F224-L279 HydrophobicContact CE2-CB 4.16Å; F224-L279 HydrophobicContact CZ-CB 3.8Å; F224-L279 HydrophobicContact CZ-CD1 3.9Å; F224-L279 HydrophobicContact CZ-CG 4.32Å; F224-W284 WeakPolarHBondContact O-CA 3.21Å; F224-H285 HydrophobicContact CD1-CB 4.08Å; F224-H285 HydrophobicContact CE1-CB 3.71Å; F224-H285 HydrophobicContact CZ-CB 4.06Å; F224-H285 AromaticContact CZ-CD2 3.94Å; F224-H285 PolarHBondContact N-O 3.42Å; F224-H285 PolarHBondContact O-N 3.4Å; F224-V287 HydrophobicContact CD1-CG2 3.64Å; F224-V287 HydrophobicContact CE1-CG2 3.51Å; F224-F342 HydrophobicContact CB-CZ 4.03Å; F224-F342 AromaticContact CD2-CE2 3.99Å; F224-F342 HydrophobicContact CD2-CE2 3.99Å; F224-F342 HydrophobicContact CD2-CZ 4.04Å; F224-F342 HydrophobicContact CG-CZ 4.47Å; F224-C345 CarbonylContact C-O 3.53Å; F224-C345 WeakPolarHBondContact CA-O 3.13Å; F224-L346 HydrophobicContact CB-CD2 3.62Å
225	R	93.3	Very high	93.9	Very high	19 Å²	19	31.8 Å²	31.8	7%	0.072	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	131	175.7	171.6	175.6	160.1	-178.6	-5.6	110.2	D282 Q283 W284 G344 C345 T424	R225-D282 WeakPolarHBondContact CD-O 3.15Å; R225-D282 IonicContact CZ-OD1 3.42Å; R225-D282 VanDerWaalsContact CZ-OD1 3.32Å; R225-D282 IonicContact CZ-OD2 3Å; R225-D282 PolarHBondContact NE-O 2.67Å; R225-D282 IonicContact NE-OD1 3.02Å; R225-D282 PolarHBondContact NE-OD1 3.46Å; R225-D282 IonicContact NE-OD2 2.87Å; R225-D282 IonicContact NH2-OD1 3.24Å; R225-D282 PolarHBondContact NH2-OD1 2.72Å; R225-D282 IonicContact NH2-OD2 2.68Å; R225-D282 PolarHBondContact NH2-OD2 2.81Å; R225-Q283 WeakPolarHBondContact CA-O 3.33Å; R225-Q283 WeakPolarHBondContact CB-O 3.3Å; R225-Q283 WeakPolarHBondContact CG-O 3.11Å; R225-W284 HydrophobicContact CB-CD2 3.84Å; R225-W284 HydrophobicContact CB-CE3 3.8Å; R225-W284 HydrophobicContact CB-CG 4.33Å; R225-W284 HydrophobicContact CB-CH2 4.43Å; R225-W284 HydrophobicContact CB-CZ2 4.48Å; R225-W284 HydrophobicContact CB-CZ3 4.1Å; R225-G344 CarbonylContact O-C 3.04Å; R225-G344 VanDerWaalsContact O-CA 3.31Å; R225-G344 WeakPolarHBondContact O-CA 3.36Å; R225-C345 HydrophobicContact CB-CB 4.45Å; R225-C345 PolarHBondContact N-O 2.87Å; R225-C345 PolarHBondContact O-N 3.34Å; R225-T424 VanDerWaalsContact NH1-CG2 3.31Å; R225-T424 VanDerWaalsContact NH2-N 3.16Å
226	T	94.2	Very high	94.2	Very high	4 Å²	4	31.4 Å²	31.4	3%	0.025	15%	0.148	C	C	.	.			trans	-157.9	162.3	179.7	-174.9	0	0	0	0	112.8	F224 E228 L248 D280 D282 F342 I343	F224-T226 HydrophobicContact CD2-CG2 4.11Å; F224-T226 HydrophobicContact CE2-CG2 4.03Å; T226-E228 PolarHBondContact OG1-N 3.38Å; T226-L248 HydrophobicContact CG2-CD2 3.48Å; T226-L248 VanDerWaalsContact CG2-CD2 3.48Å; T226-D280 CarbonylContact O-C 3.56Å; T226-D280 VanDerWaalsContact O-C 3.28Å; T226-D280 WeakPolarHBondContact O-CA 3.26Å; T226-D282 WeakPolarHBondContact O-CA 3.31Å; T226-D282 PolarHBondContact O-N 3.4Å; T226-F342 HydrophobicContact CG2-CE2 3.93Å; T226-F342 HydrophobicContact CG2-CZ 4.37Å; T226-I343 WeakPolarHBondContact CB-O 3.46Å; T226-I343 PolarHBondContact OG1-O 3.4Å
227	K	90.8	Very high	94.4	Very high	116 Å²	116	24.9 Å²	24.9	50%	0.504	12%	0.123	S	C	.	.	S	Bend	trans	-104.4	-7.8	168.3	-68.9	-175.5	-179.1	-171.3	0	112.8	D282	K227-D282 HydrophobicContact CD-CB 4.38Å; K227-D282 WeakPolarHBondContact CE-OD2 3.11Å; K227-D282 HydrophobicContact CG-CB 3.75Å; K227-D282 IonicContact NZ-OD2 2.78Å
228	E	94.6	Very high	94.2	Very high	84 Å²	84	22.6 Å²	22.6	39%	0.393	11%	0.11	S	C	.	.			trans	-85.9	138.2	-178.2	-64.5	-56.6	143.3	0	0	109.7	T226 N230 L248 I343	T226-E228 PolarHBondContact OG1-N 3.38Å; E228-N230 VanDerWaalsContact C-N 3.28Å; E228-L248 WeakPolarHBondContact O-CD2 3.41Å; E228-I343 HydrophobicContact CG-CB 4Å; E228-I343 HydrophobicContact CG-CD1 4.43Å
229	I	93.7	Very high	93.7	Very high	53 Å²	53	26.4 Å²	26.4	27%	0.272	14%	0.137	S	C	.	.	S	Bend	trans	-78.3	-15	176.1	58.3	164.5	0	0	0	112.8	Y249 R250 G251 D280 L524	I229-Y249 CarbonylContact O-C 3.53Å; I229-R250 WeakPolarHBondContact O-CA 3.34Å; I229-R250 PolarHBondContact O-N 3.4Å; I229-G251 PolarHBondContact O-N 3.39Å; I229-D280 HydrophobicContact CG2-CB 3.91Å; I229-L524 HydrophobicContact CD1-CD2 4.18Å; I229-L524 HydrophobicContact CG2-CD2 4.39Å
230	N	96.1	Very high	93.1	Very high	32 Å²	32	28.1 Å²	28.1	17%	0.171	14%	0.144	C	C	.	.			trans	-136.9	138.8	-175.1	-65.7	-45.4	0	0	0	110.9	E228 L248 Y249 R250 V338 Q340	E228-N230 VanDerWaalsContact C-N 3.28Å; N230-L248 CarbonylContact C-O 3.52Å; N230-L248 WeakPolarHBondContact CA-O 3.46Å; N230-Y249 WeakPolarHBondContact OD1-CA 3.29Å; N230-R250 PolarHBondContact OD1-N 2.04Å; N230-V338 HydrophobicContact CB-CG1 4.09Å; N230-Q340 VanDerWaalsContact CB-CD 3.46Å; N230-Q340 HydrophobicContact CB-CG 4.22Å; N230-Q340 WeakPolarHBondContact O-CG 2.97Å
231	G	97	Very high	92.6	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.7	136.6	174.8	0	0	0	0	0	113.7	I233 L248	G231-I233 PolarHBondContact O-N 3.17Å; G231-L248 PolarHBondContact N-O 2.94Å; G231-L248 PolarHBondContact O-N 3.35Å
232	L	97.9	Very high	92.4	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	118.9	178	-176.3	64.7	0	0	0	111.7	C245 E247 G325 L327 Y330 I336 V338 Q340 F342	L232-C245 VanDerWaalsContact CD1-SG 3.57Å; L232-E247 HydrophobicContact CD1-CB 4.28Å; L232-G325 CarbonylContact O-C 3.46Å; L232-G325 WeakPolarHBondContact O-CA 2.97Å; L232-L327 HydrophobicContact CD2-CB 4.22Å; L232-L327 HydrophobicContact CD2-CD1 3.53Å; L232-L327 HydrophobicContact CD2-CG 3.59Å; L232-Y330 HydrophobicContact CB-CE1 4.3Å; L232-Y330 WeakPolarHBondContact CB-OH 3.49Å; L232-Y330 HydrophobicContact CD2-CE1 3.88Å; L232-I336 HydrophobicContact CD1-CG2 4.38Å; L232-I336 HydrophobicContact CD2-CD1 4.35Å; L232-V338 HydrophobicContact CB-CG2 3.95Å; L232-Q340 PolarHBondContact N-O 2.69Å; L232-F342 VanDerWaalsContact O-CB 3.23Å; L232-F342 WeakPolarHBondContact O-CB 3.1Å; L232-F342 PolarHBondContact O-N 2.84Å
233	I	97.7	Very high	92.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	-47.1	-177.2	-65.4	170.8	0	0	0	111.7	F222 G231 V246 L248 L253 I324 G325 F342 L346 F349	F222-I233 HydrophobicContact CE1-CG2 4.38Å; F222-I233 HydrophobicContact CE2-CD1 4.21Å; F222-I233 HydrophobicContact CE2-CG2 3.88Å; F222-I233 HydrophobicContact CZ-CD1 4.36Å; F222-I233 HydrophobicContact CZ-CG2 3.76Å; G231-I233 PolarHBondContact O-N 3.17Å; I233-V246 WeakPolarHBondContact CA-O 3.42Å; I233-V246 HydrophobicContact CB-CG1 4.44Å; I233-V246 WeakPolarHBondContact CB-O 3.03Å; I233-V246 PolarHBondContact N-O 3.14Å; I233-L248 HydrophobicContact CD1-CB 4.45Å; I233-L253 HydrophobicContact CD1-CD1 3.95Å; I233-I324 CarbonylContact O-C 3.5Å; I233-I324 VanDerWaalsContact O-CA 3.27Å; I233-I324 WeakPolarHBondContact O-CA 3.41Å; I233-G325 PolarHBondContact O-N 2.62Å; I233-F342 HydrophobicContact CD1-CD2 4.2Å; I233-F342 HydrophobicContact CD1-CE2 4.22Å; I233-F342 HydrophobicContact CG1-CB 4.42Å; I233-F342 HydrophobicContact CG1-CD2 3.64Å; I233-F342 HydrophobicContact CG1-CE2 4.13Å; I233-F342 HydrophobicContact CG1-CG 4.14Å; I233-L346 HydrophobicContact CG2-CD2 4.47Å; I233-F349 HydrophobicContact CG2-CE2 3.76Å; I233-F349 HydrophobicContact CG2-CZ 4.41Å
234	L	96.9	Very high	92.3	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	138.2	-179.4	-174.1	68.4	0	0	0	110.1	I220 L244 C245 V246 L322 S323 I324 F349 F351	I220-L234 HydrophobicContact CD1-CD2 3.68Å; I220-L234 HydrophobicContact CG2-CD2 4.26Å; L234-L244 HydrophobicContact CD2-CD2 4.24Å; L234-C245 CarbonylContact O-C 3.14Å; L234-C245 WeakPolarHBondContact O-CA 3.34Å; L234-V246 HydrophobicContact CB-CB 3.78Å; L234-V246 HydrophobicContact CB-CG2 3.95Å; L234-V246 HydrophobicContact CD2-CG2 4Å; L234-V246 PolarHBondContact N-O 2.77Å; L234-V246 PolarHBondContact O-N 2.83Å; L234-L322 HydrophobicContact CD1-CD1 3.66Å; L234-L322 HydrophobicContact CD1-CD2 3.92Å; L234-L322 HydrophobicContact CD1-CG 3.64Å; L234-L322 HydrophobicContact CD2-CD1 4.43Å; L234-L322 HydrophobicContact CG-CD1 4.01Å; L234-S323 CarbonylContact C-O 3.49Å; L234-S323 WeakPolarHBondContact CA-O 3.49Å; L234-I324 HydrophobicContact CD1-CD1 4.35Å; L234-I324 HydrophobicContact CD1-CG1 3.66Å; L234-F349 HydrophobicContact CB-CZ 4.31Å; L234-F349 HydrophobicContact CD1-CE1 4.23Å; L234-F349 HydrophobicContact CD1-CZ 4.04Å; L234-F349 HydrophobicContact CD2-CZ 4.46Å; L234-F351 HydrophobicContact CD2-CD2 4.5Å
235	Y	96.5	Very high	92.3	Very high	1 Å²	1	27 Å²	27	0%	0.004	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	129.4	171.3	-177.2	-95.5	0	0	0	111.7	D237 L244 C245 L322 S323 L327 R333 R334 I336	Y235-D237 HydrophobicContact CE1-CB 3.87Å; Y235-D237 WeakPolarHBondContact CE1-OD2 3.25Å; Y235-D237 WeakPolarHBondContact OH-CB 3.34Å; Y235-D237 PolarHBondContact OH-OD2 3.42Å; Y235-L244 WeakPolarHBondContact CA-O 3.43Å; Y235-C245 HydrophobicContact CD2-CB 4.08Å; Y235-L322 CarbonylContact O-C 3.58Å; Y235-L322 WeakPolarHBondContact O-CA 3.33Å; Y235-S323 PolarHBondContact N-O 2.93Å; Y235-S323 PolarHBondContact O-N 3.08Å; Y235-L327 HydrophobicContact CD1-CD1 3.86Å; Y235-L327 HydrophobicContact CD1-CD2 4.18Å; Y235-L327 HydrophobicContact CE1-CD1 4.38Å; Y235-L327 HydrophobicContact CG-CD1 4.01Å; Y235-R333 HydrophobicContact CE1-CG 4.42Å; Y235-R333 HydrophobicContact CE2-CB 4.4Å; Y235-R334 WeakPolarHBondContact CE2-O 3.49Å; Y235-R334 PolarHBondContact OH-N 2.72Å; Y235-I336 HydrophobicContact CD2-CD1 3.55Å; Y235-I336 HydrophobicContact CD2-CG1 3.69Å; Y235-I336 HydrophobicContact CE2-CD1 3.56Å; Y235-I336 HydrophobicContact CE2-CG1 3.57Å; Y235-I336 HydrophobicContact CG-CD1 4.17Å
236	G	93.3	Very high	92.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	141.5	169.3	0	0	0	0	0	110.2	Y243 L244	G236-Y243 CarbonylContact O-C 3.6Å; G236-Y243 WeakPolarHBondContact O-CA 3.35Å; G236-Y243 WeakPolarHBondContact O-CB 3.23Å; G236-L244 PolarHBondContact N-O 3.41Å; G236-L244 PolarHBondContact O-N 3.45Å
237	D	91.8	Very high	92.7	Very high	13 Å²	13	26 Å²	26	7%	0.07	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	169.8	178.2	65.6	-2.7	0	0	0	113	Y235 D242 R320 R333	Y235-D237 HydrophobicContact CE1-CB 3.87Å; Y235-D237 WeakPolarHBondContact CE1-OD2 3.25Å; Y235-D237 WeakPolarHBondContact OH-CB 3.34Å; Y235-D237 PolarHBondContact OH-OD2 3.42Å; D237-D242 CarbonylContact C-O 3.51Å; D237-D242 WeakPolarHBondContact CA-O 3.39Å; D237-R320 WeakPolarHBondContact O-CB 3.36Å; D237-R320 WeakPolarHBondContact OD1-CD 3Å; D237-R320 IonicContact OD1-NH1 3.22Å; D237-R320 IonicContact OD2-NH1 3.71Å; D237-R333 IonicContact OD1-NH1 2.65Å; D237-R333 PolarHBondContact OD1-NH1 3.39Å; D237-R333 IonicContact OD2-NH1 3.55Å; D237-R333 PolarHBondContact OD2-NH1 3.36Å
238	S	86.9	Confident	93	Very high	11 Å²	11	20.4 Å²	20.4	8%	0.077	11%	0.11	C	C	.	.			trans	-132	165.5	172.6	88.3	0	0	0	0	113.5	Q240 G241 D242 N317 N319	S238-Q240 PolarHBondContact O-N 3Å; S238-Q240 PolarHBondContact OG-N 3.3Å; S238-G241 PolarHBondContact O-N 2.88Å; S238-D242 PolarHBondContact N-O 2.88Å; S238-D242 WeakPolarHBondContact OG-CB 3.28Å; S238-D242 PolarHBondContact OG-N 2.94Å; S238-D242 PolarHBondContact OG-OD2 2.97Å; S238-N317 WeakPolarHBondContact CB-O 3.04Å; S238-N319 VanDerWaalsContact CA-OD1 3.24Å; S238-N319 WeakPolarHBondContact CA-OD1 3.44Å; S238-N319 WeakPolarHBondContact CB-OD1 3.21Å
239	S	79.4	Confident	93	Very high	83 Å²	83	19 Å²	19	58%	0.58	10%	0.102	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-15.9	169.8	53.5	0	0	0	0	114	N319	S239-N319 PolarHBondContact N-OD1 2.97Å; S239-N319 PolarHBondContact OG-ND2 3.02Å
240	Q	77.3	Confident	92.9	Very high	123 Å²	123	18.8 Å²	18.8	58%	0.575	10%	0.098	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-1.3	-177.5	-63	-175.9	63.5	0	0	113	S238 D242	S238-Q240 PolarHBondContact O-N 3Å; S238-Q240 PolarHBondContact OG-N 3.3Å; Q240-D242 WeakPolarHBondContact CB-OD2 3.08Å
241	G	84.1	Confident	92.8	Very high	7 Å²	7	17.2 Å²	17.2	7%	0.072	9%	0.089	C	C	.	.	S	Bend	trans	98	-7.2	178.7	0	0	0	0	0	114	S238 Y243	S238-G241 PolarHBondContact O-N 2.88Å; G241-Y243 WeakPolarHBondContact O-CD1 3.06Å
242	D	91.5	Very high	92.7	Very high	3 Å²	3	21.1 Å²	21.1	2%	0.016	10%	0.104	C	C	.	.			trans	-63.7	140.8	173	-45.9	-155.3	0	0	0	110.3	D237 S238 Q240 N258 G260 N317	D237-D242 CarbonylContact C-O 3.51Å; D237-D242 WeakPolarHBondContact CA-O 3.39Å; S238-D242 PolarHBondContact N-O 2.88Å; S238-D242 WeakPolarHBondContact OG-CB 3.28Å; S238-D242 PolarHBondContact OG-N 2.94Å; S238-D242 PolarHBondContact OG-OD2 2.97Å; Q240-D242 WeakPolarHBondContact CB-OD2 3.08Å; D242-N258 CarbonylContact C-O 3.56Å; D242-N258 WeakPolarHBondContact CA-O 3.46Å; D242-G260 VanDerWaalsContact OD2-CA 3.27Å; D242-G260 WeakPolarHBondContact OD2-CA 3.46Å; D242-N317 VanDerWaalsContact CB-O 3.29Å; D242-N317 WeakPolarHBondContact CB-O 3.09Å; D242-N317 VanDerWaalsContact OD1-CB 3.28Å; D242-N317 WeakPolarHBondContact OD1-CB 3.35Å; D242-N317 PolarHBondContact OD1-N 2.86Å; D242-N317 PolarHBondContact OD1-ND2 2.91Å
243	Y	93.7	Very high	92.6	Very high	11 Å²	11	21.1 Å²	21.1	4%	0.043	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	157.1	168.8	61.3	-96.3	0	0	0	111.8	G236 G241 R256 V257 N258 D270 R334	G236-Y243 CarbonylContact O-C 3.6Å; G236-Y243 WeakPolarHBondContact O-CA 3.35Å; G236-Y243 WeakPolarHBondContact O-CB 3.23Å; G241-Y243 WeakPolarHBondContact O-CD1 3.06Å; Y243-R256 HydrophobicContact CE2-CB 3.95Å; Y243-V257 WeakPolarHBondContact O-CA 3.35Å; Y243-N258 HydrophobicContact CD1-CB 3.73Å; Y243-N258 HydrophobicContact CE1-CB 3.41Å; Y243-N258 VanDerWaalsContact CE1-CB 3.41Å; Y243-N258 HydrophobicContact CE2-CB 4.2Å; Y243-N258 HydrophobicContact CG-CB 4.29Å; Y243-N258 PolarHBondContact N-O 2.64Å; Y243-N258 PolarHBondContact O-N 3.11Å; Y243-D270 PolarHBondContact OH-OD1 3.4Å; Y243-D270 PolarHBondContact OH-OD2 3.13Å; Y243-R334 HydrophobicContact CD1-CB 4Å; Y243-R334 HydrophobicContact CE1-CB 4Å
244	L	94.9	Very high	92.6	Very high	6 Å²	6	22.7 Å²	22.7	3%	0.031	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	122.7	167.3	175.1	66.2	0	0	0	108.3	I220 L234 Y235 G236 V255 R256 V257 M316 M318	I220-L244 HydrophobicContact CD1-CD2 3.6Å; L234-L244 HydrophobicContact CD2-CD2 4.24Å; Y235-L244 WeakPolarHBondContact CA-O 3.43Å; G236-L244 PolarHBondContact N-O 3.41Å; G236-L244 PolarHBondContact O-N 3.45Å; L244-V255 HydrophobicContact CD1-CG1 4Å; L244-R256 WeakPolarHBondContact CA-O 3.29Å; L244-V257 HydrophobicContact CD1-CB 4.35Å; L244-M316 HydrophobicContact CB-CE 4.27Å; L244-M316 HydrophobicContact CB-SD 3.75Å; L244-M316 HydrophobicContact CD2-CE 3.77Å; L244-M316 HydrophobicContact CD2-SD 4.2Å; L244-M316 HydrophobicContact CG-SD 4.43Å; L244-M318 HydrophobicContact CB-SD 4.42Å
245	C	96.6	Very high	92.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.3	175.9	-178.6	0	0	0	0	109.5	L232 L234 Y235 V255 R256 G335	L232-C245 VanDerWaalsContact CD1-SG 3.57Å; L234-C245 CarbonylContact O-C 3.14Å; L234-C245 WeakPolarHBondContact O-CA 3.34Å; Y235-C245 HydrophobicContact CD2-CB 4.08Å; C245-V255 CarbonylContact O-C 3.56Å; C245-V255 WeakPolarHBondContact O-CA 3.35Å; C245-R256 HydrophobicContact CB-CB 4.26Å; C245-R256 PolarHBondContact N-O 3.46Å; C245-R256 PolarHBondContact O-N 3.1Å; C245-G335 WeakPolarHBondContact CB-O 3.13Å
246	V	98	Very high	92.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.4	167.3	-173.4	0	0	0	0	106.8	F222 I233 L234 L253 R254 V255 I289	F222-V246 HydrophobicContact CZ-CG1 4.21Å; I233-V246 WeakPolarHBondContact CA-O 3.42Å; I233-V246 HydrophobicContact CB-CG1 4.44Å; I233-V246 WeakPolarHBondContact CB-O 3.03Å; I233-V246 PolarHBondContact N-O 3.14Å; L234-V246 HydrophobicContact CB-CB 3.78Å; L234-V246 HydrophobicContact CB-CG2 3.95Å; L234-V246 HydrophobicContact CD2-CG2 4Å; L234-V246 PolarHBondContact N-O 2.77Å; L234-V246 PolarHBondContact O-N 2.83Å; V246-L253 HydrophobicContact CG1-CD1 3.65Å; V246-L253 HydrophobicContact CG1-CD2 4.49Å; V246-L253 HydrophobicContact CG1-CG 4.17Å; V246-R254 WeakPolarHBondContact CA-O 3.22Å; V246-V255 HydrophobicContact CG1-CG2 4.41Å; V246-V255 HydrophobicContact CG2-CG2 4.34Å; V246-I289 HydrophobicContact CB-CD1 4.48Å; V246-I289 HydrophobicContact CG1-CD1 3.97Å; V246-I289 HydrophobicContact CG2-CD1 3.63Å
247	E	97.7	Very high	92.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	148.6	-177.3	63.3	-172.6	173.4	0	0	109.6	L232 R254 R256 S337 V338	L232-E247 HydrophobicContact CD1-CB 4.28Å; E247-R254 HydrophobicContact CG-CB 3.85Å; E247-R254 HydrophobicContact CG-CG 4.11Å; E247-R254 PolarHBondContact N-O 3.27Å; E247-R254 PolarHBondContact O-N 3.43Å; E247-R254 VanDerWaalsContact OE1-CD 3.25Å; E247-R254 WeakPolarHBondContact OE1-CD 3.32Å; E247-R256 IonicContact OE1-NE 3.14Å; E247-S337 WeakPolarHBondContact OE1-CB 3.23Å; E247-S337 PolarHBondContact OE1-N 2.7Å; E247-S337 PolarHBondContact OE1-OG 3.06Å; E247-S337 PolarHBondContact OE2-N 2.76Å; E247-V338 HydrophobicContact CB-CG1 4.27Å; E247-V338 HydrophobicContact CB-CG2 4.19Å; E247-V338 HydrophobicContact CG-CG1 4.44Å; E247-V338 WeakPolarHBondContact OE2-CG2 3.05Å; E247-V338 PolarHBondContact OE2-N 2.69Å; E247-V338 VanDerWaalsContact OE2-N 3.08Å
248	L	97.6	Very high	92.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	122.8	161.7	-170.7	69.5	0	0	0	107	F224 T226 E228 N230 G231 I233 R252 L279 V338	F224-L248 HydrophobicContact CE2-CD1 4.28Å; F224-L248 HydrophobicContact CE2-CD2 4.49Å; F224-L248 HydrophobicContact CZ-CD1 4.26Å; T226-L248 HydrophobicContact CG2-CD2 3.48Å; T226-L248 VanDerWaalsContact CG2-CD2 3.48Å; E228-L248 WeakPolarHBondContact O-CD2 3.41Å; N230-L248 CarbonylContact C-O 3.52Å; N230-L248 WeakPolarHBondContact CA-O 3.46Å; G231-L248 PolarHBondContact N-O 2.94Å; G231-L248 PolarHBondContact O-N 3.35Å; I233-L248 HydrophobicContact CD1-CB 4.45Å; L248-R252 CarbonylContact C-O 3.58Å; L248-R252 WeakPolarHBondContact CA-O 3.37Å; L248-R252 WeakPolarHBondContact CD1-O 3.19Å; L248-L279 HydrophobicContact CD1-CB 3.89Å; L248-L279 HydrophobicContact CD1-CD1 4.09Å; L248-V338 WeakPolarHBondContact O-CG1 3.42Å
249	Y	95.1	Very high	92.9	Very high	55 Å²	55	23.6 Å²	23.6	22%	0.216	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	116.6	179.5	-178.1	-97.3	0	0	0	109.6	I229 N230 G251 R252 V338	I229-Y249 CarbonylContact O-C 3.53Å; N230-Y249 WeakPolarHBondContact OD1-CA 3.29Å; Y249-G251 VanDerWaalsContact C-N 3.29Å; Y249-G251 PolarHBondContact O-N 3.35Å; Y249-R252 PolarHBondContact N-O 3.21Å; Y249-R252 PolarHBondContact O-N 2.76Å; Y249-R252 VanDerWaalsContact O-N 3.12Å; Y249-V338 HydrophobicContact CD2-CG1 4.03Å
250	R	92	Very high	93.1	Very high	47 Å²	47	19.8 Å²	19.8	18%	0.177	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	42.6	-176.8	-58.3	179	72.4	112.5	1.6	113.7	I229 N230 R252 D512 D522 L524	I229-R250 WeakPolarHBondContact O-CA 3.34Å; I229-R250 PolarHBondContact O-N 3.4Å; N230-R250 PolarHBondContact OD1-N 2.04Å; R250-R252 VanDerWaalsContact C-N 3.28Å; R250-R252 PolarHBondContact O-N 3.14Å; R250-D512 IonicContact CZ-OD2 2.76Å; R250-D512 VanDerWaalsContact NH1-CG 3.28Å; R250-D512 IonicContact NH1-OD1 2.95Å; R250-D512 PolarHBondContact NH1-OD1 2.84Å; R250-D512 IonicContact NH1-OD2 3.28Å; R250-D512 PolarHBondContact NH1-OD2 2.81Å; R250-D512 IonicContact NH2-OD2 2.68Å; R250-D512 PolarHBondContact NH2-OD2 2.93Å; R250-D522 IonicContact NH2-OD2 3.2Å; R250-D522 PolarHBondContact NH2-OD2 2.87Å; R250-L524 HydrophobicContact CB-CD2 4.32Å
251	G	92.8	Very high	93.1	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	18.3	179.2	0	0	0	0	0	114.1	I229 Y249 S277 L278 L279	I229-G251 PolarHBondContact O-N 3.39Å; Y249-G251 VanDerWaalsContact C-N 3.29Å; Y249-G251 PolarHBondContact O-N 3.35Å; G251-S277 CarbonylContact O-C 3.28Å; G251-L278 PolarHBondContact O-N 3.43Å; G251-L279 WeakPolarHBondContact O-CG 3.41Å; G251-L279 PolarHBondContact O-N 3.39Å
252	R	94.3	Very high	92.6	Very high	83 Å²	83	19.1 Å²	19.1	31%	0.313	9%	0.088	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	148.1	174.2	-57.5	-170.4	170.7	178.1	-7.2	110.5	L248 Y249 R250 R254 G276 D611	L248-R252 CarbonylContact C-O 3.58Å; L248-R252 WeakPolarHBondContact CA-O 3.37Å; L248-R252 WeakPolarHBondContact CD1-O 3.19Å; Y249-R252 PolarHBondContact N-O 3.21Å; Y249-R252 PolarHBondContact O-N 2.76Å; Y249-R252 VanDerWaalsContact O-N 3.12Å; R250-R252 VanDerWaalsContact C-N 3.28Å; R250-R252 PolarHBondContact O-N 3.14Å; R252-R254 PolarHBondContact O-N 2.89Å; R252-G276 WeakPolarHBondContact CG-O 3.03Å; R252-D611 IonicContact NH2-OD2 2.73Å; R252-D611 PolarHBondContact NH2-OD2 3.29Å
253	L	97.2	Very high	91.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	116.9	172.7	-171.2	77.4	0	0	0	108.2	F222 I233 V246 D274 A275 L279 V287 I298 V300	F222-L253 HydrophobicContact CZ-CD1 4.36Å; I233-L253 HydrophobicContact CD1-CD1 3.95Å; V246-L253 HydrophobicContact CG1-CD1 3.65Å; V246-L253 HydrophobicContact CG1-CD2 4.49Å; V246-L253 HydrophobicContact CG1-CG 4.17Å; L253-D274 CarbonylContact O-C 3.57Å; L253-D274 WeakPolarHBondContact O-CA 3.07Å; L253-A275 WeakPolarHBondContact CA-O 3.49Å; L253-A275 WeakPolarHBondContact CB-O 3.28Å; L253-A275 PolarHBondContact N-O 3.4Å; L253-A275 PolarHBondContact O-N 3.33Å; L253-L279 HydrophobicContact CB-CD1 3.91Å; L253-V287 HydrophobicContact CD2-CB 4.43Å; L253-V287 HydrophobicContact CD2-CG1 3.49Å; L253-V287 VanDerWaalsContact CD2-CG1 3.49Å; L253-V287 HydrophobicContact CD2-CG2 4Å; L253-I298 HydrophobicContact CD2-CG2 4.09Å; L253-V300 HydrophobicContact CB-CG2 4Å; L253-V300 HydrophobicContact CD2-CG2 3.6Å; L253-V300 HydrophobicContact CG-CG2 4.45Å
254	R	96.3	Very high	90.1	Very high	34 Å²	34	31.8 Å²	31.8	13%	0.128	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125.1	177.6	173.9	166.7	-71.8	178.4	-0.9	109.4	V246 E247 R252 R256 I272 D274 S337	V246-R254 WeakPolarHBondContact CA-O 3.22Å; E247-R254 HydrophobicContact CG-CB 3.85Å; E247-R254 HydrophobicContact CG-CG 4.11Å; E247-R254 PolarHBondContact N-O 3.27Å; E247-R254 PolarHBondContact O-N 3.43Å; E247-R254 VanDerWaalsContact OE1-CD 3.25Å; E247-R254 WeakPolarHBondContact OE1-CD 3.32Å; R252-R254 PolarHBondContact O-N 2.89Å; R254-R256 HydrophobicContact CG-CG 4.05Å; R254-I272 HydrophobicContact CG-CG2 3.97Å; R254-D274 VanDerWaalsContact CB-OD1 3.23Å; R254-D274 WeakPolarHBondContact CB-OD1 3.38Å; R254-D274 WeakPolarHBondContact CG-OD1 3.45Å; R254-D274 IonicContact CZ-OD1 2.97Å; R254-D274 IonicContact CZ-OD2 3.49Å; R254-D274 IonicContact NE-OD1 3.64Å; R254-D274 PolarHBondContact NE-OD1 3.19Å; R254-D274 IonicContact NE-OD2 2.71Å; R254-D274 IonicContact NH2-OD1 3.54Å; R254-D274 PolarHBondContact NH2-OD1 3.46Å; R254-D274 IonicContact NH2-OD2 3.39Å; R254-D274 PolarHBondContact NH2-OD2 2.63Å; R254-S337 PolarHBondContact NH1-OG 3.5Å
255	V	96.9	Very high	88.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	126	172	-176.6	0	0	0	0	108.6	L244 C245 V246 V273 I289 L296 I298	L244-V255 HydrophobicContact CD1-CG1 4Å; C245-V255 CarbonylContact O-C 3.56Å; C245-V255 WeakPolarHBondContact O-CA 3.35Å; V246-V255 HydrophobicContact CG1-CG2 4.41Å; V246-V255 HydrophobicContact CG2-CG2 4.34Å; V255-V273 PolarHBondContact N-O 2.77Å; V255-V273 PolarHBondContact O-N 3.41Å; V255-I289 HydrophobicContact CG2-CD1 3.68Å; V255-I289 HydrophobicContact CG2-CG1 4.29Å; V255-L296 HydrophobicContact CG1-CD2 4.01Å; V255-I298 HydrophobicContact CB-CD1 3.61Å; V255-I298 HydrophobicContact CB-CG1 4.43Å; V255-I298 HydrophobicContact CG1-CD1 4.37Å; V255-I298 HydrophobicContact CG2-CD1 3.51Å; V255-I298 HydrophobicContact CG2-CG1 3.98Å; V255-I298 HydrophobicContact CG2-CG2 4.43Å
256	R	95.4	Very high	87.2	Confident	35 Å²	35	41.5 Å²	41.5	13%	0.132	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.7	174.4	-59.7	175.1	156.1	-111	11.7	110	Y243 L244 C245 E247 R254 D270 N271 I272 G335 S337	Y243-R256 HydrophobicContact CE2-CB 3.95Å; L244-R256 WeakPolarHBondContact CA-O 3.29Å; C245-R256 HydrophobicContact CB-CB 4.26Å; C245-R256 PolarHBondContact N-O 3.46Å; C245-R256 PolarHBondContact O-N 3.1Å; E247-R256 IonicContact OE1-NE 3.14Å; R254-R256 HydrophobicContact CG-CG 4.05Å; R256-D270 IonicContact NH1-OD2 3.7Å; R256-D270 PolarHBondContact NH1-OD2 3.15Å; R256-N271 VanDerWaalsContact CA-O 3.23Å; R256-N271 WeakPolarHBondContact CA-O 2.88Å; R256-I272 HydrophobicContact CG-CB 4.49Å; R256-I272 HydrophobicContact CG-CG1 4.14Å; R256-I272 HydrophobicContact CG-CG2 4.17Å; R256-I272 VanDerWaalsContact CZ-CD1 3.5Å; R256-G335 WeakPolarHBondContact CD-O 3.04Å; R256-S337 VanDerWaalsContact CZ-OG 3.32Å; R256-S337 PolarHBondContact NE-OG 2.94Å; R256-S337 PolarHBondContact NH2-OG 3.44Å
257	V	94.8	Very high	85.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	136.4	-177.2	63.6	0	0	0	0	111.2	Y243 L244 L259 N271 L296 I309 M316	Y243-V257 WeakPolarHBondContact O-CA 3.35Å; L244-V257 HydrophobicContact CD1-CB 4.35Å; V257-L259 HydrophobicContact CG2-CD2 3.9Å; V257-L259 HydrophobicContact CG2-CG 4.46Å; V257-N271 HydrophobicContact CG1-CB 3.87Å; V257-N271 PolarHBondContact N-O 2.79Å; V257-N271 WeakPolarHBondContact O-CB 3.16Å; V257-N271 PolarHBondContact O-N 3.4Å; V257-N271 VanDerWaalsContact O-N 3.09Å; V257-N271 PolarHBondContact O-ND2 2.97Å; V257-L296 HydrophobicContact CG1-CD2 4.06Å; V257-I309 HydrophobicContact CG1-CD1 3.56Å; V257-I309 HydrophobicContact CG1-CG1 3.86Å; V257-I309 HydrophobicContact CG1-CG2 4.15Å; V257-I309 HydrophobicContact CG2-CD1 4.33Å; V257-M316 HydrophobicContact CG2-SD 4.42Å
258	N	93.1	Very high	84.7	Confident	8 Å²	8	50.2 Å²	50.2	4%	0.043	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	124	169.2	-171.8	-56.7	0	0	0	107.7	D242 Y243 G260 T269	D242-N258 CarbonylContact C-O 3.56Å; D242-N258 WeakPolarHBondContact CA-O 3.46Å; Y243-N258 HydrophobicContact CD1-CB 3.73Å; Y243-N258 HydrophobicContact CE1-CB 3.41Å; Y243-N258 VanDerWaalsContact CE1-CB 3.41Å; Y243-N258 HydrophobicContact CE2-CB 4.2Å; Y243-N258 HydrophobicContact CG-CB 4.29Å; Y243-N258 PolarHBondContact N-O 2.64Å; Y243-N258 PolarHBondContact O-N 3.11Å; N258-G260 VanDerWaalsContact C-N 3.26Å; N258-G260 PolarHBondContact O-N 2.8Å; N258-G260 WeakPolarHBondContact OD1-CA 3.29Å; N258-G260 PolarHBondContact OD1-N 2.98Å; N258-G260 PolarHBondContact OD1-O 3.47Å; N258-T269 PolarHBondContact ND2-O 3.07Å; N258-T269 VanDerWaalsContact ND2-O 3.12Å; N258-T269 PolarHBondContact ND2-OG1 3.29Å
259	L	91.4	Very high	84.1	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.273	C	S	.	.			trans	-91.7	19.8	-179.2	-57.1	-178.8	0	0	0	112.7	V257 I309 A311 F313 M316	V257-L259 HydrophobicContact CG2-CD2 3.9Å; V257-L259 HydrophobicContact CG2-CG 4.46Å; L259-I309 HydrophobicContact CD1-CG2 4.42Å; L259-A311 HydrophobicContact CB-CB 4.1Å; L259-A311 HydrophobicContact CD1-CB 3.92Å; L259-A311 HydrophobicContact CG-CB 4.25Å; L259-F313 HydrophobicContact CB-CB 4.48Å; L259-F313 WeakPolarHBondContact CD1-O 3.49Å; L259-F313 WeakPolarHBondContact O-CB 3.26Å; L259-F313 VanDerWaalsContact O-CD2 3.28Å; L259-F313 WeakPolarHBondContact O-CD2 3.12Å; L259-M316 HydrophobicContact CD2-CB 3.75Å; L259-M316 HydrophobicContact CD2-CG 4.2Å
260	G	84.8	Confident	83.8	Confident	2 Å²	2	52 Å²	52	2%	0.021	28%	0.281	C	S	.	.			trans	103.1	159.6	-178.5	0	0	0	0	0	113.3	D242 N258	D242-G260 VanDerWaalsContact OD2-CA 3.27Å; D242-G260 WeakPolarHBondContact OD2-CA 3.46Å; N258-G260 VanDerWaalsContact C-N 3.26Å; N258-G260 PolarHBondContact O-N 2.8Å; N258-G260 WeakPolarHBondContact OD1-CA 3.29Å; N258-G260 PolarHBondContact OD1-N 2.98Å; N258-G260 PolarHBondContact OD1-O 3.47Å
261	T	76.1	Confident	83.9	Confident	59 Å²	59	50.7 Å²	50.7	36%	0.362	28%	0.277	S	S	.	.			trans	-130.9	150.4	-177.4	64.3	0	0	0	0	111.3	T269	T261-T269 HydrophobicContact CG2-CG2 4.25Å; T261-T269 VanDerWaalsContact CG2-OG1 3.22Å; T261-T269 WeakPolarHBondContact CG2-OG1 3.19Å
262	V	73.5	Confident	83.9	Confident	58 Å²	58	54.5 Å²	54.5	35%	0.352	30%	0.297	S	S	.	.			trans	-104	133.7	170	-175.5	0	0	0	0	107.8	L264 S265 I312 F313	V262-L264 PolarHBondContact O-N 2.86Å; V262-S265 PolarHBondContact O-N 2.02Å; V262-I312 HydrophobicContact CB-CD1 4.28Å; V262-I312 HydrophobicContact CG2-CD1 4.01Å; V262-I312 HydrophobicContact CG2-CG2 4.22Å; V262-F313 HydrophobicContact CG2-CE2 4.04Å; V262-F313 HydrophobicContact CG2-CZ 3.74Å
263	P	66.8	Low	83.8	Confident	136 Å²	136	50.9 Å²	50.9	88%	0.883	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-18.8	-174.6	-27.4	33.6	0	0	0	116.2
264	L	66.3	Low	83.5	Confident	144 Å²	144	53.3 Å²	53.3	75%	0.754	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	1.4	-176.9	-70.7	161.7	0	0	0	113.5	V262	V262-L264 PolarHBondContact O-N 2.86Å
265	S	63.1	Low	83.4	Confident	43 Å²	43	51.7 Å²	51.7	30%	0.301	29%	0.291	S	S	.	.			trans	-88.9	134.1	179.3	-173	0	0	0	0	111.3	V262 E267 I312	V262-S265 PolarHBondContact O-N 2.02Å; S265-E267 WeakPolarHBondContact OG-CB 2.98Å; S265-E267 PolarHBondContact OG-N 3.35Å; S265-E267 VanDerWaalsContact OG-N 3.17Å; S265-I312 VanDerWaalsContact CB-CD1 3.41Å; S265-I312 WeakPolarHBondContact OG-CD1 3.23Å
266	N	67.2	Low	83.1	Confident	166 Å²	166	52.1 Å²	52.1	89%	0.888	30%	0.295	S	S	*	.			trans	-97.8	4.2	170.8	-68.7	-5.9	0	0	0	112.1
267	E	68.4	Low	82.8	Confident	89 Å²	89	51.6 Å²	51.6	42%	0.416	30%	0.297	S	S	.	.	S	Bend	trans	-69.5	136.2	179.7	-69	172.9	-169.9	0	0	110.2	S265 T269 K721	S265-E267 WeakPolarHBondContact OG-CB 2.98Å; S265-E267 PolarHBondContact OG-N 3.35Å; S265-E267 VanDerWaalsContact OG-N 3.17Å; E267-T269 PolarHBondContact O-N 3.31Å; E267-K721 IonicContact OE1-NZ 2.62Å; E267-K721 PolarHBondContact OE1-NZ 2.99Å
268	P	76.2	Confident	82.6	Confident	94 Å²	94	52.6 Å²	52.6	61%	0.61	30%	0.302	S	S	*	.			trans	-63.3	125.8	175	26.4	-32	0	0	0	109.3	S310	P268-S310 CarbonylContact O-C 3.51Å; P268-S310 WeakPolarHBondContact O-CB 3.14Å
269	T	84.3	Confident	82.7	Confident	20 Å²	20	52.3 Å²	52.3	12%	0.123	30%	0.301	C	S	.	.			trans	-122.4	-11.4	-177.5	48.4	0	0	0	0	113.5	N258 T261 E267 N271 S310 I312	N258-T269 PolarHBondContact ND2-O 3.07Å; N258-T269 VanDerWaalsContact ND2-O 3.12Å; N258-T269 PolarHBondContact ND2-OG1 3.29Å; T261-T269 HydrophobicContact CG2-CG2 4.25Å; T261-T269 VanDerWaalsContact CG2-OG1 3.22Å; T261-T269 WeakPolarHBondContact CG2-OG1 3.19Å; E267-T269 PolarHBondContact O-N 3.31Å; T269-N271 PolarHBondContact O-ND2 2.04Å; T269-S310 WeakPolarHBondContact CA-O 3.37Å; T269-I312 HydrophobicContact CG2-CD1 4.19Å; T269-I312 HydrophobicContact CG2-CG1 4.22Å
270	D	88.8	Confident	82.7	Confident	72 Å²	72	52.9 Å²	52.9	39%	0.385	30%	0.304	S	S	.	.			trans	-86.1	121.2	171.9	-174.8	16.1	0	0	0	108.9	Y243 R256	Y243-D270 PolarHBondContact OH-OD1 3.4Å; Y243-D270 PolarHBondContact OH-OD2 3.13Å; R256-D270 IonicContact NH1-OD2 3.7Å; R256-D270 PolarHBondContact NH1-OD2 3.15Å
271	N	93.2	Very high	82.7	Confident	20 Å²	20	55.3 Å²	55.3	11%	0.107	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.7	-177.5	-63	-93.8	0	0	0	108.7	R256 V257 T269 I309 S310	R256-N271 VanDerWaalsContact CA-O 3.23Å; R256-N271 WeakPolarHBondContact CA-O 2.88Å; V257-N271 HydrophobicContact CG1-CB 3.87Å; V257-N271 PolarHBondContact N-O 2.79Å; V257-N271 WeakPolarHBondContact O-CB 3.16Å; V257-N271 PolarHBondContact O-N 3.4Å; V257-N271 VanDerWaalsContact O-N 3.09Å; V257-N271 PolarHBondContact O-ND2 2.97Å; T269-N271 PolarHBondContact O-ND2 2.04Å; N271-I309 HydrophobicContact CB-CG2 4.07Å; N271-I309 WeakPolarHBondContact ND2-CG2 3.35Å; N271-I309 WeakPolarHBondContact OD1-CA 3.32Å; N271-S310 PolarHBondContact ND2-O 3.27Å; N271-S310 PolarHBondContact OD1-N 3.33Å
272	I	93.1	Very high	83.3	Confident	80 Å²	80	53.8 Å²	53.8	41%	0.41	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	125.1	-178	-50.2	175.9	0	0	0	107.7	R254 R256	R254-I272 HydrophobicContact CG-CG2 3.97Å; R256-I272 HydrophobicContact CG-CB 4.49Å; R256-I272 HydrophobicContact CG-CG1 4.14Å; R256-I272 HydrophobicContact CG-CG2 4.17Å; R256-I272 VanDerWaalsContact CZ-CD1 3.5Å
273	V	92.4	Very high	83.9	Confident	7 Å²	7	52.5 Å²	52.5	4%	0.042	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	121.9	177.9	-167.7	0	0	0	0	109.1	V255 L296 I298 V305 R307	V255-V273 PolarHBondContact N-O 2.77Å; V255-V273 PolarHBondContact O-N 3.41Å; V273-L296 HydrophobicContact CB-CD2 4.41Å; V273-L296 HydrophobicContact CG2-CD2 3.86Å; V273-I298 HydrophobicContact CB-CD1 3.61Å; V273-I298 HydrophobicContact CG1-CD1 3.6Å; V273-V305 HydrophobicContact CG1-CG1 3.73Å; V273-R307 HydrophobicContact CB-CG 4.33Å; V273-R307 HydrophobicContact CG1-CG 3.71Å; V273-R307 HydrophobicContact CG2-CB 3.82Å; V273-R307 HydrophobicContact CG2-CG 3.63Å
274	D	92.2	Very high	85	Confident	51 Å²	51	46.9 Å²	46.9	27%	0.273	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	138.3	174.9	-68.8	-24.7	0	0	0	109.8	L253 R254	L253-D274 CarbonylContact O-C 3.57Å; L253-D274 WeakPolarHBondContact O-CA 3.07Å; R254-D274 VanDerWaalsContact CB-OD1 3.23Å; R254-D274 WeakPolarHBondContact CB-OD1 3.38Å; R254-D274 WeakPolarHBondContact CG-OD1 3.45Å; R254-D274 IonicContact CZ-OD1 2.97Å; R254-D274 IonicContact CZ-OD2 3.49Å; R254-D274 IonicContact NE-OD1 3.64Å; R254-D274 PolarHBondContact NE-OD1 3.19Å; R254-D274 IonicContact NE-OD2 2.71Å; R254-D274 IonicContact NH2-OD1 3.54Å; R254-D274 PolarHBondContact NH2-OD1 3.46Å; R254-D274 IonicContact NH2-OD2 3.39Å; R254-D274 PolarHBondContact NH2-OD2 2.63Å
275	A	92.6	Very high	86.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.1	176.9	0	0	0	0	0	111	L253 I298 V300 V305	L253-A275 WeakPolarHBondContact CA-O 3.49Å; L253-A275 WeakPolarHBondContact CB-O 3.28Å; L253-A275 PolarHBondContact N-O 3.4Å; L253-A275 PolarHBondContact O-N 3.33Å; A275-I298 HydrophobicContact CB-CB 4.16Å; A275-I298 HydrophobicContact CB-CG2 3.48Å; A275-I298 VanDerWaalsContact CB-CG2 3.48Å; A275-V300 HydrophobicContact CB-CG2 3.78Å; A275-V305 HydrophobicContact CB-CB 4.4Å; A275-V305 HydrophobicContact CB-CG2 4.1Å
276	G	91	Very high	87.7	Confident	9 Å²	9	39.7 Å²	39.7	9%	0.093	22%	0.216	C	C	.	.			trans	69.4	168	-175.3	0	0	0	0	0	113.6	R252 N614	R252-G276 WeakPolarHBondContact CG-O 3.03Å; G276-N614 WeakPolarHBondContact CA-ND2 3.34Å; G276-N614 PolarHBondContact O-ND2 2.7Å
277	S	90.5	Very high	89	Confident	24 Å²	24	32.1 Å²	32.1	17%	0.168	18%	0.176	C	C	.	.	S	Bend	trans	-154.4	145.8	-179.6	-168.9	0	0	0	0	109.1	G251 L279 D611 N614	G251-S277 CarbonylContact O-C 3.28Å; S277-L279 VanDerWaalsContact C-N 3.29Å; S277-L279 PolarHBondContact O-N 2.68Å; S277-D611 WeakPolarHBondContact CB-OD2 3.46Å; S277-D611 PolarHBondContact OG-OD2 2.89Å; S277-N614 PolarHBondContact N-ND2 2.84Å
278	L	90.6	Very high	90.2	Very high	22 Å²	22	30.2 Å²	30.2	12%	0.115	17%	0.167	C	C	.	.			trans	60	35.5	-179.7	-42.8	167.4	0	0	0	113.5	G251 D280 L463 I609	G251-L278 PolarHBondContact O-N 3.43Å; L278-D280 PolarHBondContact O-N 2.69Å; L278-D280 VanDerWaalsContact O-N 3.08Å; L278-L463 HydrophobicContact CD1-CD1 4.07Å; L278-L463 HydrophobicContact CD2-CD1 4.22Å; L278-L463 HydrophobicContact CG-CD1 4.47Å; L278-I609 HydrophobicContact CD1-CD1 4.16Å; L278-I609 HydrophobicContact CD1-CG1 3.58Å; L278-I609 VanDerWaalsContact CD1-O 3.23Å; L278-I609 WeakPolarHBondContact CD1-O 3.37Å; L278-I609 HydrophobicContact CD2-CD1 4.07Å; L278-I609 HydrophobicContact CD2-CG1 4.38Å
279	L	93.7	Very high	91.2	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	12.3	-175.8	-51.9	172.3	0	0	0	114.1	F224 L248 G251 L253 S277 H285 V300	F224-L279 HydrophobicContact CE2-CB 4.16Å; F224-L279 HydrophobicContact CZ-CB 3.8Å; F224-L279 HydrophobicContact CZ-CD1 3.9Å; F224-L279 HydrophobicContact CZ-CG 4.32Å; L248-L279 HydrophobicContact CD1-CB 3.89Å; L248-L279 HydrophobicContact CD1-CD1 4.09Å; G251-L279 WeakPolarHBondContact O-CG 3.41Å; G251-L279 PolarHBondContact O-N 3.39Å; L253-L279 HydrophobicContact CB-CD1 3.91Å; S277-L279 VanDerWaalsContact C-N 3.29Å; S277-L279 PolarHBondContact O-N 2.68Å; L279-H285 WeakPolarHBondContact CA-NE2 3.41Å; L279-V300 HydrophobicContact CD1-CG1 4.08Å; L279-V300 HydrophobicContact CD2-CG1 3.73Å
280	D	91.5	Very high	91.7	Very high	13 Å²	13	26.9 Å²	26.9	7%	0.07	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	20.8	175.9	62.5	-64.9	0	0	0	112	T226 I229 L278 D282 R461	T226-D280 CarbonylContact O-C 3.56Å; T226-D280 VanDerWaalsContact O-C 3.28Å; T226-D280 WeakPolarHBondContact O-CA 3.26Å; I229-D280 HydrophobicContact CG2-CB 3.91Å; L278-D280 PolarHBondContact O-N 2.69Å; L278-D280 VanDerWaalsContact O-N 3.08Å; D280-D282 VanDerWaalsContact C-N 3.32Å; D280-D282 PolarHBondContact O-N 3.25Å; D280-R461 IonicContact OD1-CZ 3.14Å; D280-R461 IonicContact OD1-NH1 3.73Å; D280-R461 PolarHBondContact OD1-NH1 2.77Å; D280-R461 IonicContact OD1-NH2 3.27Å; D280-R461 PolarHBondContact OD1-NH2 3.09Å; D280-R461 IonicContact OD2-CZ 3.39Å; D280-R461 IonicContact OD2-NH1 2.81Å; D280-R461 PolarHBondContact OD2-NH1 3.36Å; D280-R461 IonicContact OD2-NH2 2.84Å; D280-R461 PolarHBondContact OD2-NH2 2.86Å
281	D	86.2	Confident	91.9	Very high	53 Å²	53	23.8 Å²	23.8	28%	0.283	13%	0.125	S	C	.	.	S	Bend	trans	-86.7	6.5	-171.9	70.9	-2	0	0	0	114.6	Q283 H285	D281-Q283 PolarHBondContact O-N 3.34Å; D281-Q283 WeakPolarHBondContact OD1-CA 3.25Å; D281-Q283 WeakPolarHBondContact OD1-CB 3.24Å; D281-Q283 WeakPolarHBondContact OD1-CG 3.46Å; D281-Q283 PolarHBondContact OD1-N 2.67Å; D281-Q283 VanDerWaalsContact OD2-CD 3.27Å; D281-Q283 PolarHBondContact OD2-NE2 2.73Å; D281-H285 IonicContact OD1-CE1 3.31Å; D281-H285 IonicContact OD1-NE2 3.03Å; D281-H285 PolarHBondContact OD1-NE2 3.49Å; D281-H285 IonicContact OD2-CE1 3.64Å
282	D	87.1	Confident	91.8	Very high	26 Å²	26	28 Å²	28	14%	0.139	15%	0.145	C	C	.	.	S	Bend	trans	59.7	25	-173.9	-156.9	29.3	0	0	0	114.2	R225 T226 K227 D280	R225-D282 WeakPolarHBondContact CD-O 3.15Å; R225-D282 IonicContact CZ-OD1 3.42Å; R225-D282 VanDerWaalsContact CZ-OD1 3.32Å; R225-D282 IonicContact CZ-OD2 3Å; R225-D282 PolarHBondContact NE-O 2.67Å; R225-D282 IonicContact NE-OD1 3.02Å; R225-D282 PolarHBondContact NE-OD1 3.46Å; R225-D282 IonicContact NE-OD2 2.87Å; R225-D282 IonicContact NH2-OD1 3.24Å; R225-D282 PolarHBondContact NH2-OD1 2.72Å; R225-D282 IonicContact NH2-OD2 2.68Å; R225-D282 PolarHBondContact NH2-OD2 2.81Å; T226-D282 WeakPolarHBondContact O-CA 3.31Å; T226-D282 PolarHBondContact O-N 3.4Å; K227-D282 HydrophobicContact CD-CB 4.38Å; K227-D282 WeakPolarHBondContact CE-OD2 3.11Å; K227-D282 HydrophobicContact CG-CB 3.75Å; K227-D282 IonicContact NZ-OD2 2.78Å; D280-D282 VanDerWaalsContact C-N 3.32Å; D280-D282 PolarHBondContact O-N 3.25Å
283	Q	86	Confident	91.7	Very high	31 Å²	31	29.3 Å²	29.3	15%	0.145	15%	0.149	C	C	.	.	S	Bend	trans	-103.5	163.5	171.2	-56.7	-179.9	34	0	0	111.5	H130 R225 D281	H130-Q283 HydrophobicContact CB-CG 4.46Å; H130-Q283 VanDerWaalsContact CB-NE2 3.34Å; R225-Q283 WeakPolarHBondContact CA-O 3.33Å; R225-Q283 WeakPolarHBondContact CB-O 3.3Å; R225-Q283 WeakPolarHBondContact CG-O 3.11Å; D281-Q283 PolarHBondContact O-N 3.34Å; D281-Q283 WeakPolarHBondContact OD1-CA 3.25Å; D281-Q283 WeakPolarHBondContact OD1-CB 3.24Å; D281-Q283 WeakPolarHBondContact OD1-CG 3.46Å; D281-Q283 PolarHBondContact OD1-N 2.67Å; D281-Q283 VanDerWaalsContact OD2-CD 3.27Å; D281-Q283 PolarHBondContact OD2-NE2 2.73Å
284	W	90.4	Very high	91.5	Very high	18 Å²	18	32.1 Å²	32.1	7%	0.068	16%	0.161	C	C	.	.			trans	-81.2	123.5	174	-76	105.1	0	0	0	110.5	D124 R223 F224 R225 C345 E347 C421	D124-W284 VanDerWaalsContact CG-CD1 3.47Å; D124-W284 VanDerWaalsContact OD2-CB 3.26Å; D124-W284 WeakPolarHBondContact OD2-CB 3.2Å; D124-W284 VanDerWaalsContact OD2-CG 3.28Å; R223-W284 HydrophobicContact CB-CE3 3.89Å; R223-W284 HydrophobicContact CB-CZ3 4.27Å; R223-W284 VanDerWaalsContact NH2-CB 3.29Å; F224-W284 WeakPolarHBondContact O-CA 3.21Å; R225-W284 HydrophobicContact CB-CD2 3.84Å; R225-W284 HydrophobicContact CB-CE3 3.8Å; R225-W284 HydrophobicContact CB-CG 4.33Å; R225-W284 HydrophobicContact CB-CH2 4.43Å; R225-W284 HydrophobicContact CB-CZ2 4.48Å; R225-W284 HydrophobicContact CB-CZ3 4.1Å; W284-C345 HydrophobicContact CH2-CB 3.41Å; W284-C345 VanDerWaalsContact CH2-CB 3.41Å; W284-C345 HydrophobicContact CZ2-CB 3.96Å; W284-C345 HydrophobicContact CZ3-CB 4.13Å; W284-E347 HydrophobicContact CE3-CB 4.39Å; W284-E347 HydrophobicContact CE3-CG 4.49Å; W284-E347 HydrophobicContact CH2-CB 3.9Å; W284-E347 HydrophobicContact CH2-CG 3.34Å; W284-E347 VanDerWaalsContact CZ2-CD 3.42Å; W284-E347 HydrophobicContact CZ2-CG 3.96Å; W284-E347 VanDerWaalsContact CZ2-OE1 3.28Å; W284-E347 WeakPolarHBondContact CZ2-OE1 3.26Å; W284-E347 HydrophobicContact CZ3-CB 3.66Å; W284-E347 HydrophobicContact CZ3-CG 3.67Å; W284-C421 HydrophobicContact CZ2-CB 4.12Å
285	H	92.9	Very high	91.4	Very high	7 Å²	7	33 Å²	33	3%	0.032	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136.3	174.2	-59.4	-68.8	0	0	0	111.3	R223 F224 L279 D281 D301	R223-H285 CarbonylContact C-O 3.24Å; R223-H285 WeakPolarHBondContact CA-O 3.49Å; R223-H285 WeakPolarHBondContact CB-O 3.09Å; F224-H285 HydrophobicContact CD1-CB 4.08Å; F224-H285 HydrophobicContact CE1-CB 3.71Å; F224-H285 HydrophobicContact CZ-CB 4.06Å; F224-H285 AromaticContact CZ-CD2 3.94Å; F224-H285 PolarHBondContact N-O 3.42Å; F224-H285 PolarHBondContact O-N 3.4Å; L279-H285 WeakPolarHBondContact CA-NE2 3.41Å; D281-H285 IonicContact OD1-CE1 3.31Å; D281-H285 IonicContact OD1-NE2 3.03Å; D281-H285 PolarHBondContact OD1-NE2 3.49Å; D281-H285 IonicContact OD2-CE1 3.64Å; H285-D301 WeakPolarHBondContact CA-OD1 3.3Å; H285-D301 IonicContact CE1-OD2 3.49Å; H285-D301 IonicContact CG-OD2 3.28Å; H285-D301 IonicContact ND1-OD1 2.87Å; H285-D301 IonicContact ND1-OD2 2.84Å; H285-D301 PolarHBondContact ND1-OD2 3.04Å
286	D	92.5	Very high	91.5	Very high	30 Å²	30	33.1 Å²	33.1	16%	0.16	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.5	176.4	-58.5	-53.1	0	0	0	109.8	R223 V300 D301 R302	R223-D286 WeakPolarHBondContact CD-OD1 3.44Å; R223-D286 WeakPolarHBondContact CG-OD1 3.16Å; R223-D286 IonicContact CZ-OD1 3.17Å; R223-D286 IonicContact NE-OD1 2.86Å; R223-D286 PolarHBondContact NE-OD1 3.34Å; R223-D286 IonicContact NH2-OD1 2.65Å; D286-V300 CarbonylContact O-C 3.58Å; D286-V300 VanDerWaalsContact O-CA 3.32Å; D286-V300 WeakPolarHBondContact O-CA 3.42Å; D286-D301 PolarHBondContact N-OD1 3.39Å; D286-D301 PolarHBondContact O-N 2.79Å; D286-R302 IonicContact OD2-CZ 3.56Å; D286-R302 IonicContact OD2-NH1 3.88Å; D286-R302 PolarHBondContact OD2-NH1 3Å
287	V	95.9	Very high	91.6	Very high	6 Å²	6	35.8 Å²	35.8	4%	0.036	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.3	178.4	-179.5	0	0	0	0	110.6	S221 F222 F224 L253 I289 S299 V300	S221-V287 VanDerWaalsContact CA-O 3.25Å; S221-V287 WeakPolarHBondContact CA-O 3.39Å; F222-V287 HydrophobicContact CD1-CB 4.14Å; F222-V287 HydrophobicContact CD1-CG1 4.17Å; F222-V287 HydrophobicContact CD2-CB 4.18Å; F222-V287 HydrophobicContact CD2-CG2 4.35Å; F222-V287 HydrophobicContact CE1-CB 3.86Å; F222-V287 HydrophobicContact CE1-CG1 3.52Å; F222-V287 HydrophobicContact CE2-CB 3.9Å; F222-V287 HydrophobicContact CE2-CG1 4.27Å; F222-V287 HydrophobicContact CE2-CG2 3.81Å; F222-V287 HydrophobicContact CG-CB 4.29Å; F222-V287 HydrophobicContact CZ-CB 3.73Å; F222-V287 HydrophobicContact CZ-CG1 3.58Å; F222-V287 HydrophobicContact CZ-CG2 3.91Å; F222-V287 PolarHBondContact N-O 2.68Å; F222-V287 WeakPolarHBondContact O-CA 3.43Å; F222-V287 WeakPolarHBondContact O-CB 3.4Å; F222-V287 PolarHBondContact O-N 2.69Å; F224-V287 HydrophobicContact CD1-CG2 3.64Å; F224-V287 HydrophobicContact CE1-CG2 3.51Å; L253-V287 HydrophobicContact CD2-CB 4.43Å; L253-V287 HydrophobicContact CD2-CG1 3.49Å; L253-V287 VanDerWaalsContact CD2-CG1 3.49Å; L253-V287 HydrophobicContact CD2-CG2 4Å; V287-I289 HydrophobicContact CG1-CD1 4.16Å; V287-I289 HydrophobicContact CG1-CG1 4.03Å; V287-S299 WeakPolarHBondContact CA-O 3.43Å; V287-V300 HydrophobicContact CG2-CG2 4.49Å
288	Q	94	Very high	91.7	Very high	49 Å²	49	34.7 Å²	34.7	23%	0.229	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	127	167.2	-171.6	179.3	30.8	0	0	109.4	E219 I220 I290 I298 S299	E219-Q288 PolarHBondContact OE1-NE2 2.69Å; I220-Q288 CarbonylContact O-C 3.54Å; I220-Q288 WeakPolarHBondContact O-CA 3.2Å; Q288-I290 HydrophobicContact CG-CD1 4.24Å; Q288-I290 HydrophobicContact CG-CG1 4.14Å; Q288-I298 CarbonylContact O-C 3.53Å; Q288-S299 PolarHBondContact N-O 2.94Å; Q288-S299 PolarHBondContact O-N 3.29Å
289	I	95.9	Very high	91.8	Very high	3 Å²	3	34 Å²	34	2%	0.015	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	121.4	177	-56.9	163.5	0	0	0	106.9	E219 I220 V246 V255 V287 L296 N297 I298	E219-I289 WeakPolarHBondContact CA-O 3.29Å; I220-I289 HydrophobicContact CB-CB 4.17Å; I220-I289 PolarHBondContact N-O 3.27Å; I220-I289 PolarHBondContact O-N 2.59Å; V246-I289 HydrophobicContact CB-CD1 4.48Å; V246-I289 HydrophobicContact CG1-CD1 3.97Å; V246-I289 HydrophobicContact CG2-CD1 3.63Å; V255-I289 HydrophobicContact CG2-CD1 3.68Å; V255-I289 HydrophobicContact CG2-CG1 4.29Å; V287-I289 HydrophobicContact CG1-CD1 4.16Å; V287-I289 HydrophobicContact CG1-CG1 4.03Å; I289-L296 HydrophobicContact CG2-CD1 3.74Å; I289-N297 CarbonylContact C-O 3.53Å; I289-N297 WeakPolarHBondContact CA-O 3.01Å; I289-I298 HydrophobicContact CG1-CG1 4.35Å; I289-I298 HydrophobicContact CG1-CG2 4.17Å; I289-I298 HydrophobicContact CG2-CG1 4.24Å
290	I	94.8	Very high	91.8	Very high	41 Å²	41	34 Å²	34	21%	0.21	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.9	177.2	-59.3	170.5	0	0	0	107.3	D218 E219 Q288 E292 N297	D218-I290 CarbonylContact O-C 3.55Å; D218-I290 WeakPolarHBondContact O-CA 3.4Å; E219-I290 HydrophobicContact CG-CG1 4.3Å; Q288-I290 HydrophobicContact CG-CD1 4.24Å; Q288-I290 HydrophobicContact CG-CG1 4.14Å; I290-E292 HydrophobicContact CG2-CG 4.16Å; I290-N297 HydrophobicContact CB-CB 4.44Å; I290-N297 PolarHBondContact N-O 3.27Å; I290-N297 PolarHBondContact O-N 2.99Å
291	R	93.2	Very high	91.7	Very high	7 Å²	7	34.6 Å²	34.6	3%	0.026	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	125.2	168.7	-172.9	-170.6	67.7	87.1	-1	108.5	T215 V217 D218 E293 N295 L296 I309 V314 M316	T215-R291 PolarHBondContact O-NH2 3.43Å; T215-R291 PolarHBondContact OG1-NH2 3.31Å; V217-R291 CarbonylContact C-O 3.47Å; V217-R291 WeakPolarHBondContact CA-O 3.17Å; V217-R291 WeakPolarHBondContact CG1-O 3.48Å; D218-R291 HydrophobicContact CB-CB 4.42Å; D218-R291 PolarHBondContact N-O 3.41Å; D218-R291 PolarHBondContact O-N 2.98Å; D218-R291 IonicContact OD2-CZ 3.5Å; D218-R291 IonicContact OD2-NE 3.08Å; D218-R291 PolarHBondContact OD2-NE 3.13Å; D218-R291 IonicContact OD2-NH2 3.31Å; D218-R291 PolarHBondContact OD2-NH2 3.28Å; R291-E293 PolarHBondContact NH1-O 3.17Å; R291-N295 CarbonylContact C-O 3.6Å; R291-N295 VanDerWaalsContact CA-O 3.25Å; R291-N295 WeakPolarHBondContact CA-O 3.31Å; R291-L296 HydrophobicContact CB-CD1 4.16Å; R291-I309 HydrophobicContact CG-CD1 4.14Å; R291-V314 PolarHBondContact NH1-O 3.38Å; R291-M316 VanDerWaalsContact NH2-CB 3.32Å
292	E	90.9	Very high	91.6	Very high	109 Å²	109	32.7 Å²	32.7	51%	0.509	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	105.6	168.6	-67.2	-177	179.4	0	0	108.5	V217 I290 K294 N295	V217-E292 HydrophobicContact CG1-CG 4.29Å; V217-E292 HydrophobicContact CG2-CB 4.45Å; V217-E292 HydrophobicContact CG2-CG 4Å; I290-E292 HydrophobicContact CG2-CG 4.16Å; E292-K294 PolarHBondContact O-N 3.27Å; E292-N295 PolarHBondContact N-O 2.78Å; E292-N295 WeakPolarHBondContact O-CB 2.95Å; E292-N295 PolarHBondContact O-N 2.97Å
293	E	91.6	Very high	91.4	Very high	108 Å²	108	32.3 Å²	32.3	51%	0.505	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	-107.3	-172.9	-57.4	-177	177.5	0	0	111.4	Y216 R291 V314	Y216-E293 PolarHBondContact O-N 3.48Å; R291-E293 PolarHBondContact NH1-O 3.17Å; E293-V314 HydrophobicContact CB-CB 4.16Å; E293-V314 HydrophobicContact CB-CG1 4.4Å; E293-V314 HydrophobicContact CG-CB 4.43Å
294	K	88.1	Confident	91.4	Very high	66 Å²	66	34.6 Å²	34.6	29%	0.287	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-6	176.4	-59.7	-172.9	-172.1	-177.4	0	113.5	E292 N308 I309 A311 V314	E292-K294 PolarHBondContact O-N 3.27Å; K294-N308 VanDerWaalsContact CB-OD1 3.26Å; K294-N308 WeakPolarHBondContact CB-OD1 3.35Å; K294-N308 CarbonylContact O-C 3.57Å; K294-N308 PolarHBondContact O-OD1 2.7Å; K294-I309 HydrophobicContact CB-CB 4.34Å; K294-I309 VanDerWaalsContact O-CB 3.26Å; K294-I309 WeakPolarHBondContact O-CB 3.12Å; K294-I309 WeakPolarHBondContact O-CG1 3.49Å; K294-I309 PolarHBondContact O-N 3.19Å; K294-A311 HydrophobicContact CD-CB 4.46Å; K294-A311 VanDerWaalsContact CE-O 3.29Å; K294-A311 WeakPolarHBondContact CE-O 3.39Å; K294-A311 PolarHBondContact NZ-O 2.7Å; K294-V314 HydrophobicContact CG-CG1 4.31Å
295	N	90.4	Very high	91.2	Very high	70 Å²	70	35 Å²	35	37%	0.374	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	119.8	178.1	-64.8	-47.4	0	0	0	110.2	R291 E292	R291-N295 CarbonylContact C-O 3.6Å; R291-N295 VanDerWaalsContact CA-O 3.25Å; R291-N295 WeakPolarHBondContact CA-O 3.31Å; E292-N295 PolarHBondContact N-O 2.78Å; E292-N295 WeakPolarHBondContact O-CB 2.95Å; E292-N295 PolarHBondContact O-N 2.97Å
296	L	94	Very high	90.8	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.5	175.3	-177	62.2	0	0	0	110.2	V255 V257 V273 I289 R291 I298 W306 R307 I309	V255-L296 HydrophobicContact CG1-CD2 4.01Å; V257-L296 HydrophobicContact CG1-CD2 4.06Å; V273-L296 HydrophobicContact CB-CD2 4.41Å; V273-L296 HydrophobicContact CG2-CD2 3.86Å; I289-L296 HydrophobicContact CG2-CD1 3.74Å; R291-L296 HydrophobicContact CB-CD1 4.16Å; L296-I298 HydrophobicContact CD1-CG1 4.42Å; L296-I298 HydrophobicContact CD2-CD1 4.06Å; L296-I298 HydrophobicContact CD2-CG1 4.47Å; L296-I298 HydrophobicContact CG-CD1 4.2Å; L296-I298 HydrophobicContact CG-CG1 4.1Å; L296-W306 CarbonylContact O-C 3.59Å; L296-W306 VanDerWaalsContact O-CA 3.26Å; L296-W306 WeakPolarHBondContact O-CA 3.29Å; L296-R307 PolarHBondContact N-O 2.71Å; L296-R307 PolarHBondContact O-N 3.18Å; L296-I309 HydrophobicContact CB-CD1 3.91Å; L296-I309 HydrophobicContact CB-CG1 3.95Å
297	N	92.7	Very high	90.5	Very high	65 Å²	65	45.3 Å²	45.3	35%	0.348	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	121.8	175.4	-72.5	-26.7	0	0	0	109.5	I289 I290 W306	I289-N297 CarbonylContact C-O 3.53Å; I289-N297 WeakPolarHBondContact CA-O 3.01Å; I290-N297 HydrophobicContact CB-CB 4.44Å; I290-N297 PolarHBondContact N-O 3.27Å; I290-N297 PolarHBondContact O-N 2.99Å; N297-W306 WeakPolarHBondContact OD1-CB 3.31Å
298	I	94.5	Very high	89.9	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.1	178.3	-56.9	161.6	0	0	0	107.7	L253 V255 V273 A275 Q288 I289 L296 V300 K304 V305	L253-I298 HydrophobicContact CD2-CG2 4.09Å; V255-I298 HydrophobicContact CB-CD1 3.61Å; V255-I298 HydrophobicContact CB-CG1 4.43Å; V255-I298 HydrophobicContact CG1-CD1 4.37Å; V255-I298 HydrophobicContact CG2-CD1 3.51Å; V255-I298 HydrophobicContact CG2-CG1 3.98Å; V255-I298 HydrophobicContact CG2-CG2 4.43Å; V273-I298 HydrophobicContact CB-CD1 3.61Å; V273-I298 HydrophobicContact CG1-CD1 3.6Å; A275-I298 HydrophobicContact CB-CB 4.16Å; A275-I298 HydrophobicContact CB-CG2 3.48Å; A275-I298 VanDerWaalsContact CB-CG2 3.48Å; Q288-I298 CarbonylContact O-C 3.53Å; I289-I298 HydrophobicContact CG1-CG1 4.35Å; I289-I298 HydrophobicContact CG1-CG2 4.17Å; I289-I298 HydrophobicContact CG2-CG1 4.24Å; L296-I298 HydrophobicContact CD1-CG1 4.42Å; L296-I298 HydrophobicContact CD2-CD1 4.06Å; L296-I298 HydrophobicContact CD2-CG1 4.47Å; L296-I298 HydrophobicContact CG-CD1 4.2Å; L296-I298 HydrophobicContact CG-CG1 4.1Å; I298-V300 HydrophobicContact CG2-CG2 4.31Å; I298-K304 CarbonylContact O-C 3.52Å; I298-K304 WeakPolarHBondContact O-CA 3.43Å; I298-V305 PolarHBondContact N-O 3.3Å; I298-V305 PolarHBondContact O-N 2.87Å
299	S	92	Very high	89.6	Confident	9 Å²	9	46.7 Å²	46.7	6%	0.063	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.5	175.8	-175.9	0	0	0	0	109	V287 Q288 R302 I303	V287-S299 WeakPolarHBondContact CA-O 3.43Å; Q288-S299 PolarHBondContact N-O 2.94Å; Q288-S299 PolarHBondContact O-N 3.29Å; S299-R302 VanDerWaalsContact OG-CA 3.25Å; S299-R302 WeakPolarHBondContact OG-CA 3.48Å; S299-I303 VanDerWaalsContact CA-O 3.29Å; S299-I303 WeakPolarHBondContact CA-O 3.26Å
300	V	93.3	Very high	89.1	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	121.8	170.2	-176.8	0	0	0	0	108	L253 A275 L279 D286 V287 I298 R302 I303	L253-V300 HydrophobicContact CB-CG2 4Å; L253-V300 HydrophobicContact CD2-CG2 3.6Å; L253-V300 HydrophobicContact CG-CG2 4.45Å; A275-V300 HydrophobicContact CB-CG2 3.78Å; L279-V300 HydrophobicContact CD1-CG1 4.08Å; L279-V300 HydrophobicContact CD2-CG1 3.73Å; D286-V300 CarbonylContact O-C 3.58Å; D286-V300 VanDerWaalsContact O-CA 3.32Å; D286-V300 WeakPolarHBondContact O-CA 3.42Å; V287-V300 HydrophobicContact CG2-CG2 4.49Å; I298-V300 HydrophobicContact CG2-CG2 4.31Å; V300-R302 PolarHBondContact O-N 3.42Å; V300-I303 PolarHBondContact N-O 3.26Å; V300-I303 WeakPolarHBondContact O-CB 3.49Å; V300-I303 WeakPolarHBondContact O-CG1 3.34Å; V300-I303 PolarHBondContact O-N 2.75Å
301	D	89	Confident	88.5	Confident	24 Å²	24	48 Å²	48	13%	0.128	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	37.3	-173.6	-64.8	-29.2	0	0	0	113.6	H285 D286 I303	H285-D301 WeakPolarHBondContact CA-OD1 3.3Å; H285-D301 IonicContact CE1-OD2 3.49Å; H285-D301 IonicContact CG-OD2 3.28Å; H285-D301 IonicContact ND1-OD1 2.87Å; H285-D301 IonicContact ND1-OD2 2.84Å; H285-D301 PolarHBondContact ND1-OD2 3.04Å; D286-D301 PolarHBondContact N-OD1 3.39Å; D286-D301 PolarHBondContact O-N 2.79Å; D301-I303 PolarHBondContact O-N 3.36Å
302	R	84.4	Confident	87.9	Confident	14 Å²	14	50.3 Å²	50.3	5%	0.053	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	-1.1	-174.8	-55.8	152.2	-70	-75.5	-19	114.8	Y122 D137 Y160 D286 S299 V300 K304	Y122-R302 VanDerWaalsContact OH-CZ 3.27Å; Y122-R302 PolarHBondContact OH-NH1 3.02Å; Y122-R302 PolarHBondContact OH-NH2 3.32Å; D137-R302 WeakPolarHBondContact CA-O 3.13Å; Y160-R302 HydrophobicContact CD2-CB 4.04Å; Y160-R302 HydrophobicContact CD2-CG 3.77Å; Y160-R302 HydrophobicContact CG-CG 3.82Å; D286-R302 IonicContact OD2-CZ 3.56Å; D286-R302 IonicContact OD2-NH1 3.88Å; D286-R302 PolarHBondContact OD2-NH1 3Å; S299-R302 VanDerWaalsContact OG-CA 3.25Å; S299-R302 WeakPolarHBondContact OG-CA 3.48Å; V300-R302 PolarHBondContact O-N 3.42Å; R302-K304 PolarHBondContact O-N 3.47Å
303	I	83.8	Confident	87.6	Confident	18 Å²	18	49.3 Å²	49.3	9%	0.092	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.9	179.1	-47.1	176.9	0	0	0	109.3	K135 S299 V300 D301 P615	K135-I303 HydrophobicContact CD-CD1 3.98Å; K135-I303 HydrophobicContact CD-CG1 4.46Å; S299-I303 VanDerWaalsContact CA-O 3.29Å; S299-I303 WeakPolarHBondContact CA-O 3.26Å; V300-I303 PolarHBondContact N-O 3.26Å; V300-I303 WeakPolarHBondContact O-CB 3.49Å; V300-I303 WeakPolarHBondContact O-CG1 3.34Å; V300-I303 PolarHBondContact O-N 2.75Å; D301-I303 PolarHBondContact O-N 3.36Å; I303-P615 VanDerWaalsContact CG2-CD 3.4Å; I303-P615 HydrophobicContact CG2-CG 3.65Å
304	K	84.5	Confident	87.3	Confident	79 Å²	79	46.4 Å²	46.4	34%	0.343	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	135.8	-173.6	-67.5	175.7	-174.4	159.8	0	112	D137 Y160 I298 R302	D137-K304 HydrophobicContact CB-CD 4.3Å; D137-K304 PolarHBondContact O-N 3.39Å; D137-K304 IonicContact OD1-NZ 2.72Å; D137-K304 WeakPolarHBondContact OD2-CE 3.42Å; D137-K304 IonicContact OD2-NZ 2.79Å; D137-K304 PolarHBondContact OD2-NZ 3.25Å; Y160-K304 WeakPolarHBondContact OH-CE 3.22Å; Y160-K304 PolarHBondContact OH-NZ 3.14Å; I298-K304 CarbonylContact O-C 3.52Å; I298-K304 WeakPolarHBondContact O-CA 3.43Å; R302-K304 PolarHBondContact O-N 3.47Å
305	V	87.5	Confident	87.3	Confident	25 Å²	25	46.6 Å²	46.6	15%	0.152	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.4	166.6	-179.6	0	0	0	0	106.6	V273 A275 I298 P615	V273-V305 HydrophobicContact CG1-CG1 3.73Å; A275-V305 HydrophobicContact CB-CB 4.4Å; A275-V305 HydrophobicContact CB-CG2 4.1Å; I298-V305 PolarHBondContact N-O 3.3Å; I298-V305 PolarHBondContact O-N 2.87Å; V305-P615 HydrophobicContact CG2-CB 4.24Å
306	W	84.8	Confident	87.2	Confident	143 Å²	143	43.3 Å²	43.3	54%	0.542	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	146.7	176.7	80	-89.6	0	0	0	110.6	L296 N297 N308 V679	L296-W306 CarbonylContact O-C 3.59Å; L296-W306 VanDerWaalsContact O-CA 3.26Å; L296-W306 WeakPolarHBondContact O-CA 3.29Å; N297-W306 WeakPolarHBondContact OD1-CB 3.31Å; W306-N308 HydrophobicContact CZ3-CB 4.25Å; W306-V679 HydrophobicContact CZ2-CG1 4.32Å
307	R	84.5	Confident	86.9	Confident	112 Å²	112	44.5 Å²	44.5	42%	0.423	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	138.4	173.6	-70.7	-60.5	-171.3	178	12.3	110.8	V273 L296 E621	V273-R307 HydrophobicContact CB-CG 4.33Å; V273-R307 HydrophobicContact CG1-CG 3.71Å; V273-R307 HydrophobicContact CG2-CB 3.82Å; V273-R307 HydrophobicContact CG2-CG 3.63Å; L296-R307 PolarHBondContact N-O 2.71Å; L296-R307 PolarHBondContact O-N 3.18Å; R307-E621 IonicContact CZ-OE1 3.53Å; R307-E621 IonicContact NH1-OE1 3.65Å; R307-E621 PolarHBondContact NH1-OE1 3.1Å; R307-E621 IonicContact NH2-OE1 3.67Å; R307-E621 PolarHBondContact NH2-OE1 3.22Å
308	N	83.9	Confident	86.6	Confident	81 Å²	81	41.5 Å²	41.5	43%	0.433	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	120.9	164.2	-165	6.9	0	0	0	108.8	K294 W306	K294-N308 VanDerWaalsContact CB-OD1 3.26Å; K294-N308 WeakPolarHBondContact CB-OD1 3.35Å; K294-N308 CarbonylContact O-C 3.57Å; K294-N308 PolarHBondContact O-OD1 2.7Å; W306-N308 HydrophobicContact CZ3-CB 4.25Å
309	I	87.4	Confident	85.9	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.015	22%	0.22	C	C	.	.			trans	-75.3	124.4	-176.8	-62.5	167.6	0	0	0	108.4	V257 L259 N271 R291 K294 L296 A311	V257-I309 HydrophobicContact CG1-CD1 3.56Å; V257-I309 HydrophobicContact CG1-CG1 3.86Å; V257-I309 HydrophobicContact CG1-CG2 4.15Å; V257-I309 HydrophobicContact CG2-CD1 4.33Å; L259-I309 HydrophobicContact CD1-CG2 4.42Å; N271-I309 HydrophobicContact CB-CG2 4.07Å; N271-I309 WeakPolarHBondContact ND2-CG2 3.35Å; N271-I309 WeakPolarHBondContact OD1-CA 3.32Å; R291-I309 HydrophobicContact CG-CD1 4.14Å; K294-I309 HydrophobicContact CB-CB 4.34Å; K294-I309 VanDerWaalsContact O-CB 3.26Å; K294-I309 WeakPolarHBondContact O-CB 3.12Å; K294-I309 WeakPolarHBondContact O-CG1 3.49Å; K294-I309 PolarHBondContact O-N 3.19Å; L296-I309 HydrophobicContact CB-CD1 3.91Å; L296-I309 HydrophobicContact CB-CG1 3.95Å; I309-A311 HydrophobicContact CG2-CB 3.96Å; I309-A311 PolarHBondContact O-N 3.21Å; I309-A311 VanDerWaalsContact O-N 3.13Å
310	S	85.9	Confident	85.5	Confident	59 Å²	59	50.6 Å²	50.6	41%	0.413	24%	0.239	S	C	.	.			trans	-68.4	107.5	166.1	-63.7	0	0	0	0	109.2	P268 T269 N271	P268-S310 CarbonylContact O-C 3.51Å; P268-S310 WeakPolarHBondContact O-CB 3.14Å; T269-S310 WeakPolarHBondContact CA-O 3.37Å; N271-S310 PolarHBondContact ND2-O 3.27Å; N271-S310 PolarHBondContact OD1-N 3.33Å
311	A	83.2	Confident	85.3	Confident	11 Å²	11	53.6 Å²	53.6	9%	0.091	26%	0.255	C	S	.	.			trans	-153.3	150.2	-176.3	0	0	0	0	0	112.4	L259 K294 I309 F313	L259-A311 HydrophobicContact CB-CB 4.1Å; L259-A311 HydrophobicContact CD1-CB 3.92Å; L259-A311 HydrophobicContact CG-CB 4.25Å; K294-A311 HydrophobicContact CD-CB 4.46Å; K294-A311 VanDerWaalsContact CE-O 3.29Å; K294-A311 WeakPolarHBondContact CE-O 3.39Å; K294-A311 PolarHBondContact NZ-O 2.7Å; I309-A311 HydrophobicContact CG2-CB 3.96Å; I309-A311 PolarHBondContact O-N 3.21Å; I309-A311 VanDerWaalsContact O-N 3.13Å; A311-F313 WeakPolarHBondContact CB-O 3.39Å
312	I	79.4	Confident	85.4	Confident	56 Å²	56	52.4 Å²	52.4	29%	0.287	25%	0.249	S	C	.	.	S	Bend	trans	-83	-33.9	173.8	-56.7	166.8	0	0	0	110.5	V262 S265 T269	V262-I312 HydrophobicContact CB-CD1 4.28Å; V262-I312 HydrophobicContact CG2-CD1 4.01Å; V262-I312 HydrophobicContact CG2-CG2 4.22Å; S265-I312 VanDerWaalsContact CB-CD1 3.41Å; S265-I312 WeakPolarHBondContact OG-CD1 3.23Å; T269-I312 HydrophobicContact CG2-CD1 4.19Å; T269-I312 HydrophobicContact CG2-CG1 4.22Å
313	F	83.8	Confident	85.9	Confident	89 Å²	89	52 Å²	52	39%	0.39	25%	0.248	S	C	.	.			trans	-107.7	163.4	-179.7	-53.5	-76.2	0	0	0	111.2	L259 V262 A311	L259-F313 HydrophobicContact CB-CB 4.48Å; L259-F313 WeakPolarHBondContact CD1-O 3.49Å; L259-F313 WeakPolarHBondContact O-CB 3.26Å; L259-F313 VanDerWaalsContact O-CD2 3.28Å; L259-F313 WeakPolarHBondContact O-CD2 3.12Å; V262-F313 HydrophobicContact CG2-CE2 4.04Å; V262-F313 HydrophobicContact CG2-CZ 3.74Å; A311-F313 WeakPolarHBondContact CB-O 3.39Å
314	V	86.1	Confident	86.5	Confident	47 Å²	47	51.2 Å²	51.2	29%	0.285	24%	0.244	S	C	.	.	S	Bend	trans	-108.8	-15.6	175.9	-64.1	0	0	0	0	112.9	R291 E293 K294	R291-V314 PolarHBondContact NH1-O 3.38Å; E293-V314 HydrophobicContact CB-CB 4.16Å; E293-V314 HydrophobicContact CB-CG1 4.4Å; E293-V314 HydrophobicContact CG-CB 4.43Å; K294-V314 HydrophobicContact CG-CG1 4.31Å
315	H	87.7	Confident	87	Confident	70 Å²	70	47.4 Å²	47.4	32%	0.324	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-95.9	137.5	-179.1	-64.6	-65.4	0	0	0	110.7	Q214 T215	Q214-H315 HydrophobicContact CG-CB 3.86Å; T215-H315 CarbonylContact O-C 3.54Å; T215-H315 VanDerWaalsContact O-CA 3.28Å; T215-H315 WeakPolarHBondContact O-CA 3.43Å
316	M	89.2	Confident	87.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.1	168.2	-172.7	164	75.2	0	0	108.6	Q214 T215 D218 L244 V257 L259 R291 M318	Q214-M316 WeakPolarHBondContact CA-O 3.47Å; T215-M316 PolarHBondContact N-O 3.32Å; T215-M316 PolarHBondContact O-N 3.2Å; D218-M316 HydrophobicContact CB-CE 4.22Å; D218-M316 WeakPolarHBondContact OD1-CE 3.28Å; D218-M316 WeakPolarHBondContact OD2-CE 3.23Å; L244-M316 HydrophobicContact CB-CE 4.27Å; L244-M316 HydrophobicContact CB-SD 3.75Å; L244-M316 HydrophobicContact CD2-CE 3.77Å; L244-M316 HydrophobicContact CD2-SD 4.2Å; L244-M316 HydrophobicContact CG-SD 4.43Å; V257-M316 HydrophobicContact CG2-SD 4.42Å; L259-M316 HydrophobicContact CD2-CB 3.75Å; L259-M316 HydrophobicContact CD2-CG 4.2Å; R291-M316 VanDerWaalsContact NH2-CB 3.32Å; M316-M318 HydrophobicContact CE-CE 3.44Å; M316-M318 VanDerWaalsContact CE-CE 3.44Å; M316-M318 HydrophobicContact CE-SD 3.99Å; M316-M318 HydrophobicContact CG-CG 4.28Å; M316-M318 HydrophobicContact SD-SD 4.49Å
317	N	87.4	Confident	87.8	Confident	26 Å²	26	39.6 Å²	39.6	14%	0.139	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	124.7	174	-51.6	-71.6	0	0	0	109.5	T213 Q214 S238 D242	T213-N317 CarbonylContact O-C 3.6Å; T213-N317 VanDerWaalsContact O-CA 3.29Å; T213-N317 WeakPolarHBondContact O-CA 3.24Å; Q214-N317 VanDerWaalsContact CG-OD1 3.24Å; Q214-N317 WeakPolarHBondContact CG-OD1 3.24Å; Q214-N317 PolarHBondContact NE2-OD1 3.36Å; Q214-N317 VanDerWaalsContact NE2-OD1 3.17Å; S238-N317 WeakPolarHBondContact CB-O 3.04Å; D242-N317 VanDerWaalsContact CB-O 3.29Å; D242-N317 WeakPolarHBondContact CB-O 3.09Å; D242-N317 VanDerWaalsContact OD1-CB 3.28Å; D242-N317 WeakPolarHBondContact OD1-CB 3.35Å; D242-N317 PolarHBondContact OD1-N 2.86Å; D242-N317 PolarHBondContact OD1-ND2 2.91Å
318	M	86	Confident	88.1	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.015	20%	0.204	C	C	.	.			trans	-128.8	103.3	171.9	-67.6	-177	-65	0	0	108.6	L206 T213 L244 M316 L322 F351	L206-M318 HydrophobicContact CD1-CB 3.57Å; L206-M318 HydrophobicContact CD1-CE 3.9Å; L206-M318 HydrophobicContact CD1-SD 4.39Å; T213-M318 WeakPolarHBondContact CB-O 3.14Å; T213-M318 PolarHBondContact O-N 3.28Å; L244-M318 HydrophobicContact CB-SD 4.42Å; M316-M318 HydrophobicContact CE-CE 3.44Å; M316-M318 VanDerWaalsContact CE-CE 3.44Å; M316-M318 HydrophobicContact CE-SD 3.99Å; M316-M318 HydrophobicContact CG-CG 4.28Å; M316-M318 HydrophobicContact SD-SD 4.49Å; M318-L322 HydrophobicContact SD-CD1 4.19Å; M318-F351 HydrophobicContact CE-CE1 4.48Å; M318-F351 HydrophobicContact CE-CE2 4.35Å; M318-F351 HydrophobicContact CE-CZ 3.63Å
319	N	79.4	Confident	88.4	Confident	77 Å²	77	39 Å²	39	41%	0.412	21%	0.206	S	C	.	.			trans	-105.2	4.1	-178.1	66.7	-5.5	0	0	0	113.6	S238 S239	S238-N319 VanDerWaalsContact CA-OD1 3.24Å; S238-N319 WeakPolarHBondContact CA-OD1 3.44Å; S238-N319 WeakPolarHBondContact CB-OD1 3.21Å; S239-N319 PolarHBondContact N-OD1 2.97Å; S239-N319 PolarHBondContact OG-ND2 3.02Å
320	R	85.3	Confident	88.5	Confident	123 Å²	123	41.2 Å²	41.2	46%	0.464	21%	0.214	S	C	.	.	S	Bend	trans	-110.1	-179.3	175.2	-67	170.9	170.9	-153.6	0.4	110.2	D237	D237-R320 WeakPolarHBondContact O-CB 3.36Å; D237-R320 WeakPolarHBondContact OD1-CD 3Å; D237-R320 IonicContact OD1-NH1 3.22Å; D237-R320 IonicContact OD2-NH1 3.71Å
321	N	87.2	Confident	88.5	Confident	65 Å²	65	41.2 Å²	41.2	35%	0.348	21%	0.214	S	C	.	.			trans	-65.9	138.1	174.5	-66.7	1.3	0	0	0	110.3	D203 L204 R205	D203-N321 HydrophobicContact CB-CB 4.47Å; L204-N321 WeakPolarHBondContact O-CA 3.1Å; R205-N321 VanDerWaalsContact CG-OD1 3.27Å; R205-N321 WeakPolarHBondContact CG-OD1 3.17Å
322	L	92	Very high	88.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	121.2	164.9	-175.3	73.6	0	0	0	108	L204 L206 L234 Y235 M318 I324 F351	L204-L322 HydrophobicContact CB-CB 4.26Å; L204-L322 HydrophobicContact CD2-CD2 4.04Å; L204-L322 PolarHBondContact N-O 2.98Å; L204-L322 PolarHBondContact O-N 2.91Å; L206-L322 HydrophobicContact CD1-CB 4.25Å; L206-L322 HydrophobicContact CG-CB 4.35Å; L234-L322 HydrophobicContact CD1-CD1 3.66Å; L234-L322 HydrophobicContact CD1-CD2 3.92Å; L234-L322 HydrophobicContact CD1-CG 3.64Å; L234-L322 HydrophobicContact CD2-CD1 4.43Å; L234-L322 HydrophobicContact CG-CD1 4.01Å; Y235-L322 CarbonylContact O-C 3.58Å; Y235-L322 WeakPolarHBondContact O-CA 3.33Å; M318-L322 HydrophobicContact SD-CD1 4.19Å; L322-I324 HydrophobicContact CG-CD1 4.4Å; L322-F351 HydrophobicContact CD2-CB 4.46Å; L322-F351 HydrophobicContact CD2-CD1 3.68Å; L322-F351 HydrophobicContact CD2-CD2 3.83Å; L322-F351 HydrophobicContact CD2-CE1 3.85Å; L322-F351 HydrophobicContact CD2-CE2 4.01Å; L322-F351 HydrophobicContact CD2-CG 3.7Å; L322-F351 HydrophobicContact CD2-CZ 4.05Å
323	S	95	Very high	88.8	Confident	6 Å²	6	49.3 Å²	49.3	4%	0.042	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135	-176.8	-57.6	0	0	0	0	110.9	I202 D203 L234 Y235 G326 L327	I202-S323 CarbonylContact O-C 3.52Å; I202-S323 WeakPolarHBondContact O-CA 3.3Å; D203-S323 WeakPolarHBondContact OD1-CB 3.48Å; D203-S323 PolarHBondContact OD1-OG 2.69Å; L234-S323 CarbonylContact C-O 3.49Å; L234-S323 WeakPolarHBondContact CA-O 3.49Å; Y235-S323 PolarHBondContact N-O 2.93Å; Y235-S323 PolarHBondContact O-N 3.08Å; S323-G326 WeakPolarHBondContact CB-O 3.11Å; S323-L327 WeakPolarHBondContact OG-CD2 3.45Å
324	I	96.3	Very high	88.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.4	-174.9	-54.8	84.8	0	0	0	109.3	W201 I202 L204 I233 L234 L322 L346 F349 I356	W201-I324 CarbonylContact C-O 3.48Å; W201-I324 WeakPolarHBondContact CA-O 3.06Å; W201-I324 VanDerWaalsContact CB-O 3.29Å; W201-I324 WeakPolarHBondContact CB-O 3.06Å; I202-I324 HydrophobicContact CB-CB 4.27Å; I202-I324 HydrophobicContact CB-CD1 4.47Å; I202-I324 PolarHBondContact N-O 2.64Å; I202-I324 WeakPolarHBondContact O-CD1 3.15Å; I202-I324 PolarHBondContact O-N 3.2Å; L204-I324 HydrophobicContact CB-CD1 4.42Å; I233-I324 CarbonylContact O-C 3.5Å; I233-I324 VanDerWaalsContact O-CA 3.27Å; I233-I324 WeakPolarHBondContact O-CA 3.41Å; L234-I324 HydrophobicContact CD1-CD1 4.35Å; L234-I324 HydrophobicContact CD1-CG1 3.66Å; L322-I324 HydrophobicContact CG-CD1 4.4Å; I324-L346 HydrophobicContact CG2-CD1 4.06Å; I324-F349 HydrophobicContact CG1-CE1 4.31Å; I324-F349 HydrophobicContact CG1-CZ 4.47Å; I324-F349 HydrophobicContact CG2-CD2 3.89Å; I324-F349 HydrophobicContact CG2-CE1 4.39Å; I324-F349 HydrophobicContact CG2-CE2 3.76Å; I324-F349 HydrophobicContact CG2-CG 4.27Å; I324-F349 HydrophobicContact CG2-CZ 4.03Å; I324-I356 HydrophobicContact CD1-CD1 3.71Å; I324-I356 HydrophobicContact CD1-CG2 3.9Å; I324-I356 HydrophobicContact CG1-CD1 3.84Å; I324-I356 HydrophobicContact CG1-CG2 4.14Å
325	G	95.6	Very high	89	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.254	C	S	.	.	S	Bend	trans	89.2	-11.7	-179.8	0	0	0	0	0	115	L232 I233 N341 F342	L232-G325 CarbonylContact O-C 3.46Å; L232-G325 WeakPolarHBondContact O-CA 2.97Å; I233-G325 PolarHBondContact O-N 2.62Å; G325-N341 WeakPolarHBondContact O-CB 3.4Å; G325-F342 PolarHBondContact O-N 2.73Å
326	G	94.5	Very high	89.3	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.246	C	C	.	.			trans	164.4	-177.7	178.6	0	0	0	0	0	115.2	S323 N341	S323-G326 WeakPolarHBondContact CB-O 3.11Å; G326-N341 VanDerWaalsContact CA-CG 3.43Å; G326-N341 WeakPolarHBondContact CA-OD1 3.03Å
327	L	93.4	Very high	89.3	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.021	26%	0.259	C	S	.	.			trans	-135.8	156.4	174.6	-73.7	171.4	0	0	0	110	L232 Y235 S323 D329 R333 I336 N341	L232-L327 HydrophobicContact CD2-CB 4.22Å; L232-L327 HydrophobicContact CD2-CD1 3.53Å; L232-L327 HydrophobicContact CD2-CG 3.59Å; Y235-L327 HydrophobicContact CD1-CD1 3.86Å; Y235-L327 HydrophobicContact CD1-CD2 4.18Å; Y235-L327 HydrophobicContact CE1-CD1 4.38Å; Y235-L327 HydrophobicContact CG-CD1 4.01Å; S323-L327 WeakPolarHBondContact OG-CD2 3.45Å; L327-D329 VanDerWaalsContact C-N 3.35Å; L327-R333 HydrophobicContact CD1-CG 4.1Å; L327-I336 HydrophobicContact CD1-CD1 3.74Å; L327-N341 PolarHBondContact N-OD1 2.68Å; L327-N341 PolarHBondContact O-ND2 2.74Å; L327-N341 PolarHBondContact O-OD1 3.12Å
328	P	91.1	Very high	89.6	Confident	94 Å²	94	50.5 Å²	50.5	61%	0.61	26%	0.256	S	S	*	.	S	Bend	trans	-71.1	-31.8	173.3	26.3	-32.2	0	0	0	112.7	W201	W201-P328 HydrophobicContact CH2-CB 3.65Å; W201-P328 HydrophobicContact CH2-CG 4.43Å; W201-P328 HydrophobicContact CZ2-CB 3.6Å; W201-P328 HydrophobicContact CZ2-CG 3.9Å
329	D	89.9	Confident	90	Very high	86 Å²	86	56.6 Å²	56.6	46%	0.46	29%	0.289	S	S	.	.			trans	-153.5	138.7	-179.3	-176.3	16	0	0	0	109.8	L327 S331	L327-D329 VanDerWaalsContact C-N 3.35Å; D329-S331 WeakPolarHBondContact OD1-CB 3.09Å; D329-S331 PolarHBondContact OD1-N 3.43Å; D329-S331 VanDerWaalsContact OD2-CB 3.3Å; D329-S331 WeakPolarHBondContact OD2-CB 3.18Å; D329-S331 PolarHBondContact OD2-OG 2.74Å
330	Y	90	Very high	90.7	Very high	50 Å²	50	55.9 Å²	55.9	20%	0.196	28%	0.283	C	S	.	.			trans	-91.6	-12.2	178.9	-71.6	-100.7	0	0	0	111.8	L232 N332 R333 I336 V338 Q340 N341	L232-Y330 HydrophobicContact CB-CE1 4.3Å; L232-Y330 WeakPolarHBondContact CB-OH 3.49Å; L232-Y330 HydrophobicContact CD2-CE1 3.88Å; Y330-N332 PolarHBondContact O-N 2.67Å; Y330-R333 WeakPolarHBondContact O-CB 3.21Å; Y330-R333 PolarHBondContact O-N 3.47Å; Y330-I336 HydrophobicContact CD1-CD1 4.17Å; Y330-I336 HydrophobicContact CD1-CG2 3.93Å; Y330-I336 HydrophobicContact CE1-CD1 4.47Å; Y330-I336 HydrophobicContact CE1-CG2 3.97Å; Y330-V338 WeakPolarHBondContact CD1-O 3.29Å; Y330-V338 HydrophobicContact CE1-CG2 4.27Å; Y330-Q340 PolarHBondContact OH-O 3.1Å; Y330-N341 WeakPolarHBondContact CE2-OD1 3.1Å; Y330-N341 WeakPolarHBondContact OH-CA 3.48Å; Y330-N341 PolarHBondContact OH-N 2.68Å; Y330-N341 VanDerWaalsContact OH-N 3.17Å; Y330-N341 PolarHBondContact OH-OD1 3.39Å
331	S	86.1	Confident	91.3	Very high	59 Å²	59	51 Å²	51	41%	0.413	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	138.8	178.9	85.7	0	0	0	0	111.4	D329 R333	D329-S331 WeakPolarHBondContact OD1-CB 3.09Å; D329-S331 PolarHBondContact OD1-N 3.43Å; D329-S331 VanDerWaalsContact OD2-CB 3.3Å; D329-S331 WeakPolarHBondContact OD2-CB 3.18Å; D329-S331 PolarHBondContact OD2-OG 2.74Å; S331-R333 PolarHBondContact O-N 2.69Å; S331-R333 VanDerWaalsContact O-N 3.15Å
332	N	80.9	Confident	91.7	Very high	159 Å²	159	48 Å²	48	85%	0.85	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	13.9	-179.4	-50.4	-59.8	0	0	0	116	Y330	Y330-N332 PolarHBondContact O-N 2.67Å
333	R	87.4	Confident	91.9	Very high	77 Å²	77	50.9 Å²	50.9	29%	0.291	27%	0.265	S	S	.	.			trans	-89.9	136.9	171.9	-57.6	-55.9	-171.9	159.4	7.3	110.4	Y235 D237 L327 Y330 S331 I336	Y235-R333 HydrophobicContact CE1-CG 4.42Å; Y235-R333 HydrophobicContact CE2-CB 4.4Å; D237-R333 IonicContact OD1-NH1 2.65Å; D237-R333 PolarHBondContact OD1-NH1 3.39Å; D237-R333 IonicContact OD2-NH1 3.55Å; D237-R333 PolarHBondContact OD2-NH1 3.36Å; L327-R333 HydrophobicContact CD1-CG 4.1Å; Y330-R333 WeakPolarHBondContact O-CB 3.21Å; Y330-R333 PolarHBondContact O-N 3.47Å; S331-R333 PolarHBondContact O-N 2.69Å; S331-R333 VanDerWaalsContact O-N 3.15Å; R333-I336 HydrophobicContact CB-CD1 3.54Å; R333-I336 HydrophobicContact CB-CG1 4.23Å; R333-I336 HydrophobicContact CG-CD1 4.17Å
334	R	86.9	Confident	91.9	Very high	162 Å²	162	51 Å²	51	61%	0.611	27%	0.266	S	S	*	.	S	Bend	trans	-97.6	149.4	-179.5	-66.4	-176.4	-179.5	-174.8	0.1	109.3	Y235 Y243 I336	Y235-R334 WeakPolarHBondContact CE2-O 3.49Å; Y235-R334 PolarHBondContact OH-N 2.72Å; Y243-R334 HydrophobicContact CD1-CB 4Å; Y243-R334 HydrophobicContact CE1-CB 4Å; R334-I336 VanDerWaalsContact C-N 3.34Å; R334-I336 PolarHBondContact O-N 3.41Å
335	G	87.9	Confident	91.9	Very high	13 Å²	13	51.2 Å²	51.2	13%	0.134	27%	0.268	C	S	.	.	S	Bend	trans	65.1	33	172.8	0	0	0	0	0	114.9	C245 R256	C245-G335 WeakPolarHBondContact CB-O 3.13Å; R256-G335 WeakPolarHBondContact CD-O 3.04Å
336	I	93.2	Very high	92	Very high	33 Å²	33	51.2 Å²	51.2	17%	0.169	27%	0.268	C	S	.	.			trans	-115.8	132.4	170.1	-52.2	-177.1	0	0	0	108.3	L232 Y235 L327 Y330 R333 R334 V338	L232-I336 HydrophobicContact CD1-CG2 4.38Å; L232-I336 HydrophobicContact CD2-CD1 4.35Å; Y235-I336 HydrophobicContact CD2-CD1 3.55Å; Y235-I336 HydrophobicContact CD2-CG1 3.69Å; Y235-I336 HydrophobicContact CE2-CD1 3.56Å; Y235-I336 HydrophobicContact CE2-CG1 3.57Å; Y235-I336 HydrophobicContact CG-CD1 4.17Å; L327-I336 HydrophobicContact CD1-CD1 3.74Å; Y330-I336 HydrophobicContact CD1-CD1 4.17Å; Y330-I336 HydrophobicContact CD1-CG2 3.93Å; Y330-I336 HydrophobicContact CE1-CD1 4.47Å; Y330-I336 HydrophobicContact CE1-CG2 3.97Å; R333-I336 HydrophobicContact CB-CD1 3.54Å; R333-I336 HydrophobicContact CB-CG1 4.23Å; R333-I336 HydrophobicContact CG-CD1 4.17Å; R334-I336 VanDerWaalsContact C-N 3.34Å; R334-I336 PolarHBondContact O-N 3.41Å; I336-V338 HydrophobicContact CG2-CG2 3.86Å; I336-V338 WeakPolarHBondContact CG2-O 3.08Å
337	S	90.7	Very high	91.9	Very high	38 Å²	38	51.2 Å²	51.2	27%	0.266	27%	0.268	S	S	.	.			trans	-100.9	-24.6	176.7	-37.6	0	0	0	0	112.8	E247 R254 R256	E247-S337 WeakPolarHBondContact OE1-CB 3.23Å; E247-S337 PolarHBondContact OE1-N 2.7Å; E247-S337 PolarHBondContact OE1-OG 3.06Å; E247-S337 PolarHBondContact OE2-N 2.76Å; R254-S337 PolarHBondContact NH1-OG 3.5Å; R256-S337 VanDerWaalsContact CZ-OG 3.32Å; R256-S337 PolarHBondContact NE-OG 2.94Å; R256-S337 PolarHBondContact NH2-OG 3.44Å
338	V	93.6	Very high	91.8	Very high	11 Å²	11	52.9 Å²	52.9	7%	0.067	28%	0.275	C	S	.	.			trans	-88.8	161.1	-180	-58.4	0	0	0	0	112.5	N230 L232 E247 L248 Y249 Y330 I336	N230-V338 HydrophobicContact CB-CG1 4.09Å; L232-V338 HydrophobicContact CB-CG2 3.95Å; E247-V338 HydrophobicContact CB-CG1 4.27Å; E247-V338 HydrophobicContact CB-CG2 4.19Å; E247-V338 HydrophobicContact CG-CG1 4.44Å; E247-V338 WeakPolarHBondContact OE2-CG2 3.05Å; E247-V338 PolarHBondContact OE2-N 2.69Å; E247-V338 VanDerWaalsContact OE2-N 3.08Å; L248-V338 WeakPolarHBondContact O-CG1 3.42Å; Y249-V338 HydrophobicContact CD2-CG1 4.03Å; Y330-V338 WeakPolarHBondContact CD1-O 3.29Å; Y330-V338 HydrophobicContact CE1-CG2 4.27Å; I336-V338 HydrophobicContact CG2-CG2 3.86Å; I336-V338 WeakPolarHBondContact CG2-O 3.08Å
339	N	93	Very high	91.9	Very high	132 Å²	132	48.4 Å²	48.4	71%	0.706	25%	0.247	S	C	*	.			trans	-124.1	15.2	176.6	67.1	0.1	0	0	0	113
340	Q	95	Very high	91.9	Very high	62 Å²	62	46.1 Å²	46.1	29%	0.29	23%	0.234	S	C	.	.	S	Bend	trans	-134	146.7	179.2	63.1	-96.9	78	0	0	111.9	N230 L232 Y330	N230-Q340 VanDerWaalsContact CB-CD 3.46Å; N230-Q340 HydrophobicContact CB-CG 4.22Å; N230-Q340 WeakPolarHBondContact O-CG 2.97Å; L232-Q340 PolarHBondContact N-O 2.69Å; Y330-Q340 PolarHBondContact OH-O 3.1Å
341	N	96.6	Very high	91.9	Very high	20 Å²	20	44 Å²	44	11%	0.107	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-69.3	158.5	171.4	-68.1	-15.6	0	0	0	110.5	G198 G325 G326 L327 Y330 I343	G198-N341 VanDerWaalsContact O-CB 3.28Å; G198-N341 WeakPolarHBondContact O-CB 3.48Å; G198-N341 PolarHBondContact O-ND2 2.72Å; G325-N341 WeakPolarHBondContact O-CB 3.4Å; G326-N341 VanDerWaalsContact CA-CG 3.43Å; G326-N341 WeakPolarHBondContact CA-OD1 3.03Å; L327-N341 PolarHBondContact N-OD1 2.68Å; L327-N341 PolarHBondContact O-ND2 2.74Å; L327-N341 PolarHBondContact O-OD1 3.12Å; Y330-N341 WeakPolarHBondContact CE2-OD1 3.1Å; Y330-N341 WeakPolarHBondContact OH-CA 3.48Å; Y330-N341 PolarHBondContact OH-N 2.68Å; Y330-N341 VanDerWaalsContact OH-N 3.17Å; Y330-N341 PolarHBondContact OH-OD1 3.39Å; N341-I343 PolarHBondContact O-N 2.66Å
342	F	96.7	Very high	91.9	Very high	1 Å²	1	43.9 Å²	43.9	0%	0.004	22%	0.221	C	C	.	.			trans	-66.9	131.5	177.4	-178.8	-100.5	0	0	0	110.8	M196 G198 F224 T226 L232 I233 G325 L346	M196-F342 HydrophobicContact CB-CD1 3.98Å; M196-F342 VanDerWaalsContact CB-O 3.31Å; M196-F342 WeakPolarHBondContact CB-O 3.43Å; M196-F342 HydrophobicContact CG-CD1 4.07Å; G198-F342 PolarHBondContact N-O 3.09Å; F224-F342 HydrophobicContact CB-CZ 4.03Å; F224-F342 AromaticContact CD2-CE2 3.99Å; F224-F342 HydrophobicContact CD2-CE2 3.99Å; F224-F342 HydrophobicContact CD2-CZ 4.04Å; F224-F342 HydrophobicContact CG-CZ 4.47Å; T226-F342 HydrophobicContact CG2-CE2 3.93Å; T226-F342 HydrophobicContact CG2-CZ 4.37Å; L232-F342 VanDerWaalsContact O-CB 3.23Å; L232-F342 WeakPolarHBondContact O-CB 3.1Å; L232-F342 PolarHBondContact O-N 2.84Å; I233-F342 HydrophobicContact CD1-CD2 4.2Å; I233-F342 HydrophobicContact CD1-CE2 4.22Å; I233-F342 HydrophobicContact CG1-CB 4.42Å; I233-F342 HydrophobicContact CG1-CD2 3.64Å; I233-F342 HydrophobicContact CG1-CE2 4.13Å; I233-F342 HydrophobicContact CG1-CG 4.14Å; G325-F342 PolarHBondContact O-N 2.73Å; F342-L346 HydrophobicContact CD1-CD1 4.43Å; F342-L346 HydrophobicContact CD1-CD2 4.24Å; F342-L346 HydrophobicContact CD1-CG 4.18Å; F342-L346 HydrophobicContact CE1-CD2 3.71Å; F342-L346 HydrophobicContact CE1-CG 3.81Å; F342-L346 HydrophobicContact CZ-CD2 4.03Å
343	I	96.1	Very high	91.8	Very high	62 Å²	62	39 Å²	39	32%	0.318	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	122.3	170.9	-60.4	172.1	0	0	0	106.5	M196 T226 E228 N341	M196-I343 CarbonylContact O-C 3.57Å; M196-I343 WeakPolarHBondContact O-CA 3.48Å; T226-I343 WeakPolarHBondContact CB-O 3.46Å; T226-I343 PolarHBondContact OG1-O 3.4Å; E228-I343 HydrophobicContact CG-CB 4Å; E228-I343 HydrophobicContact CG-CD1 4.43Å; N341-I343 PolarHBondContact O-N 2.66Å
344	G	95.5	Very high	91.5	Very high	8 Å²	8	36.5 Å²	36.5	8%	0.082	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146.2	-165.5	-176.1	0	0	0	0	0	112.7	M196 R225	M196-G344 PolarHBondContact N-O 2.87Å; M196-G344 PolarHBondContact O-N 3.39Å; R225-G344 CarbonylContact O-C 3.04Å; R225-G344 VanDerWaalsContact O-CA 3.31Å; R225-G344 WeakPolarHBondContact O-CA 3.36Å
345	C	95.9	Very high	91.4	Very high	4 Å²	4	31 Å²	31	3%	0.027	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	138.3	-179	-53.5	0	0	0	0	110.7	A194 F224 R225 W284 C421	A194-C345 WeakPolarHBondContact O-CA 3.44Å; F224-C345 CarbonylContact C-O 3.53Å; F224-C345 WeakPolarHBondContact CA-O 3.13Å; R225-C345 HydrophobicContact CB-CB 4.45Å; R225-C345 PolarHBondContact N-O 2.87Å; R225-C345 PolarHBondContact O-N 3.34Å; W284-C345 HydrophobicContact CH2-CB 3.41Å; W284-C345 VanDerWaalsContact CH2-CB 3.41Å; W284-C345 HydrophobicContact CZ2-CB 3.96Å; W284-C345 HydrophobicContact CZ3-CB 4.13Å; C345-C421 HydrophobicContact CB-CB 3.8Å; C345-C421 WeakPolarHBondContact CB-SG 2.98Å; C345-C421 WeakPolarHBondContact SG-CA 3.4Å; C345-C421 WeakPolarHBondContact SG-CB 3.22Å; C345-C421 CovalentContact SG-SG 2.03Å; C345-C421 PolarHBondContact SG-SG 3.23Å
346	L	96.8	Very high	91.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	139.3	168.5	-61.2	174.2	0	0	0	108.9	V193 A194 M196 F222 R223 F224 I233 I324 F342 F349 I357	V193-L346 CarbonylContact C-O 3.57Å; V193-L346 WeakPolarHBondContact CA-O 3.46Å; A194-L346 HydrophobicContact CB-CB 4.43Å; A194-L346 PolarHBondContact N-O 3.34Å; A194-L346 PolarHBondContact O-N 3.08Å; M196-L346 HydrophobicContact CE-CD1 3.8Å; M196-L346 HydrophobicContact CG-CD1 4.16Å; F222-L346 HydrophobicContact CD2-CD2 4.21Å; R223-L346 CarbonylContact O-C 3.55Å; R223-L346 WeakPolarHBondContact O-CA 3.45Å; F224-L346 HydrophobicContact CB-CD2 3.62Å; I233-L346 HydrophobicContact CG2-CD2 4.47Å; I324-L346 HydrophobicContact CG2-CD1 4.06Å; F342-L346 HydrophobicContact CD1-CD1 4.43Å; F342-L346 HydrophobicContact CD1-CD2 4.24Å; F342-L346 HydrophobicContact CD1-CG 4.18Å; F342-L346 HydrophobicContact CE1-CD2 3.71Å; F342-L346 HydrophobicContact CE1-CG 3.81Å; F342-L346 HydrophobicContact CZ-CD2 4.03Å; L346-F349 HydrophobicContact CD1-CD2 4.23Å; L346-I357 HydrophobicContact CB-CD1 3.88Å; L346-I357 WeakPolarHBondContact O-CD1 3.41Å
347	E	93.8	Very high	91.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138.1	177.6	-96.3	179.8	-178.8	0	0	109.9	R97 P191 F192 V193 R223 W284 F349	R97-E347 IonicContact CZ-OE1 3.64Å; R97-E347 VanDerWaalsContact CZ-OE1 3.28Å; R97-E347 IonicContact NH1-OE1 3.16Å; R97-E347 PolarHBondContact NH1-OE1 3.36Å; R97-E347 IonicContact NH1-OE2 3.42Å; R97-E347 PolarHBondContact NH1-OE2 2.82Å; R97-E347 IonicContact NH2-OE1 3.53Å; R97-E347 PolarHBondContact NH2-OE1 2.92Å; P191-E347 HydrophobicContact CB-CB 4.39Å; P191-E347 HydrophobicContact CB-CG 3.92Å; P191-E347 HydrophobicContact CG-CG 4.07Å; P191-E347 WeakPolarHBondContact CG-OE1 3.47Å; F192-E347 WeakPolarHBondContact O-CA 3.29Å; V193-E347 HydrophobicContact CB-CG 4.36Å; V193-E347 HydrophobicContact CG1-CG 4.43Å; V193-E347 HydrophobicContact CG2-CG 3.71Å; R223-E347 HydrophobicContact CB-CB 3.96Å; R223-E347 PolarHBondContact N-O 3.02Å; R223-E347 IonicContact NH1-OE2 2.66Å; R223-E347 PolarHBondContact NH1-OE2 2.8Å; R223-E347 PolarHBondContact O-N 2.59Å; W284-E347 HydrophobicContact CE3-CB 4.39Å; W284-E347 HydrophobicContact CE3-CG 4.49Å; W284-E347 HydrophobicContact CH2-CB 3.9Å; W284-E347 HydrophobicContact CH2-CG 3.34Å; W284-E347 VanDerWaalsContact CZ2-CD 3.42Å; W284-E347 HydrophobicContact CZ2-CG 3.96Å; W284-E347 VanDerWaalsContact CZ2-OE1 3.28Å; W284-E347 WeakPolarHBondContact CZ2-OE1 3.26Å; W284-E347 HydrophobicContact CZ3-CB 3.66Å; W284-E347 HydrophobicContact CZ3-CG 3.67Å; E347-F349 VanDerWaalsContact C-N 3.34Å; E347-F349 PolarHBondContact O-N 2.82Å
348	E	89.8	Confident	91	Very high	39 Å²	39	29.9 Å²	29.9	18%	0.182	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	45.7	51.6	173.6	-70.7	-57.8	144.6	0	0	114.1	P191 F192 I350 H355	P191-E348 VanDerWaalsContact CA-OE1 3.27Å; P191-E348 WeakPolarHBondContact CA-OE1 3.4Å; P191-E348 HydrophobicContact CB-CG 3.88Å; F192-E348 WeakPolarHBondContact CD2-OE1 3.28Å; F192-E348 PolarHBondContact N-OE1 2.65Å; F192-E348 PolarHBondContact O-N 2.82Å; F192-E348 VanDerWaalsContact O-N 3.08Å; E348-I350 PolarHBondContact O-N 2.84Å; E348-I350 VanDerWaalsContact O-N 3.15Å; E348-H355 IonicContact OE2-CE1 3.64Å; E348-H355 IonicContact OE2-ND1 3.85Å; E348-H355 PolarHBondContact OE2-ND1 3.23Å
349	F	94.7	Very high	90.4	Very high	1 Å²	1	30.3 Å²	30.3	0%	0.004	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	108.9	178.8	-157.2	-64.7	0	0	0	111	I220 S221 F222 I233 L234 I324 L346 E347 H355 I356 I357	I220-F349 HydrophobicContact CG2-CE1 3.99Å; I220-F349 HydrophobicContact CG2-CZ 4.15Å; S221-F349 CarbonylContact O-C 3.32Å; F222-F349 HydrophobicContact CB-CB 4.09Å; F222-F349 HydrophobicContact CB-CD2 3.49Å; F222-F349 VanDerWaalsContact CB-CD2 3.49Å; F222-F349 HydrophobicContact CB-CE2 4.02Å; F222-F349 HydrophobicContact CB-CG 3.85Å; F222-F349 AromaticContact CD1-CD2 3.99Å; F222-F349 HydrophobicContact CD1-CD2 3.99Å; F222-F349 AromaticContact CD1-CE2 3.59Å; F222-F349 HydrophobicContact CD1-CE2 3.59Å; F222-F349 AromaticContact CD1-CZ 3.92Å; F222-F349 HydrophobicContact CD1-CZ 3.92Å; F222-F349 HydrophobicContact CD2-CD2 4.23Å; F222-F349 HydrophobicContact CD2-CE2 4.17Å; F222-F349 HydrophobicContact CE1-CE2 4.03Å; F222-F349 HydrophobicContact CE1-CZ 4.25Å; F222-F349 AromaticContact CG-CD2 3.67Å; F222-F349 HydrophobicContact CG-CD2 3.67Å; F222-F349 AromaticContact CG-CE2 3.68Å; F222-F349 HydrophobicContact CG-CE2 3.68Å; F222-F349 HydrophobicContact CG-CG 4.41Å; F222-F349 HydrophobicContact CG-CZ 4.43Å; F222-F349 HydrophobicContact CZ-CE2 4.48Å; I233-F349 HydrophobicContact CG2-CE2 3.76Å; I233-F349 HydrophobicContact CG2-CZ 4.41Å; L234-F349 HydrophobicContact CB-CZ 4.31Å; L234-F349 HydrophobicContact CD1-CE1 4.23Å; L234-F349 HydrophobicContact CD1-CZ 4.04Å; L234-F349 HydrophobicContact CD2-CZ 4.46Å; I324-F349 HydrophobicContact CG1-CE1 4.31Å; I324-F349 HydrophobicContact CG1-CZ 4.47Å; I324-F349 HydrophobicContact CG2-CD2 3.89Å; I324-F349 HydrophobicContact CG2-CE1 4.39Å; I324-F349 HydrophobicContact CG2-CE2 3.76Å; I324-F349 HydrophobicContact CG2-CG 4.27Å; I324-F349 HydrophobicContact CG2-CZ 4.03Å; L346-F349 HydrophobicContact CD1-CD2 4.23Å; E347-F349 VanDerWaalsContact C-N 3.34Å; E347-F349 PolarHBondContact O-N 2.82Å; F349-H355 CarbonylContact O-C 3.59Å; F349-I356 HydrophobicContact CD1-CB 4.33Å; F349-I356 HydrophobicContact CD1-CD1 3.77Å; F349-I356 HydrophobicContact CD1-CG1 4.32Å; F349-I356 HydrophobicContact CE1-CD1 3.99Å; F349-I356 PolarHBondContact O-N 3.27Å; F349-I357 HydrophobicContact CB-CD1 3.8Å; F349-I357 HydrophobicContact CB-CG1 3.86Å
350	I	89.3	Confident	90	Very high	37 Å²	37	24 Å²	24	19%	0.19	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	131.7	-179.5	-59.8	165.2	0	0	0	109	I220 S221 E348 V354	I220-I350 WeakPolarHBondContact CA-O 3.46Å; S221-I350 PolarHBondContact N-O 3.41Å; S221-I350 PolarHBondContact O-N 2.83Å; E348-I350 PolarHBondContact O-N 2.84Å; E348-I350 VanDerWaalsContact O-N 3.15Å; I350-V354 VanDerWaalsContact CA-O 3.29Å; I350-V354 WeakPolarHBondContact CA-O 3.21Å
351	F	89.2	Confident	89.5	Confident	5 Å²	5	22.2 Å²	22.2	2%	0.022	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	115.7	172.8	176.2	-92.9	0	0	0	109.1	L204 L206 I220 L234 M318 L322 G353 V354 I356	L204-F351 HydrophobicContact CD2-CD1 4.42Å; L206-F351 HydrophobicContact CD2-CE1 4.06Å; I220-F351 HydrophobicContact CD1-CD2 4.03Å; I220-F351 HydrophobicContact CD1-CE2 4.07Å; I220-F351 HydrophobicContact CG1-CD2 3.83Å; I220-F351 HydrophobicContact CG1-CE2 4.15Å; L234-F351 HydrophobicContact CD2-CD2 4.5Å; M318-F351 HydrophobicContact CE-CE1 4.48Å; M318-F351 HydrophobicContact CE-CE2 4.35Å; M318-F351 HydrophobicContact CE-CZ 3.63Å; L322-F351 HydrophobicContact CD2-CB 4.46Å; L322-F351 HydrophobicContact CD2-CD1 3.68Å; L322-F351 HydrophobicContact CD2-CD2 3.83Å; L322-F351 HydrophobicContact CD2-CE1 3.85Å; L322-F351 HydrophobicContact CD2-CE2 4.01Å; L322-F351 HydrophobicContact CD2-CG 3.7Å; L322-F351 HydrophobicContact CD2-CZ 4.05Å; F351-G353 PolarHBondContact O-N 2.78Å; F351-G353 VanDerWaalsContact O-N 3.15Å; F351-V354 PolarHBondContact N-O 2.78Å; F351-V354 WeakPolarHBondContact O-CB 3.22Å; F351-V354 PolarHBondContact O-N 3.21Å; F351-I356 HydrophobicContact CB-CD1 3.67Å; F351-I356 HydrophobicContact CB-CG1 4.34Å
352	N	86.4	Confident	88.4	Confident	58 Å²	58	22.5 Å²	22.5	31%	0.31	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.2	43.9	-179.1	-67.9	-13.5	0	0	0	112.7	D218 E219 V354	D218-N352 WeakPolarHBondContact CA-OD1 3.23Å; D218-N352 PolarHBondContact OD1-ND2 2.9Å; E219-N352 PolarHBondContact N-OD1 2.83Å; E219-N352 PolarHBondContact O-N 3.46Å; E219-N352 PolarHBondContact O-OD1 2.58Å; N352-V354 VanDerWaalsContact C-N 3.33Å; N352-V354 PolarHBondContact O-N 3.16Å
353	G	78.7	Confident	87.2	Confident	56 Å²	56	24.7 Å²	24.7	58%	0.577	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.6	-4.1	-178.8	0	0	0	0	0	116.1	F351	F351-G353 PolarHBondContact O-N 2.78Å; F351-G353 VanDerWaalsContact O-N 3.15Å
354	V	82.1	Confident	85.9	Confident	25 Å²	25	26.3 Å²	26.3	15%	0.152	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	117.9	175.1	-177.3	0	0	0	0	109.7	I350 F351 N352 I356	I350-V354 VanDerWaalsContact CA-O 3.29Å; I350-V354 WeakPolarHBondContact CA-O 3.21Å; F351-V354 PolarHBondContact N-O 2.78Å; F351-V354 WeakPolarHBondContact O-CB 3.22Å; F351-V354 PolarHBondContact O-N 3.21Å; N352-V354 VanDerWaalsContact C-N 3.33Å; N352-V354 PolarHBondContact O-N 3.16Å; V354-I356 HydrophobicContact CG1-CG1 4.33Å; V354-I356 PolarHBondContact O-N 3.06Å; V354-I356 VanDerWaalsContact O-N 3.14Å
355	H	84.4	Confident	84.4	Confident	47 Å²	47	29.6 Å²	29.6	22%	0.218	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	90.2	173.7	-65	-114.2	0	0	0	109.7	E348 F349 I357 R358 D359	E348-H355 IonicContact OE2-CE1 3.64Å; E348-H355 IonicContact OE2-ND1 3.85Å; E348-H355 PolarHBondContact OE2-ND1 3.23Å; F349-H355 CarbonylContact O-C 3.59Å; H355-I357 PolarHBondContact O-N 2.88Å; H355-R358 HydrophobicContact CB-CB 3.92Å; H355-R358 VanDerWaalsContact CD2-CZ 3.48Å; H355-R358 PolarHBondContact CD2-NH1 2.9Å; H355-R358 PolarHBondContact CD2-NH2 2.74Å; H355-R358 VanDerWaalsContact CG-CZ 3.45Å; H355-R358 PolarHBondContact O-N 3.03Å; H355-D359 VanDerWaalsContact O-CB 3.28Å; H355-D359 WeakPolarHBondContact O-CB 3.48Å; H355-D359 VanDerWaalsContact O-CG 3.24Å; H355-D359 PolarHBondContact O-N 3.22Å
356	I	89	Confident	82.6	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-48.3	-168.6	-65	-175.4	0	0	0	112.1	I202 L204 I324 F349 F351 V354 D359 A360 L409	I202-I356 HydrophobicContact CB-CG2 4.37Å; I202-I356 HydrophobicContact CD1-CG2 4.17Å; I202-I356 HydrophobicContact CG2-CG2 3.78Å; L204-I356 HydrophobicContact CD2-CD1 4.24Å; I324-I356 HydrophobicContact CD1-CD1 3.71Å; I324-I356 HydrophobicContact CD1-CG2 3.9Å; I324-I356 HydrophobicContact CG1-CD1 3.84Å; I324-I356 HydrophobicContact CG1-CG2 4.14Å; F349-I356 HydrophobicContact CD1-CB 4.33Å; F349-I356 HydrophobicContact CD1-CD1 3.77Å; F349-I356 HydrophobicContact CD1-CG1 4.32Å; F349-I356 HydrophobicContact CE1-CD1 3.99Å; F349-I356 PolarHBondContact O-N 3.27Å; F351-I356 HydrophobicContact CB-CD1 3.67Å; F351-I356 HydrophobicContact CB-CG1 4.34Å; V354-I356 HydrophobicContact CG1-CG1 4.33Å; V354-I356 PolarHBondContact O-N 3.06Å; V354-I356 VanDerWaalsContact O-N 3.14Å; I356-D359 PolarHBondContact O-N 2.93Å; I356-A360 WeakPolarHBondContact O-CB 3.43Å; I356-A360 PolarHBondContact O-N 2.86Å; I356-L409 HydrophobicContact CG2-CD2 4.27Å
357	I	90.6	Very high	80.3	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-64.5	-50	-177.4	-62.4	171.5	0	0	0	110.5	F192 A194 L346 F349 H355 D359 A360 Q361	F192-I357 HydrophobicContact CB-CB 4.31Å; F192-I357 HydrophobicContact CB-CG2 3.92Å; A194-I357 HydrophobicContact CB-CD1 3.76Å; A194-I357 HydrophobicContact CB-CG1 3.87Å; A194-I357 HydrophobicContact CB-CG2 3.88Å; L346-I357 HydrophobicContact CB-CD1 3.88Å; L346-I357 WeakPolarHBondContact O-CD1 3.41Å; F349-I357 HydrophobicContact CB-CD1 3.8Å; F349-I357 HydrophobicContact CB-CG1 3.86Å; H355-I357 PolarHBondContact O-N 2.88Å; I357-D359 VanDerWaalsContact C-N 3.3Å; I357-D359 PolarHBondContact O-N 2.77Å; I357-A360 PolarHBondContact O-N 2.71Å; I357-Q361 HydrophobicContact CG2-CG 4.42Å; I357-Q361 WeakPolarHBondContact O-CB 3.43Å; I357-Q361 WeakPolarHBondContact O-CG 3.46Å; I357-Q361 PolarHBondContact O-N 3.02Å
358	R	83.1	Confident	78.2	Confident	58 Å²	58	43.3 Å²	43.3	22%	0.219	24%	0.236	C	C	.	.	H	α-helix	trans	-54.2	-49.5	177.5	179.2	-179.6	75.2	-160.6	-0.9	111	F192 H355 Q361 R362	F192-R358 HydrophobicContact CB-CB 4.28Å; F192-R358 HydrophobicContact CD1-CB 3.94Å; F192-R358 HydrophobicContact CD1-CG 4.08Å; F192-R358 HydrophobicContact CD2-CB 3.75Å; F192-R358 HydrophobicContact CD2-CG 3.88Å; F192-R358 HydrophobicContact CE1-CB 4.2Å; F192-R358 HydrophobicContact CE1-CG 3.81Å; F192-R358 HydrophobicContact CE2-CB 4.03Å; F192-R358 HydrophobicContact CE2-CG 3.6Å; F192-R358 HydrophobicContact CG-CB 3.7Å; F192-R358 HydrophobicContact CG-CG 4.11Å; F192-R358 HydrophobicContact CZ-CB 4.25Å; F192-R358 HydrophobicContact CZ-CG 3.56Å; H355-R358 HydrophobicContact CB-CB 3.92Å; H355-R358 VanDerWaalsContact CD2-CZ 3.48Å; H355-R358 PolarHBondContact CD2-NH1 2.9Å; H355-R358 PolarHBondContact CD2-NH2 2.74Å; H355-R358 VanDerWaalsContact CG-CZ 3.45Å; H355-R358 PolarHBondContact O-N 3.03Å; R358-Q361 PolarHBondContact O-N 3.5Å; R358-R362 WeakPolarHBondContact O-CB 3.4Å; R358-R362 WeakPolarHBondContact O-CG 3.38Å; R358-R362 PolarHBondContact O-N 3.16Å
359	D	82.3	Confident	76.3	Confident	20 Å²	20	47.5 Å²	47.5	11%	0.107	26%	0.255	C	S	.	.	H	α-helix	trans	-74.4	-33.4	-173.7	-69	-5	0	0	0	111.6	H355 I356 I357 R362 S363 I406 L409	H355-D359 VanDerWaalsContact O-CB 3.28Å; H355-D359 WeakPolarHBondContact O-CB 3.48Å; H355-D359 VanDerWaalsContact O-CG 3.24Å; H355-D359 PolarHBondContact O-N 3.22Å; I356-D359 PolarHBondContact O-N 2.93Å; I357-D359 VanDerWaalsContact C-N 3.3Å; I357-D359 PolarHBondContact O-N 2.77Å; D359-R362 PolarHBondContact O-N 3.14Å; D359-S363 PolarHBondContact O-N 3.4Å; D359-I406 HydrophobicContact CB-CD1 3.91Å; D359-I406 HydrophobicContact CB-CG2 3.94Å; D359-L409 HydrophobicContact CB-CD1 3.44Å; D359-L409 VanDerWaalsContact CB-CD1 3.44Å
360	A	85	Confident	74.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.5	-45.6	172.5	0	0	0	0	0	111.9	I202 I356 I357 R362 S363 L364 L409 I411	I202-A360 HydrophobicContact CD1-CB 3.99Å; I202-A360 HydrophobicContact CG1-CB 4.29Å; I202-A360 HydrophobicContact CG2-CB 3.88Å; I356-A360 WeakPolarHBondContact O-CB 3.43Å; I356-A360 PolarHBondContact O-N 2.86Å; I357-A360 PolarHBondContact O-N 2.71Å; A360-R362 VanDerWaalsContact C-N 3.34Å; A360-R362 PolarHBondContact O-N 3.2Å; A360-S363 WeakPolarHBondContact O-CB 3.35Å; A360-S363 PolarHBondContact O-N 3.12Å; A360-S363 VanDerWaalsContact O-N 3.11Å; A360-S363 PolarHBondContact O-OG 2.72Å; A360-L364 PolarHBondContact O-N 3.27Å; A360-L409 HydrophobicContact CB-CD2 4.42Å; A360-I411 HydrophobicContact CB-CD1 4.48Å; A360-I411 HydrophobicContact CB-CG1 4.32Å
361	Q	82.5	Confident	72.3	Confident	25 Å²	25	54.2 Å²	54.2	12%	0.117	29%	0.29	C	S	.	.	H	α-helix	trans	-63.8	-39.4	176.3	-71.5	177.7	-1.8	0	0	111.9	V193 I357 R358 S363 L364 M365 L417	V193-Q361 PolarHBondContact O-NE2 2.57Å; I357-Q361 HydrophobicContact CG2-CG 4.42Å; I357-Q361 WeakPolarHBondContact O-CB 3.43Å; I357-Q361 WeakPolarHBondContact O-CG 3.46Å; I357-Q361 PolarHBondContact O-N 3.02Å; R358-Q361 PolarHBondContact O-N 3.5Å; Q361-S363 VanDerWaalsContact C-N 3.3Å; Q361-S363 PolarHBondContact O-N 3.21Å; Q361-L364 WeakPolarHBondContact O-CB 3.49Å; Q361-L364 PolarHBondContact O-N 2.65Å; Q361-M365 PolarHBondContact O-N 2.66Å; Q361-L417 HydrophobicContact CG-CD2 4.13Å
362	R	74.2	Confident	70.6	Confident	26 Å²	26	58.3 Å²	58.3	10%	0.098	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-34.4	171.6	-77.6	177.1	161.6	-172.8	0.8	112.9	R358 D359 A360 L364 M365 L384 Y386 I406	R358-R362 WeakPolarHBondContact O-CB 3.4Å; R358-R362 WeakPolarHBondContact O-CG 3.38Å; R358-R362 PolarHBondContact O-N 3.16Å; D359-R362 PolarHBondContact O-N 3.14Å; A360-R362 VanDerWaalsContact C-N 3.34Å; A360-R362 PolarHBondContact O-N 3.2Å; R362-L364 PolarHBondContact O-N 2.64Å; R362-M365 WeakPolarHBondContact O-CA 3.01Å; R362-M365 WeakPolarHBondContact O-CB 3.34Å; R362-M365 PolarHBondContact O-N 3.35Å; R362-L384 HydrophobicContact CG-CD2 4.03Å; R362-L384 PolarHBondContact NE-O 2.93Å; R362-L384 PolarHBondContact NH2-O 2.05Å; R362-Y386 PolarHBondContact NH1-OH 2.77Å; R362-Y386 PolarHBondContact NH2-OH 3.39Å; R362-I406 HydrophobicContact CB-CD1 3.57Å; R362-I406 HydrophobicContact CG-CD1 4.27Å
363	S	72.4	Confident	68.6	Low	46 Å²	46	60.7 Å²	60.7	32%	0.322	33%	0.332	S	S	.	.	H	α-helix	trans	-63.6	-24.9	176.6	80.8	0	0	0	0	113.1	D359 A360 Q361	D359-S363 PolarHBondContact O-N 3.4Å; A360-S363 WeakPolarHBondContact O-CB 3.35Å; A360-S363 PolarHBondContact O-N 3.12Å; A360-S363 VanDerWaalsContact O-N 3.11Å; A360-S363 PolarHBondContact O-OG 2.72Å; Q361-S363 VanDerWaalsContact C-N 3.3Å; Q361-S363 PolarHBondContact O-N 3.21Å
364	L	68.5	Low	67.2	Low	97 Å²	97	66.2 Å²	66.2	51%	0.508	35%	0.349	S	S	.	.	H	α-helix	trans	-74.1	-29.5	170.5	-64.3	175.9	0	0	0	112.5	A360 Q361 R362 K366 I411	A360-L364 PolarHBondContact O-N 3.27Å; Q361-L364 WeakPolarHBondContact O-CB 3.49Å; Q361-L364 PolarHBondContact O-N 2.65Å; R362-L364 PolarHBondContact O-N 2.64Å; L364-K366 PolarHBondContact O-N 2.69Å; L364-I411 HydrophobicContact CD1-CD1 3.49Å; L364-I411 VanDerWaalsContact CD1-CD1 3.49Å; L364-I411 HydrophobicContact CD2-CD1 3.95Å; L364-I411 HydrophobicContact CG-CD1 3.67Å
365	M	64.5	Low	65.5	Low	77 Å²	77	73.1 Å²	73.1	38%	0.379	38%	0.38	S	S	.	.	S	Bend	trans	-72.9	96.7	176.5	-60.5	-177	177.6	0	0	109	Q361 R362 L367 L383 L384	Q361-M365 PolarHBondContact O-N 2.66Å; R362-M365 WeakPolarHBondContact O-CA 3.01Å; R362-M365 WeakPolarHBondContact O-CB 3.34Å; R362-M365 PolarHBondContact O-N 3.35Å; M365-L367 VanDerWaalsContact C-N 3.31Å; M365-L367 PolarHBondContact O-N 3.28Å; M365-L383 HydrophobicContact CE-CD2 4.23Å; M365-L383 HydrophobicContact SD-CD2 4.25Å; M365-L384 HydrophobicContact SD-CD2 4.37Å
366	K	56.4	Low	63.8	Low	139 Å²	139	74.9 Å²	74.9	60%	0.604	39%	0.39	S	S	*	.			trans	-62.5	91.8	170.4	-71.2	177.7	-179.1	174.9	0	109.4	L364 P368 Q369	L364-K366 PolarHBondContact O-N 2.69Å; K366-P368 WeakPolarHBondContact O-CD 3.19Å; K366-Q369 HydrophobicContact CB-CB 4.39Å; K366-Q369 HydrophobicContact CB-CG 4.35Å; K366-Q369 PolarHBondContact O-N 3.28Å
367	L	50.2	Low	62.1	Low	45 Å²	45	84.3 Å²	84.3	24%	0.236	43%	0.434	C	S	.	.	H	α-helix	trans	-46.1	-35.2	177.9	-151.6	81.5	0	0	0	113.9	M365 Q369 L370 L404	M365-L367 VanDerWaalsContact C-N 3.31Å; M365-L367 PolarHBondContact O-N 3.28Å; L367-Q369 PolarHBondContact O-N 2.72Å; L367-L370 PolarHBondContact O-N 2.6Å; L367-L404 HydrophobicContact CD2-CB 4.14Å; L367-L404 HydrophobicContact CD2-CD1 4.03Å
368	P	49	Very low	60.2	Low	108 Å²	108	88.3 Å²	88.3	70%	0.701	46%	0.455	S	S	*	.	H	α-helix	trans	-68.3	-27.7	176.7	-20.7	33.3	0	0	0	115.1	K366	K366-P368 WeakPolarHBondContact O-CD 3.19Å
369	Q	49.3	Very low	58.7	Low	126 Å²	126	88.2 Å²	88.2	59%	0.589	46%	0.461	S	S	*	.	H	α-helix	trans	-80.2	-28.2	178.9	-72.8	-174.5	-40.1	0	0	112.1	K366 L367 S372	K366-Q369 HydrophobicContact CB-CB 4.39Å; K366-Q369 HydrophobicContact CB-CG 4.35Å; K366-Q369 PolarHBondContact O-N 3.28Å; L367-Q369 PolarHBondContact O-N 2.72Å; Q369-S372 PolarHBondContact O-N 2.73Å; Q369-S372 PolarHBondContact O-OG 2.66Å
370	L	48.3	Very low	57.2	Low	60 Å²	60	92.3 Å²	92.3	31%	0.314	48%	0.475	S	S	.	.	H	α-helix	trans	-72.2	-34.9	-179.7	-142	96	0	0	0	112.6	L367 S372 L376 L383	L367-L370 PolarHBondContact O-N 2.6Å; L370-S372 VanDerWaalsContact C-N 3.3Å; L370-S372 PolarHBondContact O-N 2.77Å; L370-L376 HydrophobicContact CD1-CD1 3.85Å; L370-L376 HydrophobicContact CD2-CD1 3.47Å; L370-L376 VanDerWaalsContact CD2-CD1 3.47Å; L370-L376 HydrophobicContact CG-CD1 3.33Å; L370-L383 HydrophobicContact CD2-CD1 4.15Å; L370-L383 HydrophobicContact CD2-CD2 4.36Å
371	L	51.5	Low	55.5	Low	119 Å²	119	94.5 Å²	94.5	62%	0.623	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-16.6	177.9	-68.4	170.3	0	0	0	113.3
372	S	53.6	Low	54	Low	91 Å²	91	97.2 Å²	97.2	64%	0.636	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-25	174.7	56.5	0	0	0	0	113.4	Q369 L370 N374	Q369-S372 PolarHBondContact O-N 2.73Å; Q369-S372 PolarHBondContact O-OG 2.66Å; L370-S372 VanDerWaalsContact C-N 3.3Å; L370-S372 PolarHBondContact O-N 2.77Å; S372-N374 PolarHBondContact O-N 2.68Å
373	D	44.1	Very low	52.8	Low	108 Å²	108	98 Å²	98	58%	0.578	51%	0.505	S	S	*	.			trans	-95	98	177.9	-105.9	-23	0	0	0	110.3	Q375	D373-Q375 PolarHBondContact O-N 2.91Å
374	N	50.2	Low	51.8	Low	172 Å²	172	96.4 Å²	96.4	92%	0.92	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	24.1	175.6	-121.5	8.2	0	0	0	113.3	S372	S372-N374 PolarHBondContact O-N 2.68Å
375	Q	47.1	Very low	50.9	Low	171 Å²	171	93.5 Å²	93.5	80%	0.799	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	11.1	-173.7	-90.6	-159.2	-15.6	0	0	115.1	D373 E377	D373-Q375 PolarHBondContact O-N 2.91Å; Q375-E377 PolarHBondContact O-N 3.08Å
376	L	49.1	Very low	50	Low	83 Å²	83	92.9 Å²	92.9	44%	0.435	48%	0.479	S	S	.	.			trans	-85.2	107	174.5	-77	162.2	0	0	0	111.2	L370 I378 L383	L370-L376 HydrophobicContact CD1-CD1 3.85Å; L370-L376 HydrophobicContact CD2-CD1 3.47Å; L370-L376 VanDerWaalsContact CD2-CD1 3.47Å; L370-L376 HydrophobicContact CG-CD1 3.33Å; L376-I378 PolarHBondContact O-N 3.5Å; L376-L383 HydrophobicContact CB-CD1 4.47Å; L376-L383 HydrophobicContact CD1-CD1 3.84Å; L376-L383 HydrophobicContact CD2-CD1 3.69Å; L376-L383 HydrophobicContact CG-CD1 4.21Å
377	E	52.3	Low	49.3	Very low	199 Å²	199	89.7 Å²	89.7	93%	0.93	47%	0.473	S	S	*	.			trans	-66.1	-15.1	169.6	-73.4	-174.3	156.3	0	0	112.9	Q375	Q375-E377 PolarHBondContact O-N 3.08Å
378	I	49.9	Very low	48.9	Very low	85 Å²	85	95.2 Å²	95.2	44%	0.436	50%	0.495	S	S	.	.	S	Bend	trans	-97.8	122.3	-179.3	-54.2	172.8	0	0	0	108.4	L376 W380 E382 L383	L376-I378 PolarHBondContact O-N 3.5Å; I378-W380 PolarHBondContact O-N 2.77Å; I378-E382 HydrophobicContact CG2-CB 3.8Å; I378-E382 HydrophobicContact CG2-CG 3.77Å; I378-L383 HydrophobicContact CB-CD1 4.26Å; I378-L383 HydrophobicContact CG2-CB 4.5Å; I378-L383 HydrophobicContact CG2-CD1 4.48Å
379	P	51.6	Low	48.4	Very low	55 Å²	55	98.2 Å²	98.2	36%	0.357	49%	0.492	S	S	.	.			trans	-51.1	138.4	173.8	-23.7	32.2	0	0	0	111.1	E381 E382 L383	P379-E381 WeakPolarHBondContact CB-OE2 3.49Å; P379-E381 PolarHBondContact O-N 2.9Å; P379-E381 VanDerWaalsContact O-N 3.11Å; P379-E382 HydrophobicContact CB-CB 4.4Å; P379-E382 WeakPolarHBondContact O-CA 2.85Å; P379-E382 WeakPolarHBondContact O-CB 3.31Å; P379-E382 PolarHBondContact O-N 2.83Å; P379-L383 PolarHBondContact O-N 3.24Å
380	W	51.4	Low	47.8	Very low	106 Å²	106	95.4 Å²	95.4	40%	0.402	49%	0.487	S	S	.	.	H	α-helix	trans	-58	-29.4	-179.2	69.1	-85.2	0	0	0	111.8	I378 L383 L384	I378-W380 PolarHBondContact O-N 2.77Å; W380-L383 PolarHBondContact O-N 2.81Å; W380-L384 HydrophobicContact CE3-CD1 3.39Å; W380-L384 HydrophobicContact CE3-CG 4.15Å; W380-L384 HydrophobicContact CZ3-CD1 3.54Å; W380-L384 VanDerWaalsContact O-CB 3.23Å; W380-L384 WeakPolarHBondContact O-CB 3.34Å; W380-L384 WeakPolarHBondContact O-CG 3.06Å; W380-L384 PolarHBondContact O-N 2.89Å
381	E	49.9	Very low	47.4	Very low	46 Å²	46	97.9 Å²	97.9	22%	0.215	51%	0.509	C	S	.	.	H	α-helix	trans	-58.2	-48.7	172.5	-61.9	89.2	165.9	0	0	111.2	P379 L384 G385 Y386	P379-E381 WeakPolarHBondContact CB-OE2 3.49Å; P379-E381 PolarHBondContact O-N 2.9Å; P379-E381 VanDerWaalsContact O-N 3.11Å; E381-L384 CarbonylContact O-C 3.49Å; E381-L384 PolarHBondContact O-N 2.92Å; E381-G385 PolarHBondContact O-N 2.79Å; E381-G385 VanDerWaalsContact O-N 3.16Å; E381-Y386 CarbonylContact C-O 3.56Å; E381-Y386 WeakPolarHBondContact O-CA 3.49Å; E381-Y386 WeakPolarHBondContact O-CB 3.07Å; E381-Y386 PolarHBondContact O-N 2.82Å
382	E	50.9	Low	46.8	Very low	83 Å²	83	100.9 Å²	100.9	39%	0.388	52%	0.517	S	S	.	.	H	α-helix	trans	-69.3	-36.1	179.5	-174.7	166.6	-172.2	0	0	111.5	I378 P379 L384 G385 K388	I378-E382 HydrophobicContact CG2-CB 3.8Å; I378-E382 HydrophobicContact CG2-CG 3.77Å; P379-E382 HydrophobicContact CB-CB 4.4Å; P379-E382 WeakPolarHBondContact O-CA 2.85Å; P379-E382 WeakPolarHBondContact O-CB 3.31Å; P379-E382 PolarHBondContact O-N 2.83Å; E382-L384 VanDerWaalsContact C-N 3.26Å; E382-L384 PolarHBondContact O-N 2.97Å; E382-G385 PolarHBondContact O-N 2.89Å; E382-G385 VanDerWaalsContact O-N 3.08Å; E382-K388 WeakPolarHBondContact OE2-CE 3.13Å
383	L	49.5	Very low	45.8	Very low	43 Å²	43	102.3 Å²	102.3	23%	0.225	52%	0.516	C	S	.	.	H	α-helix	trans	-64.7	-31	173	-130.8	148.1	0	0	0	112.8	M365 L370 L376 I378 P379 W380 G385	M365-L383 HydrophobicContact CE-CD2 4.23Å; M365-L383 HydrophobicContact SD-CD2 4.25Å; L370-L383 HydrophobicContact CD2-CD1 4.15Å; L370-L383 HydrophobicContact CD2-CD2 4.36Å; L376-L383 HydrophobicContact CB-CD1 4.47Å; L376-L383 HydrophobicContact CD1-CD1 3.84Å; L376-L383 HydrophobicContact CD2-CD1 3.69Å; L376-L383 HydrophobicContact CG-CD1 4.21Å; I378-L383 HydrophobicContact CB-CD1 4.26Å; I378-L383 HydrophobicContact CG2-CB 4.5Å; I378-L383 HydrophobicContact CG2-CD1 4.48Å; P379-L383 PolarHBondContact O-N 3.24Å; W380-L383 PolarHBondContact O-N 2.81Å; L383-G385 VanDerWaalsContact C-N 3.34Å
384	L	50.8	Low	45	Very low	12 Å²	12	103.5 Å²	103.5	6%	0.063	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	1.4	175	-73.7	-169.4	0	0	0	113	R362 M365 W380 E381 E382 Y386 L404	R362-L384 HydrophobicContact CG-CD2 4.03Å; R362-L384 PolarHBondContact NE-O 2.93Å; R362-L384 PolarHBondContact NH2-O 2.05Å; M365-L384 HydrophobicContact SD-CD2 4.37Å; W380-L384 HydrophobicContact CE3-CD1 3.39Å; W380-L384 HydrophobicContact CE3-CG 4.15Å; W380-L384 HydrophobicContact CZ3-CD1 3.54Å; W380-L384 VanDerWaalsContact O-CB 3.23Å; W380-L384 WeakPolarHBondContact O-CB 3.34Å; W380-L384 WeakPolarHBondContact O-CG 3.06Å; W380-L384 PolarHBondContact O-N 2.89Å; E381-L384 CarbonylContact O-C 3.49Å; E381-L384 PolarHBondContact O-N 2.92Å; E382-L384 VanDerWaalsContact C-N 3.26Å; E382-L384 PolarHBondContact O-N 2.97Å; L384-Y386 HydrophobicContact CB-CD2 3.87Å; L384-Y386 HydrophobicContact CB-CE2 4.08Å; L384-Y386 HydrophobicContact CD1-CD2 4.46Å; L384-Y386 HydrophobicContact CD1-CE2 4.11Å; L384-L404 HydrophobicContact CD1-CD2 4.06Å
385	G	49.3	Very low	44.1	Very low	35 Å²	35	106.7 Å²	106.7	36%	0.361	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	18.5	-178.6	0	0	0	0	0	115.3	E381 E382 L383	E381-G385 PolarHBondContact O-N 2.79Å; E381-G385 VanDerWaalsContact O-N 3.16Å; E382-G385 PolarHBondContact O-N 2.89Å; E382-G385 VanDerWaalsContact O-N 3.08Å; L383-G385 VanDerWaalsContact C-N 3.34Å
386	Y	45.9	Very low	43.7	Very low	64 Å²	64	99.6 Å²	99.6	25%	0.251	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-85.1	136.2	169.1	-65.4	-66.5	0	0	0	110.2	R362 E381 L384 P397	R362-Y386 PolarHBondContact NH1-OH 2.77Å; R362-Y386 PolarHBondContact NH2-OH 3.39Å; E381-Y386 CarbonylContact C-O 3.56Å; E381-Y386 WeakPolarHBondContact O-CA 3.49Å; E381-Y386 WeakPolarHBondContact O-CB 3.07Å; E381-Y386 PolarHBondContact O-N 2.82Å; L384-Y386 HydrophobicContact CB-CD2 3.87Å; L384-Y386 HydrophobicContact CB-CE2 4.08Å; L384-Y386 HydrophobicContact CD1-CD2 4.46Å; L384-Y386 HydrophobicContact CD1-CE2 4.11Å; Y386-P397 HydrophobicContact CE1-CG 3.76Å
387	P	41.6	Very low	43.2	Very low	73 Å²	73	99.2 Å²	99.2	47%	0.474	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-62.4	152.5	175.1	23.4	-31.9	0	0	0	111.5	E21 R389	E21-P387 WeakPolarHBondContact OE2-CB 3.42Å; E21-P387 WeakPolarHBondContact OE2-CD 3.07Å; E21-P387 VanDerWaalsContact OE2-CG 3.32Å; E21-P387 WeakPolarHBondContact OE2-CG 3.2Å; P387-R389 PolarHBondContact O-N 2.9Å
388	K	42.4	Very low	42.5	Very low	160 Å²	160	93.6 Å²	93.6	70%	0.696	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-53.9	131	170.9	-85.8	-179	178.2	170.5	0	109.6	E382 S390	E382-K388 WeakPolarHBondContact OE2-CE 3.13Å; K388-S390 PolarHBondContact O-N 2.69Å
389	R	37.3	Very low	42.2	Very low	172 Å²	172	95.1 Å²	95.1	65%	0.649	48%	0.476	S	S	*	.			trans	-50.8	110.9	178.3	-71.2	-175.1	-177.1	-167.4	1	110.8	P387	P387-R389 PolarHBondContact O-N 2.9Å
390	S	37.8	Very low	42	Very low	67 Å²	67	95.7 Å²	95.7	47%	0.469	48%	0.479	S	S	.	.			trans	-76.2	134.2	158.6	169	0	0	0	0	108.4	K388 F392	K388-S390 PolarHBondContact O-N 2.69Å; S390-F392 PolarHBondContact O-N 3.26Å
391	S	40.1	Very low	41.7	Very low	111 Å²	111	97.3 Å²	97.3	78%	0.776	49%	0.491	S	S	*	.	S	Bend	trans	-71.4	-5.1	-174.9	49.9	0	0	0	0	114.8
392	F	39	Very low	41.5	Very low	183 Å²	183	103 Å²	103	80%	0.803	52%	0.517	S	S	*	.	S	Bend	trans	-112.8	-20.4	-171.5	-84.1	-83.6	0	0	0	116.4	S390	S390-F392 PolarHBondContact O-N 3.26Å
393	I	32.6	Very low	41.4	Very low	120 Å²	120	105.3 Å²	105.3	62%	0.615	53%	0.526	S	S	*	.			trans	-149	100.2	-179.8	-53.3	177.4	0	0	0	108.6
394	W	27.3	Very low	41.3	Very low	134 Å²	134	105.6 Å²	105.6	51%	0.508	53%	0.528	S	S	.	.			trans	-125.9	109.9	172.2	-174.9	84.1	0	0	0	109.1	G396 I399	W394-G396 VanDerWaalsContact CE2-CA 3.46Å; W394-G396 WeakPolarHBondContact CH2-O 3.42Å; W394-I399 HydrophobicContact CH2-CD1 3.4Å; W394-I399 HydrophobicContact CH2-CG1 3.37Å; W394-I399 HydrophobicContact CZ2-CD1 4.07Å; W394-I399 HydrophobicContact CZ2-CG1 4Å; W394-I399 HydrophobicContact CZ3-CD1 3.9Å; W394-I399 HydrophobicContact CZ3-CG1 4.27Å
395	W	30.3	Very low	41.4	Very low	238 Å²	238	110.3 Å²	110.3	90%	0.902	55%	0.553	S	S	*	*			trans	-116.5	48.5	164.8	-48.1	85.2	0	0	0	108.2
396	G	37.8	Very low	42	Very low	23 Å²	23	110.4 Å²	110.4	24%	0.237	55%	0.545	C	S	.	.	P	Polyproline II helix	trans	-66.4	155.3	179.9	0	0	0	0	0	111.5	W394	W394-G396 VanDerWaalsContact CE2-CA 3.46Å; W394-G396 WeakPolarHBondContact CH2-O 3.42Å
397	P	38.6	Very low	43.1	Very low	75 Å²	75	111.2 Å²	111.2	49%	0.487	56%	0.557	S	S	.	*	S	Bend	trans	-61.7	159.8	179.4	26.4	-32.9	0	0	0	111.3	Y386 I399	Y386-P397 HydrophobicContact CE1-CG 3.76Å; P397-I399 PolarHBondContact O-N 2.81Å
398	P	39.5	Very low	44.9	Very low	80 Å²	80	108.4 Å²	108.4	52%	0.519	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-71.3	130.7	-156	-9.8	23.7	0	0	0	112.7	T400 K403	P398-T400 PolarHBondContact O-N 2.86Å; P398-K403 HydrophobicContact CB-CD 3.65Å; P398-K403 HydrophobicContact CG-CD 3.99Å; P398-K403 WeakPolarHBondContact O-CD 3.14Å
399	I	41.8	Very low	47	Very low	117 Å²	117	101.3 Å²	101.3	60%	0.6	51%	0.51	S	S	*	.			trans	-81.3	68.2	-168.2	-24.9	168	0	0	0	112.3	W394 P397	W394-I399 HydrophobicContact CH2-CD1 3.4Å; W394-I399 HydrophobicContact CH2-CG1 3.37Å; W394-I399 HydrophobicContact CZ2-CD1 4.07Å; W394-I399 HydrophobicContact CZ2-CG1 4Å; W394-I399 HydrophobicContact CZ3-CD1 3.9Å; W394-I399 HydrophobicContact CZ3-CG1 4.27Å; P397-I399 PolarHBondContact O-N 2.81Å
400	T	47.9	Very low	49.4	Very low	68 Å²	68	96 Å²	96	42%	0.417	50%	0.497	S	S	.	.			trans	-123.2	140.4	161.3	63.7	0	0	0	0	110.8	P398 E402 K403 L404	P398-T400 PolarHBondContact O-N 2.86Å; T400-E402 PolarHBondContact O-N 2.85Å; T400-K403 WeakPolarHBondContact O-CB 3.29Å; T400-K403 PolarHBondContact O-N 2.84Å; T400-K403 WeakPolarHBondContact OG1-CG 3.39Å; T400-L404 PolarHBondContact O-N 2.8Å
401	Q	45.2	Very low	51.7	Low	139 Å²	139	94 Å²	94	65%	0.65	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-26	177.7	-156.2	166.4	-7.1	0	0	111.8	L404	Q401-L404 PolarHBondContact O-N 3.11Å
402	E	46.3	Very low	54.1	Low	166 Å²	166	90 Å²	90	78%	0.776	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-32.2	169.9	-75.8	-179.3	153.9	0	0	113.8	T400 L404 N405	T400-E402 PolarHBondContact O-N 2.85Å; E402-L404 VanDerWaalsContact C-N 3.3Å; E402-L404 PolarHBondContact O-N 3.35Å; E402-N405 PolarHBondContact O-N 3.44Å
403	K	47.7	Very low	56.3	Low	131 Å²	131	83.8 Å²	83.8	57%	0.57	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-13.7	176.8	-76.2	176.2	178.2	-176.6	0	113.5	P398 T400	P398-K403 HydrophobicContact CB-CD 3.65Å; P398-K403 HydrophobicContact CG-CD 3.99Å; P398-K403 WeakPolarHBondContact O-CD 3.14Å; T400-K403 WeakPolarHBondContact O-CB 3.29Å; T400-K403 PolarHBondContact O-N 2.84Å; T400-K403 WeakPolarHBondContact OG1-CG 3.39Å
404	L	48.8	Very low	58.7	Low	50 Å²	50	81 Å²	81	26%	0.262	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-14.8	173	-70.3	169.9	0	0	0	113	L367 L384 T400 Q401 E402 I406	L367-L404 HydrophobicContact CD2-CB 4.14Å; L367-L404 HydrophobicContact CD2-CD1 4.03Å; L384-L404 HydrophobicContact CD1-CD2 4.06Å; T400-L404 PolarHBondContact O-N 2.8Å; Q401-L404 PolarHBondContact O-N 3.11Å; E402-L404 VanDerWaalsContact C-N 3.3Å; E402-L404 PolarHBondContact O-N 3.35Å; L404-I406 VanDerWaalsContact C-N 3.27Å; L404-I406 PolarHBondContact O-N 3.08Å
405	N	53	Low	60.9	Low	111 Å²	111	76 Å²	76	59%	0.594	42%	0.422	S	S	*	.			trans	-73.1	86.3	170.8	-81.7	-11.6	0	0	0	109.2	E402 T407	E402-N405 PolarHBondContact O-N 3.44Å; N405-T407 HydrophobicContact CB-CG2 4.47Å; N405-T407 PolarHBondContact O-N 3.07Å
406	I	60.7	Low	63.2	Low	37 Å²	37	70.6 Å²	70.6	19%	0.19	41%	0.41	C	S	.	.			trans	-65.1	102.6	169.9	-63.6	169.4	0	0	0	107.2	D359 R362 L404 L409	D359-I406 HydrophobicContact CB-CD1 3.91Å; D359-I406 HydrophobicContact CB-CG2 3.94Å; R362-I406 HydrophobicContact CB-CD1 3.57Å; R362-I406 HydrophobicContact CG-CD1 4.27Å; L404-I406 VanDerWaalsContact C-N 3.27Å; L404-I406 PolarHBondContact O-N 3.08Å; I406-L409 HydrophobicContact CG2-CB 4.35Å; I406-L409 HydrophobicContact CG2-CD1 3.47Å; I406-L409 VanDerWaalsContact CG2-CD1 3.47Å; I406-L409 HydrophobicContact CG2-CG 4.44Å
407	T	69.8	Low	65.3	Low	81 Å²	81	70.1 Å²	70.1	50%	0.497	40%	0.401	S	S	.	.			trans	-98.5	151.1	-179.9	50.8	0	0	0	0	110.9	L208 R211 N405 L409	L208-T407 VanDerWaalsContact CD1-C 3.41Å; L208-T407 VanDerWaalsContact CD1-O 3.27Å; L208-T407 WeakPolarHBondContact CD1-O 3.3Å; R211-T407 PolarHBondContact NH1-O 3.34Å; R211-T407 PolarHBondContact NH2-O 3.25Å; N405-T407 HydrophobicContact CB-CG2 4.47Å; N405-T407 PolarHBondContact O-N 3.07Å; T407-L409 PolarHBondContact O-N 2.78Å
408	G	79.3	Confident	67.4	Low	14 Å²	14	67.7 Å²	67.7	14%	0.144	39%	0.39	C	S	.	.	S	Bend	trans	76.2	13.8	174.7	0	0	0	0	0	116.1	L204 R205 L208	L204-G408 CarbonylContact C-O 3.53Å; L204-G408 WeakPolarHBondContact CA-O 3.45Å; R205-G408 PolarHBondContact N-O 2.67Å; L208-G408 VanDerWaalsContact CD1-CA 3.43Å
409	L	85.9	Confident	69.6	Low	11 Å²	11	68.1 Å²	68.1	6%	0.058	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	131.1	167.5	-84.5	155.2	0	0	0	108.9	I202 D203 L204 I356 D359 A360 I406 T407	I202-L409 HydrophobicContact CG2-CD2 3.69Å; D203-L409 WeakPolarHBondContact O-CA 2.99Å; L204-L409 HydrophobicContact CB-CD2 4.09Å; L204-L409 HydrophobicContact CD1-CD1 4.29Å; L204-L409 HydrophobicContact CD1-CD2 3.8Å; L204-L409 HydrophobicContact CD1-CG 3.73Å; I356-L409 HydrophobicContact CG2-CD2 4.27Å; D359-L409 HydrophobicContact CB-CD1 3.44Å; D359-L409 VanDerWaalsContact CB-CD1 3.44Å; A360-L409 HydrophobicContact CB-CD2 4.42Å; I406-L409 HydrophobicContact CG2-CB 4.35Å; I406-L409 HydrophobicContact CG2-CD1 3.47Å; I406-L409 VanDerWaalsContact CG2-CD1 3.47Å; I406-L409 HydrophobicContact CG2-CG 4.44Å; T407-L409 PolarHBondContact O-N 2.78Å
410	T	87.2	Confident	71.8	Confident	60 Å²	60	70.2 Å²	70.2	37%	0.368	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	135.1	176.1	51.2	0	0	0	0	110.3	D203	D203-T410 PolarHBondContact N-O 3.42Å; D203-T410 PolarHBondContact O-N 3.37Å
411	I	87.9	Confident	73.7	Confident	24 Å²	24	68.6 Å²	68.6	12%	0.123	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	111	168.8	-60.2	164.7	0	0	0	106.7	I202 A360 L364 L417	I202-I411 HydrophobicContact CG1-CG1 4.42Å; A360-I411 HydrophobicContact CB-CD1 4.48Å; A360-I411 HydrophobicContact CB-CG1 4.32Å; L364-I411 HydrophobicContact CD1-CD1 3.49Å; L364-I411 VanDerWaalsContact CD1-CD1 3.49Å; L364-I411 HydrophobicContact CD2-CD1 3.95Å; L364-I411 HydrophobicContact CG-CD1 3.67Å; I411-L417 HydrophobicContact CD1-CB 4.12Å; I411-L417 HydrophobicContact CD1-CD2 4.48Å
412	S	88.7	Confident	75.6	Confident	28 Å²	28	65.2 Å²	65.2	20%	0.196	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	170	-176.7	-67.7	0	0	0	0	110.4	S200 W201 D203	S200-S412 WeakPolarHBondContact CA-O 3.35Å; W201-S412 PolarHBondContact N-O 2.96Å; W201-S412 PolarHBondContact O-N 3.48Å; D203-S412 WeakPolarHBondContact OD2-CB 3.31Å; D203-S412 PolarHBondContact OD2-OG 2.65Å
413	G	86.3	Confident	77.2	Confident	52 Å²	52	61.5 Å²	61.5	54%	0.536	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-122.4	-176	0	0	0	0	0	112.5	T199 G415	T199-G413 WeakPolarHBondContact O-CA 3.05Å; G413-G415 PolarHBondContact O-N 2.64Å
414	S	81.8	Confident	78.5	Confident	62 Å²	62	57.2 Å²	57.2	43%	0.434	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-17.6	177	81.2	0	0	0	0	113.4	S200 I416	S200-S414 PolarHBondContact OG-OG 2.78Å; S414-I416 PolarHBondContact O-N 2.96Å; S414-I416 PolarHBondContact OG-N 3.01Å; S414-I416 PolarHBondContact OG-O 3.41Å
415	G	75.5	Confident	79.6	Confident	30 Å²	30	59.8 Å²	59.8	31%	0.309	38%	0.375	S	S	.	.	S	Bend	trans	74.9	1.7	-175	0	0	0	0	0	114	G413	G413-G415 PolarHBondContact O-N 2.64Å
416	I	78.4	Confident	80.4	Confident	124 Å²	124	57.2 Å²	57.2	64%	0.636	36%	0.361	S	S	*	.			trans	-110.3	129.5	179.8	-56.7	173.8	0	0	0	108.6	S200 S414	S200-I416 WeakPolarHBondContact CB-O 3.12Å; S200-I416 PolarHBondContact OG-O 3.12Å; S414-I416 PolarHBondContact O-N 2.96Å; S414-I416 PolarHBondContact OG-N 3.01Å; S414-I416 PolarHBondContact OG-O 3.41Å
417	L	81.2	Confident	81.1	Confident	12 Å²	12	58.1 Å²	58.1	6%	0.063	37%	0.366	C	S	.	.			trans	-116	121.6	173.3	-162.5	74.9	0	0	0	107.8	A194 M196 I202 Q361 I411 T419	A194-L417 HydrophobicContact CB-CD1 3.97Å; A194-L417 HydrophobicContact CB-CD2 3.66Å; A194-L417 HydrophobicContact CB-CG 3.86Å; M196-L417 HydrophobicContact CE-CD1 3.84Å; M196-L417 HydrophobicContact SD-CD1 3.57Å; M196-L417 VanDerWaalsContact SD-CD1 3.57Å; I202-L417 HydrophobicContact CD1-CD1 4.42Å; I202-L417 HydrophobicContact CD1-CD2 4.05Å; I202-L417 HydrophobicContact CG1-CD1 4.43Å; Q361-L417 HydrophobicContact CG-CD2 4.13Å; I411-L417 HydrophobicContact CD1-CB 4.12Å; I411-L417 HydrophobicContact CD1-CD2 4.48Å; L417-T419 PolarHBondContact O-N 3.08Å
418	G	83.1	Confident	81.5	Confident	25 Å²	25	57.9 Å²	57.9	26%	0.258	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-66.9	132.2	175	0	0	0	0	0	109.9	A194 Y195	A194-G418 CarbonylContact C-O 3.56Å; A194-G418 WeakPolarHBondContact CA-O 3.27Å; Y195-G418 PolarHBondContact N-O 3.48Å; Y195-G418 PolarHBondContact O-N 3.12Å
419	T	86.2	Confident	81.8	Confident	89 Å²	89	60 Å²	60	55%	0.546	37%	0.372	S	S	.	.	S	Bend	trans	-94.2	-3.6	-179.8	56.7	0	0	0	0	113	L417	L417-T419 PolarHBondContact O-N 3.08Å
420	E	86.1	Confident	81.9	Confident	160 Å²	160	59.9 Å²	59.9	75%	0.748	37%	0.371	S	S	*	.	S	Bend	trans	-127.4	138.8	179.2	-66.3	-177.2	-179.6	0	0	109.3
421	C	87.8	Confident	82.1	Confident	35 Å²	35	57.2 Å²	57.2	24%	0.236	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-87.4	132	174.6	-171.8	0	0	0	0	109.8	V193 W284 C345	V193-C421 HydrophobicContact CG1-CB 4.06Å; W284-C421 HydrophobicContact CZ2-CB 4.12Å; C345-C421 HydrophobicContact CB-CB 3.8Å; C345-C421 WeakPolarHBondContact CB-SG 2.98Å; C345-C421 WeakPolarHBondContact SG-CA 3.4Å; C345-C421 WeakPolarHBondContact SG-CB 3.22Å; C345-C421 CovalentContact SG-SG 2.03Å; C345-C421 PolarHBondContact SG-SG 3.23Å
422	P	85.5	Confident	82.1	Confident	68 Å²	68	56.1 Å²	56.1	44%	0.442	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-54.6	146.1	174.1	-26.1	35	0	0	0	112.7	Y195	Y195-P422 HydrophobicContact CD2-CG 4.11Å; Y195-P422 HydrophobicContact CE2-CG 3.89Å
423	S	80.3	Confident	82.1	Confident	88 Å²	88	54.8 Å²	54.8	62%	0.615	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-65.3	144.7	176.3	45.2	0	0	0	0	111.8	V425	S423-V425 PolarHBondContact O-N 3.04Å
424	T	75.8	Confident	81.8	Confident	40 Å²	40	54.2 Å²	54.2	25%	0.245	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-56.2	123.7	167.6	39.8	0	0	0	0	109.4	R225	R225-T424 VanDerWaalsContact NH1-CG2 3.31Å; R225-T424 VanDerWaalsContact NH2-N 3.16Å
425	V	71.2	Confident	81.5	Confident	104 Å²	104	54.2 Å²	54.2	63%	0.63	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-101.7	120.4	167.4	-178	0	0	0	0	107.5	S423 D427	S423-V425 PolarHBondContact O-N 3.04Å; V425-D427 PolarHBondContact O-N 3.19Å
426	I	69.9	Low	81.6	Confident	58 Å²	58	56.3 Å²	56.3	30%	0.297	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-63.7	127.6	176.4	-51	158.9	0	0	0	108.5	I129 N428	I129-I426 HydrophobicContact CD1-CD1 3.17Å; I129-I426 HydrophobicContact CD1-CG1 3.52Å; I426-N428 WeakPolarHBondContact CG2-OD1 3.33Å; I426-N428 PolarHBondContact O-N 3.25Å
427	D	76.2	Confident	81.5	Confident	55 Å²	55	53.2 Å²	53.2	29%	0.294	31%	0.308	S	S	.	.			trans	-88	91.5	167.9	-171.9	-9.5	0	0	0	109.4	V425 T429 V430	V425-D427 PolarHBondContact O-N 3.19Å; D427-T429 PolarHBondContact O-N 3.26Å; D427-T429 VanDerWaalsContact OD1-CB 3.28Å; D427-T429 WeakPolarHBondContact OD1-CB 3.01Å; D427-T429 WeakPolarHBondContact OD1-CG2 3.36Å; D427-T429 PolarHBondContact OD1-N 3.02Å; D427-T429 PolarHBondContact OD1-OG1 3.47Å; D427-T429 PolarHBondContact OD2-OG1 2.92Å; D427-V430 HydrophobicContact CB-CG2 3.78Å; D427-V430 PolarHBondContact O-N 3.22Å; D427-V430 WeakPolarHBondContact OD2-CG2 3.27Å
428	N	77.3	Confident	81.1	Confident	77 Å²	77	57 Å²	57	41%	0.412	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-4	177.1	-72.1	-9.4	0	0	0	113.8	I426 N604	I426-N428 WeakPolarHBondContact CG2-OD1 3.33Å; I426-N428 PolarHBondContact O-N 3.25Å; N428-N604 PolarHBondContact O-OD1 3.43Å
429	T	85.7	Confident	80.2	Confident	58 Å²	58	62 Å²	62	36%	0.356	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-16.9	173.1	77	0	0	0	0	112.5	D427 R579	D427-T429 PolarHBondContact O-N 3.26Å; D427-T429 VanDerWaalsContact OD1-CB 3.28Å; D427-T429 WeakPolarHBondContact OD1-CB 3.01Å; D427-T429 WeakPolarHBondContact OD1-CG2 3.36Å; D427-T429 PolarHBondContact OD1-N 3.02Å; D427-T429 PolarHBondContact OD1-OG1 3.47Å; D427-T429 PolarHBondContact OD2-OG1 2.92Å; T429-R579 VanDerWaalsContact O-CA 3.3Å; T429-R579 WeakPolarHBondContact O-CA 3.42Å
430	V	88.6	Confident	79.2	Confident	9 Å²	9	60.2 Å²	60.2	6%	0.055	32%	0.324	C	S	.	.			trans	-81.9	121.8	-177.9	-177.5	0	0	0	0	110.6	D427 W525 L578 R579 N604 G605 S606 C607	D427-V430 HydrophobicContact CB-CG2 3.78Å; D427-V430 PolarHBondContact O-N 3.22Å; D427-V430 WeakPolarHBondContact OD2-CG2 3.27Å; V430-W525 HydrophobicContact CG1-CH2 4.24Å; V430-W525 HydrophobicContact CG1-CZ2 4.43Å; V430-L578 WeakPolarHBondContact CA-O 3.43Å; V430-R579 HydrophobicContact CB-CB 4.44Å; V430-R579 HydrophobicContact CG2-CB 3.85Å; V430-N604 PolarHBondContact O-OD1 3.28Å; V430-G605 PolarHBondContact O-N 3.26Å; V430-S606 VanDerWaalsContact CG1-C 3.41Å; V430-S606 WeakPolarHBondContact CG1-O 2.83Å; V430-C607 HydrophobicContact CG1-CB 3.98Å
431	L	89.8	Confident	78.4	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.021	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124.6	175.3	-57.9	-179.1	0	0	0	109.7	F433 L443 C577 L578 I581 W590 I602 N604	L431-F433 HydrophobicContact CB-CE2 3.89Å; L431-F433 HydrophobicContact CB-CZ 4.21Å; L431-F433 WeakPolarHBondContact O-CE2 3.46Å; L431-L443 HydrophobicContact CD1-CD1 3.72Å; L431-C577 CarbonylContact O-C 3.57Å; L431-C577 VanDerWaalsContact O-CA 3.26Å; L431-C577 WeakPolarHBondContact O-CA 3.42Å; L431-L578 PolarHBondContact N-O 2.88Å; L431-L578 PolarHBondContact O-N 3.48Å; L431-I581 HydrophobicContact CD1-CD1 4.01Å; L431-W590 HydrophobicContact CD1-CE3 4.15Å; L431-W590 HydrophobicContact CD2-CB 4.28Å; L431-W590 HydrophobicContact CD2-CD2 3.87Å; L431-W590 HydrophobicContact CD2-CE3 3.39Å; L431-W590 HydrophobicContact CD2-CG 4.28Å; L431-W590 HydrophobicContact CD2-CZ3 4Å; L431-W590 HydrophobicContact CG-CE3 4.44Å; L431-I602 HydrophobicContact CB-CG2 4.2Å; L431-I602 HydrophobicContact CD2-CG2 4.44Å; L431-N604 HydrophobicContact CD2-CB 4.2Å; L431-N604 WeakPolarHBondContact CD2-OD1 3.46Å
432	T	88.1	Confident	77.8	Confident	1 Å²	1	52 Å²	52	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	132.8	170.3	-65	0	0	0	0	110.5	P434 I602 I603 S606 C607 M608	T432-P434 HydrophobicContact CG2-CB 4.34Å; T432-P434 WeakPolarHBondContact O-CD 3.11Å; T432-I602 WeakPolarHBondContact O-CA 3.44Å; T432-I602 WeakPolarHBondContact O-CG2 3.18Å; T432-I603 PolarHBondContact N-O 2.89Å; T432-I603 PolarHBondContact O-N 2.79Å; T432-S606 PolarHBondContact OG1-O 2.94Å; T432-C607 VanDerWaalsContact OG1-CA 3.3Å; T432-C607 WeakPolarHBondContact OG1-CA 3.43Å; T432-M608 HydrophobicContact CG2-CB 4.3Å; T432-M608 PolarHBondContact OG1-N 2.94Å
433	F	89.2	Confident	77.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	93.6	172.3	-58.7	-95	0	0	0	107	L431 F442 L443 I564 F574 Q575 G576 L578 I602	L431-F433 HydrophobicContact CB-CE2 3.89Å; L431-F433 HydrophobicContact CB-CZ 4.21Å; L431-F433 WeakPolarHBondContact O-CE2 3.46Å; F433-F442 HydrophobicContact CB-CD2 4.27Å; F433-F442 HydrophobicContact CB-CE2 4.25Å; F433-F442 HydrophobicContact CD1-CB 3.47Å; F433-F442 VanDerWaalsContact CD1-CB 3.47Å; F433-F442 HydrophobicContact CD1-CD1 4.32Å; F433-F442 AromaticContact CD1-CD2 3.5Å; F433-F442 HydrophobicContact CD1-CD2 3.5Å; F433-F442 VanDerWaalsContact CD1-CD2 3.5Å; F433-F442 HydrophobicContact CD1-CE2 4.29Å; F433-F442 AromaticContact CD1-CG 3.54Å; F433-F442 HydrophobicContact CD1-CG 3.54Å; F433-F442 HydrophobicContact CE1-CB 3.5Å; F433-F442 VanDerWaalsContact CE1-CB 3.5Å; F433-F442 HydrophobicContact CE1-CD2 4.32Å; F433-F442 HydrophobicContact CE1-CG 4.12Å; F433-F442 HydrophobicContact CG-CD2 4.31Å; F433-L443 HydrophobicContact CE1-CD1 4.01Å; F433-L443 HydrophobicContact CE1-CG 4.23Å; F433-L443 HydrophobicContact CZ-CD1 3.78Å; F433-L443 HydrophobicContact CZ-CG 4.5Å; F433-I564 HydrophobicContact CZ-CG2 4.23Å; F433-F574 HydrophobicContact CD2-CD1 4.29Å; F433-F574 HydrophobicContact CD2-CE1 4.39Å; F433-F574 HydrophobicContact CG-CD1 4.49Å; F433-Q575 WeakPolarHBondContact O-CA 3.4Å; F433-Q575 WeakPolarHBondContact O-CG 3.33Å; F433-G576 PolarHBondContact N-O 3.13Å; F433-G576 PolarHBondContact O-N 2.81Å; F433-G576 VanDerWaalsContact O-N 3.12Å; F433-L578 HydrophobicContact CD2-CD1 4.39Å; F433-L578 HydrophobicContact CD2-CG 4.19Å; F433-L578 HydrophobicContact CE2-CB 3.84Å; F433-L578 HydrophobicContact CE2-CD1 3.56Å; F433-L578 HydrophobicContact CE2-CG 3.58Å; F433-L578 HydrophobicContact CZ-CD1 3.78Å; F433-L578 HydrophobicContact CZ-CG 4.31Å; F433-I602 HydrophobicContact CD1-CD1 4.4Å; F433-I602 HydrophobicContact CD1-CG1 4.21Å; F433-I602 HydrophobicContact CE1-CD1 4.02Å; F433-I602 HydrophobicContact CE1-CG1 4.29Å
434	P	79.2	Confident	78.1	Confident	39 Å²	39	48 Å²	48	25%	0.253	25%	0.248	S	C	.	.			trans	-85.5	-15.6	-167.4	33.2	-36.6	0	0	0	114	T432 Q575 S601 I603	T432-P434 HydrophobicContact CG2-CB 4.34Å; T432-P434 WeakPolarHBondContact O-CD 3.11Å; P434-Q575 PolarHBondContact O-NE2 2.64Å; P434-S601 WeakPolarHBondContact CD-O 3.09Å; P434-S601 WeakPolarHBondContact CG-O 3.33Å; P434-I603 HydrophobicContact CG-CD1 4.49Å
435	D	77.2	Confident	78.6	Confident	62 Å²	62	46.3 Å²	46.3	33%	0.332	24%	0.238	S	C	.	.			trans	-110.2	151.1	-174.4	-59.1	-46	0	0	0	111.8	Q437 F442 S573 S601	D435-Q437 HydrophobicContact CB-CG 4.13Å; D435-F442 HydrophobicContact CB-CZ 4.2Å; D435-F442 WeakPolarHBondContact O-CE2 3.27Å; D435-F442 WeakPolarHBondContact O-CZ 3.43Å; D435-S573 PolarHBondContact O-OG 2.97Å; D435-S601 WeakPolarHBondContact OD2-CB 3.09Å; D435-S601 PolarHBondContact OD2-OG 3.24Å
436	I	77.8	Confident	79.2	Confident	74 Å²	74	47 Å²	47	38%	0.379	23%	0.234	S	C	.	.			trans	-103.8	120.4	163.4	-61.5	173.5	0	0	0	107.3	Y572 Q575	I436-Y572 HydrophobicContact CG2-CD1 3.87Å; I436-Q575 HydrophobicContact CD1-CB 4.33Å; I436-Q575 HydrophobicContact CG1-CB 3.68Å; I436-Q575 HydrophobicContact CG1-CG 4.27Å
437	Q	75.8	Confident	79.7	Confident	60 Å²	60	47.2 Å²	47.2	28%	0.28	23%	0.231	S	C	.	.			trans	-135.4	136.1	179.5	-64.7	-170.9	-44.9	0	0	110.6	D435 I440 S573 H599	D435-Q437 HydrophobicContact CB-CG 4.13Å; Q437-I440 HydrophobicContact CB-CB 3.87Å; Q437-I440 HydrophobicContact CB-CD1 3.85Å; Q437-I440 HydrophobicContact CB-CG1 4.15Å; Q437-I440 VanDerWaalsContact CD-CD1 3.47Å; Q437-I440 HydrophobicContact CG-CD1 4.23Å; Q437-S573 PolarHBondContact N-OG 2.92Å; Q437-S573 PolarHBondContact O-N 2.79Å; Q437-S573 PolarHBondContact O-OG 3.05Å; Q437-H599 PolarHBondContact OE1-CE1 2.86Å; Q437-H599 PolarHBondContact OE1-NE2 2.92Å
438	Q	73.3	Confident	79.4	Confident	92 Å²	92	52.1 Å²	52.1	43%	0.43	26%	0.257	S	S	.	.	B	Isolated β-bridge	trans	-75.5	144.6	168.9	-69.4	-175.2	-19.8	0	0	109.8	I440 Y572	Q438-I440 PolarHBondContact O-N 2.96Å; Q438-I440 VanDerWaalsContact O-N 3.11Å; Q438-Y572 HydrophobicContact CG-CD1 3.63Å; Q438-Y572 HydrophobicContact CG-CE1 3.28Å; Q438-Y572 HydrophobicContact CG-CG 4.48Å; Q438-Y572 PolarHBondContact NE2-OH 2.84Å
439	Y	63.7	Low	78.2	Confident	130 Å²	130	50.2 Å²	50.2	51%	0.51	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	7.5	173.9	-45	-77.3	0	0	0	115.8	Q570	Y439-Q570 HydrophobicContact CE1-CB 4.47Å; Y439-Q570 HydrophobicContact CE1-CG 3.93Å
440	I	65.7	Low	77.1	Confident	50 Å²	50	48.9 Å²	48.9	26%	0.256	25%	0.254	S	S	.	.			trans	-105.5	135.7	-178.5	-68.7	-179.1	0	0	0	109.6	Q437 Q438	Q437-I440 HydrophobicContact CB-CB 3.87Å; Q437-I440 HydrophobicContact CB-CD1 3.85Å; Q437-I440 HydrophobicContact CB-CG1 4.15Å; Q437-I440 VanDerWaalsContact CD-CD1 3.47Å; Q437-I440 HydrophobicContact CG-CD1 4.23Å; Q438-I440 PolarHBondContact O-N 2.96Å; Q438-I440 VanDerWaalsContact O-N 3.11Å
441	V	67.4	Low	76.6	Confident	22 Å²	22	50.9 Å²	50.9	13%	0.133	27%	0.266	C	S	.	.			trans	-106.7	128.2	167.5	179.5	0	0	0	0	107.5	L443 Y563 R568	V441-L443 WeakPolarHBondContact CG1-O 3.39Å; V441-Y563 HydrophobicContact CB-CD1 4.15Å; V441-Y563 HydrophobicContact CG1-CD1 3.54Å; V441-Y563 HydrophobicContact CG1-CE1 4.5Å; V441-Y563 HydrophobicContact CG1-CG 3.93Å; V441-Y563 HydrophobicContact CG2-CD1 4.04Å; V441-Y563 HydrophobicContact CG2-CG 4.2Å; V441-R568 HydrophobicContact CG2-CG 3.98Å
442	F	77.1	Confident	76.4	Confident	1 Å²	1	55.3 Å²	55.3	0%	0.004	29%	0.29	C	S	.	.	S	Bend	trans	-75.5	-44	-178.3	-76.5	-61.4	0	0	0	112.5	F433 D435 G565 S573 F574 H599 I602	F433-F442 HydrophobicContact CB-CD2 4.27Å; F433-F442 HydrophobicContact CB-CE2 4.25Å; F433-F442 HydrophobicContact CD1-CB 3.47Å; F433-F442 VanDerWaalsContact CD1-CB 3.47Å; F433-F442 HydrophobicContact CD1-CD1 4.32Å; F433-F442 AromaticContact CD1-CD2 3.5Å; F433-F442 HydrophobicContact CD1-CD2 3.5Å; F433-F442 VanDerWaalsContact CD1-CD2 3.5Å; F433-F442 HydrophobicContact CD1-CE2 4.29Å; F433-F442 AromaticContact CD1-CG 3.54Å; F433-F442 HydrophobicContact CD1-CG 3.54Å; F433-F442 HydrophobicContact CE1-CB 3.5Å; F433-F442 VanDerWaalsContact CE1-CB 3.5Å; F433-F442 HydrophobicContact CE1-CD2 4.32Å; F433-F442 HydrophobicContact CE1-CG 4.12Å; F433-F442 HydrophobicContact CG-CD2 4.31Å; D435-F442 HydrophobicContact CB-CZ 4.2Å; D435-F442 WeakPolarHBondContact O-CE2 3.27Å; D435-F442 WeakPolarHBondContact O-CZ 3.43Å; F442-G565 WeakPolarHBondContact CD2-O 3.47Å; F442-S573 VanDerWaalsContact CE2-OG 3.3Å; F442-S573 WeakPolarHBondContact CE2-OG 3.26Å; F442-F574 WeakPolarHBondContact CE2-O 3.28Å; F442-H599 HydrophobicContact CD1-CB 3.67Å; F442-H599 AromaticContact CD1-CG 3.88Å; F442-H599 AromaticContact CD1-ND1 3.87Å; F442-H599 HydrophobicContact CE1-CB 4.4Å; F442-H599 AromaticContact CE1-ND1 3.72Å; F442-H599 PolarHBondContact O-N 2.65Å; F442-I602 HydrophobicContact CB-CD1 3.84Å; F442-I602 HydrophobicContact CB-CG1 4.24Å; F442-I602 HydrophobicContact CD1-CG1 4.11Å; F442-I602 HydrophobicContact CG-CG1 4.48Å; F442-I602 WeakPolarHBondContact O-CD1 3.41Å
443	L	84.8	Confident	76.5	Confident	1 Å²	1	59 Å²	59	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	125.6	179.2	-64.4	169.1	0	0	0	111.4	L431 F433 V441 Y563 I564 W590 L593 R598 I602	L431-L443 HydrophobicContact CD1-CD1 3.72Å; F433-L443 HydrophobicContact CE1-CD1 4.01Å; F433-L443 HydrophobicContact CE1-CG 4.23Å; F433-L443 HydrophobicContact CZ-CD1 3.78Å; F433-L443 HydrophobicContact CZ-CG 4.5Å; V441-L443 WeakPolarHBondContact CG1-O 3.39Å; L443-Y563 WeakPolarHBondContact O-CA 3.37Å; L443-I564 HydrophobicContact CB-CB 4.12Å; L443-I564 HydrophobicContact CD1-CB 4.42Å; L443-I564 HydrophobicContact CD1-CG2 4.43Å; L443-I564 PolarHBondContact N-O 3.3Å; L443-I564 VanDerWaalsContact N-O 3.13Å; L443-I564 PolarHBondContact O-N 2.78Å; L443-W590 HydrophobicContact CD2-CZ3 4.33Å; L443-L593 HydrophobicContact CD2-CD1 4.19Å; L443-R598 HydrophobicContact CD2-CB 3.94Å; L443-R598 HydrophobicContact CD2-CG 3.82Å; L443-I602 HydrophobicContact CD1-CD1 4.35Å; L443-I602 HydrophobicContact CD2-CD1 3.47Å; L443-I602 VanDerWaalsContact CD2-CD1 3.47Å; L443-I602 HydrophobicContact CG-CD1 3.61Å
444	K	87	Confident	76.7	Confident	71 Å²	71	59.1 Å²	59.1	31%	0.309	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	116.7	168.6	-177.6	-168.8	171	-147.7	0	109.3	E446 V561 Y563 T597	K444-E446 IonicContact NZ-OE2 3.33Å; K444-E446 PolarHBondContact NZ-OE2 2.9Å; K444-V561 HydrophobicContact CD-CG1 4.19Å; K444-V561 HydrophobicContact CG-CG1 3.7Å; K444-Y563 HydrophobicContact CB-CD1 4.17Å; K444-Y563 HydrophobicContact CB-CE1 4.15Å; K444-Y563 HydrophobicContact CD-CE1 4.36Å; K444-Y563 HydrophobicContact CG-CD1 4.13Å; K444-Y563 HydrophobicContact CG-CE1 3.78Å; K444-T597 PolarHBondContact N-O 3.37Å; K444-T597 WeakPolarHBondContact O-CB 3.33Å
445	I	85.8	Confident	77.4	Confident	5 Å²	5	61 Å²	61	3%	0.026	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	116.8	177.1	-53.2	-59.6	0	0	0	109.1	R447 V561 S562 I564 I583 V588 L593	I445-R447 HydrophobicContact CG2-CG 3.99Å; I445-V561 WeakPolarHBondContact O-CA 3.45Å; I445-S562 PolarHBondContact N-O 3.32Å; I445-S562 PolarHBondContact O-N 3.23Å; I445-I564 HydrophobicContact CD1-CD1 4.3Å; I445-I564 HydrophobicContact CG1-CD1 3.64Å; I445-I564 HydrophobicContact CG1-CG1 4.45Å; I445-I583 HydrophobicContact CB-CD1 3.96Å; I445-I583 HydrophobicContact CG1-CD1 3.94Å; I445-I583 HydrophobicContact CG2-CD1 3.95Å; I445-V588 HydrophobicContact CD1-CG1 3.8Å; I445-V588 HydrophobicContact CD1-CG2 4.23Å; I445-V588 HydrophobicContact CG1-CG2 4.43Å; I445-L593 HydrophobicContact CD1-CD2 3.57Å
446	E	83.9	Confident	78.3	Confident	117 Å²	117	58.3 Å²	58.3	55%	0.547	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	121.4	176.1	-167.4	166.4	161.4	0	0	109.7	K444 K560 V561	K444-E446 IonicContact NZ-OE2 3.33Å; K444-E446 PolarHBondContact NZ-OE2 2.9Å; E446-K560 WeakPolarHBondContact CA-O 3.43Å; E446-K560 HydrophobicContact CG-CB 4.2Å; E446-V561 HydrophobicContact CB-CG2 4.48Å; E446-V561 HydrophobicContact CG-CG2 4.1Å
447	R	79.5	Confident	79.2	Confident	63 Å²	63	56.2 Å²	56.2	24%	0.238	29%	0.289	C	S	.	.			trans	-121	172.3	-179.9	-59.4	-62.4	-170.8	162.9	5.5	111.2	I445 K560 I586 D587	I445-R447 HydrophobicContact CG2-CG 3.99Å; R447-K560 PolarHBondContact N-O 2.81Å; R447-K560 VanDerWaalsContact O-CB 3.25Å; R447-K560 WeakPolarHBondContact O-CB 3.2Å; R447-K560 WeakPolarHBondContact O-CG 3.28Å; R447-I586 VanDerWaalsContact NH1-CG2 3.29Å; R447-D587 PolarHBondContact NH2-O 3.18Å
448	N	70.2	Confident	80.2	Confident	158 Å²	158	53.4 Å²	53.4	85%	0.845	28%	0.275	S	S	*	.	S	Bend	trans	-63.3	136.8	176.8	-72.2	-21.3	0	0	0	110.7
449	G	53.2	Low	81.3	Confident	37 Å²	37	49.7 Å²	49.7	38%	0.381	26%	0.258	S	S	.	.			trans	-93.5	162.2	-158.7	0	0	0	0	0	117.4
450	G	62.9	Low	82.9	Confident	31 Å²	31	43.5 Å²	43.5	32%	0.32	23%	0.234	S	C	.	.			trans	79.3	52.9	166.6	0	0	0	0	0	114.5
451	T	76.8	Confident	84.3	Confident	50 Å²	50	41.6 Å²	41.6	31%	0.307	22%	0.224	S	C	.	.	B	Isolated β-bridge	trans	-94.8	147.1	172.2	60	0	0	0	0	110.8	I453 F558	T451-I453 WeakPolarHBondContact CB-O 3.37Å; T451-I453 PolarHBondContact O-N 2.67Å; T451-I453 PolarHBondContact OG1-O 3.17Å; T451-F558 WeakPolarHBondContact O-CD2 3.34Å; T451-F558 PolarHBondContact O-N 2.9Å
452	N	86.5	Confident	85.6	Confident	98 Å²	98	40.6 Å²	40.6	52%	0.524	22%	0.218	S	C	.	.	S	Bend	trans	-87	8.8	170.3	-59.3	-4.3	0	0	0	111.7	L556	N452-L556 PolarHBondContact OD1-O 3.2Å
453	I	90.2	Very high	86.3	Confident	79 Å²	79	41.3 Å²	41.3	41%	0.405	22%	0.221	S	C	.	.			trans	-135.8	130.9	-175.9	-56.5	177.2	0	0	0	108	T451 Q455 M532 F558	T451-I453 WeakPolarHBondContact CB-O 3.37Å; T451-I453 PolarHBondContact O-N 2.67Å; T451-I453 PolarHBondContact OG1-O 3.17Å; I453-Q455 HydrophobicContact CG2-CG 3.98Å; I453-M532 VanDerWaalsContact CA-O 3.28Å; I453-M532 WeakPolarHBondContact CA-O 3.46Å; I453-F558 VanDerWaalsContact C-CD2 3.5Å
454	L	92.8	Very high	86.6	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.4	170.1	-179.2	66.8	0	0	0	108.9	F470 H472 I481 F530 S531 M532 F558	L454-F470 HydrophobicContact CD1-CZ 4.38Å; L454-F470 HydrophobicContact CD2-CE1 4.19Å; L454-F470 HydrophobicContact CD2-CZ 4.35Å; L454-H472 HydrophobicContact CD2-CB 4.09Å; L454-I481 HydrophobicContact CD2-CD1 3.54Å; L454-F530 HydrophobicContact CD2-CE1 4.42Å; L454-S531 WeakPolarHBondContact O-CA 3.28Å; L454-M532 PolarHBondContact N-O 3.37Å; L454-M532 PolarHBondContact O-N 2.9Å; L454-F558 HydrophobicContact CB-CD1 3.98Å; L454-F558 HydrophobicContact CB-CD2 3.67Å; L454-F558 HydrophobicContact CB-CE1 4Å; L454-F558 HydrophobicContact CB-CE2 3.68Å; L454-F558 HydrophobicContact CB-CG 3.81Å; L454-F558 HydrophobicContact CB-CZ 3.83Å; L454-F558 HydrophobicContact CD2-CD1 4.19Å; L454-F558 HydrophobicContact CD2-CE1 4.28Å
455	Q	94.1	Very high	86.8	Confident	80 Å²	80	43.2 Å²	43.2	37%	0.374	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	135.3	176.1	-72.3	173	-23.9	0	0	110.3	I453 F530 S531 I583 N584	I453-Q455 HydrophobicContact CG2-CG 3.98Å; Q455-F530 VanDerWaalsContact CA-O 3.27Å; Q455-F530 WeakPolarHBondContact CA-O 3.4Å; Q455-S531 WeakPolarHBondContact CG-OG 3.42Å; Q455-S531 PolarHBondContact NE2-OG 2.87Å; Q455-S531 VanDerWaalsContact NE2-OG 3.14Å; Q455-I583 CarbonylContact O-C 3.58Å; Q455-I583 WeakPolarHBondContact O-CA 3.21Å; Q455-N584 PolarHBondContact N-OD1 2.91Å; Q455-N584 PolarHBondContact O-N 3.18Å; Q455-N584 PolarHBondContact O-OD1 3.32Å
456	F	95.3	Very high	87	Confident	5 Å²	5	43.3 Å²	43.3	2%	0.022	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	147	167.3	65.9	-101	0	0	0	110.3	F458 F470 F483 V528 F530 R582 I583	F456-F458 AromaticContact CD2-CD1 4Å; F456-F458 HydrophobicContact CD2-CD1 4Å; F456-F458 AromaticContact CD2-CE1 3.42Å; F456-F458 HydrophobicContact CD2-CE1 3.42Å; F456-F458 VanDerWaalsContact CD2-CE1 3.42Å; F456-F458 HydrophobicContact CD2-CZ 4.26Å; F456-F458 AromaticContact CE2-CE1 3.69Å; F456-F458 HydrophobicContact CE2-CE1 3.69Å; F456-F458 HydrophobicContact CE2-CZ 4.09Å; F456-F458 HydrophobicContact CG-CE1 4.45Å; F456-F470 HydrophobicContact CB-CD2 3.97Å; F456-F470 HydrophobicContact CB-CE2 3.76Å; F456-F470 HydrophobicContact CB-CZ 4.19Å; F456-F470 AromaticContact CD1-CD1 3.5Å; F456-F470 HydrophobicContact CD1-CD1 3.5Å; F456-F470 HydrophobicContact CD1-CD2 4.02Å; F456-F470 AromaticContact CD1-CE1 3.42Å; F456-F470 HydrophobicContact CD1-CE1 3.42Å; F456-F470 VanDerWaalsContact CD1-CE1 3.42Å; F456-F470 AromaticContact CD1-CE2 3.93Å; F456-F470 HydrophobicContact CD1-CE2 3.93Å; F456-F470 AromaticContact CD1-CG 3.81Å; F456-F470 HydrophobicContact CD1-CG 3.81Å; F456-F470 AromaticContact CD1-CZ 3.64Å; F456-F470 HydrophobicContact CD1-CZ 3.64Å; F456-F470 HydrophobicContact CD2-CD2 4.42Å; F456-F470 HydrophobicContact CD2-CG 4.3Å; F456-F470 AromaticContact CE1-CD1 3.43Å; F456-F470 HydrophobicContact CE1-CD1 3.43Å; F456-F470 VanDerWaalsContact CE1-CD1 3.43Å; F456-F470 AromaticContact CE1-CE1 3.67Å; F456-F470 HydrophobicContact CE1-CE1 3.67Å; F456-F470 AromaticContact CE1-CG 3.97Å; F456-F470 HydrophobicContact CE1-CG 3.97Å; F456-F470 HydrophobicContact CE1-CZ 4.36Å; F456-F470 HydrophobicContact CE2-CB 4.38Å; F456-F470 HydrophobicContact CE2-CG 4.44Å; F456-F470 HydrophobicContact CG-CD1 4.16Å; F456-F470 AromaticContact CG-CD2 3.9Å; F456-F470 HydrophobicContact CG-CD2 3.9Å; F456-F470 HydrophobicContact CG-CE1 4.27Å; F456-F470 AromaticContact CG-CE2 4Å; F456-F470 HydrophobicContact CG-CE2 4Å; F456-F470 AromaticContact CG-CG 3.99Å; F456-F470 HydrophobicContact CG-CG 3.99Å; F456-F470 HydrophobicContact CG-CZ 4.18Å; F456-F470 HydrophobicContact CZ-CB 4.4Å; F456-F470 HydrophobicContact CZ-CD1 4.06Å; F456-F470 HydrophobicContact CZ-CG 4.28Å; F456-F483 HydrophobicContact CE2-CB 4.35Å; F456-F483 HydrophobicContact CE2-CD1 4.21Å; F456-F483 HydrophobicContact CE2-CG 4.23Å; F456-F483 HydrophobicContact CZ-CB 3.74Å; F456-F483 HydrophobicContact CZ-CD1 4.4Å; F456-F483 AromaticContact CZ-CG 3.97Å; F456-F483 HydrophobicContact CZ-CG 3.97Å; F456-V528 HydrophobicContact CE2-CG1 3.94Å; F456-F530 HydrophobicContact CD1-CB 3.73Å; F456-F530 AromaticContact CD1-CD1 3.46Å; F456-F530 HydrophobicContact CD1-CD1 3.46Å; F456-F530 VanDerWaalsContact CD1-CD1 3.46Å; F456-F530 HydrophobicContact CD1-CE1 4.33Å; F456-F530 AromaticContact CD1-CG 3.88Å; F456-F530 HydrophobicContact CD1-CG 3.88Å; F456-F530 HydrophobicContact CD2-CB 3.87Å; F456-F530 HydrophobicContact CE1-CB 3.36Å; F456-F530 AromaticContact CE1-CD1 3.15Å; F456-F530 HydrophobicContact CE1-CD1 3.15Å; F456-F530 HydrophobicContact CE1-CD2 4.14Å; F456-F530 AromaticContact CE1-CE1 3.9Å; F456-F530 HydrophobicContact CE1-CE1 3.9Å; F456-F530 AromaticContact CE1-CG 3.28Å; F456-F530 HydrophobicContact CE1-CG 3.28Å; F456-F530 HydrophobicContact CE2-CB 3.51Å; F456-F530 HydrophobicContact CE2-CG 4.31Å; F456-F530 HydrophobicContact CG-CB 3.99Å; F456-F530 HydrophobicContact CG-CD1 4.43Å; F456-F530 HydrophobicContact CZ-CB 3.23Å; F456-F530 AromaticContact CZ-CD1 3.93Å; F456-F530 HydrophobicContact CZ-CD1 3.93Å; F456-F530 HydrophobicContact CZ-CD2 4.18Å; F456-F530 AromaticContact CZ-CG 3.53Å; F456-F530 HydrophobicContact CZ-CG 3.53Å; F456-F530 PolarHBondContact N-O 3.21Å; F456-F530 VanDerWaalsContact N-O 3.1Å; F456-F530 PolarHBondContact O-N 2.88Å; F456-R582 CarbonylContact C-O 3.24Å; F456-R582 VanDerWaalsContact CA-O 3.25Å; F456-R582 WeakPolarHBondContact CA-O 3.37Å; F456-I583 HydrophobicContact CB-CG1 4.43Å
457	E	97.2	Very high	87.3	Confident	30 Å²	30	37.9 Å²	37.9	14%	0.14	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	141.5	175.6	162.7	174.7	-174	0	0	108.9	V528 K529 I581 R582	E457-V528 WeakPolarHBondContact CA-O 3.48Å; E457-K529 HydrophobicContact CB-CG 4.05Å; E457-K529 HydrophobicContact CG-CG 3.78Å; E457-K529 WeakPolarHBondContact OE1-CE 3.48Å; E457-K529 IonicContact OE1-NZ 3.38Å; E457-I581 CarbonylContact O-C 3.54Å; E457-I581 WeakPolarHBondContact O-CA 3.15Å; E457-R582 HydrophobicContact CB-CB 4.15Å; E457-R582 PolarHBondContact N-O 2.78Å; E457-R582 PolarHBondContact O-N 2.95Å; E457-R582 IonicContact OE1-CZ 3.28Å; E457-R582 IonicContact OE1-NE 3.28Å; E457-R582 IonicContact OE1-NH2 2.88Å; E457-R582 PolarHBondContact OE1-NH2 3.03Å; E457-R582 IonicContact OE2-CZ 3.51Å; E457-R582 VanDerWaalsContact OE2-CZ 3.24Å; E457-R582 IonicContact OE2-NE 3.98Å; E457-R582 PolarHBondContact OE2-NE 3.05Å; E457-R582 VanDerWaalsContact OE2-NE 3.16Å; E457-R582 IonicContact OE2-NH2 3.55Å; E457-R582 PolarHBondContact OE2-NH2 2.79Å
458	F	97.1	Very high	88	Confident	1 Å²	1	35.4 Å²	35.4	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	158.2	171.9	50	-99.1	0	0	0	108.8	F456 F460 L469 F470 F483 V528 L578 I581	F456-F458 AromaticContact CD2-CD1 4Å; F456-F458 HydrophobicContact CD2-CD1 4Å; F456-F458 AromaticContact CD2-CE1 3.42Å; F456-F458 HydrophobicContact CD2-CE1 3.42Å; F456-F458 VanDerWaalsContact CD2-CE1 3.42Å; F456-F458 HydrophobicContact CD2-CZ 4.26Å; F456-F458 AromaticContact CE2-CE1 3.69Å; F456-F458 HydrophobicContact CE2-CE1 3.69Å; F456-F458 HydrophobicContact CE2-CZ 4.09Å; F456-F458 HydrophobicContact CG-CE1 4.45Å; F458-F460 HydrophobicContact CD2-CB 4.31Å; F458-F460 HydrophobicContact CE2-CB 4.41Å; F458-F460 HydrophobicContact CE2-CD1 4.19Å; F458-L469 HydrophobicContact CE2-CB 4.16Å; F458-L469 HydrophobicContact CE2-CD2 3.59Å; F458-L469 HydrophobicContact CZ-CB 3.85Å; F458-L469 HydrophobicContact CZ-CD2 4.14Å; F458-F470 HydrophobicContact CE1-CB 4.09Å; F458-F483 HydrophobicContact CE2-CE1 4.21Å; F458-F483 AromaticContact CZ-CD1 3.78Å; F458-F483 HydrophobicContact CZ-CD1 3.78Å; F458-F483 AromaticContact CZ-CE1 3.85Å; F458-F483 HydrophobicContact CZ-CE1 3.85Å; F458-V528 HydrophobicContact CD2-CB 4.22Å; F458-V528 HydrophobicContact CE2-CB 3.91Å; F458-V528 HydrophobicContact CE2-CG1 4.32Å; F458-V528 HydrophobicContact CE2-CG2 4Å; F458-V528 HydrophobicContact CZ-CB 4.27Å; F458-V528 HydrophobicContact CZ-CG1 4.19Å; F458-V528 PolarHBondContact N-O 3Å; F458-V528 PolarHBondContact O-N 2.73Å; F458-L578 HydrophobicContact CD2-CD2 3.91Å; F458-L578 HydrophobicContact CE2-CD2 4.26Å; F458-I581 HydrophobicContact CB-CB 4.41Å; F458-I581 HydrophobicContact CB-CG1 3.99Å
459	D	97.2	Very high	89.1	Confident	13 Å²	13	27.9 Å²	27.9	7%	0.07	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	147.8	159.8	-61.7	-18	0	0	0	109.2	W525 H526 S527 L578 R579	D459-W525 HydrophobicContact CB-CE3 3.89Å; D459-W525 HydrophobicContact CB-CZ3 4.3Å; D459-H526 CarbonylContact C-O 3.6Å; D459-H526 WeakPolarHBondContact CA-O 3.41Å; D459-S527 WeakPolarHBondContact OD1-CA 3.37Å; D459-S527 WeakPolarHBondContact OD1-CB 3.36Å; D459-S527 PolarHBondContact OD1-OG 2.87Å; D459-L578 CarbonylContact O-C 3.51Å; D459-L578 VanDerWaalsContact O-CA 3.26Å; D459-L578 WeakPolarHBondContact O-CA 3.42Å; D459-R579 HydrophobicContact CB-CG 3.72Å; D459-R579 PolarHBondContact N-O 2.93Å; D459-R579 PolarHBondContact O-N 3.28Å; D459-R579 IonicContact OD2-CZ 3.31Å; D459-R579 IonicContact OD2-NE 3.13Å; D459-R579 PolarHBondContact OD2-NE 2.97Å; D459-R579 IonicContact OD2-NH2 3.39Å; D459-R579 PolarHBondContact OD2-NH2 2.95Å
460	F	96.8	Very high	91.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	154.1	173.8	78	-86.1	0	0	0	112.3	F458 T462 L469 M485 L492 F520 W525 H526 V528 F574 C577 L578	F458-F460 HydrophobicContact CD2-CB 4.31Å; F458-F460 HydrophobicContact CE2-CB 4.41Å; F458-F460 HydrophobicContact CE2-CD1 4.19Å; F460-T462 HydrophobicContact CD2-CG2 4.47Å; F460-T462 HydrophobicContact CE2-CG2 4.46Å; F460-L469 HydrophobicContact CB-CD2 3.6Å; F460-L469 HydrophobicContact CD1-CD2 3.81Å; F460-L469 HydrophobicContact CD2-CD2 3.89Å; F460-L469 HydrophobicContact CE1-CD2 4.46Å; F460-L469 HydrophobicContact CG-CD2 3.48Å; F460-L469 VanDerWaalsContact CG-CD2 3.48Å; F460-M485 HydrophobicContact CE2-CE 3.73Å; F460-M485 HydrophobicContact CZ-CE 4.39Å; F460-L492 HydrophobicContact CE1-CD1 3.94Å; F460-L492 HydrophobicContact CE1-CD2 4.17Å; F460-L492 HydrophobicContact CE2-CD2 4.49Å; F460-L492 HydrophobicContact CZ-CD1 3.87Å; F460-L492 HydrophobicContact CZ-CD2 3.78Å; F460-L492 HydrophobicContact CZ-CG 4.28Å; F460-F520 HydrophobicContact CE2-CB 4.15Å; F460-F520 HydrophobicContact CZ-CB 3.92Å; F460-F520 AromaticContact CZ-CD1 3.99Å; F460-F520 HydrophobicContact CZ-CD1 3.99Å; F460-F520 HydrophobicContact CZ-CG 4.2Å; F460-W525 VanDerWaalsContact C-CE3 3.5Å; F460-W525 CarbonylContact O-C 3.53Å; F460-W525 WeakPolarHBondContact O-CA 2.91Å; F460-H526 HydrophobicContact CD1-CB 3.95Å; F460-H526 HydrophobicContact CE1-CB 3.45Å; F460-H526 VanDerWaalsContact CE1-CB 3.45Å; F460-H526 HydrophobicContact CE2-CB 4.33Å; F460-H526 HydrophobicContact CZ-CB 3.65Å; F460-H526 AromaticContact CZ-CD2 3.98Å; F460-H526 PolarHBondContact N-O 3.46Å; F460-H526 PolarHBondContact O-N 2.82Å; F460-V528 HydrophobicContact CD1-CG2 3.73Å; F460-V528 HydrophobicContact CE1-CG2 3.62Å; F460-F574 HydrophobicContact CB-CZ 4.29Å; F460-F574 HydrophobicContact CD2-CE2 4.35Å; F460-F574 HydrophobicContact CD2-CZ 4.35Å; F460-C577 CarbonylContact C-O 3.46Å; F460-C577 VanDerWaalsContact CA-O 3.23Å; F460-C577 WeakPolarHBondContact CA-O 3.37Å; F460-L578 HydrophobicContact CB-CD2 3.36Å
461	R	94.4	Very high	92.6	Very high	11 Å²	11	24.8 Å²	24.8	4%	0.042	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	129.9	175.3	179.3	179.8	-173.2	162.9	18.2	109.4	D280 G523 L524 W525 G576 C577 I609	D280-R461 IonicContact OD1-CZ 3.14Å; D280-R461 IonicContact OD1-NH1 3.73Å; D280-R461 PolarHBondContact OD1-NH1 2.77Å; D280-R461 IonicContact OD1-NH2 3.27Å; D280-R461 PolarHBondContact OD1-NH2 3.09Å; D280-R461 IonicContact OD2-CZ 3.39Å; D280-R461 IonicContact OD2-NH1 2.81Å; D280-R461 PolarHBondContact OD2-NH1 3.36Å; D280-R461 IonicContact OD2-NH2 2.84Å; D280-R461 PolarHBondContact OD2-NH2 2.86Å; R461-G523 WeakPolarHBondContact CG-O 3.17Å; R461-G523 VanDerWaalsContact CZ-O 3.28Å; R461-G523 PolarHBondContact NE-O 2.81Å; R461-G523 PolarHBondContact NH2-O 3.13Å; R461-L524 WeakPolarHBondContact CA-O 3.37Å; R461-L524 WeakPolarHBondContact CG-O 3.26Å; R461-W525 HydrophobicContact CB-CD2 3.65Å; R461-W525 HydrophobicContact CB-CE3 3.61Å; R461-W525 HydrophobicContact CB-CG 4.22Å; R461-W525 HydrophobicContact CB-CH2 4.14Å; R461-W525 HydrophobicContact CB-CZ2 4.17Å; R461-W525 HydrophobicContact CB-CZ3 3.85Å; R461-W525 HydrophobicContact CG-CD2 4.43Å; R461-G576 CarbonylContact O-C 3.53Å; R461-G576 WeakPolarHBondContact O-CA 3.16Å; R461-C577 HydrophobicContact CB-CB 4.4Å; R461-C577 PolarHBondContact N-O 2.74Å; R461-C577 PolarHBondContact O-N 2.98Å; R461-I609 HydrophobicContact CG-CD1 3.85Å
462	T	94.4	Very high	93.3	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.006	11%	0.112	C	C	.	.			trans	-154.7	156.4	175.9	-170	0	0	0	0	112	F460 N464 M485 A521 G523 F574 Q575	F460-T462 HydrophobicContact CD2-CG2 4.47Å; F460-T462 HydrophobicContact CE2-CG2 4.46Å; T462-N464 WeakPolarHBondContact CG2-O 3.2Å; T462-N464 PolarHBondContact OG1-N 3.3Å; T462-N464 VanDerWaalsContact OG1-N 3.11Å; T462-N464 PolarHBondContact OG1-O 3.44Å; T462-M485 HydrophobicContact CG2-CE 3.57Å; T462-M485 HydrophobicContact CG2-SD 4.4Å; T462-A521 HydrophobicContact CG2-CB 4.33Å; T462-A521 CarbonylContact O-C 3.44Å; T462-A521 WeakPolarHBondContact O-CA 3.4Å; T462-G523 WeakPolarHBondContact O-CA 2.92Å; T462-G523 PolarHBondContact O-N 2.93Å; T462-F574 HydrophobicContact CG2-CE2 3.88Å; T462-F574 HydrophobicContact CG2-CZ 4.43Å; T462-Q575 PolarHBondContact OG1-O 3.38Å
463	L	92.2	Very high	93.3	Very high	15 Å²	15	18.3 Å²	18.3	8%	0.079	9%	0.09	C	C	.	.	S	Bend	trans	-108	-3.4	171.2	-71.8	165.6	0	0	0	112.2	L278 I609 D611	L278-L463 HydrophobicContact CD1-CD1 4.07Å; L278-L463 HydrophobicContact CD2-CD1 4.22Å; L278-L463 HydrophobicContact CG-CD1 4.47Å; L463-I609 HydrophobicContact CD1-CD1 4.21Å; L463-I609 HydrophobicContact CD1-CG1 4.46Å; L463-I609 HydrophobicContact CG-CD1 4.2Å; L463-D611 HydrophobicContact CD1-CB 3.53Å
464	N	91.5	Very high	93.1	Very high	9 Å²	9	16.7 Å²	16.7	5%	0.048	8%	0.084	C	C	.	.	S	Bend	trans	-114.8	134.8	-173.9	-65	-49.6	0	0	0	110.1	T462 Q575 Q626 T627 G628	T462-N464 WeakPolarHBondContact CG2-O 3.2Å; T462-N464 PolarHBondContact OG1-N 3.3Å; T462-N464 VanDerWaalsContact OG1-N 3.11Å; T462-N464 PolarHBondContact OG1-O 3.44Å; N464-Q575 PolarHBondContact ND2-OE1 3.31Å; N464-Q626 VanDerWaalsContact OD1-C 3.25Å; N464-Q626 WeakPolarHBondContact OD1-CG 3.24Å; N464-Q626 PolarHBondContact OD1-O 3.01Å; N464-T627 WeakPolarHBondContact OD1-CA 3.43Å; N464-T627 PolarHBondContact OD1-N 3.02Å; N464-T627 PolarHBondContact OD1-O 3.05Å; N464-G628 WeakPolarHBondContact ND2-CA 3.37Å; N464-G628 PolarHBondContact ND2-N 2.84Å
465	K	91.2	Very high	92.7	Very high	103 Å²	103	19.3 Å²	19.3	45%	0.448	10%	0.098	S	C	.	.			trans	-73.7	152	174.6	-61.8	178.6	178.9	176.9	0	110.1	D487 E488 A521	K465-D487 VanDerWaalsContact CB-O 3.23Å; K465-D487 WeakPolarHBondContact CB-O 3.13Å; K465-D487 WeakPolarHBondContact CD-O 3.37Å; K465-E488 WeakPolarHBondContact CD-O 3.48Å; K465-E488 PolarHBondContact NZ-O 3.14Å; K465-A521 HydrophobicContact CG-CB 4Å
466	G	90.3	Very high	91.9	Very high	7 Å²	7	24.7 Å²	24.7	7%	0.072	12%	0.12	C	C	.	.			trans	90.8	172.1	173.3	0	0	0	0	0	115.8	M485 D487	G466-M485 CarbonylContact C-O 3.55Å; G466-M485 WeakPolarHBondContact CA-O 3.08Å; G466-D487 WeakPolarHBondContact CA-OD1 3.38Å
467	G	90.6	Very high	91.2	Very high	4 Å²	4	26.2 Å²	26.2	4%	0.041	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	94.6	154.9	173.8	0	0	0	0	0	115.2	G484 M485 Y572	G467-G484 CarbonylContact O-C 3.58Å; G467-G484 VanDerWaalsContact O-CA 3.27Å; G467-G484 WeakPolarHBondContact O-CA 3.31Å; G467-M485 PolarHBondContact N-O 2.95Å; G467-M485 PolarHBondContact O-N 2.94Å; G467-Y572 WeakPolarHBondContact CA-O 3.5Å
468	I	92.9	Very high	90.7	Very high	11 Å²	11	30.5 Å²	30.5	6%	0.056	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121.1	-176.8	-58.4	-51.7	0	0	0	111	F470 S482 G565 G566 R571 Y572 F574	I468-F470 WeakPolarHBondContact CG2-O 3.07Å; I468-S482 WeakPolarHBondContact CD1-OG 3.43Å; I468-G565 CarbonylContact O-C 3.52Å; I468-G565 WeakPolarHBondContact O-CA 3.22Å; I468-G566 PolarHBondContact O-N 3.4Å; I468-G566 VanDerWaalsContact O-N 3.11Å; I468-R571 HydrophobicContact CG1-CB 3.75Å; I468-R571 HydrophobicContact CG1-CG 4.3Å; I468-Y572 PolarHBondContact N-O 2.94Å; I468-Y572 VanDerWaalsContact N-O 3.17Å; I468-F574 VanDerWaalsContact O-CB 3.26Å; I468-F574 WeakPolarHBondContact O-CB 3.38Å
469	L	94.6	Very high	90.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-42	177.5	-72.4	87.1	0	0	0	111.1	F458 F460 F483 I564 G565 F574 L578	F458-L469 HydrophobicContact CE2-CB 4.16Å; F458-L469 HydrophobicContact CE2-CD2 3.59Å; F458-L469 HydrophobicContact CZ-CB 3.85Å; F458-L469 HydrophobicContact CZ-CD2 4.14Å; F460-L469 HydrophobicContact CB-CD2 3.6Å; F460-L469 HydrophobicContact CD1-CD2 3.81Å; F460-L469 HydrophobicContact CD2-CD2 3.89Å; F460-L469 HydrophobicContact CE1-CD2 4.46Å; F460-L469 HydrophobicContact CG-CD2 3.48Å; F460-L469 VanDerWaalsContact CG-CD2 3.48Å; L469-F483 HydrophobicContact CB-CD1 4.22Å; L469-F483 PolarHBondContact N-O 2.83Å; L469-I564 WeakPolarHBondContact O-CA 3.25Å; L469-G565 PolarHBondContact O-N 3.43Å; L469-F574 HydrophobicContact CD1-CD2 3.74Å; L469-F574 HydrophobicContact CD1-CE2 4.18Å; L469-F574 HydrophobicContact CD1-CG 4.34Å; L469-F574 HydrophobicContact CD2-CD2 4.27Å; L469-F574 HydrophobicContact CD2-CE2 4.09Å; L469-F574 HydrophobicContact CD2-CZ 4.35Å; L469-F574 HydrophobicContact CG-CB 4.32Å; L469-F574 HydrophobicContact CG-CD1 4.45Å; L469-F574 HydrophobicContact CG-CD2 3.68Å; L469-F574 HydrophobicContact CG-CE2 4.02Å; L469-F574 HydrophobicContact CG-CG 3.91Å; L469-L578 HydrophobicContact CD2-CD2 4.02Å
470	F	94.6	Very high	90	Very high	1 Å²	1	32.7 Å²	32.7	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	136.5	-179.8	179.3	-86.5	0	0	0	111.6	L454 F456 F458 I468 H472 F483 Y563 I583	L454-F470 HydrophobicContact CD1-CZ 4.38Å; L454-F470 HydrophobicContact CD2-CE1 4.19Å; L454-F470 HydrophobicContact CD2-CZ 4.35Å; F456-F470 HydrophobicContact CB-CD2 3.97Å; F456-F470 HydrophobicContact CB-CE2 3.76Å; F456-F470 HydrophobicContact CB-CZ 4.19Å; F456-F470 AromaticContact CD1-CD1 3.5Å; F456-F470 HydrophobicContact CD1-CD1 3.5Å; F456-F470 HydrophobicContact CD1-CD2 4.02Å; F456-F470 AromaticContact CD1-CE1 3.42Å; F456-F470 HydrophobicContact CD1-CE1 3.42Å; F456-F470 VanDerWaalsContact CD1-CE1 3.42Å; F456-F470 AromaticContact CD1-CE2 3.93Å; F456-F470 HydrophobicContact CD1-CE2 3.93Å; F456-F470 AromaticContact CD1-CG 3.81Å; F456-F470 HydrophobicContact CD1-CG 3.81Å; F456-F470 AromaticContact CD1-CZ 3.64Å; F456-F470 HydrophobicContact CD1-CZ 3.64Å; F456-F470 HydrophobicContact CD2-CD2 4.42Å; F456-F470 HydrophobicContact CD2-CG 4.3Å; F456-F470 AromaticContact CE1-CD1 3.43Å; F456-F470 HydrophobicContact CE1-CD1 3.43Å; F456-F470 VanDerWaalsContact CE1-CD1 3.43Å; F456-F470 AromaticContact CE1-CE1 3.67Å; F456-F470 HydrophobicContact CE1-CE1 3.67Å; F456-F470 AromaticContact CE1-CG 3.97Å; F456-F470 HydrophobicContact CE1-CG 3.97Å; F456-F470 HydrophobicContact CE1-CZ 4.36Å; F456-F470 HydrophobicContact CE2-CB 4.38Å; F456-F470 HydrophobicContact CE2-CG 4.44Å; F456-F470 HydrophobicContact CG-CD1 4.16Å; F456-F470 AromaticContact CG-CD2 3.9Å; F456-F470 HydrophobicContact CG-CD2 3.9Å; F456-F470 HydrophobicContact CG-CE1 4.27Å; F456-F470 AromaticContact CG-CE2 4Å; F456-F470 HydrophobicContact CG-CE2 4Å; F456-F470 AromaticContact CG-CG 3.99Å; F456-F470 HydrophobicContact CG-CG 3.99Å; F456-F470 HydrophobicContact CG-CZ 4.18Å; F456-F470 HydrophobicContact CZ-CB 4.4Å; F456-F470 HydrophobicContact CZ-CD1 4.06Å; F456-F470 HydrophobicContact CZ-CG 4.28Å; F458-F470 HydrophobicContact CE1-CB 4.09Å; I468-F470 WeakPolarHBondContact CG2-O 3.07Å; F470-H472 HydrophobicContact CE1-CB 3.77Å; F470-H472 HydrophobicContact CZ-CB 4.08Å; F470-F483 HydrophobicContact CB-CB 4.31Å; F470-F483 PolarHBondContact N-O 3.37Å; F470-F483 PolarHBondContact O-N 2.77Å; F470-Y563 WeakPolarHBondContact CA-O 3.35Å; F470-I583 HydrophobicContact CE2-CD1 4.13Å; F470-I583 HydrophobicContact CE2-CG1 4.36Å
471	Y	93.1	Very high	89.8	Confident	1 Å²	1	32.7 Å²	32.7	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	135.4	177.7	-173.3	-95.1	0	0	0	111.3	T473 D477 Y480 I481 Y563 R568	Y471-T473 HydrophobicContact CE1-CG2 4.15Å; Y471-D477 WeakPolarHBondContact CE1-OD1 3.39Å; Y471-D477 WeakPolarHBondContact OH-CB 3.48Å; Y471-D477 PolarHBondContact OH-OD1 3.23Å; Y471-Y480 HydrophobicContact CD2-CD2 4.47Å; Y471-Y480 HydrophobicContact CE2-CD1 4.43Å; Y471-Y480 AromaticContact CE2-CD2 3.7Å; Y471-Y480 HydrophobicContact CE2-CD2 3.7Å; Y471-Y480 HydrophobicContact CE2-CE2 4.45Å; Y471-Y480 AromaticContact CE2-CG 3.69Å; Y471-Y480 HydrophobicContact CE2-CG 3.69Å; Y471-Y480 AromaticContact CZ-CG 3.92Å; Y471-Y480 VanDerWaalsContact OH-CB 3.22Å; Y471-Y480 WeakPolarHBondContact OH-CB 3.21Å; Y471-I481 CarbonylContact C-O 3.46Å; Y471-I481 WeakPolarHBondContact CA-O 3.12Å; Y471-Y563 AromaticContact CD1-CD2 3.85Å; Y471-Y563 HydrophobicContact CD1-CD2 3.85Å; Y471-Y563 PolarHBondContact N-O 3.11Å; Y471-Y563 WeakPolarHBondContact O-CB 3.47Å; Y471-Y563 PolarHBondContact O-N 3.43Å; Y471-R568 PolarHBondContact OH-O 2.74Å
472	H	91.4	Very high	89.8	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	130.1	176.8	-177.4	81.4	0	0	0	109.4	L454 F470 Y480 I481 F558 D559 V561 S562	L454-H472 HydrophobicContact CD2-CB 4.09Å; F470-H472 HydrophobicContact CE1-CB 3.77Å; F470-H472 HydrophobicContact CZ-CB 4.08Å; H472-Y480 CarbonylContact O-C 3.34Å; H472-Y480 WeakPolarHBondContact O-CA 3.5Å; H472-Y480 WeakPolarHBondContact O-CB 3.36Å; H472-I481 HydrophobicContact CB-CB 4.44Å; H472-I481 PolarHBondContact N-O 3.49Å; H472-I481 PolarHBondContact O-N 2.78Å; H472-F558 AromaticContact CD2-CD1 3.96Å; H472-F558 AromaticContact NE2-CD1 3.8Å; H472-D559 PolarHBondContact CE1-N 3.4Å; H472-D559 PolarHBondContact CE1-O 3.02Å; H472-D559 VanDerWaalsContact CE1-O 3.27Å; H472-D559 PolarHBondContact NE2-N 2.75Å; H472-D559 VanDerWaalsContact NE2-N 3.18Å; H472-V561 PolarHBondContact CE1-O 3.48Å; H472-V561 PolarHBondContact ND1-O 3.1Å; H472-S562 PolarHBondContact ND1-OG 3.25Å; H472-S562 VanDerWaalsContact ND1-OG 3.1Å
473	T	88.1	Confident	89.8	Confident	13 Å²	13	32.2 Å²	32.2	8%	0.08	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	150.1	178.9	-179.5	0	0	0	0	110.8	Y471 D475 D477 N479 Y563	Y471-T473 HydrophobicContact CE1-CG2 4.15Å; T473-D475 PolarHBondContact OG1-N 2.96Å; T473-D477 WeakPolarHBondContact CG2-OD1 3.34Å; T473-D477 VanDerWaalsContact OG1-CA 3.27Å; T473-D477 WeakPolarHBondContact OG1-CA 3.44Å; T473-D477 PolarHBondContact OG1-N 3.49Å; T473-N479 WeakPolarHBondContact CA-O 3.4Å; T473-N479 PolarHBondContact OG1-O 3.22Å; T473-Y563 HydrophobicContact CG2-CE2 4.36Å
474	V	85.2	Confident	89.9	Confident	44 Å²	44	31.6 Å²	31.6	27%	0.267	16%	0.158	S	C	.	.	S	Bend	trans	-110.3	-13.6	178.5	-62.4	0	0	0	0	113.7	N479 L498 Y557	V474-N479 HydrophobicContact CG2-CB 3.56Å; V474-N479 PolarHBondContact N-O 3.24Å; V474-N479 VanDerWaalsContact N-O 3.14Å; V474-L498 HydrophobicContact CG1-CD2 4.16Å; V474-L498 HydrophobicContact CG2-CD2 3.82Å; V474-Y557 WeakPolarHBondContact CG1-O 3.22Å
475	D	83.5	Confident	90.1	Very high	56 Å²	56	31.5 Å²	31.5	30%	0.299	16%	0.157	S	C	.	.	S	Bend	trans	-155	55	-172.5	70.2	-20.7	0	0	0	114.4	T473 D477 N478 N479	T473-D475 PolarHBondContact OG1-N 2.96Å; D475-D477 VanDerWaalsContact C-N 3.34Å; D475-D477 PolarHBondContact O-N 2.87Å; D475-N478 PolarHBondContact O-ND2 2.86Å; D475-N478 PolarHBondContact OD1-N 3.49Å; D475-N478 WeakPolarHBondContact OD2-CB 3.48Å; D475-N479 WeakPolarHBondContact OD1-CA 3.25Å; D475-N479 VanDerWaalsContact OD1-CB 3.22Å; D475-N479 WeakPolarHBondContact OD1-CB 3.45Å; D475-N479 PolarHBondContact OD1-N 2.99Å; D475-N479 PolarHBondContact OD2-ND2 2.96Å
476	K	78.4	Confident	90.2	Very high	193 Å²	193	29.9 Å²	29.9	84%	0.839	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.2	49	179.3	-54.4	179.6	179.5	179.2	0	112	N478	K476-N478 VanDerWaalsContact C-N 3.35Å; K476-N478 PolarHBondContact O-N 3.23Å
477	D	81.2	Confident	90.1	Very high	37 Å²	37	34.3 Å²	34.3	20%	0.198	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	3.2	170.9	-46.7	-42.6	0	0	0	117.2	Y471 T473 D475 Y480 R568 P569	Y471-D477 WeakPolarHBondContact CE1-OD1 3.39Å; Y471-D477 WeakPolarHBondContact OH-CB 3.48Å; Y471-D477 PolarHBondContact OH-OD1 3.23Å; T473-D477 WeakPolarHBondContact CG2-OD1 3.34Å; T473-D477 VanDerWaalsContact OG1-CA 3.27Å; T473-D477 WeakPolarHBondContact OG1-CA 3.44Å; T473-D477 PolarHBondContact OG1-N 3.49Å; D475-D477 VanDerWaalsContact C-N 3.34Å; D475-D477 PolarHBondContact O-N 2.87Å; D477-Y480 WeakPolarHBondContact O-CD1 3.3Å; D477-R568 WeakPolarHBondContact OD2-CB 3.35Å; D477-P569 HydrophobicContact CB-CG 4.41Å; D477-P569 WeakPolarHBondContact OD2-CD 3.4Å
478	N	85.3	Confident	90.1	Very high	121 Å²	121	42.7 Å²	42.7	65%	0.647	21%	0.211	S	C	*	.	S	Bend	trans	-72.6	-34.9	172.8	-67.1	-48.2	0	0	0	112.1	D475 K476	D475-N478 PolarHBondContact O-ND2 2.86Å; D475-N478 PolarHBondContact OD1-N 3.49Å; D475-N478 WeakPolarHBondContact OD2-CB 3.48Å; K476-N478 VanDerWaalsContact C-N 3.35Å; K476-N478 PolarHBondContact O-N 3.23Å
479	N	88.9	Confident	90.1	Very high	30 Å²	30	43.4 Å²	43.4	16%	0.16	22%	0.217	C	C	.	.	S	Bend	trans	-125.4	127.5	176.7	-67.8	-79	0	0	0	108.9	T473 V474 D475 I497 L498 P499	T473-N479 WeakPolarHBondContact CA-O 3.4Å; T473-N479 PolarHBondContact OG1-O 3.22Å; V474-N479 HydrophobicContact CG2-CB 3.56Å; V474-N479 PolarHBondContact N-O 3.24Å; V474-N479 VanDerWaalsContact N-O 3.14Å; D475-N479 WeakPolarHBondContact OD1-CA 3.25Å; D475-N479 VanDerWaalsContact OD1-CB 3.22Å; D475-N479 WeakPolarHBondContact OD1-CB 3.45Å; D475-N479 PolarHBondContact OD1-N 2.99Å; D475-N479 PolarHBondContact OD2-ND2 2.96Å; N479-I497 CarbonylContact C-O 3.57Å; N479-I497 VanDerWaalsContact C-O 3.29Å; N479-I497 WeakPolarHBondContact CA-O 3.41Å; N479-I497 VanDerWaalsContact CB-O 3.31Å; N479-I497 WeakPolarHBondContact CB-O 3.41Å; N479-L498 HydrophobicContact CB-CD2 4.18Å; N479-P499 HydrophobicContact CB-CG 4.39Å; N479-P499 VanDerWaalsContact CG-CD 3.49Å; N479-P499 WeakPolarHBondContact OD1-CD 3.38Å
480	Y	91.2	Very high	90	Very high	29 Å²	29	43.4 Å²	43.4	11%	0.114	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	162.7	-171.6	63.9	-96.3	0	0	0	113.7	Y471 H472 D477 E495 I497 R571	Y471-Y480 HydrophobicContact CD2-CD2 4.47Å; Y471-Y480 HydrophobicContact CE2-CD1 4.43Å; Y471-Y480 AromaticContact CE2-CD2 3.7Å; Y471-Y480 HydrophobicContact CE2-CD2 3.7Å; Y471-Y480 HydrophobicContact CE2-CE2 4.45Å; Y471-Y480 AromaticContact CE2-CG 3.69Å; Y471-Y480 HydrophobicContact CE2-CG 3.69Å; Y471-Y480 AromaticContact CZ-CG 3.92Å; Y471-Y480 VanDerWaalsContact OH-CB 3.22Å; Y471-Y480 WeakPolarHBondContact OH-CB 3.21Å; H472-Y480 CarbonylContact O-C 3.34Å; H472-Y480 WeakPolarHBondContact O-CA 3.5Å; H472-Y480 WeakPolarHBondContact O-CB 3.36Å; D477-Y480 WeakPolarHBondContact O-CD1 3.3Å; Y480-E495 HydrophobicContact CE2-CB 4.41Å; Y480-E495 HydrophobicContact CE2-CG 3.93Å; Y480-E495 PolarHBondContact OH-OE1 3.35Å; Y480-E495 PolarHBondContact OH-OE2 3.42Å; Y480-I497 HydrophobicContact CE1-CD1 3.92Å; Y480-I497 HydrophobicContact CE2-CD1 4.42Å; Y480-I497 PolarHBondContact N-O 2.86Å; Y480-I497 PolarHBondContact O-N 3.13Å; Y480-I497 WeakPolarHBondContact OH-CD1 3.33Å; Y480-R571 PolarHBondContact OH-NH2 2.78Å; Y480-R571 VanDerWaalsContact OH-NH2 3.09Å
481	I	93.3	Very high	90.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.3	163.7	-62.7	171.2	0	0	0	106.8	L454 Y471 H472 L494 E495 I496 L498 F530 M532 F558	L454-I481 HydrophobicContact CD2-CD1 3.54Å; Y471-I481 CarbonylContact C-O 3.46Å; Y471-I481 WeakPolarHBondContact CA-O 3.12Å; H472-I481 HydrophobicContact CB-CB 4.44Å; H472-I481 PolarHBondContact N-O 3.49Å; H472-I481 PolarHBondContact O-N 2.78Å; I481-L494 HydrophobicContact CG2-CD1 4.25Å; I481-E495 CarbonylContact C-O 3.57Å; I481-E495 WeakPolarHBondContact CA-O 3.15Å; I481-I496 HydrophobicContact CG1-CG1 4.22Å; I481-I496 HydrophobicContact CG1-CG2 4.09Å; I481-I496 HydrophobicContact CG2-CG1 4.26Å; I481-L498 HydrophobicContact CD1-CD1 4.01Å; I481-L498 HydrophobicContact CG1-CD1 4.12Å; I481-L498 HydrophobicContact CG1-CG 4.41Å; I481-F530 HydrophobicContact CG2-CE1 4.46Å; I481-F530 HydrophobicContact CG2-CZ 4.26Å; I481-M532 HydrophobicContact CD1-SD 3.67Å; I481-F558 HydrophobicContact CD1-CD1 4.32Å; I481-F558 HydrophobicContact CD1-CE1 3.57Å; I481-F558 HydrophobicContact CD1-CZ 4.31Å
482	S	93.4	Very high	90.4	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.014	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.2	178.4	-177.4	0	0	0	0	109.4	I468 L494 E495	I468-S482 WeakPolarHBondContact CD1-OG 3.43Å; S482-L494 WeakPolarHBondContact O-CA 3.4Å; S482-E495 PolarHBondContact N-O 3.31Å; S482-E495 PolarHBondContact O-N 2.84Å
483	F	95.7	Very high	90.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	122.1	170.4	-179.5	-95.5	0	0	0	108.8	F456 F458 L469 F470 L492 A493 L494 V528 L539 I541	F456-F483 HydrophobicContact CE2-CB 4.35Å; F456-F483 HydrophobicContact CE2-CD1 4.21Å; F456-F483 HydrophobicContact CE2-CG 4.23Å; F456-F483 HydrophobicContact CZ-CB 3.74Å; F456-F483 HydrophobicContact CZ-CD1 4.4Å; F456-F483 AromaticContact CZ-CG 3.97Å; F456-F483 HydrophobicContact CZ-CG 3.97Å; F458-F483 HydrophobicContact CE2-CE1 4.21Å; F458-F483 AromaticContact CZ-CD1 3.78Å; F458-F483 HydrophobicContact CZ-CD1 3.78Å; F458-F483 AromaticContact CZ-CE1 3.85Å; F458-F483 HydrophobicContact CZ-CE1 3.85Å; L469-F483 HydrophobicContact CB-CD1 4.22Å; L469-F483 PolarHBondContact N-O 2.83Å; F470-F483 HydrophobicContact CB-CB 4.31Å; F470-F483 PolarHBondContact N-O 3.37Å; F470-F483 PolarHBondContact O-N 2.77Å; F483-L492 HydrophobicContact CE1-CD2 4.26Å; F483-L492 HydrophobicContact CE2-CB 4.29Å; F483-L492 HydrophobicContact CZ-CB 4.2Å; F483-L492 HydrophobicContact CZ-CD1 4.02Å; F483-L492 HydrophobicContact CZ-CD2 4.04Å; F483-L492 HydrophobicContact CZ-CG 4.31Å; F483-A493 WeakPolarHBondContact CA-O 3.49Å; F483-L494 HydrophobicContact CB-CD1 4.47Å; F483-L494 HydrophobicContact CD2-CB 4.26Å; F483-L494 HydrophobicContact CD2-CD1 4.43Å; F483-V528 HydrophobicContact CD1-CG1 4.38Å; F483-V528 HydrophobicContact CE1-CB 4.34Å; F483-V528 HydrophobicContact CE1-CG1 3.66Å; F483-V528 HydrophobicContact CE1-CG2 3.9Å; F483-V528 HydrophobicContact CE2-CG1 4.32Å; F483-V528 HydrophobicContact CZ-CB 4.4Å; F483-V528 HydrophobicContact CZ-CG1 3.59Å; F483-V528 HydrophobicContact CZ-CG2 3.86Å; F483-L539 HydrophobicContact CD2-CD1 4.38Å; F483-L539 HydrophobicContact CE2-CD1 3.85Å; F483-L539 HydrophobicContact CE2-CD2 4.2Å; F483-L539 HydrophobicContact CZ-CD1 4.47Å; F483-I541 HydrophobicContact CE2-CD1 4.44Å; F483-I541 HydrophobicContact CZ-CD1 4.48Å
484	G	94.7	Very high	91	Very high	2 Å²	2	45.5 Å²	45.5	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	-170.4	-173.6	0	0	0	0	0	112.2	G467 L492 A493	G467-G484 CarbonylContact O-C 3.58Å; G467-G484 VanDerWaalsContact O-CA 3.27Å; G467-G484 WeakPolarHBondContact O-CA 3.31Å; G484-L492 CarbonylContact O-C 3.51Å; G484-L492 WeakPolarHBondContact O-CA 3.45Å; G484-A493 PolarHBondContact N-O 3.15Å; G484-A493 PolarHBondContact O-N 3.22Å
485	M	94.6	Very high	91.4	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.039	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	141.6	173.9	-165.1	178	-57.9	0	0	109.6	F460 T462 G466 G467 H491 L492 F520 A521	F460-M485 HydrophobicContact CE2-CE 3.73Å; F460-M485 HydrophobicContact CZ-CE 4.39Å; T462-M485 HydrophobicContact CG2-CE 3.57Å; T462-M485 HydrophobicContact CG2-SD 4.4Å; G466-M485 CarbonylContact C-O 3.55Å; G466-M485 WeakPolarHBondContact CA-O 3.08Å; G467-M485 PolarHBondContact N-O 2.95Å; G467-M485 PolarHBondContact O-N 2.94Å; M485-H491 CarbonylContact C-O 3.54Å; M485-H491 WeakPolarHBondContact CA-O 3.34Å; M485-L492 HydrophobicContact CB-CD2 4.46Å; M485-L492 HydrophobicContact CE-CD2 4.35Å; M485-F520 HydrophobicContact CE-CB 3.83Å; M485-A521 HydrophobicContact SD-CB 3.99Å
486	E	93.3	Very high	91.9	Very high	69 Å²	69	41.7 Å²	41.7	32%	0.322	21%	0.208	S	C	.	.			trans	-74.1	137.5	172.9	-70.2	179.1	177.7	0	0	110.5	S489 G490 H491 A493 T507	E486-S489 VanDerWaalsContact CB-OG 3.28Å; E486-S489 WeakPolarHBondContact CB-OG 3.45Å; E486-S489 PolarHBondContact OE2-OG 3.1Å; E486-G490 WeakPolarHBondContact O-CA 3.42Å; E486-G490 PolarHBondContact O-N 3.42Å; E486-H491 PolarHBondContact N-O 2.93Å; E486-A493 HydrophobicContact CG-CB 3.97Å; E486-T507 VanDerWaalsContact OE1-CG2 3.22Å; E486-T507 WeakPolarHBondContact OE1-CG2 3.42Å; E486-T507 PolarHBondContact OE1-OG1 3.38Å
487	D	88.7	Confident	92.6	Very high	100 Å²	100	34.4 Å²	34.4	54%	0.535	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-37.4	-173.3	-58.4	-23	0	0	0	112.5	K465 G466	K465-D487 VanDerWaalsContact CB-O 3.23Å; K465-D487 WeakPolarHBondContact CB-O 3.13Å; K465-D487 WeakPolarHBondContact CD-O 3.37Å; G466-D487 WeakPolarHBondContact CA-OD1 3.38Å
488	E	89.7	Confident	93.1	Very high	180 Å²	180	33.1 Å²	33.1	84%	0.841	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-49.7	-176.9	-65.4	179.5	-178.9	0	0	112.5	K465	K465-E488 WeakPolarHBondContact CD-O 3.48Å; K465-E488 PolarHBondContact NZ-O 3.14Å
489	S	93.2	Very high	93.3	Very high	25 Å²	25	30.4 Å²	30.4	18%	0.175	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-27.6	-170.6	69.5	0	0	0	0	113.2	E486 H491	E486-S489 VanDerWaalsContact CB-OG 3.28Å; E486-S489 WeakPolarHBondContact CB-OG 3.45Å; E486-S489 PolarHBondContact OE2-OG 3.1Å; S489-H491 WeakPolarHBondContact CB-ND1 3.23Å; S489-H491 PolarHBondContact O-N 3.03Å; S489-H491 WeakPolarHBondContact OG-CB 3.45Å; S489-H491 PolarHBondContact OG-N 3.43Å; S489-H491 VanDerWaalsContact OG-N 3.1Å; S489-H491 PolarHBondContact OG-ND1 2.89Å
490	G	93.6	Very high	93.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.164	C	C	.	.			trans	70.8	14.8	-168.7	0	0	0	0	0	113.5	E486 F520	E486-G490 WeakPolarHBondContact O-CA 3.42Å; E486-G490 PolarHBondContact O-N 3.42Å; G490-F520 PolarHBondContact O-N 2.84Å
491	H	97.3	Very high	93.3	Very high	28 Å²	28	29.4 Å²	29.4	13%	0.13	16%	0.163	C	C	.	.			trans	-80.1	151.9	175.4	-61.3	154.5	0	0	0	110.9	M485 E486 S489 T507 V508 N517 G518	M485-H491 CarbonylContact C-O 3.54Å; M485-H491 WeakPolarHBondContact CA-O 3.34Å; E486-H491 PolarHBondContact N-O 2.93Å; S489-H491 WeakPolarHBondContact CB-ND1 3.23Å; S489-H491 PolarHBondContact O-N 3.03Å; S489-H491 WeakPolarHBondContact OG-CB 3.45Å; S489-H491 PolarHBondContact OG-N 3.43Å; S489-H491 VanDerWaalsContact OG-N 3.1Å; S489-H491 PolarHBondContact OG-ND1 2.89Å; H491-T507 HydrophobicContact CB-CG2 3.4Å; H491-V508 WeakPolarHBondContact CB-O 3.12Å; H491-N517 PolarHBondContact NE2-O 2.65Å; H491-G518 PolarHBondContact CD2-O 2.77Å
492	L	97.7	Very high	93.1	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	127.8	177.3	-69.6	169.8	0	0	0	109.9	F460 F483 G484 M485 T507 V508 F520 I541	F460-L492 HydrophobicContact CE1-CD1 3.94Å; F460-L492 HydrophobicContact CE1-CD2 4.17Å; F460-L492 HydrophobicContact CE2-CD2 4.49Å; F460-L492 HydrophobicContact CZ-CD1 3.87Å; F460-L492 HydrophobicContact CZ-CD2 3.78Å; F460-L492 HydrophobicContact CZ-CG 4.28Å; F483-L492 HydrophobicContact CE1-CD2 4.26Å; F483-L492 HydrophobicContact CE2-CB 4.29Å; F483-L492 HydrophobicContact CZ-CB 4.2Å; F483-L492 HydrophobicContact CZ-CD1 4.02Å; F483-L492 HydrophobicContact CZ-CD2 4.04Å; F483-L492 HydrophobicContact CZ-CG 4.31Å; G484-L492 CarbonylContact O-C 3.51Å; G484-L492 WeakPolarHBondContact O-CA 3.45Å; M485-L492 HydrophobicContact CB-CD2 4.46Å; M485-L492 HydrophobicContact CE-CD2 4.35Å; L492-T507 CarbonylContact O-C 3.5Å; L492-T507 WeakPolarHBondContact O-CA 3.36Å; L492-V508 HydrophobicContact CB-CB 4.49Å; L492-V508 PolarHBondContact N-O 2.98Å; L492-V508 PolarHBondContact O-N 3.43Å; L492-F520 HydrophobicContact CB-CD2 4.28Å; L492-F520 HydrophobicContact CB-CE2 4.22Å; L492-F520 HydrophobicContact CD1-CD1 3.77Å; L492-F520 HydrophobicContact CD1-CD2 3.72Å; L492-F520 HydrophobicContact CD1-CE1 3.74Å; L492-F520 HydrophobicContact CD1-CE2 3.64Å; L492-F520 HydrophobicContact CD1-CG 3.76Å; L492-F520 HydrophobicContact CD1-CZ 3.67Å; L492-F520 HydrophobicContact CG-CB 4.3Å; L492-F520 HydrophobicContact CG-CD1 4.33Å; L492-F520 HydrophobicContact CG-CD2 3.51Å; L492-F520 HydrophobicContact CG-CE2 3.78Å; L492-F520 HydrophobicContact CG-CG 3.8Å; L492-F520 HydrophobicContact CG-CZ 4.33Å; L492-I541 HydrophobicContact CB-CD1 4.3Å; L492-I541 HydrophobicContact CD1-CD1 3.74Å; L492-I541 HydrophobicContact CD1-CG1 4.22Å; L492-I541 HydrophobicContact CD1-CG2 4.01Å
493	A	95.4	Very high	92.9	Very high	25 Å²	25	42.4 Å²	42.4	21%	0.207	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.4	-179.4	0	0	0	0	0	111.2	F483 G484 E486 Y506	F483-A493 WeakPolarHBondContact CA-O 3.49Å; G484-A493 PolarHBondContact N-O 3.15Å; G484-A493 PolarHBondContact O-N 3.22Å; E486-A493 HydrophobicContact CG-CB 3.97Å; A493-Y506 WeakPolarHBondContact CA-O 3.26Å
494	L	95.9	Very high	92.6	Very high	6 Å²	6	43.1 Å²	43.1	3%	0.031	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.6	168.1	174.7	67.4	0	0	0	109	I481 S482 F483 I496 K505 Y506 F530 V537 L539	I481-L494 HydrophobicContact CG2-CD1 4.25Å; S482-L494 WeakPolarHBondContact O-CA 3.4Å; F483-L494 HydrophobicContact CB-CD1 4.47Å; F483-L494 HydrophobicContact CD2-CB 4.26Å; F483-L494 HydrophobicContact CD2-CD1 4.43Å; L494-I496 HydrophobicContact CD1-CD1 4.36Å; L494-I496 HydrophobicContact CD1-CG1 4.15Å; L494-I496 HydrophobicContact CD2-CD1 4.14Å; L494-I496 HydrophobicContact CG-CD1 4.29Å; L494-I496 HydrophobicContact CG-CG1 4.21Å; L494-K505 CarbonylContact O-C 3.32Å; L494-K505 WeakPolarHBondContact O-CA 3.17Å; L494-Y506 PolarHBondContact N-O 3.19Å; L494-Y506 PolarHBondContact O-N 3.49Å; L494-F530 HydrophobicContact CD1-CD2 4.21Å; L494-F530 HydrophobicContact CD1-CE2 3.78Å; L494-F530 HydrophobicContact CD1-CZ 4.42Å; L494-F530 HydrophobicContact CD2-CD2 4.21Å; L494-F530 HydrophobicContact CD2-CE2 3.73Å; L494-F530 HydrophobicContact CG-CE2 4.42Å; L494-V537 HydrophobicContact CD2-CG1 4.25Å; L494-L539 HydrophobicContact CB-CD2 4.44Å; L494-L539 HydrophobicContact CD2-CD2 4.37Å
495	E	93.9	Very high	92.5	Very high	20 Å²	20	50 Å²	50	9%	0.093	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	124.7	174.7	-176.9	172	-148.3	0	0	110.3	Y480 I481 S482 I497 I504 K505 R571	Y480-E495 HydrophobicContact CE2-CB 4.41Å; Y480-E495 HydrophobicContact CE2-CG 3.93Å; Y480-E495 PolarHBondContact OH-OE1 3.35Å; Y480-E495 PolarHBondContact OH-OE2 3.42Å; I481-E495 CarbonylContact C-O 3.57Å; I481-E495 WeakPolarHBondContact CA-O 3.15Å; S482-E495 PolarHBondContact N-O 3.31Å; S482-E495 PolarHBondContact O-N 2.84Å; E495-I497 HydrophobicContact CG-CD1 4.27Å; E495-I497 HydrophobicContact CG-CG1 4.09Å; E495-I504 CarbonylContact C-O 3.5Å; E495-I504 VanDerWaalsContact CA-O 3.28Å; E495-I504 WeakPolarHBondContact CA-O 3.18Å; E495-K505 HydrophobicContact CG-CG 4.12Å; E495-K505 WeakPolarHBondContact OE1-CE 3.47Å; E495-K505 IonicContact OE1-NZ 3.51Å; E495-K505 PolarHBondContact OE1-NZ 3.39Å; E495-R571 IonicContact OE2-CZ 3.7Å; E495-R571 IonicContact OE2-NH1 3.05Å; E495-R571 IonicContact OE2-NH2 3.32Å; E495-R571 PolarHBondContact OE2-NH2 2.87Å
496	I	94.2	Very high	92.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	114.6	177.6	-56	173.4	0	0	0	108	I481 L494 L498 V501 I504 F530 M532 V537	I481-I496 HydrophobicContact CG1-CG1 4.22Å; I481-I496 HydrophobicContact CG1-CG2 4.09Å; I481-I496 HydrophobicContact CG2-CG1 4.26Å; L494-I496 HydrophobicContact CD1-CD1 4.36Å; L494-I496 HydrophobicContact CD1-CG1 4.15Å; L494-I496 HydrophobicContact CD2-CD1 4.14Å; L494-I496 HydrophobicContact CG-CD1 4.29Å; L494-I496 HydrophobicContact CG-CG1 4.21Å; I496-L498 HydrophobicContact CG2-CD1 3.99Å; I496-L498 HydrophobicContact CG2-CG 3.97Å; I496-V501 HydrophobicContact CG2-CG1 4.36Å; I496-I504 HydrophobicContact CB-CB 4.11Å; I496-I504 HydrophobicContact CD1-CB 4.41Å; I496-I504 HydrophobicContact CD1-CD1 4Å; I496-I504 HydrophobicContact CG1-CB 4.47Å; I496-I504 PolarHBondContact N-O 2.8Å; I496-I504 PolarHBondContact O-N 2.85Å; I496-I504 VanDerWaalsContact O-N 3.1Å; I496-F530 HydrophobicContact CD1-CE2 4.28Å; I496-F530 HydrophobicContact CD1-CZ 4.15Å; I496-M532 HydrophobicContact CD1-SD 4.03Å; I496-M532 HydrophobicContact CG2-CE 3.98Å; I496-M532 HydrophobicContact CG2-SD 4.28Å; I496-V537 HydrophobicContact CD1-CG1 3.94Å; I496-V537 HydrophobicContact CD1-CG2 4.18Å
497	I	92.4	Very high	92.6	Very high	39 Å²	39	53.4 Å²	53.4	20%	0.2	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	97.2	173.9	-56.7	-176.5	0	0	0	105.9	N479 Y480 E495 I503	N479-I497 CarbonylContact C-O 3.57Å; N479-I497 VanDerWaalsContact C-O 3.29Å; N479-I497 WeakPolarHBondContact CA-O 3.41Å; N479-I497 VanDerWaalsContact CB-O 3.31Å; N479-I497 WeakPolarHBondContact CB-O 3.41Å; Y480-I497 HydrophobicContact CE1-CD1 3.92Å; Y480-I497 HydrophobicContact CE2-CD1 4.42Å; Y480-I497 PolarHBondContact N-O 2.86Å; Y480-I497 PolarHBondContact O-N 3.13Å; Y480-I497 WeakPolarHBondContact OH-CD1 3.33Å; E495-I497 HydrophobicContact CG-CD1 4.27Å; E495-I497 HydrophobicContact CG-CG1 4.09Å; I497-I503 HydrophobicContact CG1-CG2 4.32Å
498	L	92.5	Very high	92.9	Very high	10 Å²	10	48.9 Å²	48.9	5%	0.052	25%	0.246	C	C	.	.			trans	-131.5	153.2	179.5	-67.6	178.3	0	0	0	110.4	V474 N479 I481 I496 G500 V501 M532 L556 F558	V474-L498 HydrophobicContact CG1-CD2 4.16Å; V474-L498 HydrophobicContact CG2-CD2 3.82Å; N479-L498 HydrophobicContact CB-CD2 4.18Å; I481-L498 HydrophobicContact CD1-CD1 4.01Å; I481-L498 HydrophobicContact CG1-CD1 4.12Å; I481-L498 HydrophobicContact CG1-CG 4.41Å; I496-L498 HydrophobicContact CG2-CD1 3.99Å; I496-L498 HydrophobicContact CG2-CG 3.97Å; L498-G500 PolarHBondContact O-N 2.62Å; L498-V501 HydrophobicContact CB-CB 4.14Å; L498-V501 HydrophobicContact CB-CG2 3.79Å; L498-V501 PolarHBondContact O-N 2.6Å; L498-V501 VanDerWaalsContact O-N 3.15Å; L498-M532 HydrophobicContact CD1-CE 3.89Å; L498-M532 HydrophobicContact CD1-SD 4.26Å; L498-L556 HydrophobicContact CD1-CD2 4.13Å; L498-F558 HydrophobicContact CD1-CE1 3.92Å
499	P	89.4	Confident	93.3	Very high	64 Å²	64	48.4 Å²	48.4	42%	0.416	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	129.6	177.1	-22.2	34.8	0	0	0	110.9	N479 V501 L554	N479-P499 HydrophobicContact CB-CG 4.39Å; N479-P499 VanDerWaalsContact CG-CD 3.49Å; N479-P499 WeakPolarHBondContact OD1-CD 3.38Å; P499-V501 PolarHBondContact O-N 2.72Å; P499-L554 HydrophobicContact CB-CD1 3.84Å
500	G	90.4	Very high	93.4	Very high	24 Å²	24	47.9 Å²	47.9	25%	0.247	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	6	177.8	0	0	0	0	0	115.5	L498 M552 T553	L498-G500 PolarHBondContact O-N 2.62Å; G500-M552 WeakPolarHBondContact O-CA 3.07Å; G500-T553 WeakPolarHBondContact CA-OG1 3.22Å; G500-T553 PolarHBondContact O-N 2.85Å; G500-T553 PolarHBondContact O-OG1 2.82Å; G500-T553 VanDerWaalsContact O-OG1 3.05Å
501	V	89.6	Confident	93.4	Very high	15 Å²	15	54.5 Å²	54.5	9%	0.091	26%	0.26	C	S	.	.	S	Bend	trans	-106.6	131.5	173.2	-172.9	0	0	0	0	108.3	I496 L498 P499 I503 I504 M532 M552 L556	I496-V501 HydrophobicContact CG2-CG1 4.36Å; L498-V501 HydrophobicContact CB-CB 4.14Å; L498-V501 HydrophobicContact CB-CG2 3.79Å; L498-V501 PolarHBondContact O-N 2.6Å; L498-V501 VanDerWaalsContact O-N 3.15Å; P499-V501 PolarHBondContact O-N 2.72Å; V501-I503 PolarHBondContact O-N 2.87Å; V501-I504 HydrophobicContact CG1-CD1 4.44Å; V501-M532 HydrophobicContact CG1-CE 4.44Å; V501-M532 HydrophobicContact CG2-CE 4.41Å; V501-M552 HydrophobicContact CG1-CE 4.25Å; V501-M552 HydrophobicContact CG1-CG 4.42Å; V501-M552 HydrophobicContact CG2-CB 4.44Å; V501-M552 HydrophobicContact CG2-CE 4.48Å; V501-M552 HydrophobicContact CG2-CG 3.98Å; V501-M552 HydrophobicContact CG2-SD 4.06Å; V501-L556 HydrophobicContact CG2-CD2 3.88Å
502	Y	89	Confident	93	Very high	161 Å²	161	55.7 Å²	55.7	63%	0.631	27%	0.268	S	S	*	.			trans	-61.8	132.9	168.3	-70.8	-74.8	0	0	0	108.9	I504	Y502-I504 WeakPolarHBondContact O-CG1 3.43Å; Y502-I504 PolarHBondContact O-N 2.74Å; Y502-I504 VanDerWaalsContact O-N 3.13Å
503	I	89.8	Confident	92.5	Very high	113 Å²	113	61.8 Å²	61.8	58%	0.579	31%	0.31	S	S	*	.			trans	-52.1	122.8	-178.2	-63.8	171.8	0	0	0	109.5	I497 V501 K505	I497-I503 HydrophobicContact CG1-CG2 4.32Å; V501-I503 PolarHBondContact O-N 2.87Å; I503-K505 HydrophobicContact CG2-CG 4.08Å
504	I	89.9	Confident	92	Very high	16 Å²	16	62.7 Å²	62.7	8%	0.082	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.2	173.8	-59.7	165.9	0	0	0	106.8	E495 I496 V501 Y502 V537 Q550	E495-I504 CarbonylContact C-O 3.5Å; E495-I504 VanDerWaalsContact CA-O 3.28Å; E495-I504 WeakPolarHBondContact CA-O 3.18Å; I496-I504 HydrophobicContact CB-CB 4.11Å; I496-I504 HydrophobicContact CD1-CB 4.41Å; I496-I504 HydrophobicContact CD1-CD1 4Å; I496-I504 HydrophobicContact CG1-CB 4.47Å; I496-I504 PolarHBondContact N-O 2.8Å; I496-I504 PolarHBondContact O-N 2.85Å; I496-I504 VanDerWaalsContact O-N 3.1Å; V501-I504 HydrophobicContact CG1-CD1 4.44Å; Y502-I504 WeakPolarHBondContact O-CG1 3.43Å; Y502-I504 PolarHBondContact O-N 2.74Å; Y502-I504 VanDerWaalsContact O-N 3.13Å; I504-V537 HydrophobicContact CD1-CG2 3.96Å; I504-Q550 HydrophobicContact CD1-CG 4.23Å
505	K	92.6	Very high	91.6	Very high	146 Å²	146	62.9 Å²	62.9	64%	0.635	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	112.9	164.2	-66.3	-172.7	-174.8	-141.3	0	107.2	L494 E495 I503	L494-K505 CarbonylContact O-C 3.32Å; L494-K505 WeakPolarHBondContact O-CA 3.17Å; E495-K505 HydrophobicContact CG-CG 4.12Å; E495-K505 WeakPolarHBondContact OE1-CE 3.47Å; E495-K505 IonicContact OE1-NZ 3.51Å; E495-K505 PolarHBondContact OE1-NZ 3.39Å; I503-K505 HydrophobicContact CG2-CG 4.08Å
506	Y	93.4	Very high	91.1	Very high	88 Å²	88	68.2 Å²	68.2	35%	0.345	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	117.9	-176.6	-168.2	-112.3	0	0	0	110.1	A493 L494 V508 L539 Y546	A493-Y506 WeakPolarHBondContact CA-O 3.26Å; L494-Y506 PolarHBondContact N-O 3.19Å; L494-Y506 PolarHBondContact O-N 3.49Å; Y506-V508 HydrophobicContact CD1-CG2 3.56Å; Y506-V508 HydrophobicContact CE1-CG2 3.31Å; Y506-L539 HydrophobicContact CD1-CD2 4.46Å; Y506-Y546 AromaticContact CE1-CD1 3.71Å; Y506-Y546 HydrophobicContact CE1-CD1 3.71Å; Y506-Y546 HydrophobicContact CE1-CE1 4.34Å; Y506-Y546 AromaticContact CE1-CG 3.81Å; Y506-Y546 HydrophobicContact CE1-CG 3.81Å; Y506-Y546 AromaticContact CZ-CD1 3.79Å; Y506-Y546 WeakPolarHBondContact OH-CD1 3.16Å; Y506-Y546 WeakPolarHBondContact OH-CE1 3.28Å
507	T	95.7	Very high	90.8	Very high	61 Å²	61	75 Å²	75	37%	0.374	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	129.6	178.4	-55.7	0	0	0	0	109.4	E486 H491 L492	E486-T507 VanDerWaalsContact OE1-CG2 3.22Å; E486-T507 WeakPolarHBondContact OE1-CG2 3.42Å; E486-T507 PolarHBondContact OE1-OG1 3.38Å; H491-T507 HydrophobicContact CB-CG2 3.4Å; L492-T507 CarbonylContact O-C 3.5Å; L492-T507 WeakPolarHBondContact O-CA 3.36Å
508	V	96.4	Very high	90.9	Very high	4 Å²	4	73.6 Å²	73.6	2%	0.024	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.4	-178.8	-177.5	0	0	0	0	108.9	H491 L492 Y506 F520 L539 I541 Y546	H491-V508 WeakPolarHBondContact CB-O 3.12Å; L492-V508 HydrophobicContact CB-CB 4.49Å; L492-V508 PolarHBondContact N-O 2.98Å; L492-V508 PolarHBondContact O-N 3.43Å; Y506-V508 HydrophobicContact CD1-CG2 3.56Å; Y506-V508 HydrophobicContact CE1-CG2 3.31Å; V508-F520 HydrophobicContact CG1-CE2 4.49Å; V508-F520 HydrophobicContact CG1-CZ 4.44Å; V508-F520 WeakPolarHBondContact O-CE2 3.17Å; V508-L539 HydrophobicContact CG2-CD2 4.16Å; V508-I541 HydrophobicContact CB-CD1 3.84Å; V508-I541 HydrophobicContact CG1-CD1 3.77Å; V508-I541 HydrophobicContact CG2-CD1 3.94Å; V508-Y546 HydrophobicContact CG1-CE2 3.79Å; V508-Y546 WeakPolarHBondContact CG1-OH 3.49Å; V508-Y546 HydrophobicContact CG2-CD2 4.44Å; V508-Y546 HydrophobicContact CG2-CE2 4.27Å
509	R	96.7	Very high	91	Very high	171 Å²	171	73.9 Å²	73.9	65%	0.645	38%	0.381	S	S	*	.			trans	-93.6	145.8	173.8	-54.4	-169.8	-71.6	-170.7	-2.8	110.1	K511 F520	R509-K511 PolarHBondContact O-N 3.16Å; R509-F520 VanDerWaalsContact C-CE2 3.45Å
510	N	95.8	Very high	91.3	Very high	13 Å²	13	71 Å²	71	7%	0.07	36%	0.362	C	S	.	.			trans	-62.4	125.3	169.8	-170.9	-10	0	0	0	108.1	D512 A515 G518 T519 F520 D522 H526	N510-D512 VanDerWaalsContact C-N 3.34Å; N510-D512 VanDerWaalsContact OD1-CB 3.23Å; N510-D512 WeakPolarHBondContact OD1-CB 3.07Å; N510-D512 PolarHBondContact OD1-N 3.05Å; N510-A515 HydrophobicContact CB-CB 3.95Å; N510-A515 WeakPolarHBondContact ND2-CB 3Å; N510-G518 VanDerWaalsContact CB-O 3.24Å; N510-G518 WeakPolarHBondContact CB-O 3.36Å; N510-G518 PolarHBondContact N-O 3.44Å; N510-T519 VanDerWaalsContact CB-O 3.3Å; N510-T519 WeakPolarHBondContact CB-O 3.41Å; N510-T519 PolarHBondContact ND2-O 3.14Å; N510-F520 VanDerWaalsContact CA-CZ 3.48Å; N510-F520 HydrophobicContact CB-CD1 4.13Å; N510-F520 HydrophobicContact CB-CD2 3.94Å; N510-F520 HydrophobicContact CB-CE1 3.99Å; N510-F520 HydrophobicContact CB-CE2 3.82Å; N510-F520 HydrophobicContact CB-CG 4.11Å; N510-F520 HydrophobicContact CB-CZ 3.84Å; N510-D522 PolarHBondContact ND2-OD2 2.84Å; N510-H526 PolarHBondContact ND2-CE1 3.45Å
511	K	92.9	Very high	91.5	Very high	139 Å²	139	70.5 Å²	70.5	60%	0.604	36%	0.356	S	S	*	.			trans	-90.6	-1.8	-178.5	-66.3	-161	-171.2	167.9	0	113	R509 S513 I544 Y546	R509-K511 PolarHBondContact O-N 3.16Å; K511-S513 PolarHBondContact O-N 3.05Å; K511-I544 HydrophobicContact CB-CD1 4.17Å; K511-I544 HydrophobicContact CD-CD1 3.82Å; K511-I544 HydrophobicContact CG-CD1 4.16Å; K511-Y546 VanDerWaalsContact CE-OH 3.3Å; K511-Y546 WeakPolarHBondContact CE-OH 3.33Å
512	D	89.7	Confident	91.6	Very high	54 Å²	54	71.5 Å²	71.5	29%	0.289	36%	0.361	S	S	.	.			trans	-60.5	124.2	169.9	-177.6	-12.4	0	0	0	109.9	R250 N510 A514 A515	R250-D512 IonicContact CZ-OD2 2.76Å; R250-D512 VanDerWaalsContact NH1-CG 3.28Å; R250-D512 IonicContact NH1-OD1 2.95Å; R250-D512 PolarHBondContact NH1-OD1 2.84Å; R250-D512 IonicContact NH1-OD2 3.28Å; R250-D512 PolarHBondContact NH1-OD2 2.81Å; R250-D512 IonicContact NH2-OD2 2.68Å; R250-D512 PolarHBondContact NH2-OD2 2.93Å; N510-D512 VanDerWaalsContact C-N 3.34Å; N510-D512 VanDerWaalsContact OD1-CB 3.23Å; N510-D512 WeakPolarHBondContact OD1-CB 3.07Å; N510-D512 PolarHBondContact OD1-N 3.05Å; D512-A514 PolarHBondContact O-N 3.22Å; D512-A514 PolarHBondContact OD1-N 2.82Å; D512-A515 HydrophobicContact CB-CB 4.07Å; D512-A515 WeakPolarHBondContact O-CB 3.11Å; D512-A515 PolarHBondContact O-N 3.48Å; D512-A515 VanDerWaalsContact O-N 3.08Å
513	S	86.7	Confident	91.7	Very high	128 Å²	128	64 Å²	64	90%	0.895	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.1	-178.6	50.5	0	0	0	0	113.8	K511	K511-S513 PolarHBondContact O-N 3.05Å
514	A	84.5	Confident	91.9	Very high	44 Å²	44	59.5 Å²	59.5	36%	0.364	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	0.2	177.6	0	0	0	0	0	113.1	D512 I516	D512-A514 PolarHBondContact O-N 3.22Å; D512-A514 PolarHBondContact OD1-N 2.82Å; A514-I516 PolarHBondContact O-N 2.9Å
515	A	87.6	Confident	92.1	Very high	10 Å²	10	61.4 Å²	61.4	8%	0.083	32%	0.316	C	S	.	.	S	Bend	trans	-74.8	111.5	170	0	0	0	0	0	110.6	N510 D512 N517 G518	N510-A515 HydrophobicContact CB-CB 3.95Å; N510-A515 WeakPolarHBondContact ND2-CB 3Å; D512-A515 HydrophobicContact CB-CB 4.07Å; D512-A515 WeakPolarHBondContact O-CB 3.11Å; D512-A515 PolarHBondContact O-N 3.48Å; D512-A515 VanDerWaalsContact O-N 3.08Å; A515-N517 PolarHBondContact O-N 2.71Å; A515-N517 VanDerWaalsContact O-N 3.16Å; A515-G518 PolarHBondContact O-N 2.94Å
516	I	83.5	Confident	92.3	Very high	132 Å²	132	54.8 Å²	54.8	68%	0.677	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-57.4	121	179.2	-58.1	171.1	0	0	0	109.2	A514 G518 T519	A514-I516 PolarHBondContact O-N 2.9Å; I516-G518 PolarHBondContact O-N 2.82Å; I516-T519 VanDerWaalsContact O-CG2 3.24Å; I516-T519 WeakPolarHBondContact O-CG2 3.37Å; I516-T519 PolarHBondContact O-N 2.79Å; I516-T519 VanDerWaalsContact O-N 3.15Å
517	N	89.3	Confident	92.5	Very high	143 Å²	143	52 Å²	52	77%	0.765	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	53.8	21.4	-177.3	-62.2	-30.4	0	0	0	114.9	H491 A515 T519	H491-N517 PolarHBondContact NE2-O 2.65Å; A515-N517 PolarHBondContact O-N 2.71Å; A515-N517 VanDerWaalsContact O-N 3.16Å; N517-T519 VanDerWaalsContact C-N 3.32Å; N517-T519 PolarHBondContact O-N 3.45Å
518	G	93.5	Very high	92.6	Very high	10 Å²	10	49 Å²	49	10%	0.103	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	67.7	26.2	-178.6	0	0	0	0	0	114.4	H491 N510 A515 I516	H491-G518 PolarHBondContact CD2-O 2.77Å; N510-G518 VanDerWaalsContact CB-O 3.24Å; N510-G518 WeakPolarHBondContact CB-O 3.36Å; N510-G518 PolarHBondContact N-O 3.44Å; A515-G518 PolarHBondContact O-N 2.94Å; I516-G518 PolarHBondContact O-N 2.82Å
519	T	94.7	Very high	92.7	Very high	15 Å²	15	52.5 Å²	52.5	9%	0.092	28%	0.277	C	S	.	.			trans	-68.7	147	175.6	-173.1	0	0	0	0	112.4	N510 I516 N517 A521	N510-T519 VanDerWaalsContact CB-O 3.3Å; N510-T519 WeakPolarHBondContact CB-O 3.41Å; N510-T519 PolarHBondContact ND2-O 3.14Å; I516-T519 VanDerWaalsContact O-CG2 3.24Å; I516-T519 WeakPolarHBondContact O-CG2 3.37Å; I516-T519 PolarHBondContact O-N 2.79Å; I516-T519 VanDerWaalsContact O-N 3.15Å; N517-T519 VanDerWaalsContact C-N 3.32Å; N517-T519 PolarHBondContact O-N 3.45Å; T519-A521 PolarHBondContact OG1-N 3.12Å; T519-A521 VanDerWaalsContact OG1-N 3.07Å
520	F	96.5	Very high	92.7	Very high	3 Å²	3	44.6 Å²	44.6	1%	0.013	25%	0.248	C	C	.	.	S	Bend	trans	-94.9	-2.1	167.2	-75.5	-86.9	0	0	0	113	F460 M485 G490 L492 V508 R509 N510 D522 H526 I541	F460-F520 HydrophobicContact CE2-CB 4.15Å; F460-F520 HydrophobicContact CZ-CB 3.92Å; F460-F520 AromaticContact CZ-CD1 3.99Å; F460-F520 HydrophobicContact CZ-CD1 3.99Å; F460-F520 HydrophobicContact CZ-CG 4.2Å; M485-F520 HydrophobicContact CE-CB 3.83Å; G490-F520 PolarHBondContact O-N 2.84Å; L492-F520 HydrophobicContact CB-CD2 4.28Å; L492-F520 HydrophobicContact CB-CE2 4.22Å; L492-F520 HydrophobicContact CD1-CD1 3.77Å; L492-F520 HydrophobicContact CD1-CD2 3.72Å; L492-F520 HydrophobicContact CD1-CE1 3.74Å; L492-F520 HydrophobicContact CD1-CE2 3.64Å; L492-F520 HydrophobicContact CD1-CG 3.76Å; L492-F520 HydrophobicContact CD1-CZ 3.67Å; L492-F520 HydrophobicContact CG-CB 4.3Å; L492-F520 HydrophobicContact CG-CD1 4.33Å; L492-F520 HydrophobicContact CG-CD2 3.51Å; L492-F520 HydrophobicContact CG-CE2 3.78Å; L492-F520 HydrophobicContact CG-CG 3.8Å; L492-F520 HydrophobicContact CG-CZ 4.33Å; V508-F520 HydrophobicContact CG1-CE2 4.49Å; V508-F520 HydrophobicContact CG1-CZ 4.44Å; V508-F520 WeakPolarHBondContact O-CE2 3.17Å; R509-F520 VanDerWaalsContact C-CE2 3.45Å; N510-F520 VanDerWaalsContact CA-CZ 3.48Å; N510-F520 HydrophobicContact CB-CD1 4.13Å; N510-F520 HydrophobicContact CB-CD2 3.94Å; N510-F520 HydrophobicContact CB-CE1 3.99Å; N510-F520 HydrophobicContact CB-CE2 3.82Å; N510-F520 HydrophobicContact CB-CG 4.11Å; N510-F520 HydrophobicContact CB-CZ 3.84Å; F520-D522 PolarHBondContact O-N 2.76Å; F520-H526 HydrophobicContact CD1-CB 4.33Å; F520-H526 AromaticContact CD1-CD2 3.77Å; F520-H526 AromaticContact CD1-CE1 3.63Å; F520-H526 AromaticContact CD1-CG 3.65Å; F520-H526 AromaticContact CD1-ND1 3.57Å; F520-H526 AromaticContact CD1-NE2 3.71Å; F520-H526 AromaticContact CE1-ND1 3.77Å; F520-I541 HydrophobicContact CE1-CG2 3.58Å; F520-I541 HydrophobicContact CZ-CG2 3.68Å
521	A	94	Very high	92.7	Very high	15 Å²	15	45.3 Å²	45.3	12%	0.124	25%	0.253	C	S	.	.			trans	-86.5	54.5	170.9	0	0	0	0	0	110.6	T462 K465 M485 T519	T462-A521 HydrophobicContact CG2-CB 4.33Å; T462-A521 CarbonylContact O-C 3.44Å; T462-A521 WeakPolarHBondContact O-CA 3.4Å; K465-A521 HydrophobicContact CG-CB 4Å; M485-A521 HydrophobicContact SD-CB 3.99Å; T519-A521 PolarHBondContact OG1-N 3.12Å; T519-A521 VanDerWaalsContact OG1-N 3.07Å
522	D	91.9	Very high	92.8	Very high	35 Å²	35	38.7 Å²	38.7	19%	0.187	23%	0.225	C	C	.	.	S	Bend	trans	-107.1	4.4	-175.2	68.9	0.2	0	0	0	113.2	R250 N510 F520 L524 H526	R250-D522 IonicContact NH2-OD2 3.2Å; R250-D522 PolarHBondContact NH2-OD2 2.87Å; N510-D522 PolarHBondContact ND2-OD2 2.84Å; F520-D522 PolarHBondContact O-N 2.76Å; D522-L524 VanDerWaalsContact C-N 3.25Å; D522-L524 PolarHBondContact O-N 3.42Å; D522-L524 WeakPolarHBondContact OD1-CB 3.49Å; D522-L524 PolarHBondContact OD1-N 3.29Å; D522-H526 IonicContact OD1-CD2 2.79Å; D522-H526 IonicContact OD1-CE1 3.91Å; D522-H526 IonicContact OD1-NE2 4Å; D522-H526 PolarHBondContact OD1-NE2 2.87Å; D522-H526 IonicContact OD2-CE1 2.81Å; D522-H526 IonicContact OD2-NE2 2.68Å
523	G	91.9	Very high	92.9	Very high	4 Å²	4	37.5 Å²	37.5	4%	0.041	22%	0.221	C	C	.	.	S	Bend	trans	76.3	5.1	-179.2	0	0	0	0	0	114.6	R461 T462	R461-G523 WeakPolarHBondContact CG-O 3.17Å; R461-G523 VanDerWaalsContact CZ-O 3.28Å; R461-G523 PolarHBondContact NE-O 2.81Å; R461-G523 PolarHBondContact NH2-O 3.13Å; T462-G523 WeakPolarHBondContact O-CA 2.92Å; T462-G523 PolarHBondContact O-N 2.93Å
524	L	93.3	Very high	93.2	Very high	18 Å²	18	34.9 Å²	34.9	9%	0.094	20%	0.195	C	C	.	.	S	Bend	trans	-92.7	163	175.6	-58.3	-174.6	0	0	0	112	I229 R250 R461 D522	I229-L524 HydrophobicContact CD1-CD2 4.18Å; I229-L524 HydrophobicContact CG2-CD2 4.39Å; R250-L524 HydrophobicContact CB-CD2 4.32Å; R461-L524 WeakPolarHBondContact CA-O 3.37Å; R461-L524 WeakPolarHBondContact CG-O 3.26Å; D522-L524 VanDerWaalsContact C-N 3.25Å; D522-L524 PolarHBondContact O-N 3.42Å; D522-L524 WeakPolarHBondContact OD1-CB 3.49Å; D522-L524 PolarHBondContact OD1-N 3.29Å
525	W	94.1	Very high	93.6	Very high	57 Å²	57	35.4 Å²	35.4	22%	0.216	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	126.2	169.8	-76.1	105.4	0	0	0	110.4	V430 D459 F460 R461 C577 R579 C607	V430-W525 HydrophobicContact CG1-CH2 4.24Å; V430-W525 HydrophobicContact CG1-CZ2 4.43Å; D459-W525 HydrophobicContact CB-CE3 3.89Å; D459-W525 HydrophobicContact CB-CZ3 4.3Å; F460-W525 VanDerWaalsContact C-CE3 3.5Å; F460-W525 CarbonylContact O-C 3.53Å; F460-W525 WeakPolarHBondContact O-CA 2.91Å; R461-W525 HydrophobicContact CB-CD2 3.65Å; R461-W525 HydrophobicContact CB-CE3 3.61Å; R461-W525 HydrophobicContact CB-CG 4.22Å; R461-W525 HydrophobicContact CB-CH2 4.14Å; R461-W525 HydrophobicContact CB-CZ2 4.17Å; R461-W525 HydrophobicContact CB-CZ3 3.85Å; R461-W525 HydrophobicContact CG-CD2 4.43Å; W525-C577 HydrophobicContact CH2-CB 3.57Å; W525-C577 HydrophobicContact CZ2-CB 4.21Å; W525-C577 HydrophobicContact CZ3-CB 4.22Å; W525-R579 HydrophobicContact CE3-CG 4.14Å; W525-R579 HydrophobicContact CH2-CB 4.16Å; W525-R579 HydrophobicContact CH2-CG 3.92Å; W525-R579 HydrophobicContact CZ3-CB 4.23Å; W525-R579 HydrophobicContact CZ3-CG 3.66Å; W525-C607 HydrophobicContact CZ2-CB 4.13Å
526	H	96.6	Very high	93.9	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.028	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.3	176	-66.8	-74.5	0	0	0	110.8	D459 F460 N510 F520 D522 D542	D459-H526 CarbonylContact C-O 3.6Å; D459-H526 WeakPolarHBondContact CA-O 3.41Å; F460-H526 HydrophobicContact CD1-CB 3.95Å; F460-H526 HydrophobicContact CE1-CB 3.45Å; F460-H526 VanDerWaalsContact CE1-CB 3.45Å; F460-H526 HydrophobicContact CE2-CB 4.33Å; F460-H526 HydrophobicContact CZ-CB 3.65Å; F460-H526 AromaticContact CZ-CD2 3.98Å; F460-H526 PolarHBondContact N-O 3.46Å; F460-H526 PolarHBondContact O-N 2.82Å; N510-H526 PolarHBondContact ND2-CE1 3.45Å; F520-H526 HydrophobicContact CD1-CB 4.33Å; F520-H526 AromaticContact CD1-CD2 3.77Å; F520-H526 AromaticContact CD1-CE1 3.63Å; F520-H526 AromaticContact CD1-CG 3.65Å; F520-H526 AromaticContact CD1-ND1 3.57Å; F520-H526 AromaticContact CD1-NE2 3.71Å; F520-H526 AromaticContact CE1-ND1 3.77Å; D522-H526 IonicContact OD1-CD2 2.79Å; D522-H526 IonicContact OD1-CE1 3.91Å; D522-H526 IonicContact OD1-NE2 4Å; D522-H526 PolarHBondContact OD1-NE2 2.87Å; D522-H526 IonicContact OD2-CE1 2.81Å; D522-H526 IonicContact OD2-NE2 2.68Å; H526-D542 VanDerWaalsContact CA-OD1 3.28Å; H526-D542 WeakPolarHBondContact CA-OD1 3.19Å; H526-D542 IonicContact CE1-OD2 2.93Å; H526-D542 IonicContact CG-OD2 3.32Å; H526-D542 IonicContact ND1-OD1 3.01Å; H526-D542 IonicContact ND1-OD2 3.95Å; H526-D542 PolarHBondContact ND1-OD2 3.47Å
527	S	97.4	Very high	94.5	Very high	29 Å²	29	31.6 Å²	31.6	20%	0.203	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.2	-178.5	-163.8	0	0	0	0	111.6	D459 I541 D542	D459-S527 WeakPolarHBondContact OD1-CA 3.37Å; D459-S527 WeakPolarHBondContact OD1-CB 3.36Å; D459-S527 PolarHBondContact OD1-OG 2.87Å; S527-I541 CarbonylContact O-C 3.59Å; S527-I541 VanDerWaalsContact O-CA 3.3Å; S527-I541 WeakPolarHBondContact O-CA 3.41Å; S527-D542 PolarHBondContact N-OD1 3.17Å; S527-D542 PolarHBondContact O-N 3.47Å
528	V	98	Very high	94.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.2	-178.6	179.4	0	0	0	0	110.2	F456 E457 F458 F460 F483 L539 I540 I541	F456-V528 HydrophobicContact CE2-CG1 3.94Å; E457-V528 WeakPolarHBondContact CA-O 3.48Å; F458-V528 HydrophobicContact CD2-CB 4.22Å; F458-V528 HydrophobicContact CE2-CB 3.91Å; F458-V528 HydrophobicContact CE2-CG1 4.32Å; F458-V528 HydrophobicContact CE2-CG2 4Å; F458-V528 HydrophobicContact CZ-CB 4.27Å; F458-V528 HydrophobicContact CZ-CG1 4.19Å; F458-V528 PolarHBondContact N-O 3Å; F458-V528 PolarHBondContact O-N 2.73Å; F460-V528 HydrophobicContact CD1-CG2 3.73Å; F460-V528 HydrophobicContact CE1-CG2 3.62Å; F483-V528 HydrophobicContact CD1-CG1 4.38Å; F483-V528 HydrophobicContact CE1-CB 4.34Å; F483-V528 HydrophobicContact CE1-CG1 3.66Å; F483-V528 HydrophobicContact CE1-CG2 3.9Å; F483-V528 HydrophobicContact CE2-CG1 4.32Å; F483-V528 HydrophobicContact CZ-CB 4.4Å; F483-V528 HydrophobicContact CZ-CG1 3.59Å; F483-V528 HydrophobicContact CZ-CG2 3.86Å; V528-L539 HydrophobicContact CG1-CD1 4.18Å; V528-I540 CarbonylContact C-O 3.6Å; V528-I540 WeakPolarHBondContact CA-O 3.27Å; V528-I541 HydrophobicContact CG2-CG1 4.48Å
529	K	98	Very high	95	Very high	77 Å²	77	25.9 Å²	25.9	34%	0.335	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.6	169.3	-58.1	169.9	169.7	159.8	0	110	E457 L539 I540	E457-K529 HydrophobicContact CB-CG 4.05Å; E457-K529 HydrophobicContact CG-CG 3.78Å; E457-K529 WeakPolarHBondContact OE1-CE 3.48Å; E457-K529 IonicContact OE1-NZ 3.38Å; K529-L539 CarbonylContact O-C 3.55Å; K529-L539 WeakPolarHBondContact O-CA 3.32Å; K529-I540 HydrophobicContact CB-CB 4.13Å; K529-I540 HydrophobicContact CB-CD1 4.44Å; K529-I540 PolarHBondContact N-O 3.34Å; K529-I540 PolarHBondContact O-N 2.89Å
530	F	97.4	Very high	95.1	Very high	5 Å²	5	27.3 Å²	27.3	2%	0.022	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	140.3	177.5	175.3	-93.8	0	0	0	110.7	L454 Q455 F456 I481 L494 I496 M532 V537 I538 L539	L454-F530 HydrophobicContact CD2-CE1 4.42Å; Q455-F530 VanDerWaalsContact CA-O 3.27Å; Q455-F530 WeakPolarHBondContact CA-O 3.4Å; F456-F530 HydrophobicContact CD1-CB 3.73Å; F456-F530 AromaticContact CD1-CD1 3.46Å; F456-F530 HydrophobicContact CD1-CD1 3.46Å; F456-F530 VanDerWaalsContact CD1-CD1 3.46Å; F456-F530 HydrophobicContact CD1-CE1 4.33Å; F456-F530 AromaticContact CD1-CG 3.88Å; F456-F530 HydrophobicContact CD1-CG 3.88Å; F456-F530 HydrophobicContact CD2-CB 3.87Å; F456-F530 HydrophobicContact CE1-CB 3.36Å; F456-F530 AromaticContact CE1-CD1 3.15Å; F456-F530 HydrophobicContact CE1-CD1 3.15Å; F456-F530 HydrophobicContact CE1-CD2 4.14Å; F456-F530 AromaticContact CE1-CE1 3.9Å; F456-F530 HydrophobicContact CE1-CE1 3.9Å; F456-F530 AromaticContact CE1-CG 3.28Å; F456-F530 HydrophobicContact CE1-CG 3.28Å; F456-F530 HydrophobicContact CE2-CB 3.51Å; F456-F530 HydrophobicContact CE2-CG 4.31Å; F456-F530 HydrophobicContact CG-CB 3.99Å; F456-F530 HydrophobicContact CG-CD1 4.43Å; F456-F530 HydrophobicContact CZ-CB 3.23Å; F456-F530 AromaticContact CZ-CD1 3.93Å; F456-F530 HydrophobicContact CZ-CD1 3.93Å; F456-F530 HydrophobicContact CZ-CD2 4.18Å; F456-F530 AromaticContact CZ-CG 3.53Å; F456-F530 HydrophobicContact CZ-CG 3.53Å; F456-F530 PolarHBondContact N-O 3.21Å; F456-F530 VanDerWaalsContact N-O 3.1Å; F456-F530 PolarHBondContact O-N 2.88Å; I481-F530 HydrophobicContact CG2-CE1 4.46Å; I481-F530 HydrophobicContact CG2-CZ 4.26Å; L494-F530 HydrophobicContact CD1-CD2 4.21Å; L494-F530 HydrophobicContact CD1-CE2 3.78Å; L494-F530 HydrophobicContact CD1-CZ 4.42Å; L494-F530 HydrophobicContact CD2-CD2 4.21Å; L494-F530 HydrophobicContact CD2-CE2 3.73Å; L494-F530 HydrophobicContact CG-CE2 4.42Å; I496-F530 HydrophobicContact CD1-CE2 4.28Å; I496-F530 HydrophobicContact CD1-CZ 4.15Å; F530-M532 HydrophobicContact CE1-CB 3.63Å; F530-M532 HydrophobicContact CZ-CB 3.61Å; F530-M532 HydrophobicContact CZ-SD 4.31Å; F530-V537 HydrophobicContact CE2-CG1 3.68Å; F530-V537 HydrophobicContact CZ-CG1 4.22Å; F530-I538 CarbonylContact C-O 3.59Å; F530-I538 WeakPolarHBondContact CA-O 3.45Å; F530-L539 HydrophobicContact CB-CD1 4.45Å; F530-L539 HydrophobicContact CD2-CD1 4.46Å
531	S	95.6	Very high	95.2	Very high	27 Å²	27	27.3 Å²	27.3	19%	0.189	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	125.3	172.7	-175.1	0	0	0	0	109.9	L454 Q455 I538	L454-S531 WeakPolarHBondContact O-CA 3.28Å; Q455-S531 WeakPolarHBondContact CG-OG 3.42Å; Q455-S531 PolarHBondContact NE2-OG 2.87Å; Q455-S531 VanDerWaalsContact NE2-OG 3.14Å; S531-I538 PolarHBondContact N-O 3.06Å; S531-I538 PolarHBondContact O-N 3.36Å
532	M	94.1	Very high	95.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.4	173.5	-178.9	171.7	-171.3	0	0	110.2	I453 L454 I481 I496 L498 V501 F530 L536 V537 M552 L556 F558	I453-M532 VanDerWaalsContact CA-O 3.28Å; I453-M532 WeakPolarHBondContact CA-O 3.46Å; L454-M532 PolarHBondContact N-O 3.37Å; L454-M532 PolarHBondContact O-N 2.9Å; I481-M532 HydrophobicContact CD1-SD 3.67Å; I496-M532 HydrophobicContact CD1-SD 4.03Å; I496-M532 HydrophobicContact CG2-CE 3.98Å; I496-M532 HydrophobicContact CG2-SD 4.28Å; L498-M532 HydrophobicContact CD1-CE 3.89Å; L498-M532 HydrophobicContact CD1-SD 4.26Å; V501-M532 HydrophobicContact CG1-CE 4.44Å; V501-M532 HydrophobicContact CG2-CE 4.41Å; F530-M532 HydrophobicContact CE1-CB 3.63Å; F530-M532 HydrophobicContact CZ-CB 3.61Å; F530-M532 HydrophobicContact CZ-SD 4.31Å; M532-L536 WeakPolarHBondContact CA-O 3.37Å; M532-V537 HydrophobicContact CE-CG2 4.24Å; M532-V537 HydrophobicContact CG-CG2 4.06Å; M532-V537 HydrophobicContact SD-CG2 4.34Å; M532-M552 HydrophobicContact CE-CE 3.43Å; M532-M552 VanDerWaalsContact CE-CE 3.43Å; M532-M552 HydrophobicContact CE-SD 4.23Å; M532-L556 HydrophobicContact CE-CD1 3.88Å; M532-L556 HydrophobicContact CE-CD2 3.95Å; M532-L556 HydrophobicContact CG-CD1 3.99Å; M532-F558 HydrophobicContact CB-CZ 4.32Å; M532-F558 HydrophobicContact CG-CZ 3.94Å; M532-F558 HydrophobicContact SD-CE1 4.3Å; M532-F558 HydrophobicContact SD-CZ 3.9Å
533	S	92.8	Very high	95.3	Very high	30 Å²	30	34.3 Å²	34.3	21%	0.21	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	178	172.1	65	0	0	0	0	109.5	N535 L536 L556	S533-N535 PolarHBondContact O-N 3.08Å; S533-L536 PolarHBondContact N-O 2.61Å; S533-L536 PolarHBondContact O-N 2.82Å; S533-L536 VanDerWaalsContact O-O 3.07Å; S533-L556 WeakPolarHBondContact O-CD1 3.45Å
534	Q	92	Very high	95.5	Very high	73 Å²	73	36.8 Å²	36.8	34%	0.341	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	121.4	179.8	-167.4	69.6	30.8	0	0	110.5	L536 L554 L556	Q534-L536 PolarHBondContact O-N 2.79Å; Q534-L554 PolarHBondContact NE2-O 2.89Å; Q534-L554 VanDerWaalsContact NE2-O 3.12Å; Q534-L556 VanDerWaalsContact OE1-N 3.11Å
535	N	92.7	Very high	95.7	Very high	55 Å²	55	41.9 Å²	41.9	29%	0.294	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	3.8	-179.9	-53.2	-31.1	0	0	0	117.2	S533 V549 Q550 M552	S533-N535 PolarHBondContact O-N 3.08Å; N535-V549 CarbonylContact O-C 3.11Å; N535-V549 VanDerWaalsContact O-CA 3.29Å; N535-V549 WeakPolarHBondContact O-CA 3.23Å; N535-V549 WeakPolarHBondContact O-CG1 3.28Å; N535-Q550 WeakPolarHBondContact CA-O 3.34Å; N535-Q550 WeakPolarHBondContact CB-O 3.1Å; N535-Q550 PolarHBondContact O-N 2.63Å; N535-Q550 PolarHBondContact OD1-O 3.19Å; N535-Q550 VanDerWaalsContact OD1-O 3.14Å; N535-M552 PolarHBondContact N-SD 2.77Å; N535-M552 VanDerWaalsContact N-SD 3.41Å; N535-M552 PolarHBondContact OD1-N 2.92Å
536	L	95.1	Very high	95.7	Very high	57 Å²	57	40.6 Å²	40.6	30%	0.298	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	125.6	-173.5	-178.5	65.7	0	0	0	111.7	M532 S533 Q534 I538 T547 V549	M532-L536 WeakPolarHBondContact CA-O 3.37Å; S533-L536 PolarHBondContact N-O 2.61Å; S533-L536 PolarHBondContact O-N 2.82Å; S533-L536 VanDerWaalsContact O-O 3.07Å; Q534-L536 PolarHBondContact O-N 2.79Å; L536-I538 HydrophobicContact CD1-CD1 4.44Å; L536-I538 HydrophobicContact CD1-CG1 4.18Å; L536-I538 HydrophobicContact CD2-CD1 4Å; L536-I538 HydrophobicContact CD2-CG1 4.46Å; L536-I538 HydrophobicContact CG-CD1 4.21Å; L536-I538 HydrophobicContact CG-CG1 4.12Å; L536-T547 HydrophobicContact CD1-CG2 3.7Å; L536-V549 HydrophobicContact CD1-CG2 4.03Å
537	V	95.2	Very high	95.6	Very high	4 Å²	4	43.8 Å²	43.8	2%	0.024	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125.8	173.3	-176.6	0	0	0	0	108.7	L494 I496 I504 F530 M532 T547 T548 M552	L494-V537 HydrophobicContact CD2-CG1 4.25Å; I496-V537 HydrophobicContact CD1-CG1 3.94Å; I496-V537 HydrophobicContact CD1-CG2 4.18Å; I504-V537 HydrophobicContact CD1-CG2 3.96Å; F530-V537 HydrophobicContact CE2-CG1 3.68Å; F530-V537 HydrophobicContact CZ-CG1 4.22Å; M532-V537 HydrophobicContact CE-CG2 4.24Å; M532-V537 HydrophobicContact CG-CG2 4.06Å; M532-V537 HydrophobicContact SD-CG2 4.34Å; V537-T547 WeakPolarHBondContact O-CA 3.33Å; V537-T548 PolarHBondContact N-O 2.72Å; V537-T548 PolarHBondContact O-N 3.26Å; V537-M552 HydrophobicContact CG2-CE 4.2Å
538	I	96.7	Very high	95.4	Very high	30 Å²	30	44.5 Å²	44.5	15%	0.154	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	128	177.6	-60.7	173.1	0	0	0	108.4	F530 S531 L536 I540 K545 Y546 T547	F530-I538 CarbonylContact C-O 3.59Å; F530-I538 WeakPolarHBondContact CA-O 3.45Å; S531-I538 PolarHBondContact N-O 3.06Å; S531-I538 PolarHBondContact O-N 3.36Å; L536-I538 HydrophobicContact CD1-CD1 4.44Å; L536-I538 HydrophobicContact CD1-CG1 4.18Å; L536-I538 HydrophobicContact CD2-CD1 4Å; L536-I538 HydrophobicContact CD2-CG1 4.46Å; L536-I538 HydrophobicContact CG-CD1 4.21Å; L536-I538 HydrophobicContact CG-CG1 4.12Å; I538-I540 HydrophobicContact CG2-CD1 4.41Å; I538-I540 HydrophobicContact CG2-CG1 4.02Å; I538-K545 HydrophobicContact CG2-CD 4.38Å; I538-K545 HydrophobicContact CG2-CG 4.07Å; I538-Y546 WeakPolarHBondContact CA-O 3.21Å; I538-T547 HydrophobicContact CG1-CG2 4.19Å
539	L	97.2	Very high	95.1	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.016	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130	170	176.4	64.7	0	0	0	108.1	F483 L494 Y506 V508 V528 K529 F530 I541 Y546	F483-L539 HydrophobicContact CD2-CD1 4.38Å; F483-L539 HydrophobicContact CE2-CD1 3.85Å; F483-L539 HydrophobicContact CE2-CD2 4.2Å; F483-L539 HydrophobicContact CZ-CD1 4.47Å; L494-L539 HydrophobicContact CB-CD2 4.44Å; L494-L539 HydrophobicContact CD2-CD2 4.37Å; Y506-L539 HydrophobicContact CD1-CD2 4.46Å; V508-L539 HydrophobicContact CG2-CD2 4.16Å; V528-L539 HydrophobicContact CG1-CD1 4.18Å; K529-L539 CarbonylContact O-C 3.55Å; K529-L539 WeakPolarHBondContact O-CA 3.32Å; F530-L539 HydrophobicContact CB-CD1 4.45Å; F530-L539 HydrophobicContact CD2-CD1 4.46Å; L539-I541 HydrophobicContact CD1-CD1 4.31Å; L539-I541 HydrophobicContact CD1-CG1 4.17Å; L539-I541 HydrophobicContact CD2-CD1 3.77Å; L539-I541 HydrophobicContact CD2-CG1 4.44Å; L539-I541 HydrophobicContact CG-CD1 3.99Å; L539-I541 HydrophobicContact CG-CG1 4.11Å; L539-Y546 PolarHBondContact N-O 3.07Å; L539-Y546 PolarHBondContact O-N 3.43Å
540	I	97.5	Very high	94.5	Very high	45 Å²	45	48.4 Å²	48.4	23%	0.231	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	123.1	175	-50.5	174.1	0	0	0	106.8	V528 K529 I538 I544 K545	V528-I540 CarbonylContact C-O 3.6Å; V528-I540 WeakPolarHBondContact CA-O 3.27Å; K529-I540 HydrophobicContact CB-CB 4.13Å; K529-I540 HydrophobicContact CB-CD1 4.44Å; K529-I540 PolarHBondContact N-O 3.34Å; K529-I540 PolarHBondContact O-N 2.89Å; I538-I540 HydrophobicContact CG2-CD1 4.41Å; I538-I540 HydrophobicContact CG2-CG1 4.02Å; I540-I544 VanDerWaalsContact CA-O 3.28Å; I540-I544 WeakPolarHBondContact CA-O 3.45Å; I540-K545 HydrophobicContact CG1-CB 4.24Å; I540-K545 HydrophobicContact CG1-CG 4.12Å
541	I	97.2	Very high	94	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.9	175.1	-64.4	161.3	0	0	0	107	F483 L492 V508 F520 S527 V528 L539 N543 I544	F483-I541 HydrophobicContact CE2-CD1 4.44Å; F483-I541 HydrophobicContact CZ-CD1 4.48Å; L492-I541 HydrophobicContact CB-CD1 4.3Å; L492-I541 HydrophobicContact CD1-CD1 3.74Å; L492-I541 HydrophobicContact CD1-CG1 4.22Å; L492-I541 HydrophobicContact CD1-CG2 4.01Å; V508-I541 HydrophobicContact CB-CD1 3.84Å; V508-I541 HydrophobicContact CG1-CD1 3.77Å; V508-I541 HydrophobicContact CG2-CD1 3.94Å; F520-I541 HydrophobicContact CE1-CG2 3.58Å; F520-I541 HydrophobicContact CZ-CG2 3.68Å; S527-I541 CarbonylContact O-C 3.59Å; S527-I541 VanDerWaalsContact O-CA 3.3Å; S527-I541 WeakPolarHBondContact O-CA 3.41Å; V528-I541 HydrophobicContact CG2-CG1 4.48Å; L539-I541 HydrophobicContact CD1-CD1 4.31Å; L539-I541 HydrophobicContact CD1-CG1 4.17Å; L539-I541 HydrophobicContact CD2-CD1 3.77Å; L539-I541 HydrophobicContact CD2-CG1 4.44Å; L539-I541 HydrophobicContact CG-CD1 3.99Å; L539-I541 HydrophobicContact CG-CG1 4.11Å; I541-N543 VanDerWaalsContact C-N 3.26Å; I541-N543 PolarHBondContact O-N 3.3Å; I541-I544 PolarHBondContact N-O 3.18Å; I541-I544 WeakPolarHBondContact O-CA 3.26Å; I541-I544 WeakPolarHBondContact O-CB 3.38Å; I541-I544 PolarHBondContact O-N 2.91Å
542	D	95	Very high	93.8	Very high	52 Å²	52	53.6 Å²	53.6	28%	0.278	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.3	49	-178.9	-60.1	-26.9	0	0	0	113.1	H526 S527 I544	H526-D542 VanDerWaalsContact CA-OD1 3.28Å; H526-D542 WeakPolarHBondContact CA-OD1 3.19Å; H526-D542 IonicContact CE1-OD2 2.93Å; H526-D542 IonicContact CG-OD2 3.32Å; H526-D542 IonicContact ND1-OD1 3.01Å; H526-D542 IonicContact ND1-OD2 3.95Å; H526-D542 PolarHBondContact ND1-OD2 3.47Å; S527-D542 PolarHBondContact N-OD1 3.17Å; S527-D542 PolarHBondContact O-N 3.47Å; D542-I544 PolarHBondContact O-N 3.1Å; D542-I544 VanDerWaalsContact O-N 3.12Å
543	N	94.3	Very high	93.6	Very high	144 Å²	144	58.7 Å²	58.7	77%	0.77	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	4.8	-177.2	-55	-50.3	0	0	0	116	I541	I541-N543 VanDerWaalsContact C-N 3.26Å; I541-N543 PolarHBondContact O-N 3.3Å
544	I	95.9	Very high	93.5	Very high	56 Å²	56	61.4 Å²	61.4	29%	0.287	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	119.3	173.6	-59	159	0	0	0	109.3	K511 I540 I541 D542 Y546	K511-I544 HydrophobicContact CB-CD1 4.17Å; K511-I544 HydrophobicContact CD-CD1 3.82Å; K511-I544 HydrophobicContact CG-CD1 4.16Å; I540-I544 VanDerWaalsContact CA-O 3.28Å; I540-I544 WeakPolarHBondContact CA-O 3.45Å; I541-I544 PolarHBondContact N-O 3.18Å; I541-I544 WeakPolarHBondContact O-CA 3.26Å; I541-I544 WeakPolarHBondContact O-CB 3.38Å; I541-I544 PolarHBondContact O-N 2.91Å; D542-I544 PolarHBondContact O-N 3.1Å; D542-I544 VanDerWaalsContact O-N 3.12Å; I544-Y546 HydrophobicContact CB-CE2 4.17Å; I544-Y546 HydrophobicContact CG2-CD2 4.49Å; I544-Y546 HydrophobicContact CG2-CE1 4.23Å; I544-Y546 HydrophobicContact CG2-CE2 3.73Å
545	K	96.6	Very high	93.4	Very high	125 Å²	125	62.9 Å²	62.9	54%	0.543	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.4	-177.7	-175.1	177.7	-177.9	-178.7	0	112.4	I538 I540 T547	I538-K545 HydrophobicContact CG2-CD 4.38Å; I538-K545 HydrophobicContact CG2-CG 4.07Å; I540-K545 HydrophobicContact CG1-CB 4.24Å; I540-K545 HydrophobicContact CG1-CG 4.12Å; K545-T547 VanDerWaalsContact CE-OG1 3.27Å; K545-T547 WeakPolarHBondContact CE-OG1 3.13Å
546	Y	94.9	Very high	93.2	Very high	31 Å²	31	60.6 Å²	60.6	12%	0.122	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.1	171.2	-55.8	-84.1	0	0	0	108.6	Y506 V508 K511 I538 L539 I544	Y506-Y546 AromaticContact CE1-CD1 3.71Å; Y506-Y546 HydrophobicContact CE1-CD1 3.71Å; Y506-Y546 HydrophobicContact CE1-CE1 4.34Å; Y506-Y546 AromaticContact CE1-CG 3.81Å; Y506-Y546 HydrophobicContact CE1-CG 3.81Å; Y506-Y546 AromaticContact CZ-CD1 3.79Å; Y506-Y546 WeakPolarHBondContact OH-CD1 3.16Å; Y506-Y546 WeakPolarHBondContact OH-CE1 3.28Å; V508-Y546 HydrophobicContact CG1-CE2 3.79Å; V508-Y546 WeakPolarHBondContact CG1-OH 3.49Å; V508-Y546 HydrophobicContact CG2-CD2 4.44Å; V508-Y546 HydrophobicContact CG2-CE2 4.27Å; K511-Y546 VanDerWaalsContact CE-OH 3.3Å; K511-Y546 WeakPolarHBondContact CE-OH 3.33Å; I538-Y546 WeakPolarHBondContact CA-O 3.21Å; L539-Y546 PolarHBondContact N-O 3.07Å; L539-Y546 PolarHBondContact O-N 3.43Å; I544-Y546 HydrophobicContact CB-CE2 4.17Å; I544-Y546 HydrophobicContact CG2-CD2 4.49Å; I544-Y546 HydrophobicContact CG2-CE1 4.23Å; I544-Y546 HydrophobicContact CG2-CE2 3.73Å
547	T	94.9	Very high	92.8	Very high	72 Å²	72	64.9 Å²	64.9	44%	0.442	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130	-177.2	-56.3	0	0	0	0	109.9	L536 V537 I538 K545	L536-T547 HydrophobicContact CD1-CG2 3.7Å; V537-T547 WeakPolarHBondContact O-CA 3.33Å; I538-T547 HydrophobicContact CG1-CG2 4.19Å; K545-T547 VanDerWaalsContact CE-OG1 3.27Å; K545-T547 WeakPolarHBondContact CE-OG1 3.13Å
548	T	92.1	Very high	92.5	Very high	45 Å²	45	64.8 Å²	64.8	28%	0.276	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	128.8	175	-54.4	0	0	0	0	108.9	V537 Q550	V537-T548 PolarHBondContact N-O 2.72Å; V537-T548 PolarHBondContact O-N 3.26Å; T548-Q550 HydrophobicContact CG2-CG 3.94Å
549	V	91.7	Very high	91.8	Very high	101 Å²	101	66.8 Å²	66.8	61%	0.612	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	124.8	173	-178.5	0	0	0	0	107.8	N535 L536	N535-V549 CarbonylContact O-C 3.11Å; N535-V549 VanDerWaalsContact O-CA 3.29Å; N535-V549 WeakPolarHBondContact O-CA 3.23Å; N535-V549 WeakPolarHBondContact O-CG1 3.28Å; L536-V549 HydrophobicContact CD1-CG2 4.03Å
550	Q	84.8	Confident	91.2	Very high	57 Å²	57	71.3 Å²	71.3	27%	0.266	37%	0.372	S	S	.	.			trans	-130.1	138	-178.2	-72.5	-66.4	-22.9	0	0	109.6	I504 N535 T548 M552	I504-Q550 HydrophobicContact CD1-CG 4.23Å; N535-Q550 WeakPolarHBondContact CA-O 3.34Å; N535-Q550 WeakPolarHBondContact CB-O 3.1Å; N535-Q550 PolarHBondContact O-N 2.63Å; N535-Q550 PolarHBondContact OD1-O 3.19Å; N535-Q550 VanDerWaalsContact OD1-O 3.14Å; T548-Q550 HydrophobicContact CG2-CG 3.94Å; Q550-M552 PolarHBondContact O-N 2.03Å; Q550-M552 VanDerWaalsContact O-N 3.15Å
551	N	88.1	Confident	90.7	Very high	126 Å²	126	70 Å²	70	67%	0.674	37%	0.367	S	S	*	.			trans	-81.3	97.8	171.9	-74.4	-19.4	0	0	0	109.3
552	M	90.4	Very high	90.3	Very high	15 Å²	15	70 Å²	70	7%	0.074	37%	0.367	C	S	.	.			trans	-81.8	129.5	179.6	-59.2	172.5	-177.9	0	0	109.7	G500 V501 M532 N535 V537 Q550 L556	G500-M552 WeakPolarHBondContact O-CA 3.07Å; V501-M552 HydrophobicContact CG1-CE 4.25Å; V501-M552 HydrophobicContact CG1-CG 4.42Å; V501-M552 HydrophobicContact CG2-CB 4.44Å; V501-M552 HydrophobicContact CG2-CE 4.48Å; V501-M552 HydrophobicContact CG2-CG 3.98Å; V501-M552 HydrophobicContact CG2-SD 4.06Å; M532-M552 HydrophobicContact CE-CE 3.43Å; M532-M552 VanDerWaalsContact CE-CE 3.43Å; M532-M552 HydrophobicContact CE-SD 4.23Å; N535-M552 PolarHBondContact N-SD 2.77Å; N535-M552 VanDerWaalsContact N-SD 3.41Å; N535-M552 PolarHBondContact OD1-N 2.92Å; V537-M552 HydrophobicContact CG2-CE 4.2Å; Q550-M552 PolarHBondContact O-N 2.03Å; Q550-M552 VanDerWaalsContact O-N 3.15Å; M552-L556 HydrophobicContact CE-CD1 4.25Å; M552-L556 HydrophobicContact SD-CD1 3.62Å; M552-L556 HydrophobicContact SD-CD2 3.8Å; M552-L556 HydrophobicContact SD-CG 3.77Å
553	T	91	Very high	90.1	Very high	107 Å²	107	68.9 Å²	68.9	66%	0.656	36%	0.359	S	S	*	.	S	Bend	trans	-83	-15.3	-173.5	54.9	0	0	0	0	113.6	G500	G500-T553 WeakPolarHBondContact CA-OG1 3.22Å; G500-T553 PolarHBondContact O-N 2.85Å; G500-T553 PolarHBondContact O-OG1 2.82Å; G500-T553 VanDerWaalsContact O-OG1 3.05Å
554	L	91.2	Very high	90	Very high	87 Å²	87	62 Å²	62	46%	0.455	32%	0.322	S	S	.	.	S	Bend	trans	-123.1	151.8	177.1	-64.5	177.4	0	0	0	110.3	P499 Q534	P499-L554 HydrophobicContact CB-CD1 3.84Å; Q534-L554 PolarHBondContact NE2-O 2.89Å; Q534-L554 VanDerWaalsContact NE2-O 3.12Å
555	P	88.3	Confident	89.7	Confident	105 Å²	105	59.4 Å²	59.4	68%	0.682	31%	0.309	S	S	*	.			trans	-66.4	135	170.3	27.7	-32.9	0	0	0	110.3
556	L	88.4	Confident	89.2	Confident	7 Å²	7	53.4 Å²	53.4	4%	0.037	28%	0.283	C	S	.	.			trans	-71.7	135.2	175.6	-64.8	177.2	0	0	0	111.3	N452 L498 V501 M532 S533 Q534 M552 F558	N452-L556 PolarHBondContact OD1-O 3.2Å; L498-L556 HydrophobicContact CD1-CD2 4.13Å; V501-L556 HydrophobicContact CG2-CD2 3.88Å; M532-L556 HydrophobicContact CE-CD1 3.88Å; M532-L556 HydrophobicContact CE-CD2 3.95Å; M532-L556 HydrophobicContact CG-CD1 3.99Å; S533-L556 WeakPolarHBondContact O-CD1 3.45Å; Q534-L556 VanDerWaalsContact OE1-N 3.11Å; M552-L556 HydrophobicContact CE-CD1 4.25Å; M552-L556 HydrophobicContact SD-CD1 3.62Å; M552-L556 HydrophobicContact SD-CD2 3.8Å; M552-L556 HydrophobicContact SD-CG 3.77Å; L556-F558 HydrophobicContact CB-CE2 4.13Å; L556-F558 HydrophobicContact CB-CZ 4.21Å; L556-F558 HydrophobicContact CD1-CE2 4.21Å; L556-F558 HydrophobicContact CD1-CZ 3.94Å; L556-F558 HydrophobicContact CG-CZ 4.48Å
557	Y	86.7	Confident	88.1	Confident	147 Å²	147	52 Å²	52	58%	0.576	28%	0.277	S	S	*	.			trans	-135.6	121.8	170.5	-177.4	-93.2	0	0	0	108.6	V474	V474-Y557 WeakPolarHBondContact CG1-O 3.22Å
558	F	88.8	Confident	87.1	Confident	1 Å²	1	53.9 Å²	53.9	0%	0.004	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-104.1	142.9	178.9	-60.7	-66	0	0	0	111.2	T451 I453 L454 H472 I481 L498 M532 L556	T451-F558 WeakPolarHBondContact O-CD2 3.34Å; T451-F558 PolarHBondContact O-N 2.9Å; I453-F558 VanDerWaalsContact C-CD2 3.5Å; L454-F558 HydrophobicContact CB-CD1 3.98Å; L454-F558 HydrophobicContact CB-CD2 3.67Å; L454-F558 HydrophobicContact CB-CE1 4Å; L454-F558 HydrophobicContact CB-CE2 3.68Å; L454-F558 HydrophobicContact CB-CG 3.81Å; L454-F558 HydrophobicContact CB-CZ 3.83Å; L454-F558 HydrophobicContact CD2-CD1 4.19Å; L454-F558 HydrophobicContact CD2-CE1 4.28Å; H472-F558 AromaticContact CD2-CD1 3.96Å; H472-F558 AromaticContact NE2-CD1 3.8Å; I481-F558 HydrophobicContact CD1-CD1 4.32Å; I481-F558 HydrophobicContact CD1-CE1 3.57Å; I481-F558 HydrophobicContact CD1-CZ 4.31Å; L498-F558 HydrophobicContact CD1-CE1 3.92Å; M532-F558 HydrophobicContact CB-CZ 4.32Å; M532-F558 HydrophobicContact CG-CZ 3.94Å; M532-F558 HydrophobicContact SD-CE1 4.3Å; M532-F558 HydrophobicContact SD-CZ 3.9Å; L556-F558 HydrophobicContact CB-CE2 4.13Å; L556-F558 HydrophobicContact CB-CZ 4.21Å; L556-F558 HydrophobicContact CD1-CE2 4.21Å; L556-F558 HydrophobicContact CD1-CZ 3.94Å; L556-F558 HydrophobicContact CG-CZ 4.48Å
559	D	83.9	Confident	85.7	Confident	73 Å²	73	55.3 Å²	55.3	39%	0.39	29%	0.286	S	S	.	.			trans	-75.3	171.8	178.9	-156.1	-7	0	0	0	111.2	H472 V561	H472-D559 PolarHBondContact CE1-N 3.4Å; H472-D559 PolarHBondContact CE1-O 3.02Å; H472-D559 VanDerWaalsContact CE1-O 3.27Å; H472-D559 PolarHBondContact NE2-N 2.75Å; H472-D559 VanDerWaalsContact NE2-N 3.18Å; D559-V561 VanDerWaalsContact C-N 3.3Å
560	K	84.1	Confident	84.5	Confident	97 Å²	97	57.9 Å²	57.9	42%	0.422	29%	0.292	S	S	.	.	S	Bend	trans	-72.9	-23.9	177	-70.9	-176.6	-178.6	-179.5	0	113.5	E446 R447	E446-K560 WeakPolarHBondContact CA-O 3.43Å; E446-K560 HydrophobicContact CG-CB 4.2Å; R447-K560 PolarHBondContact N-O 2.81Å; R447-K560 VanDerWaalsContact O-CB 3.25Å; R447-K560 WeakPolarHBondContact O-CB 3.2Å; R447-K560 WeakPolarHBondContact O-CG 3.28Å
561	V	86.7	Confident	83.9	Confident	19 Å²	19	58.6 Å²	58.6	12%	0.115	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.4	-166.2	-177.3	0	0	0	0	110.4	K444 I445 E446 H472 D559 Y563	K444-V561 HydrophobicContact CD-CG1 4.19Å; K444-V561 HydrophobicContact CG-CG1 3.7Å; I445-V561 WeakPolarHBondContact O-CA 3.45Å; E446-V561 HydrophobicContact CB-CG2 4.48Å; E446-V561 HydrophobicContact CG-CG2 4.1Å; H472-V561 PolarHBondContact CE1-O 3.48Å; H472-V561 PolarHBondContact ND1-O 3.1Å; D559-V561 VanDerWaalsContact C-N 3.3Å; V561-Y563 HydrophobicContact CG1-CD1 4.28Å; V561-Y563 HydrophobicContact CG1-CD2 4.49Å; V561-Y563 HydrophobicContact CG1-CE1 3.76Å; V561-Y563 HydrophobicContact CG1-CE2 3.96Å
562	S	89.7	Confident	83.7	Confident	4 Å²	4	58 Å²	58	3%	0.028	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	153.1	168.6	-62.5	0	0	0	0	109.7	I445 H472	I445-S562 PolarHBondContact N-O 3.32Å; I445-S562 PolarHBondContact O-N 3.23Å; H472-S562 PolarHBondContact ND1-OG 3.25Å; H472-S562 VanDerWaalsContact ND1-OG 3.1Å
563	Y	90.1	Very high	83.5	Confident	28 Å²	28	57.4 Å²	57.4	11%	0.11	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.6	-174.1	-63.5	-66.3	0	0	0	109.4	V441 L443 K444 F470 Y471 T473 V561	V441-Y563 HydrophobicContact CB-CD1 4.15Å; V441-Y563 HydrophobicContact CG1-CD1 3.54Å; V441-Y563 HydrophobicContact CG1-CE1 4.5Å; V441-Y563 HydrophobicContact CG1-CG 3.93Å; V441-Y563 HydrophobicContact CG2-CD1 4.04Å; V441-Y563 HydrophobicContact CG2-CG 4.2Å; L443-Y563 WeakPolarHBondContact O-CA 3.37Å; K444-Y563 HydrophobicContact CB-CD1 4.17Å; K444-Y563 HydrophobicContact CB-CE1 4.15Å; K444-Y563 HydrophobicContact CD-CE1 4.36Å; K444-Y563 HydrophobicContact CG-CD1 4.13Å; K444-Y563 HydrophobicContact CG-CE1 3.78Å; F470-Y563 WeakPolarHBondContact CA-O 3.35Å; Y471-Y563 AromaticContact CD1-CD2 3.85Å; Y471-Y563 HydrophobicContact CD1-CD2 3.85Å; Y471-Y563 PolarHBondContact N-O 3.11Å; Y471-Y563 WeakPolarHBondContact O-CB 3.47Å; Y471-Y563 PolarHBondContact O-N 3.43Å; T473-Y563 HydrophobicContact CG2-CE2 4.36Å; V561-Y563 HydrophobicContact CG1-CD1 4.28Å; V561-Y563 HydrophobicContact CG1-CD2 4.49Å; V561-Y563 HydrophobicContact CG1-CE1 3.76Å; V561-Y563 HydrophobicContact CG1-CE2 3.96Å
564	I	91.8	Very high	83.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	140	179.3	-58.5	158.2	0	0	0	109.1	F433 L443 I445 L469 G566 L578 I581 I583	F433-I564 HydrophobicContact CZ-CG2 4.23Å; L443-I564 HydrophobicContact CB-CB 4.12Å; L443-I564 HydrophobicContact CD1-CB 4.42Å; L443-I564 HydrophobicContact CD1-CG2 4.43Å; L443-I564 PolarHBondContact N-O 3.3Å; L443-I564 VanDerWaalsContact N-O 3.13Å; L443-I564 PolarHBondContact O-N 2.78Å; I445-I564 HydrophobicContact CD1-CD1 4.3Å; I445-I564 HydrophobicContact CG1-CD1 3.64Å; I445-I564 HydrophobicContact CG1-CG1 4.45Å; L469-I564 WeakPolarHBondContact O-CA 3.25Å; I564-G566 VanDerWaalsContact C-N 3.26Å; I564-G566 PolarHBondContact O-N 2.76Å; I564-L578 HydrophobicContact CG2-CD1 3.21Å; I564-I581 HydrophobicContact CD1-CD1 4.49Å; I564-I581 HydrophobicContact CD1-CG2 3.66Å; I564-I583 HydrophobicContact CD1-CD1 3.9Å; I564-I583 HydrophobicContact CG1-CD1 4.31Å
565	G	89.2	Confident	83.4	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	76.6	5	177.6	0	0	0	0	0	114.3	F442 I468 L469 S573 F574	F442-G565 WeakPolarHBondContact CD2-O 3.47Å; I468-G565 CarbonylContact O-C 3.52Å; I468-G565 WeakPolarHBondContact O-CA 3.22Å; L469-G565 PolarHBondContact O-N 3.43Å; G565-S573 CarbonylContact O-C 3.56Å; G565-S573 VanDerWaalsContact O-CA 3.24Å; G565-S573 WeakPolarHBondContact O-CA 3.39Å; G565-S573 WeakPolarHBondContact O-CB 3.29Å; G565-F574 PolarHBondContact O-N 2.84Å
566	G	86.5	Confident	83.6	Confident	0 Å²	0	44 Å²	44	0%	0	20%	0.197	C	C	.	.			trans	-174.6	164.8	176.2	0	0	0	0	0	112.8	I468 I564	I468-G566 PolarHBondContact O-N 3.4Å; I468-G566 VanDerWaalsContact O-N 3.11Å; I564-G566 VanDerWaalsContact C-N 3.26Å; I564-G566 PolarHBondContact O-N 2.76Å
567	G	72.9	Confident	83.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.195	C	C	.	.			trans	-132.8	165.5	-176.9	0	0	0	0	0	113.2
568	R	72.4	Confident	84.3	Confident	113 Å²	113	36.7 Å²	36.7	43%	0.426	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.3	155.5	177.7	-67.9	-177.8	173.2	-176.4	-2.5	111.4	V441 Y471 D477	V441-R568 HydrophobicContact CG2-CG 3.98Å; Y471-R568 PolarHBondContact OH-O 2.74Å; D477-R568 WeakPolarHBondContact OD2-CB 3.35Å
569	P	63.8	Low	84.5	Confident	74 Å²	74	39.6 Å²	39.6	48%	0.481	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	cis	-76	165	-37.7	35.9	-35	0	0	0	110.3	D477 R571	D477-P569 HydrophobicContact CB-CG 4.41Å; D477-P569 WeakPolarHBondContact OD2-CD 3.4Å; P569-R571 PolarHBondContact O-N 3.37Å
570	Q	65.5	Low	84.9	Confident	156 Å²	156	40.3 Å²	40.3	73%	0.729	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	64	35.7	170	-53.9	-169.5	6.8	0	0	117	Y439	Y439-Q570 HydrophobicContact CE1-CB 4.47Å; Y439-Q570 HydrophobicContact CE1-CG 3.93Å
571	R	73.4	Confident	85.4	Confident	72 Å²	72	36 Å²	36	27%	0.272	16%	0.161	S	C	.	.			trans	-124.8	143.8	169.6	-62.9	-168.9	177.3	-121.4	0.4	111.7	I468 Y480 E495 P569	I468-R571 HydrophobicContact CG1-CB 3.75Å; I468-R571 HydrophobicContact CG1-CG 4.3Å; Y480-R571 PolarHBondContact OH-NH2 2.78Å; Y480-R571 VanDerWaalsContact OH-NH2 3.09Å; E495-R571 IonicContact OE2-CZ 3.7Å; E495-R571 IonicContact OE2-NH1 3.05Å; E495-R571 IonicContact OE2-NH2 3.32Å; E495-R571 PolarHBondContact OE2-NH2 2.87Å; P569-R571 PolarHBondContact O-N 3.37Å
572	Y	84	Confident	85.7	Confident	113 Å²	113	39.3 Å²	39.3	44%	0.443	17%	0.171	S	C	.	.	B	Isolated β-bridge	trans	-72	142.6	174.1	-70.9	-83.3	0	0	0	110.6	I436 Q438 G467 I468	I436-Y572 HydrophobicContact CG2-CD1 3.87Å; Q438-Y572 HydrophobicContact CG-CD1 3.63Å; Q438-Y572 HydrophobicContact CG-CE1 3.28Å; Q438-Y572 HydrophobicContact CG-CG 4.48Å; Q438-Y572 PolarHBondContact NE2-OH 2.84Å; G467-Y572 WeakPolarHBondContact CA-O 3.5Å; I468-Y572 PolarHBondContact N-O 2.94Å; I468-Y572 VanDerWaalsContact N-O 3.17Å
573	S	86.2	Confident	85.8	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.021	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-68.3	150.5	174.2	66.6	0	0	0	0	111.6	D435 Q437 F442 G565	D435-S573 PolarHBondContact O-OG 2.97Å; Q437-S573 PolarHBondContact N-OG 2.92Å; Q437-S573 PolarHBondContact O-N 2.79Å; Q437-S573 PolarHBondContact O-OG 3.05Å; F442-S573 VanDerWaalsContact CE2-OG 3.3Å; F442-S573 WeakPolarHBondContact CE2-OG 3.26Å; G565-S573 CarbonylContact O-C 3.56Å; G565-S573 VanDerWaalsContact O-CA 3.24Å; G565-S573 WeakPolarHBondContact O-CA 3.39Å; G565-S573 WeakPolarHBondContact O-CB 3.29Å
574	F	90.5	Very high	85.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-71.3	138.2	169.7	169.2	-102.8	0	0	0	109.8	F433 F442 F460 T462 I468 L469 G565 L578	F433-F574 HydrophobicContact CD2-CD1 4.29Å; F433-F574 HydrophobicContact CD2-CE1 4.39Å; F433-F574 HydrophobicContact CG-CD1 4.49Å; F442-F574 WeakPolarHBondContact CE2-O 3.28Å; F460-F574 HydrophobicContact CB-CZ 4.29Å; F460-F574 HydrophobicContact CD2-CE2 4.35Å; F460-F574 HydrophobicContact CD2-CZ 4.35Å; T462-F574 HydrophobicContact CG2-CE2 3.88Å; T462-F574 HydrophobicContact CG2-CZ 4.43Å; I468-F574 VanDerWaalsContact O-CB 3.26Å; I468-F574 WeakPolarHBondContact O-CB 3.38Å; L469-F574 HydrophobicContact CD1-CD2 3.74Å; L469-F574 HydrophobicContact CD1-CE2 4.18Å; L469-F574 HydrophobicContact CD1-CG 4.34Å; L469-F574 HydrophobicContact CD2-CD2 4.27Å; L469-F574 HydrophobicContact CD2-CE2 4.09Å; L469-F574 HydrophobicContact CD2-CZ 4.35Å; L469-F574 HydrophobicContact CG-CB 4.32Å; L469-F574 HydrophobicContact CG-CD1 4.45Å; L469-F574 HydrophobicContact CG-CD2 3.68Å; L469-F574 HydrophobicContact CG-CE2 4.02Å; L469-F574 HydrophobicContact CG-CG 3.91Å; G565-F574 PolarHBondContact O-N 2.84Å; F574-L578 HydrophobicContact CD1-CD2 4.45Å; F574-L578 HydrophobicContact CD1-CG 4.43Å; F574-L578 HydrophobicContact CE1-CD2 3.89Å; F574-L578 HydrophobicContact CE1-CG 4.03Å; F574-L578 HydrophobicContact CZ-CD2 4.36Å
575	Q	89.2	Confident	85.6	Confident	17 Å²	17	43.1 Å²	43.1	8%	0.079	21%	0.207	C	C	.	.			trans	-119.5	129.5	169.4	-167.7	-149.4	46	0	0	108.9	F433 P434 I436 T462 N464 G628	F433-Q575 WeakPolarHBondContact O-CA 3.4Å; F433-Q575 WeakPolarHBondContact O-CG 3.33Å; P434-Q575 PolarHBondContact O-NE2 2.64Å; I436-Q575 HydrophobicContact CD1-CB 4.33Å; I436-Q575 HydrophobicContact CG1-CB 3.68Å; I436-Q575 HydrophobicContact CG1-CG 4.27Å; T462-Q575 PolarHBondContact OG1-O 3.38Å; N464-Q575 PolarHBondContact ND2-OE1 3.31Å; Q575-G628 VanDerWaalsContact NE2-C 3.33Å; Q575-G628 PolarHBondContact NE2-O 2.88Å
576	G	92.9	Very high	85.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.5	-156.9	-171	0	0	0	0	0	111	F433 R461	F433-G576 PolarHBondContact N-O 3.13Å; F433-G576 PolarHBondContact O-N 2.81Å; F433-G576 VanDerWaalsContact O-N 3.12Å; R461-G576 CarbonylContact O-C 3.53Å; R461-G576 WeakPolarHBondContact O-CA 3.16Å
577	C	93.5	Very high	85.7	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	142.9	179	-51.1	0	0	0	0	110.5	L431 F460 R461 W525 C607 I609	L431-C577 CarbonylContact O-C 3.57Å; L431-C577 VanDerWaalsContact O-CA 3.26Å; L431-C577 WeakPolarHBondContact O-CA 3.42Å; F460-C577 CarbonylContact C-O 3.46Å; F460-C577 VanDerWaalsContact CA-O 3.23Å; F460-C577 WeakPolarHBondContact CA-O 3.37Å; R461-C577 HydrophobicContact CB-CB 4.4Å; R461-C577 PolarHBondContact N-O 2.74Å; R461-C577 PolarHBondContact O-N 2.98Å; W525-C577 HydrophobicContact CH2-CB 3.57Å; W525-C577 HydrophobicContact CZ2-CB 4.21Å; W525-C577 HydrophobicContact CZ3-CB 4.22Å; C577-C607 HydrophobicContact CB-CB 3.74Å; C577-C607 WeakPolarHBondContact CB-SG 2.99Å; C577-C607 WeakPolarHBondContact SG-CA 3.44Å; C577-C607 WeakPolarHBondContact SG-CB 3.04Å; C577-C607 CovalentContact SG-SG 2.02Å; C577-C607 PolarHBondContact SG-SG 2.85Å; C577-I609 VanDerWaalsContact SG-CG2 3.58Å
578	L	95.1	Very high	86.4	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	146.8	167.9	-58.4	176.9	0	0	0	109.3	V430 L431 F433 F458 D459 F460 L469 I564 F574 I581	V430-L578 WeakPolarHBondContact CA-O 3.43Å; L431-L578 PolarHBondContact N-O 2.88Å; L431-L578 PolarHBondContact O-N 3.48Å; F433-L578 HydrophobicContact CD2-CD1 4.39Å; F433-L578 HydrophobicContact CD2-CG 4.19Å; F433-L578 HydrophobicContact CE2-CB 3.84Å; F433-L578 HydrophobicContact CE2-CD1 3.56Å; F433-L578 HydrophobicContact CE2-CG 3.58Å; F433-L578 HydrophobicContact CZ-CD1 3.78Å; F433-L578 HydrophobicContact CZ-CG 4.31Å; F458-L578 HydrophobicContact CD2-CD2 3.91Å; F458-L578 HydrophobicContact CE2-CD2 4.26Å; D459-L578 CarbonylContact O-C 3.51Å; D459-L578 VanDerWaalsContact O-CA 3.26Å; D459-L578 WeakPolarHBondContact O-CA 3.42Å; F460-L578 HydrophobicContact CB-CD2 3.36Å; L469-L578 HydrophobicContact CD2-CD2 4.02Å; I564-L578 HydrophobicContact CG2-CD1 3.21Å; F574-L578 HydrophobicContact CD1-CD2 4.45Å; F574-L578 HydrophobicContact CD1-CG 4.43Å; F574-L578 HydrophobicContact CE1-CD2 3.89Å; F574-L578 HydrophobicContact CE1-CG 4.03Å; F574-L578 HydrophobicContact CZ-CD2 4.36Å; L578-I581 HydrophobicContact CB-CD1 3.84Å; L578-I581 HydrophobicContact CB-CG1 4.13Å; L578-I581 HydrophobicContact CD1-CD1 4.31Å
579	R	93.4	Very high	87	Confident	62 Å²	62	51 Å²	51	23%	0.234	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	169.8	169.4	72	172.9	-173	-162	-6.1	112.1	T429 V430 D459 W525 I581	T429-R579 VanDerWaalsContact O-CA 3.3Å; T429-R579 WeakPolarHBondContact O-CA 3.42Å; V430-R579 HydrophobicContact CB-CB 4.44Å; V430-R579 HydrophobicContact CG2-CB 3.85Å; D459-R579 HydrophobicContact CB-CG 3.72Å; D459-R579 PolarHBondContact N-O 2.93Å; D459-R579 PolarHBondContact O-N 3.28Å; D459-R579 IonicContact OD2-CZ 3.31Å; D459-R579 IonicContact OD2-NE 3.13Å; D459-R579 PolarHBondContact OD2-NE 2.97Å; D459-R579 IonicContact OD2-NH2 3.39Å; D459-R579 PolarHBondContact OD2-NH2 2.95Å; W525-R579 HydrophobicContact CE3-CG 4.14Å; W525-R579 HydrophobicContact CH2-CB 4.16Å; W525-R579 HydrophobicContact CH2-CG 3.92Å; W525-R579 HydrophobicContact CZ3-CB 4.23Å; W525-R579 HydrophobicContact CZ3-CG 3.66Å; R579-I581 PolarHBondContact O-N 2.84Å
580	Q	92.9	Very high	87.9	Confident	88 Å²	88	49.6 Å²	49.6	41%	0.411	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51.6	40.1	177.8	-59.3	-176.9	-2.2	0	0	113.3	R582	Q580-R582 PolarHBondContact O-N 2.98Å
581	I	94	Very high	88.7	Confident	6 Å²	6	47.8 Å²	47.8	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	120.5	-173.8	-53.7	171.2	0	0	0	109.8	L431 E457 F458 I564 L578 R579 D587 V588	L431-I581 HydrophobicContact CD1-CD1 4.01Å; E457-I581 CarbonylContact O-C 3.54Å; E457-I581 WeakPolarHBondContact O-CA 3.15Å; F458-I581 HydrophobicContact CB-CB 4.41Å; F458-I581 HydrophobicContact CB-CG1 3.99Å; I564-I581 HydrophobicContact CD1-CD1 4.49Å; I564-I581 HydrophobicContact CD1-CG2 3.66Å; L578-I581 HydrophobicContact CB-CD1 3.84Å; L578-I581 HydrophobicContact CB-CG1 4.13Å; L578-I581 HydrophobicContact CD1-CD1 4.31Å; R579-I581 PolarHBondContact O-N 2.84Å; I581-D587 CarbonylContact O-C 3.53Å; I581-D587 WeakPolarHBondContact O-CA 3.47Å; I581-V588 HydrophobicContact CB-CB 4.03Å; I581-V588 HydrophobicContact CB-CG2 4.28Å; I581-V588 HydrophobicContact CG2-CB 4Å; I581-V588 HydrophobicContact CG2-CG2 3.72Å; I581-V588 PolarHBondContact O-N 3.29Å
582	R	93.4	Very high	89.2	Confident	89 Å²	89	51.7 Å²	51.7	34%	0.336	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.3	175	-73.1	-170.8	-79.4	-165.2	-6.2	111	F456 E457 Q580 I586 D587	F456-R582 CarbonylContact C-O 3.24Å; F456-R582 VanDerWaalsContact CA-O 3.25Å; F456-R582 WeakPolarHBondContact CA-O 3.37Å; E457-R582 HydrophobicContact CB-CB 4.15Å; E457-R582 PolarHBondContact N-O 2.78Å; E457-R582 PolarHBondContact O-N 2.95Å; E457-R582 IonicContact OE1-CZ 3.28Å; E457-R582 IonicContact OE1-NE 3.28Å; E457-R582 IonicContact OE1-NH2 2.88Å; E457-R582 PolarHBondContact OE1-NH2 3.03Å; E457-R582 IonicContact OE2-CZ 3.51Å; E457-R582 VanDerWaalsContact OE2-CZ 3.24Å; E457-R582 IonicContact OE2-NE 3.98Å; E457-R582 PolarHBondContact OE2-NE 3.05Å; E457-R582 VanDerWaalsContact OE2-NE 3.16Å; E457-R582 IonicContact OE2-NH2 3.55Å; E457-R582 PolarHBondContact OE2-NH2 2.79Å; Q580-R582 PolarHBondContact O-N 2.98Å; R582-I586 WeakPolarHBondContact CA-O 3.17Å; R582-D587 WeakPolarHBondContact CD-OD1 3.35Å; R582-D587 WeakPolarHBondContact CG-OD1 3.4Å
583	I	91.2	Very high	89.1	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.015	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124.9	172.3	-64.6	172.7	0	0	0	108.3	I445 Q455 F456 F470 I564 G585 I586 V588	I445-I583 HydrophobicContact CB-CD1 3.96Å; I445-I583 HydrophobicContact CG1-CD1 3.94Å; I445-I583 HydrophobicContact CG2-CD1 3.95Å; Q455-I583 CarbonylContact O-C 3.58Å; Q455-I583 WeakPolarHBondContact O-CA 3.21Å; F456-I583 HydrophobicContact CB-CG1 4.43Å; F470-I583 HydrophobicContact CE2-CD1 4.13Å; F470-I583 HydrophobicContact CE2-CG1 4.36Å; I564-I583 HydrophobicContact CD1-CD1 3.9Å; I564-I583 HydrophobicContact CG1-CD1 4.31Å; I583-G585 PolarHBondContact O-N 3.15Å; I583-I586 PolarHBondContact N-O 3.11Å; I583-I586 PolarHBondContact O-N 2.94Å; I583-I586 VanDerWaalsContact O-N 3.08Å; I583-V588 HydrophobicContact CD1-CG2 4.44Å
584	N	89.8	Confident	89	Confident	50 Å²	50	51.9 Å²	51.9	27%	0.267	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	41.8	-176.3	-64.4	-21.1	0	0	0	112.8	Q455 I586	Q455-N584 PolarHBondContact N-OD1 2.91Å; Q455-N584 PolarHBondContact O-N 3.18Å; Q455-N584 PolarHBondContact O-OD1 3.32Å; N584-I586 VanDerWaalsContact C-N 3.31Å; N584-I586 PolarHBondContact O-N 3.28Å
585	G	86.9	Confident	88.5	Confident	59 Å²	59	56.6 Å²	56.6	61%	0.608	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	4	178.5	0	0	0	0	0	115.7	I583	I583-G585 PolarHBondContact O-N 3.15Å
586	I	88.9	Confident	88.1	Confident	90 Å²	90	60 Å²	60	46%	0.462	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129.2	-179.5	-50.8	174.7	0	0	0	110.2	R447 R582 I583 N584	R447-I586 VanDerWaalsContact NH1-CG2 3.29Å; R582-I586 WeakPolarHBondContact CA-O 3.17Å; I583-I586 PolarHBondContact N-O 3.11Å; I583-I586 PolarHBondContact O-N 2.94Å; I583-I586 VanDerWaalsContact O-N 3.08Å; N584-I586 VanDerWaalsContact C-N 3.31Å; N584-I586 PolarHBondContact O-N 3.28Å
587	D	90.3	Very high	87.6	Confident	84 Å²	84	61.6 Å²	61.6	45%	0.449	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	143.5	174.5	-60.1	-55	0	0	0	111.8	R447 I581 R582	R447-D587 PolarHBondContact NH2-O 3.18Å; I581-D587 CarbonylContact O-C 3.53Å; I581-D587 WeakPolarHBondContact O-CA 3.47Å; R582-D587 WeakPolarHBondContact CD-OD1 3.35Å; R582-D587 WeakPolarHBondContact CG-OD1 3.4Å
588	V	87.5	Confident	87.1	Confident	15 Å²	15	63.6 Å²	63.6	9%	0.091	34%	0.341	C	S	.	.			trans	-95.3	100	170.5	177.3	0	0	0	0	107.2	I445 I581 I583 L593	I445-V588 HydrophobicContact CD1-CG1 3.8Å; I445-V588 HydrophobicContact CD1-CG2 4.23Å; I445-V588 HydrophobicContact CG1-CG2 4.43Å; I581-V588 HydrophobicContact CB-CB 4.03Å; I581-V588 HydrophobicContact CB-CG2 4.28Å; I581-V588 HydrophobicContact CG2-CB 4Å; I581-V588 HydrophobicContact CG2-CG2 3.72Å; I581-V588 PolarHBondContact O-N 3.29Å; I583-V588 HydrophobicContact CD1-CG2 4.44Å; V588-L593 HydrophobicContact CG1-CD1 3.87Å; V588-L593 HydrophobicContact CG1-CD2 4.17Å; V588-L593 HydrophobicContact CG1-CG 4.32Å
589	E	84.7	Confident	86.5	Confident	90 Å²	90	65.5 Å²	65.5	42%	0.421	35%	0.35	S	S	.	.			trans	-93.5	123.4	178.9	-65.8	175.4	-136.8	0	0	110.3	D591 K592 L593	E589-D591 VanDerWaalsContact C-N 3.32Å; E589-D591 PolarHBondContact O-N 2.63Å; E589-K592 HydrophobicContact CB-CB 4.26Å; E589-K592 HydrophobicContact CB-CD 4.17Å; E589-K592 HydrophobicContact CB-CG 4.21Å; E589-K592 PolarHBondContact O-N 2.92Å; E589-K592 VanDerWaalsContact O-N 3.1Å; E589-K592 IonicContact OE1-NZ 2.65Å; E589-K592 PolarHBondContact OE1-NZ 3.03Å; E589-K592 WeakPolarHBondContact OE2-CD 3.45Å; E589-K592 WeakPolarHBondContact OE2-CE 3.44Å; E589-K592 IonicContact OE2-NZ 3.8Å; E589-K592 PolarHBondContact OE2-NZ 2.99Å; E589-L593 PolarHBondContact O-N 3.38Å
590	W	82.9	Confident	85.8	Confident	45 Å²	45	73.9 Å²	73.9	17%	0.17	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-52.4	-47.3	-176.9	177.5	-102.8	0	0	0	112.8	L431 L443 K592 L593 R598 I602 N604	L431-W590 HydrophobicContact CD1-CE3 4.15Å; L431-W590 HydrophobicContact CD2-CB 4.28Å; L431-W590 HydrophobicContact CD2-CD2 3.87Å; L431-W590 HydrophobicContact CD2-CE3 3.39Å; L431-W590 HydrophobicContact CD2-CG 4.28Å; L431-W590 HydrophobicContact CD2-CZ3 4Å; L431-W590 HydrophobicContact CG-CE3 4.44Å; L443-W590 HydrophobicContact CD2-CZ3 4.33Å; W590-K592 PolarHBondContact O-N 3.14Å; W590-L593 HydrophobicContact CE3-CD1 4.44Å; W590-L593 PolarHBondContact O-N 3.17Å; W590-R598 HydrophobicContact CH2-CB 4.44Å; W590-R598 HydrophobicContact CZ3-CB 4.49Å; W590-R598 VanDerWaalsContact CZ3-CD 3.5Å; W590-R598 HydrophobicContact CZ3-CG 4.36Å; W590-R598 PolarHBondContact O-NH1 2.68Å; W590-R598 PolarHBondContact O-NH2 3.16Å; W590-I602 HydrophobicContact CH2-CB 3.97Å; W590-I602 HydrophobicContact CH2-CG2 3.84Å; W590-I602 HydrophobicContact CZ3-CB 4.17Å; W590-I602 HydrophobicContact CZ3-CD1 4.48Å; W590-I602 HydrophobicContact CZ3-CG2 3.66Å; W590-N604 HydrophobicContact CD2-CB 3.87Å; W590-N604 HydrophobicContact CG-CB 3.94Å; W590-N604 VanDerWaalsContact CG-CG 3.48Å; W590-N604 HydrophobicContact CZ2-CB 4.18Å
591	D	82.4	Confident	85.1	Confident	118 Å²	118	70.8 Å²	70.8	63%	0.631	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-68.5	-20.2	-175.4	-59.9	-37.7	0	0	0	113.7	E589	E589-D591 VanDerWaalsContact C-N 3.32Å; E589-D591 PolarHBondContact O-N 2.63Å
592	K	84	Confident	84.6	Confident	154 Å²	154	71.1 Å²	71.1	67%	0.67	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-92	-9.7	-179.5	-67.1	-176.1	179.3	155.2	0	114.2	E589 W590	E589-K592 HydrophobicContact CB-CB 4.26Å; E589-K592 HydrophobicContact CB-CD 4.17Å; E589-K592 HydrophobicContact CB-CG 4.21Å; E589-K592 PolarHBondContact O-N 2.92Å; E589-K592 VanDerWaalsContact O-N 3.1Å; E589-K592 IonicContact OE1-NZ 2.65Å; E589-K592 PolarHBondContact OE1-NZ 3.03Å; E589-K592 WeakPolarHBondContact OE2-CD 3.45Å; E589-K592 WeakPolarHBondContact OE2-CE 3.44Å; E589-K592 IonicContact OE2-NZ 3.8Å; E589-K592 PolarHBondContact OE2-NZ 2.99Å; W590-K592 PolarHBondContact O-N 3.14Å
593	L	82.3	Confident	84	Confident	27 Å²	27	70.3 Å²	70.3	14%	0.141	37%	0.373	C	S	.	.	S	Bend	trans	-72.3	154.9	179.3	-71.1	172.2	0	0	0	111.1	L443 I445 V588 E589 W590 R598	L443-L593 HydrophobicContact CD2-CD1 4.19Å; I445-L593 HydrophobicContact CD1-CD2 3.57Å; V588-L593 HydrophobicContact CG1-CD1 3.87Å; V588-L593 HydrophobicContact CG1-CD2 4.17Å; V588-L593 HydrophobicContact CG1-CG 4.32Å; E589-L593 PolarHBondContact O-N 3.38Å; W590-L593 HydrophobicContact CE3-CD1 4.44Å; W590-L593 PolarHBondContact O-N 3.17Å; L593-R598 HydrophobicContact CB-CG 4.16Å; L593-R598 HydrophobicContact CD1-CG 4.36Å; L593-R598 PolarHBondContact O-NH2 2.67Å
594	D	82.3	Confident	83.5	Confident	92 Å²	92	72.1 Å²	72.1	49%	0.492	38%	0.383	S	S	.	.			trans	-78.1	128.3	170	175.7	-4.7	0	0	0	108.6	A596 T597	D594-A596 PolarHBondContact O-N 3.31Å; D594-A596 VanDerWaalsContact O-N 3.07Å; D594-A596 WeakPolarHBondContact OD1-CB 3.11Å; D594-A596 PolarHBondContact OD1-N 3.07Å; D594-T597 HydrophobicContact CB-CG2 3.96Å; D594-T597 WeakPolarHBondContact O-CB 3.25Å; D594-T597 PolarHBondContact O-N 2.78Å; D594-T597 PolarHBondContact O-OG1 3.29Å
595	P	80.3	Confident	82.8	Confident	99 Å²	99	70 Å²	70	64%	0.643	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-48.6	-31.8	173.1	-28.5	35.6	0	0	0	114.4	T597 R598	P595-T597 PolarHBondContact O-N 3.3Å; P595-R598 PolarHBondContact O-N 2.85Å
596	A	81.2	Confident	82.2	Confident	88 Å²	88	67.7 Å²	67.7	73%	0.727	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-69.2	-18	176.9	0	0	0	0	0	114	D594	D594-A596 PolarHBondContact O-N 3.31Å; D594-A596 VanDerWaalsContact O-N 3.07Å; D594-A596 WeakPolarHBondContact OD1-CB 3.11Å; D594-A596 PolarHBondContact OD1-N 3.07Å
597	T	82.8	Confident	82	Confident	34 Å²	34	65 Å²	65	21%	0.209	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-91.3	-4.1	178.1	63.3	0	0	0	0	113.7	K444 D594 P595	K444-T597 PolarHBondContact N-O 3.37Å; K444-T597 WeakPolarHBondContact O-CB 3.33Å; D594-T597 HydrophobicContact CB-CG2 3.96Å; D594-T597 WeakPolarHBondContact O-CB 3.25Å; D594-T597 PolarHBondContact O-N 2.78Å; D594-T597 PolarHBondContact O-OG1 3.29Å; P595-T597 PolarHBondContact O-N 3.3Å
598	R	83.4	Confident	81.4	Confident	42 Å²	42	64.8 Å²	64.8	16%	0.158	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-116.3	137.8	-175.7	-44.1	-179.2	-135	-178.2	-6.6	109.7	L443 W590 L593 P595	L443-R598 HydrophobicContact CD2-CB 3.94Å; L443-R598 HydrophobicContact CD2-CG 3.82Å; W590-R598 HydrophobicContact CH2-CB 4.44Å; W590-R598 HydrophobicContact CZ3-CB 4.49Å; W590-R598 VanDerWaalsContact CZ3-CD 3.5Å; W590-R598 HydrophobicContact CZ3-CG 4.36Å; W590-R598 PolarHBondContact O-NH1 2.68Å; W590-R598 PolarHBondContact O-NH2 3.16Å; L593-R598 HydrophobicContact CB-CG 4.16Å; L593-R598 HydrophobicContact CD1-CG 4.36Å; L593-R598 PolarHBondContact O-NH2 2.67Å; P595-R598 PolarHBondContact O-N 2.85Å
599	H	82.6	Confident	81.2	Confident	40 Å²	40	65.3 Å²	65.3	19%	0.185	34%	0.336	C	S	.	.			trans	-72.8	141.5	169.6	-168.9	-101.6	0	0	0	110.7	Q437 F442 S601 I602	Q437-H599 PolarHBondContact OE1-CE1 2.86Å; Q437-H599 PolarHBondContact OE1-NE2 2.92Å; F442-H599 HydrophobicContact CD1-CB 3.67Å; F442-H599 AromaticContact CD1-CG 3.88Å; F442-H599 AromaticContact CD1-ND1 3.87Å; F442-H599 HydrophobicContact CE1-CB 4.4Å; F442-H599 AromaticContact CE1-ND1 3.72Å; F442-H599 PolarHBondContact O-N 2.65Å; H599-S601 PolarHBondContact CE1-OG 2.82Å; H599-S601 VanDerWaalsContact CE1-OG 3.27Å; H599-S601 PolarHBondContact ND1-N 2.88Å; H599-S601 PolarHBondContact ND1-OG 2.95Å; H599-S601 PolarHBondContact O-N 2.87Å; H599-S601 VanDerWaalsContact O-N 3.12Å; H599-I602 HydrophobicContact CB-CD1 4.41Å; H599-I602 HydrophobicContact CB-CG1 4.42Å; H599-I602 PolarHBondContact O-N 3.43Å
600	R	78	Confident	80.9	Confident	238 Å²	238	64.8 Å²	64.8	90%	0.898	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.3	-175.7	65.1	-178.8	177.7	-174.4	-0.1	115.5
601	S	79.3	Confident	81	Confident	24 Å²	24	63.4 Å²	63.4	17%	0.168	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-8.6	-177.9	66.7	0	0	0	0	114.6	P434 D435 H599 I603	P434-S601 WeakPolarHBondContact CD-O 3.09Å; P434-S601 WeakPolarHBondContact CG-O 3.33Å; D435-S601 WeakPolarHBondContact OD2-CB 3.09Å; D435-S601 PolarHBondContact OD2-OG 3.24Å; H599-S601 PolarHBondContact CE1-OG 2.82Å; H599-S601 VanDerWaalsContact CE1-OG 3.27Å; H599-S601 PolarHBondContact ND1-N 2.88Å; H599-S601 PolarHBondContact ND1-OG 2.95Å; H599-S601 PolarHBondContact O-N 2.87Å; H599-S601 VanDerWaalsContact O-N 3.12Å; S601-I603 PolarHBondContact O-N 2.95Å
602	I	82.6	Confident	81.1	Confident	12 Å²	12	60.3 Å²	60.3	6%	0.062	31%	0.309	C	S	.	.			trans	-67.1	132.4	177.6	-57.9	170.9	0	0	0	109.5	L431 T432 F433 F442 L443 W590 H599	L431-I602 HydrophobicContact CB-CG2 4.2Å; L431-I602 HydrophobicContact CD2-CG2 4.44Å; T432-I602 WeakPolarHBondContact O-CA 3.44Å; T432-I602 WeakPolarHBondContact O-CG2 3.18Å; F433-I602 HydrophobicContact CD1-CD1 4.4Å; F433-I602 HydrophobicContact CD1-CG1 4.21Å; F433-I602 HydrophobicContact CE1-CD1 4.02Å; F433-I602 HydrophobicContact CE1-CG1 4.29Å; F442-I602 HydrophobicContact CB-CD1 3.84Å; F442-I602 HydrophobicContact CB-CG1 4.24Å; F442-I602 HydrophobicContact CD1-CG1 4.11Å; F442-I602 HydrophobicContact CG-CG1 4.48Å; F442-I602 WeakPolarHBondContact O-CD1 3.41Å; L443-I602 HydrophobicContact CD1-CD1 4.35Å; L443-I602 HydrophobicContact CD2-CD1 3.47Å; L443-I602 VanDerWaalsContact CD2-CD1 3.47Å; L443-I602 HydrophobicContact CG-CD1 3.61Å; W590-I602 HydrophobicContact CH2-CB 3.97Å; W590-I602 HydrophobicContact CH2-CG2 3.84Å; W590-I602 HydrophobicContact CZ3-CB 4.17Å; W590-I602 HydrophobicContact CZ3-CD1 4.48Å; W590-I602 HydrophobicContact CZ3-CG2 3.66Å; H599-I602 HydrophobicContact CB-CD1 4.41Å; H599-I602 HydrophobicContact CB-CG1 4.42Å; H599-I602 PolarHBondContact O-N 3.43Å
603	I	80.3	Confident	81.2	Confident	73 Å²	73	54 Å²	54	37%	0.374	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	129	177.7	-51.9	170.7	0	0	0	108.2	T432 P434 S601	T432-I603 PolarHBondContact N-O 2.89Å; T432-I603 PolarHBondContact O-N 2.79Å; P434-I603 HydrophobicContact CG-CD1 4.49Å; S601-I603 PolarHBondContact O-N 2.95Å
604	N	81.5	Confident	81.3	Confident	40 Å²	40	54.1 Å²	54.1	21%	0.214	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	149.2	177.9	-178.9	39.5	0	0	0	111.7	N428 V430 L431 W590 S606	N428-N604 PolarHBondContact O-OD1 3.43Å; V430-N604 PolarHBondContact O-OD1 3.28Å; L431-N604 HydrophobicContact CD2-CB 4.2Å; L431-N604 WeakPolarHBondContact CD2-OD1 3.46Å; W590-N604 HydrophobicContact CD2-CB 3.87Å; W590-N604 HydrophobicContact CG-CB 3.94Å; W590-N604 VanDerWaalsContact CG-CG 3.48Å; W590-N604 HydrophobicContact CZ2-CB 4.18Å; N604-S606 VanDerWaalsContact C-N 3.35Å; N604-S606 PolarHBondContact O-N 2.96Å
605	G	75	Confident	81.2	Confident	6 Å²	6	51.1 Å²	51.1	6%	0.062	27%	0.27	C	S	.	.	S	Bend	trans	86.9	-5.1	166.6	0	0	0	0	0	115.3	H130 V430	H130-G605 PolarHBondContact CE1-O 3.09Å; V430-G605 PolarHBondContact O-N 3.26Å
606	S	74.7	Confident	81.3	Confident	11 Å²	11	49.8 Å²	49.8	8%	0.077	26%	0.257	C	S	.	.	S	Bend	trans	-144.2	156.5	174	14.3	0	0	0	0	112.4	H130 V430 T432 N604	H130-S606 WeakPolarHBondContact CE1-CB 3.37Å; H130-S606 PolarHBondContact CE1-OG 3.42Å; H130-S606 VanDerWaalsContact CE1-OG 3.25Å; H130-S606 WeakPolarHBondContact ND1-CB 3.42Å; H130-S606 PolarHBondContact ND1-OG 3.4Å; H130-S606 VanDerWaalsContact ND1-OG 3.14Å; V430-S606 VanDerWaalsContact CG1-C 3.41Å; V430-S606 WeakPolarHBondContact CG1-O 2.83Å; T432-S606 PolarHBondContact OG1-O 2.94Å; N604-S606 VanDerWaalsContact C-N 3.35Å; N604-S606 PolarHBondContact O-N 2.96Å
607	C	84.6	Confident	81.4	Confident	32 Å²	32	46.4 Å²	46.4	22%	0.216	23%	0.228	C	C	.	.			trans	-96.2	93	162.8	-175	0	0	0	0	110.6	V430 T432 W525 C577 I609	V430-C607 HydrophobicContact CG1-CB 3.98Å; T432-C607 VanDerWaalsContact OG1-CA 3.3Å; T432-C607 WeakPolarHBondContact OG1-CA 3.43Å; W525-C607 HydrophobicContact CZ2-CB 4.13Å; C577-C607 HydrophobicContact CB-CB 3.74Å; C577-C607 WeakPolarHBondContact CB-SG 2.99Å; C577-C607 WeakPolarHBondContact SG-CA 3.44Å; C577-C607 WeakPolarHBondContact SG-CB 3.04Å; C577-C607 CovalentContact SG-SG 2.02Å; C577-C607 PolarHBondContact SG-SG 2.85Å; C607-I609 PolarHBondContact O-N 3.27Å
608	M	77.3	Confident	81.6	Confident	80 Å²	80	45.1 Å²	45.1	39%	0.394	22%	0.22	S	C	.	.			trans	-97.2	53.6	-176.9	-60.5	-62	-72.4	0	0	111.6	T432	T432-M608 HydrophobicContact CG2-CB 4.3Å; T432-M608 PolarHBondContact OG1-N 2.94Å
609	I	82.9	Confident	81.7	Confident	27 Å²	27	47.7 Å²	47.7	14%	0.138	23%	0.233	C	C	.	.			trans	-87.3	145.5	172.9	61	176.3	0	0	0	110.1	L278 R461 L463 C577 C607	L278-I609 HydrophobicContact CD1-CD1 4.16Å; L278-I609 HydrophobicContact CD1-CG1 3.58Å; L278-I609 VanDerWaalsContact CD1-O 3.23Å; L278-I609 WeakPolarHBondContact CD1-O 3.37Å; L278-I609 HydrophobicContact CD2-CD1 4.07Å; L278-I609 HydrophobicContact CD2-CG1 4.38Å; R461-I609 HydrophobicContact CG-CD1 3.85Å; L463-I609 HydrophobicContact CD1-CD1 4.21Å; L463-I609 HydrophobicContact CD1-CG1 4.46Å; L463-I609 HydrophobicContact CG-CD1 4.2Å; C577-I609 VanDerWaalsContact SG-CG2 3.58Å; C607-I609 PolarHBondContact O-N 3.27Å
610	Q	79.1	Confident	81.6	Confident	79 Å²	79	48.4 Å²	48.4	37%	0.369	24%	0.236	S	C	.	.			trans	-112.2	128.5	179.9	-176.6	-177.6	10.2	0	0	110	R612	Q610-R612 HydrophobicContact CG-CG 4.36Å; Q610-R612 PolarHBondContact O-N 2.8Å; Q610-R612 PolarHBondContact O-NH1 3.12Å
611	D	85.4	Confident	81.8	Confident	16 Å²	16	43.4 Å²	43.4	9%	0.086	22%	0.223	C	C	.	.			trans	-83.4	98.3	169	-163.4	-10.4	0	0	0	110.3	R252 S277 L463 C613 N614 Q626	R252-D611 IonicContact NH2-OD2 2.73Å; R252-D611 PolarHBondContact NH2-OD2 3.29Å; S277-D611 WeakPolarHBondContact CB-OD2 3.46Å; S277-D611 PolarHBondContact OG-OD2 2.89Å; L463-D611 HydrophobicContact CD1-CB 3.53Å; D611-C613 PolarHBondContact O-N 3.3Å; D611-C613 PolarHBondContact OD1-N 3.48Å; D611-C613 VanDerWaalsContact OD1-N 3.17Å; D611-N614 HydrophobicContact CB-CB 4.01Å; D611-N614 VanDerWaalsContact CG-CB 3.47Å; D611-N614 PolarHBondContact O-N 2.95Å; D611-N614 PolarHBondContact OD1-N 3.08Å; D611-N614 VanDerWaalsContact OD2-CB 3.32Å; D611-N614 WeakPolarHBondContact OD2-CB 3.36Å; D611-Q626 PolarHBondContact OD1-NE2 3.14Å
612	R	84	Confident	82.2	Confident	52 Å²	52	42.3 Å²	42.3	20%	0.196	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-11.1	178.2	-64.2	173.9	176.2	69.3	3.5	112.7	Q610 P617 Q626 G628 F631	Q610-R612 HydrophobicContact CG-CG 4.36Å; Q610-R612 PolarHBondContact O-N 2.8Å; Q610-R612 PolarHBondContact O-NH1 3.12Å; R612-P617 WeakPolarHBondContact O-CG 3.3Å; R612-Q626 HydrophobicContact CB-CB 4.41Å; R612-G628 VanDerWaalsContact CZ-O 3.25Å; R612-G628 PolarHBondContact NH1-O 2.84Å; R612-G628 PolarHBondContact NH2-O 3.47Å; R612-F631 HydrophobicContact CB-CB 4.09Å; R612-F631 HydrophobicContact CB-CD1 4.45Å
613	C	86.9	Confident	82.6	Confident	22 Å²	22	45.6 Å²	45.6	15%	0.149	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	6.2	173.7	-72.9	0	0	0	0	112.8	D611 P615 N616 C624 S625	D611-C613 PolarHBondContact O-N 3.3Å; D611-C613 PolarHBondContact OD1-N 3.48Å; D611-C613 VanDerWaalsContact OD1-N 3.17Å; C613-P615 CarbonylContact C-O 3.49Å; C613-P615 CarbonylContact O-C 3.49Å; C613-P615 VanDerWaalsContact O-C 3.29Å; C613-N616 WeakPolarHBondContact O-CA 3.2Å; C613-N616 PolarHBondContact O-N 2.7Å; C613-C624 WeakPolarHBondContact CA-SG 2.87Å; C613-C624 HydrophobicContact CB-CB 3.73Å; C613-C624 WeakPolarHBondContact CB-SG 3.38Å; C613-C624 VanDerWaalsContact SG-C 3.51Å; C613-C624 WeakPolarHBondContact SG-CB 3.48Å; C613-C624 CovalentContact SG-SG 2.05Å; C613-C624 PolarHBondContact SG-SG 2.84Å; C613-S625 VanDerWaalsContact SG-C 3.58Å
614	N	83.9	Confident	83.1	Confident	29 Å²	29	43.9 Å²	43.9	16%	0.155	23%	0.232	C	C	.	.	S	Bend	trans	-128.8	117.5	179	-175.9	73.4	0	0	0	112.9	G276 S277 D611	G276-N614 WeakPolarHBondContact CA-ND2 3.34Å; G276-N614 PolarHBondContact O-ND2 2.7Å; S277-N614 PolarHBondContact N-ND2 2.84Å; D611-N614 HydrophobicContact CB-CB 4.01Å; D611-N614 VanDerWaalsContact CG-CB 3.47Å; D611-N614 PolarHBondContact O-N 2.95Å; D611-N614 PolarHBondContact OD1-N 3.08Å; D611-N614 VanDerWaalsContact OD2-CB 3.32Å; D611-N614 WeakPolarHBondContact OD2-CB 3.36Å
615	P	79.6	Confident	83.5	Confident	30 Å²	30	45.1 Å²	45.1	20%	0.195	24%	0.243	C	C	.	.	S	Bend	cis	-61.1	159.1	-8.6	27.9	-36.3	0	0	0	110.2	I303 V305 C613 P617	I303-P615 VanDerWaalsContact CG2-CD 3.4Å; I303-P615 HydrophobicContact CG2-CG 3.65Å; V305-P615 HydrophobicContact CG2-CB 4.24Å; C613-P615 CarbonylContact C-O 3.49Å; C613-P615 CarbonylContact O-C 3.49Å; C613-P615 VanDerWaalsContact O-C 3.29Å; P615-P617 WeakPolarHBondContact O-CD 3.44Å
616	N	83.3	Confident	84	Confident	70 Å²	70	46.2 Å²	46.2	37%	0.374	25%	0.247	S	C	.	.			trans	-56.7	113.2	-179.5	-173.7	-2.9	0	0	0	109.6	C613 C618 A622 C624	C613-N616 WeakPolarHBondContact O-CA 3.2Å; C613-N616 PolarHBondContact O-N 2.7Å; N616-C618 PolarHBondContact O-N 3.38Å; N616-C618 WeakPolarHBondContact OD1-CB 3.22Å; N616-C618 PolarHBondContact OD1-N 2.74Å; N616-C618 PolarHBondContact OD1-SG 3.06Å; N616-C618 VanDerWaalsContact OD1-SG 3.37Å; N616-A622 PolarHBondContact ND2-O 3.1Å; N616-C624 VanDerWaalsContact OD1-CB 3.29Å; N616-C624 WeakPolarHBondContact OD1-CB 3.49Å
617	P	81.9	Confident	84.1	Confident	18 Å²	18	47.8 Å²	47.8	12%	0.117	26%	0.256	C	S	.	.			trans	-73.5	-14.2	179.3	32.8	-37.8	0	0	0	112.1	R612 P615 F631	R612-P617 WeakPolarHBondContact O-CG 3.3Å; P615-P617 WeakPolarHBondContact O-CD 3.44Å; P617-F631 HydrophobicContact CB-CD2 4.11Å; P617-F631 HydrophobicContact CB-CE1 4.11Å; P617-F631 HydrophobicContact CB-CE2 3.66Å; P617-F631 HydrophobicContact CB-CZ 3.66Å; P617-F631 HydrophobicContact CG-CB 4.46Å; P617-F631 HydrophobicContact CG-CD1 4.1Å; P617-F631 HydrophobicContact CG-CD2 3.36Å; P617-F631 HydrophobicContact CG-CE1 4.17Å; P617-F631 HydrophobicContact CG-CE2 3.45Å; P617-F631 VanDerWaalsContact CG-CE2 3.45Å; P617-F631 HydrophobicContact CG-CG 3.72Å; P617-F631 HydrophobicContact CG-CZ 3.86Å
618	C	87.8	Confident	83.5	Confident	6 Å²	6	46.5 Å²	46.5	4%	0.041	25%	0.249	C	C	.	.	S	Bend	trans	-80.8	128.9	178.1	-47	0	0	0	0	109.7	N616 A622 C624 C633	N616-C618 PolarHBondContact O-N 3.38Å; N616-C618 WeakPolarHBondContact OD1-CB 3.22Å; N616-C618 PolarHBondContact OD1-N 2.74Å; N616-C618 PolarHBondContact OD1-SG 3.06Å; N616-C618 VanDerWaalsContact OD1-SG 3.37Å; C618-A622 HydrophobicContact CB-CB 3.8Å; C618-A622 WeakPolarHBondContact CB-O 3.49Å; C618-C624 VanDerWaalsContact SG-CB 3.55Å; C618-C633 WeakPolarHBondContact CA-SG 3.24Å; C618-C633 HydrophobicContact CB-CB 3.6Å; C618-C633 WeakPolarHBondContact CB-SG 3.38Å; C618-C633 WeakPolarHBondContact SG-CA 3.36Å; C618-C633 WeakPolarHBondContact SG-CB 3.34Å; C618-C633 CovalentContact SG-SG 2.02Å; C618-C633 PolarHBondContact SG-SG 2.93Å
619	K	85	Confident	83.2	Confident	96 Å²	96	47.2 Å²	47.2	42%	0.417	26%	0.261	S	S	.	.	S	Bend	trans	-78.2	165.1	-179.3	-60.7	-64	-172.2	169	0	110.9	E621 A622 V644 H646	K619-E621 PolarHBondContact O-N 2.94Å; K619-E621 VanDerWaalsContact O-N 3.16Å; K619-A622 VanDerWaalsContact O-CB 3.25Å; K619-A622 WeakPolarHBondContact O-CB 3.45Å; K619-A622 PolarHBondContact O-N 3.2Å; K619-A622 VanDerWaalsContact O-N 3.1Å; K619-V644 PolarHBondContact N-O 3.23Å; K619-H646 HydrophobicContact CB-CB 4.47Å; K619-H646 HydrophobicContact CG-CB 4.05Å
620	H	81.6	Confident	83.1	Confident	55 Å²	55	47.2 Å²	47.2	26%	0.255	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	39	176.5	-46.8	104.6	0	0	0	113.3	A622 Y640 C645 G678	H620-A622 PolarHBondContact O-N 2.91Å; H620-Y640 HydrophobicContact CB-CD2 3.81Å; H620-Y640 HydrophobicContact CB-CE2 3.83Å; H620-Y640 AromaticContact CD2-CE2 3.68Å; H620-Y640 AromaticContact CD2-CZ 3.58Å; H620-Y640 AromaticContact CE1-CD1 3.4Å; H620-Y640 VanDerWaalsContact CE1-CD1 3.4Å; H620-Y640 WeakPolarHBondContact CE1-CD1 3.31Å; H620-Y640 AromaticContact CE1-CE1 3.36Å; H620-Y640 WeakPolarHBondContact CE1-CE1 3.5Å; H620-Y640 AromaticContact CE1-CG 3.82Å; H620-Y640 AromaticContact CE1-CZ 3.72Å; H620-Y640 AromaticContact CG-CD2 3.57Å; H620-Y640 AromaticContact CG-CE2 3.45Å; H620-Y640 VanDerWaalsContact CG-CE2 3.45Å; H620-Y640 AromaticContact CG-CG 3.99Å; H620-Y640 AromaticContact CG-CZ 3.77Å; H620-Y640 AromaticContact ND1-CD1 3.53Å; H620-Y640 AromaticContact ND1-CD2 3.52Å; H620-Y640 AromaticContact ND1-CE1 3.76Å; H620-Y640 AromaticContact ND1-CE2 3.74Å; H620-Y640 AromaticContact ND1-CG 3.42Å; H620-Y640 AromaticContact ND1-CZ 3.87Å; H620-Y640 AromaticContact NE2-CE1 3.6Å; H620-Y640 AromaticContact NE2-CZ 3.6Å; H620-C645 PolarHBondContact CE1-O 2.65Å; H620-C645 PolarHBondContact ND1-O 2.99Å; H620-G678 PolarHBondContact NE2-O 3.16Å; H620-G678 VanDerWaalsContact NE2-O 3.16Å
621	E	80.9	Confident	83.4	Confident	134 Å²	134	43.6 Å²	43.6	63%	0.626	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	18.2	179	-46.6	-159.4	139	0	0	115.6	R307 K619	R307-E621 IonicContact CZ-OE1 3.53Å; R307-E621 IonicContact NH1-OE1 3.65Å; R307-E621 PolarHBondContact NH1-OE1 3.1Å; R307-E621 IonicContact NH2-OE1 3.67Å; R307-E621 PolarHBondContact NH2-OE1 3.22Å; K619-E621 PolarHBondContact O-N 2.94Å; K619-E621 VanDerWaalsContact O-N 3.16Å
622	A	89	Confident	83.6	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.008	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-58.1	140.5	179.4	0	0	0	0	0	111.8	N616 C618 K619 H620 C624 T638 C645	N616-A622 PolarHBondContact ND2-O 3.1Å; C618-A622 HydrophobicContact CB-CB 3.8Å; C618-A622 WeakPolarHBondContact CB-O 3.49Å; K619-A622 VanDerWaalsContact O-CB 3.25Å; K619-A622 WeakPolarHBondContact O-CB 3.45Å; K619-A622 PolarHBondContact O-N 3.2Å; K619-A622 VanDerWaalsContact O-N 3.1Å; H620-A622 PolarHBondContact O-N 2.91Å; A622-C624 PolarHBondContact O-N 3.01Å; A622-T638 HydrophobicContact CB-CG2 4.03Å; A622-C645 HydrophobicContact CB-CB 3.94Å; A622-C645 WeakPolarHBondContact CB-SG 3.29Å
623	P	91	Very high	84	Confident	81 Å²	81	47.2 Å²	47.2	53%	0.526	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-60.2	128.9	178.1	-24.4	33.6	0	0	0	112.6	D634	P623-D634 HydrophobicContact CB-CB 4.32Å; P623-D634 WeakPolarHBondContact CD-O 3.45Å; P623-D634 HydrophobicContact CG-CB 4.5Å; P623-D634 PolarHBondContact O-N 3.3Å
624	C	89.6	Confident	84.3	Confident	37 Å²	37	50 Å²	50	25%	0.25	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	135.2	173.4	-175	0	0	0	0	111.6	C613 N616 C618 A622 Y632	C613-C624 WeakPolarHBondContact CA-SG 2.87Å; C613-C624 HydrophobicContact CB-CB 3.73Å; C613-C624 WeakPolarHBondContact CB-SG 3.38Å; C613-C624 VanDerWaalsContact SG-C 3.51Å; C613-C624 WeakPolarHBondContact SG-CB 3.48Å; C613-C624 CovalentContact SG-SG 2.05Å; C613-C624 PolarHBondContact SG-SG 2.84Å; N616-C624 VanDerWaalsContact OD1-CB 3.29Å; N616-C624 WeakPolarHBondContact OD1-CB 3.49Å; C618-C624 VanDerWaalsContact SG-CB 3.55Å; A622-C624 PolarHBondContact O-N 3.01Å; C624-Y632 WeakPolarHBondContact CA-O 3.3Å
625	S	89.2	Confident	84.7	Confident	66 Å²	66	49.9 Å²	49.9	46%	0.462	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	156.8	165.8	63	0	0	0	0	110.1	C613 F631 Y632	C613-S625 VanDerWaalsContact SG-C 3.58Å; S625-F631 CarbonylContact O-C 3.57Å; S625-F631 VanDerWaalsContact O-CA 3.26Å; S625-F631 WeakPolarHBondContact O-CA 3.33Å; S625-Y632 PolarHBondContact N-O 3.35Å; S625-Y632 PolarHBondContact O-N 2.61Å
626	Q	86	Confident	85.2	Confident	29 Å²	29	52.8 Å²	52.8	14%	0.136	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	156.6	-177.3	58.6	-177.8	-31.8	0	0	113.7	N464 D611 R612 F631	N464-Q626 VanDerWaalsContact OD1-C 3.25Å; N464-Q626 WeakPolarHBondContact OD1-CG 3.24Å; N464-Q626 PolarHBondContact OD1-O 3.01Å; D611-Q626 PolarHBondContact OD1-NE2 3.14Å; R612-Q626 HydrophobicContact CB-CB 4.41Å; Q626-F631 HydrophobicContact CB-CB 4.33Å
627	T	78.1	Confident	85.2	Confident	43 Å²	43	57 Å²	57	26%	0.264	32%	0.317	S	S	.	.			trans	-125.7	176.1	170	63.1	0	0	0	0	108.4	N464 S629 T630 Y632	N464-T627 WeakPolarHBondContact OD1-CA 3.43Å; N464-T627 PolarHBondContact OD1-N 3.02Å; N464-T627 PolarHBondContact OD1-O 3.05Å; T627-S629 PolarHBondContact O-N 2.88Å; T627-S629 VanDerWaalsContact O-N 3.16Å; T627-T630 PolarHBondContact N-O 3.42Å; T627-T630 PolarHBondContact O-N 2.65Å; T627-T630 VanDerWaalsContact OG1-CG2 3.28Å; T627-T630 WeakPolarHBondContact OG1-CG2 3.32Å; T627-T630 PolarHBondContact OG1-N 3.46Å; T627-T630 PolarHBondContact OG1-O 2.76Å; T627-Y632 HydrophobicContact CG2-CD2 4.5Å; T627-Y632 HydrophobicContact CG2-CE2 3.7Å
628	G	70.4	Confident	85.4	Confident	6 Å²	6	57.6 Å²	57.6	6%	0.062	32%	0.32	C	S	.	.	S	Bend	trans	-64.5	-20.4	-178.3	0	0	0	0	0	117.4	N464 Q575 R612	N464-G628 WeakPolarHBondContact ND2-CA 3.37Å; N464-G628 PolarHBondContact ND2-N 2.84Å; Q575-G628 VanDerWaalsContact NE2-C 3.33Å; Q575-G628 PolarHBondContact NE2-O 2.88Å; R612-G628 VanDerWaalsContact CZ-O 3.25Å; R612-G628 PolarHBondContact NH1-O 2.84Å; R612-G628 PolarHBondContact NH2-O 3.47Å
629	S	72	Confident	85.4	Confident	94 Å²	94	57.7 Å²	57.7	66%	0.657	32%	0.322	S	S	*	.	S	Bend	trans	-110.4	-26.2	179.1	53.6	0	0	0	0	112.8	T627	T627-S629 PolarHBondContact O-N 2.88Å; T627-S629 VanDerWaalsContact O-N 3.16Å
630	T	80.8	Confident	85.7	Confident	27 Å²	27	53.5 Å²	53.5	17%	0.166	30%	0.303	C	S	.	.			trans	-154.4	161.9	-168.7	-179.8	0	0	0	0	113	T627 Y632 K965	T627-T630 PolarHBondContact N-O 3.42Å; T627-T630 PolarHBondContact O-N 2.65Å; T627-T630 VanDerWaalsContact OG1-CG2 3.28Å; T627-T630 WeakPolarHBondContact OG1-CG2 3.32Å; T627-T630 PolarHBondContact OG1-N 3.46Å; T627-T630 PolarHBondContact OG1-O 2.76Å; T630-Y632 HydrophobicContact CG2-CE1 4.46Å; T630-Y632 HydrophobicContact CG2-CE2 3.75Å; T630-Y632 WeakPolarHBondContact CG2-OH 3.34Å; T630-K965 WeakPolarHBondContact OG1-CE 3.34Å; T630-K965 PolarHBondContact OG1-NZ 2.76Å
631	F	85.4	Confident	86.1	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.018	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	169.1	169	70	-90.5	0	0	0	112.1	R612 P617 S625 Q626 V644 K965	R612-F631 HydrophobicContact CB-CB 4.09Å; R612-F631 HydrophobicContact CB-CD1 4.45Å; P617-F631 HydrophobicContact CB-CD2 4.11Å; P617-F631 HydrophobicContact CB-CE1 4.11Å; P617-F631 HydrophobicContact CB-CE2 3.66Å; P617-F631 HydrophobicContact CB-CZ 3.66Å; P617-F631 HydrophobicContact CG-CB 4.46Å; P617-F631 HydrophobicContact CG-CD1 4.1Å; P617-F631 HydrophobicContact CG-CD2 3.36Å; P617-F631 HydrophobicContact CG-CE1 4.17Å; P617-F631 HydrophobicContact CG-CE2 3.45Å; P617-F631 VanDerWaalsContact CG-CE2 3.45Å; P617-F631 HydrophobicContact CG-CG 3.72Å; P617-F631 HydrophobicContact CG-CZ 3.86Å; S625-F631 CarbonylContact O-C 3.57Å; S625-F631 VanDerWaalsContact O-CA 3.26Å; S625-F631 WeakPolarHBondContact O-CA 3.33Å; Q626-F631 HydrophobicContact CB-CB 4.33Å; F631-V644 HydrophobicContact CE2-CG1 3.95Å; F631-V644 HydrophobicContact CZ-CG1 4.08Å; F631-K965 HydrophobicContact CE1-CD 4.19Å; F631-K965 HydrophobicContact CE2-CG 4.27Å; F631-K965 HydrophobicContact CZ-CD 3.99Å; F631-K965 VanDerWaalsContact CZ-CE 3.45Å; F631-K965 HydrophobicContact CZ-CG 3.91Å; F631-K965 VanDerWaalsContact O-CE 3.27Å; F631-K965 WeakPolarHBondContact O-CE 3.42Å; F631-K965 PolarHBondContact O-NZ 2.64Å
632	Y	89.1	Confident	86.4	Confident	120 Å²	120	46 Å²	46	47%	0.471	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	142.5	176.6	-56.2	-90.6	0	0	0	109.8	C624 S625 T627 T630	C624-Y632 WeakPolarHBondContact CA-O 3.3Å; S625-Y632 PolarHBondContact N-O 3.35Å; S625-Y632 PolarHBondContact O-N 2.61Å; T627-Y632 HydrophobicContact CG2-CD2 4.5Å; T627-Y632 HydrophobicContact CG2-CE2 3.7Å; T630-Y632 HydrophobicContact CG2-CE1 4.46Å; T630-Y632 HydrophobicContact CG2-CE2 3.75Å; T630-Y632 WeakPolarHBondContact CG2-OH 3.34Å
633	C	92.3	Very high	86.4	Confident	23 Å²	23	47.4 Å²	47.4	16%	0.155	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	131	178.3	-59.6	0	0	0	0	109.8	C618 A643	C618-C633 WeakPolarHBondContact CA-SG 3.24Å; C618-C633 HydrophobicContact CB-CB 3.6Å; C618-C633 WeakPolarHBondContact CB-SG 3.38Å; C618-C633 WeakPolarHBondContact SG-CA 3.36Å; C618-C633 WeakPolarHBondContact SG-CB 3.34Å; C618-C633 CovalentContact SG-SG 2.02Å; C618-C633 PolarHBondContact SG-SG 2.93Å; C633-A643 WeakPolarHBondContact CB-O 3.36Å
634	D	93.1	Very high	86.3	Confident	81 Å²	81	43.9 Å²	43.9	43%	0.433	27%	0.265	S	S	.	.			trans	-89.8	104.9	170.8	-175.4	2.7	0	0	0	109.3	P623 T636	P623-D634 HydrophobicContact CB-CB 4.32Å; P623-D634 WeakPolarHBondContact CD-O 3.45Å; P623-D634 HydrophobicContact CG-CB 4.5Å; P623-D634 PolarHBondContact O-N 3.3Å; D634-T636 VanDerWaalsContact C-N 3.28Å; D634-T636 WeakPolarHBondContact OD1-CB 3.25Å; D634-T636 PolarHBondContact OD1-N 3.08Å; D634-T636 PolarHBondContact OD1-OG1 2.84Å
635	C	91.9	Very high	86.3	Confident	26 Å²	26	42.1 Å²	42.1	18%	0.176	25%	0.253	C	S	.	.			trans	-89.4	5.9	179.8	-46.9	0	0	0	0	113	N637 T638 Y640 G642 C645	C635-N637 PolarHBondContact O-N 2.87Å; C635-T638 PolarHBondContact O-N 2.89Å; C635-T638 PolarHBondContact O-OG1 2.86Å; C635-Y640 VanDerWaalsContact CB-O 3.25Å; C635-Y640 WeakPolarHBondContact CB-O 3.37Å; C635-G642 PolarHBondContact SG-O 3.37Å; C635-C645 WeakPolarHBondContact CA-SG 3.48Å; C635-C645 HydrophobicContact CB-CB 3.75Å; C635-C645 WeakPolarHBondContact CB-SG 3.5Å; C635-C645 WeakPolarHBondContact SG-CA 3.15Å; C635-C645 WeakPolarHBondContact SG-CB 3.44Å; C635-C645 PolarHBondContact SG-N 2.06Å; C635-C645 VanDerWaalsContact SG-N 3.37Å; C635-C645 CovalentContact SG-SG 2.03Å; C635-C645 PolarHBondContact SG-SG 3.07Å
636	T	90.5	Very high	86.1	Confident	92 Å²	92	39.9 Å²	39.9	56%	0.564	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	131.3	-179.9	-46.3	0	0	0	0	110	D634 T638	D634-T636 VanDerWaalsContact C-N 3.28Å; D634-T636 WeakPolarHBondContact OD1-CB 3.25Å; D634-T636 PolarHBondContact OD1-N 3.08Å; D634-T636 PolarHBondContact OD1-OG1 2.84Å; T636-T638 PolarHBondContact O-N 2.77Å
637	N	84.4	Confident	86.2	Confident	158 Å²	158	39.2 Å²	39.2	85%	0.845	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.7	14.1	-179.7	-49.4	-52.6	0	0	0	115.9	C635	C635-N637 PolarHBondContact O-N 2.87Å
638	T	86.4	Confident	86.6	Confident	31 Å²	31	37.6 Å²	37.6	19%	0.19	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-25.8	173.3	67.4	0	0	0	0	112	A622 C635 T636 Y640	A622-T638 HydrophobicContact CB-CG2 4.03Å; C635-T638 PolarHBondContact O-N 2.89Å; C635-T638 PolarHBondContact O-OG1 2.86Å; T636-T638 PolarHBondContact O-N 2.77Å; T638-Y640 VanDerWaalsContact C-N 3.3Å; T638-Y640 VanDerWaalsContact O-CD2 3.24Å; T638-Y640 WeakPolarHBondContact O-CD2 3.37Å; T638-Y640 WeakPolarHBondContact O-CE2 3.39Å; T638-Y640 PolarHBondContact OG1-N 3.12Å; T638-Y640 VanDerWaalsContact OG1-N 3.16Å; T638-Y640 PolarHBondContact OG1-O 3.1Å
639	G	87.7	Confident	87.5	Confident	7 Å²	7	43.6 Å²	43.6	7%	0.072	25%	0.248	C	C	.	.	S	Bend	trans	83.8	7.4	-170.2	0	0	0	0	0	113.8	E649	G639-E649 WeakPolarHBondContact O-CB 3.21Å; G639-E649 PolarHBondContact O-N 2.03Å; G639-E649 VanDerWaalsContact O-N 3.08Å
640	Y	90.5	Very high	88.3	Confident	8 Å²	8	42.4 Å²	42.4	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	154.3	-179.9	-60.9	-88.7	0	0	0	110.5	H620 C635 T638 C645 Q647 D673 G676 P682	H620-Y640 HydrophobicContact CB-CD2 3.81Å; H620-Y640 HydrophobicContact CB-CE2 3.83Å; H620-Y640 AromaticContact CD2-CE2 3.68Å; H620-Y640 AromaticContact CD2-CZ 3.58Å; H620-Y640 AromaticContact CE1-CD1 3.4Å; H620-Y640 VanDerWaalsContact CE1-CD1 3.4Å; H620-Y640 WeakPolarHBondContact CE1-CD1 3.31Å; H620-Y640 AromaticContact CE1-CE1 3.36Å; H620-Y640 WeakPolarHBondContact CE1-CE1 3.5Å; H620-Y640 AromaticContact CE1-CG 3.82Å; H620-Y640 AromaticContact CE1-CZ 3.72Å; H620-Y640 AromaticContact CG-CD2 3.57Å; H620-Y640 AromaticContact CG-CE2 3.45Å; H620-Y640 VanDerWaalsContact CG-CE2 3.45Å; H620-Y640 AromaticContact CG-CG 3.99Å; H620-Y640 AromaticContact CG-CZ 3.77Å; H620-Y640 AromaticContact ND1-CD1 3.53Å; H620-Y640 AromaticContact ND1-CD2 3.52Å; H620-Y640 AromaticContact ND1-CE1 3.76Å; H620-Y640 AromaticContact ND1-CE2 3.74Å; H620-Y640 AromaticContact ND1-CG 3.42Å; H620-Y640 AromaticContact ND1-CZ 3.87Å; H620-Y640 AromaticContact NE2-CE1 3.6Å; H620-Y640 AromaticContact NE2-CZ 3.6Å; C635-Y640 VanDerWaalsContact CB-O 3.25Å; C635-Y640 WeakPolarHBondContact CB-O 3.37Å; T638-Y640 VanDerWaalsContact C-N 3.3Å; T638-Y640 VanDerWaalsContact O-CD2 3.24Å; T638-Y640 WeakPolarHBondContact O-CD2 3.37Å; T638-Y640 WeakPolarHBondContact O-CE2 3.39Å; T638-Y640 PolarHBondContact OG1-N 3.12Å; T638-Y640 VanDerWaalsContact OG1-N 3.16Å; T638-Y640 PolarHBondContact OG1-O 3.1Å; Y640-C645 VanDerWaalsContact CB-O 3.25Å; Y640-C645 WeakPolarHBondContact CB-O 3.48Å; Y640-Q647 CarbonylContact C-O 3.5Å; Y640-Q647 WeakPolarHBondContact CA-O 3.3Å; Y640-D673 VanDerWaalsContact CE1-OD2 3.31Å; Y640-D673 WeakPolarHBondContact CE1-OD2 3.46Å; Y640-D673 PolarHBondContact OH-OD2 2.9Å; Y640-G676 WeakPolarHBondContact CE1-O 3.17Å; Y640-P682 HydrophobicContact CE2-CG 4.24Å; Y640-P682 WeakPolarHBondContact OH-CD 3.15Å; Y640-P682 WeakPolarHBondContact OH-CG 3.44Å
641	A	89.2	Confident	88.8	Confident	11 Å²	11	42.7 Å²	42.7	9%	0.091	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	177.4	-177.7	0	0	0	0	0	112.3	C645 H646 Q647 E649	A641-C645 WeakPolarHBondContact O-CA 3.42Å; A641-H646 PolarHBondContact O-N 2.97Å; A641-Q647 PolarHBondContact N-O 3.08Å; A641-Q647 PolarHBondContact O-N 3.39Å; A641-E649 HydrophobicContact CB-CG 3.8Å
642	G	87.9	Confident	89	Confident	21 Å²	21	43.2 Å²	43.2	22%	0.216	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	167.3	-178.3	0	0	0	0	0	112.9	C635 V644 C645 E966	C635-G642 PolarHBondContact SG-O 3.37Å; G642-V644 PolarHBondContact O-N 3.16Å; G642-C645 PolarHBondContact O-N 2.59Å; G642-C645 VanDerWaalsContact O-N 3.1Å; G642-E966 WeakPolarHBondContact CA-OE1 3.3Å
643	A	88.2	Confident	89.1	Confident	30 Å²	30	37.8 Å²	37.8	25%	0.248	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-11.1	-171.7	0	0	0	0	0	115.6	C633 K965 E966	C633-A643 WeakPolarHBondContact CB-O 3.36Å; A643-K965 HydrophobicContact CB-CB 3.46Å; A643-K965 VanDerWaalsContact CB-CB 3.46Å; A643-K965 HydrophobicContact CB-CG 3.99Å; A643-E966 HydrophobicContact CB-CG 4.02Å; A643-E966 PolarHBondContact N-OE1 2.89Å
644	V	88.8	Confident	89.2	Confident	8 Å²	8	36.7 Å²	36.7	5%	0.048	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.2	12.1	177.7	-63.1	0	0	0	0	113.5	K619 F631 G642 H646 N963 K965	K619-V644 PolarHBondContact N-O 3.23Å; F631-V644 HydrophobicContact CE2-CG1 3.95Å; F631-V644 HydrophobicContact CZ-CG1 4.08Å; G642-V644 PolarHBondContact O-N 3.16Å; V644-H646 VanDerWaalsContact C-N 3.34Å; V644-H646 HydrophobicContact CG2-CB 3.87Å; V644-H646 PolarHBondContact O-N 3.36Å; V644-N963 HydrophobicContact CG2-CB 4.02Å; V644-N963 WeakPolarHBondContact CG2-ND2 3.12Å; V644-K965 HydrophobicContact CG1-CG 4.03Å
645	C	90.1	Very high	89.2	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	41.4	178.4	-38.3	0	0	0	0	113.7	H620 A622 C635 Y640 A641 G642	H620-C645 PolarHBondContact CE1-O 2.65Å; H620-C645 PolarHBondContact ND1-O 2.99Å; A622-C645 HydrophobicContact CB-CB 3.94Å; A622-C645 WeakPolarHBondContact CB-SG 3.29Å; C635-C645 WeakPolarHBondContact CA-SG 3.48Å; C635-C645 HydrophobicContact CB-CB 3.75Å; C635-C645 WeakPolarHBondContact CB-SG 3.5Å; C635-C645 WeakPolarHBondContact SG-CA 3.15Å; C635-C645 WeakPolarHBondContact SG-CB 3.44Å; C635-C645 PolarHBondContact SG-N 2.06Å; C635-C645 VanDerWaalsContact SG-N 3.37Å; C635-C645 CovalentContact SG-SG 2.03Å; C635-C645 PolarHBondContact SG-SG 3.07Å; Y640-C645 VanDerWaalsContact CB-O 3.25Å; Y640-C645 WeakPolarHBondContact CB-O 3.48Å; A641-C645 WeakPolarHBondContact O-CA 3.42Å; G642-C645 PolarHBondContact O-N 2.59Å; G642-C645 VanDerWaalsContact O-N 3.1Å
646	H	85.9	Confident	89.1	Confident	19 Å²	19	32.7 Å²	32.7	9%	0.088	18%	0.183	C	C	.	.			trans	-101.2	-41	-173.5	-176	-134.5	0	0	0	112.1	K619 A641 V644 S648 S677 D893 E961	K619-H646 HydrophobicContact CB-CB 4.47Å; K619-H646 HydrophobicContact CG-CB 4.05Å; A641-H646 PolarHBondContact O-N 2.97Å; V644-H646 VanDerWaalsContact C-N 3.34Å; V644-H646 HydrophobicContact CG2-CB 3.87Å; V644-H646 PolarHBondContact O-N 3.36Å; H646-S648 PolarHBondContact O-N 3.47Å; H646-S677 WeakPolarHBondContact NE2-CB 3.27Å; H646-S677 WeakPolarHBondContact O-CA 3.42Å; H646-S677 WeakPolarHBondContact O-CB 3.38Å; H646-S677 PolarHBondContact O-OG 2.64Å; H646-D893 IonicContact CE1-OD2 3.19Å; H646-E961 WeakPolarHBondContact CB-OE1 3.19Å; H646-E961 IonicContact CG-OE1 3.76Å; H646-E961 IonicContact ND1-OE1 3.52Å; H646-E961 PolarHBondContact ND1-OE1 2.91Å
647	Q	86.6	Confident	89.2	Confident	14 Å²	14	28.3 Å²	28.3	7%	0.065	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	119.5	-178.9	-177.9	64.6	65.1	0	0	111.5	Y640 A641 E961 I970	Y640-Q647 CarbonylContact C-O 3.5Å; Y640-Q647 WeakPolarHBondContact CA-O 3.3Å; A641-Q647 PolarHBondContact N-O 3.08Å; A641-Q647 PolarHBondContact O-N 3.39Å; Q647-E961 WeakPolarHBondContact CB-OE2 3.09Å; Q647-I970 HydrophobicContact CG-CD1 4.2Å
648	S	87.4	Confident	89.5	Confident	9 Å²	9	21.4 Å²	21.4	6%	0.063	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	140.3	174	-169.6	0	0	0	0	112.5	H646 Y650 D673	H646-S648 PolarHBondContact O-N 3.47Å; S648-Y650 VanDerWaalsContact C-N 3.32Å; S648-Y650 PolarHBondContact OG-N 3.47Å; S648-D673 WeakPolarHBondContact CB-OD2 3.4Å; S648-D673 VanDerWaalsContact OG-CB 3.31Å; S648-D673 WeakPolarHBondContact OG-CB 3.36Å; S648-D673 PolarHBondContact OG-OD2 2.86Å
649	E	88.3	Confident	89.7	Confident	132 Å²	132	22.9 Å²	22.9	62%	0.617	13%	0.129	S	C	*	.	S	Bend	trans	-85.8	-6.6	170	-63.4	-170.4	157.3	0	0	112.6	G639 A641	G639-E649 WeakPolarHBondContact O-CB 3.21Å; G639-E649 PolarHBondContact O-N 2.03Å; G639-E649 VanDerWaalsContact O-N 3.08Å; A641-E649 HydrophobicContact CB-CG 3.8Å
650	Y	90.3	Very high	89.7	Confident	69 Å²	69	25.1 Å²	25.1	27%	0.271	14%	0.136	S	C	.	.	S	Bend	trans	-102.4	163.1	-173.8	-54.6	-58.8	0	0	0	112.6	S648 T671 D673 P682	S648-Y650 VanDerWaalsContact C-N 3.32Å; S648-Y650 PolarHBondContact OG-N 3.47Å; Y650-T671 HydrophobicContact CD1-CG2 3.86Å; Y650-T671 HydrophobicContact CD2-CG2 3.88Å; Y650-T671 HydrophobicContact CE1-CG2 3.84Å; Y650-T671 HydrophobicContact CE2-CG2 3.84Å; Y650-T671 HydrophobicContact CG-CG2 3.88Å; Y650-D673 HydrophobicContact CD2-CB 4.25Å; Y650-P682 HydrophobicContact CD2-CB 3.64Å; Y650-P682 HydrophobicContact CD2-CG 3.86Å; Y650-P682 HydrophobicContact CE2-CB 3.71Å; Y650-P682 HydrophobicContact CE2-CG 3.87Å
651	F	91.2	Very high	89.7	Confident	33 Å²	33	28.5 Å²	28.5	15%	0.145	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-75.9	148.8	172.8	-63.4	-70.9	0	0	0	110.9	S653 E656 A657 F660 Y661 I670 I672 D673	F651-S653 VanDerWaalsContact C-N 3.28Å; F651-S653 PolarHBondContact O-N 3.46Å; F651-E656 HydrophobicContact CB-CB 4.22Å; F651-E656 HydrophobicContact CD1-CB 4.37Å; F651-E656 HydrophobicContact CD1-CG 4.05Å; F651-A657 HydrophobicContact CB-CB 4.43Å; F651-A657 HydrophobicContact CD2-CB 3.87Å; F651-A657 HydrophobicContact CE2-CB 4.32Å; F651-A657 HydrophobicContact CG-CB 4.1Å; F651-F660 HydrophobicContact CD1-CD2 4.43Å; F651-F660 HydrophobicContact CD1-CE2 4.39Å; F651-F660 AromaticContact CE1-CD2 3.59Å; F651-F660 HydrophobicContact CE1-CD2 3.59Å; F651-F660 AromaticContact CE1-CE2 3.7Å; F651-F660 HydrophobicContact CE1-CE2 3.7Å; F651-F660 HydrophobicContact CZ-CD2 4.07Å; F651-Y661 AromaticContact CE2-CE2 3.79Å; F651-Y661 HydrophobicContact CE2-CE2 3.79Å; F651-Y661 AromaticContact CZ-CE2 3.92Å; F651-Y661 HydrophobicContact CZ-CE2 3.92Å; F651-I670 HydrophobicContact CD2-CD1 4.13Å; F651-I672 CarbonylContact O-C 3.6Å; F651-I672 WeakPolarHBondContact O-CA 3.31Å; F651-I672 WeakPolarHBondContact O-CB 3.31Å; F651-D673 PolarHBondContact O-N 2.97Å
652	T	89.6	Confident	89.6	Confident	16 Å²	16	30 Å²	30	10%	0.098	16%	0.162	C	C	.	.	S	Bend	trans	-72.2	-20.8	179.3	61.5	0	0	0	0	114.3	E656 D673 M674	T652-E656 WeakPolarHBondContact CB-OE2 3.16Å; T652-E656 PolarHBondContact N-OE2 2.78Å; T652-E656 PolarHBondContact OG1-OE2 3.12Å; T652-D673 VanDerWaalsContact CA-O 3.25Å; T652-D673 WeakPolarHBondContact CA-O 3.44Å; T652-M674 WeakPolarHBondContact O-CA 3.11Å
653	S	91.6	Very high	89.5	Confident	6 Å²	6	37.6 Å²	37.6	4%	0.042	20%	0.197	C	C	.	.			trans	-166.3	171.3	169.9	65.9	0	0	0	0	111.8	F651 S655 E656 A657 D865 F868	F651-S653 VanDerWaalsContact C-N 3.28Å; F651-S653 PolarHBondContact O-N 3.46Å; S653-S655 PolarHBondContact O-N 2.71Å; S653-S655 WeakPolarHBondContact OG-CB 3.34Å; S653-S655 PolarHBondContact OG-N 3.4Å; S653-E656 WeakPolarHBondContact O-CB 3.09Å; S653-E656 PolarHBondContact O-N 3.04Å; S653-E656 VanDerWaalsContact O-N 3.13Å; S653-A657 PolarHBondContact O-N 3.41Å; S653-A657 VanDerWaalsContact O-N 3.15Å; S653-D865 WeakPolarHBondContact CB-OD2 3.39Å; S653-D865 PolarHBondContact OG-OD2 2.89Å; S653-F868 WeakPolarHBondContact OG-CE2 3.36Å
654	C	94.3	Very high	89.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58	-32.5	169.5	-73.5	0	0	0	0	112.3	E656 A657 G658 C687 F689 V695 T697	C654-E656 VanDerWaalsContact C-N 3.28Å; C654-E656 PolarHBondContact O-N 3.11Å; C654-A657 PolarHBondContact O-N 3.11Å; C654-G658 PolarHBondContact O-N 2.78Å; C654-C687 WeakPolarHBondContact CA-SG 3.4Å; C654-C687 HydrophobicContact CB-CB 3.59Å; C654-C687 WeakPolarHBondContact CB-SG 2.87Å; C654-C687 WeakPolarHBondContact SG-CA 3.35Å; C654-C687 WeakPolarHBondContact SG-CB 2.85Å; C654-C687 CovalentContact SG-SG 2.03Å; C654-C687 PolarHBondContact SG-SG 2.85Å; C654-F689 WeakPolarHBondContact O-CE1 3.03Å; C654-V695 HydrophobicContact CB-CG1 3.59Å; C654-T697 WeakPolarHBondContact CB-OG1 3.27Å; C654-T697 PolarHBondContact SG-OG1 2.69Å; C654-T697 VanDerWaalsContact SG-OG1 3.4Å
655	S	91.8	Very high	89.5	Confident	18 Å²	18	47.3 Å²	47.3	13%	0.126	24%	0.237	C	C	.	.	H	α-helix	trans	-61.3	-37.7	176.3	-58.7	0	0	0	0	111.9	S653 G658	S653-S655 PolarHBondContact O-N 2.71Å; S653-S655 WeakPolarHBondContact OG-CB 3.34Å; S653-S655 PolarHBondContact OG-N 3.4Å; S655-G658 PolarHBondContact O-N 2.65Å
656	E	90.9	Very high	89.6	Confident	5 Å²	5	50.6 Å²	50.6	2%	0.023	26%	0.26	C	S	.	.	H	α-helix	trans	-67.6	-47.1	173.1	-159.2	-179.3	164.6	0	0	111.7	F651 T652 S653 C654 G658 L659 F868 V957 R959	F651-E656 HydrophobicContact CB-CB 4.22Å; F651-E656 HydrophobicContact CD1-CB 4.37Å; F651-E656 HydrophobicContact CD1-CG 4.05Å; T652-E656 WeakPolarHBondContact CB-OE2 3.16Å; T652-E656 PolarHBondContact N-OE2 2.78Å; T652-E656 PolarHBondContact OG1-OE2 3.12Å; S653-E656 WeakPolarHBondContact O-CB 3.09Å; S653-E656 PolarHBondContact O-N 3.04Å; S653-E656 VanDerWaalsContact O-N 3.13Å; C654-E656 VanDerWaalsContact C-N 3.28Å; C654-E656 PolarHBondContact O-N 3.11Å; E656-G658 PolarHBondContact O-N 2.93Å; E656-L659 VanDerWaalsContact O-CB 3.25Å; E656-L659 WeakPolarHBondContact O-CB 3.38Å; E656-L659 WeakPolarHBondContact O-CG 3.2Å; E656-L659 PolarHBondContact O-N 3.48Å; E656-F868 VanDerWaalsContact CA-CZ 3.42Å; E656-F868 HydrophobicContact CB-CE1 4.33Å; E656-F868 HydrophobicContact CB-CE2 4.16Å; E656-F868 HydrophobicContact CB-CZ 3.45Å; E656-F868 VanDerWaalsContact CB-CZ 3.45Å; E656-F868 HydrophobicContact CG-CZ 3.95Å; E656-F868 VanDerWaalsContact N-CZ 3.31Å; E656-V957 HydrophobicContact CG-CG2 4.43Å; E656-V957 WeakPolarHBondContact OE1-CG1 3.46Å; E656-R959 IonicContact OE1-CZ 2.74Å; E656-R959 IonicContact OE1-NE 3.94Å; E656-R959 IonicContact OE1-NH2 3.81Å; E656-R959 PolarHBondContact OE1-NH2 2.88Å; E656-R959 IonicContact OE2-NH2 3.61Å
657	A	91.8	Very high	90	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.2	-34.2	177.9	0	0	0	0	0	111.6	F651 S653 C654 L659 F660 Y661 I670 F689	F651-A657 HydrophobicContact CB-CB 4.43Å; F651-A657 HydrophobicContact CD2-CB 3.87Å; F651-A657 HydrophobicContact CE2-CB 4.32Å; F651-A657 HydrophobicContact CG-CB 4.1Å; S653-A657 PolarHBondContact O-N 3.41Å; S653-A657 VanDerWaalsContact O-N 3.15Å; C654-A657 PolarHBondContact O-N 3.11Å; A657-L659 PolarHBondContact O-N 3.14Å; A657-F660 PolarHBondContact O-N 2.88Å; A657-Y661 HydrophobicContact CB-CD2 4.42Å; A657-Y661 WeakPolarHBondContact O-CD2 3.03Å; A657-Y661 PolarHBondContact O-N 3.36Å; A657-I670 HydrophobicContact CB-CD1 3.43Å; A657-I670 VanDerWaalsContact CB-CD1 3.43Å; A657-F689 HydrophobicContact CB-CZ 4.34Å
658	G	91.7	Very high	90.4	Very high	13 Å²	13	53.8 Å²	53.8	13%	0.134	28%	0.28	C	S	.	.	H	α-helix	trans	-57.7	-31.1	174.7	0	0	0	0	0	113.6	C654 S655 E656 F660 A662 F689	C654-G658 PolarHBondContact O-N 2.78Å; S655-G658 PolarHBondContact O-N 2.65Å; E656-G658 PolarHBondContact O-N 2.93Å; G658-F660 PolarHBondContact O-N 3.45Å; G658-A662 WeakPolarHBondContact O-CB 3.44Å; G658-A662 PolarHBondContact O-N 2.82Å; G658-A662 VanDerWaalsContact O-N 3.12Å; G658-F689 VanDerWaalsContact CA-CE1 3.41Å
659	L	89.3	Confident	90.8	Very high	62 Å²	62	59.1 Å²	59.1	33%	0.325	31%	0.308	S	S	.	.	H	α-helix	trans	-60.3	-28.3	175.9	-58.8	-179.5	0	0	0	112.6	E656 A657 F868 I897 W955 V957	E656-L659 VanDerWaalsContact O-CB 3.25Å; E656-L659 WeakPolarHBondContact O-CB 3.38Å; E656-L659 WeakPolarHBondContact O-CG 3.2Å; E656-L659 PolarHBondContact O-N 3.48Å; A657-L659 PolarHBondContact O-N 3.14Å; L659-F868 HydrophobicContact CD1-CE1 4.36Å; L659-I897 HydrophobicContact CD1-CD1 4.39Å; L659-W955 HydrophobicContact CD1-CB 4.05Å; L659-W955 HydrophobicContact CD2-CB 3.97Å; L659-W955 HydrophobicContact CD2-CG 4.19Å; L659-V957 HydrophobicContact CD1-CG2 4.29Å
660	F	88.8	Confident	91.1	Very high	53 Å²	53	54.1 Å²	54.1	23%	0.232	29%	0.285	C	S	.	.	H	α-helix	trans	-104.5	-34.8	-176.4	-57.7	-77.2	0	0	0	113.1	F651 A657 G658 V957 D972 T973	F651-F660 HydrophobicContact CD1-CD2 4.43Å; F651-F660 HydrophobicContact CD1-CE2 4.39Å; F651-F660 AromaticContact CE1-CD2 3.59Å; F651-F660 HydrophobicContact CE1-CD2 3.59Å; F651-F660 AromaticContact CE1-CE2 3.7Å; F651-F660 HydrophobicContact CE1-CE2 3.7Å; F651-F660 HydrophobicContact CZ-CD2 4.07Å; A657-F660 PolarHBondContact O-N 2.88Å; G658-F660 PolarHBondContact O-N 3.45Å; F660-V957 HydrophobicContact CE2-CG2 3.87Å; F660-V957 HydrophobicContact CZ-CB 4.32Å; F660-V957 HydrophobicContact CZ-CG2 3.63Å; F660-D972 HydrophobicContact CE1-CB 4.1Å; F660-D972 HydrophobicContact CZ-CB 4.48Å; F660-T973 HydrophobicContact CD1-CG2 4.13Å; F660-T973 HydrophobicContact CE1-CG2 4.03Å; F660-T973 HydrophobicContact CZ-CG2 4.41Å
661	Y	90.3	Very high	91.3	Very high	79 Å²	79	52.3 Å²	52.3	31%	0.31	28%	0.281	S	S	.	.	H	α-helix	trans	-111.4	-19.7	-169	-63.8	-71.3	0	0	0	115.6	F651 A657 L663 Q664 Q665 I668	F651-Y661 AromaticContact CE2-CE2 3.79Å; F651-Y661 HydrophobicContact CE2-CE2 3.79Å; F651-Y661 AromaticContact CZ-CE2 3.92Å; F651-Y661 HydrophobicContact CZ-CE2 3.92Å; A657-Y661 HydrophobicContact CB-CD2 4.42Å; A657-Y661 WeakPolarHBondContact O-CD2 3.03Å; A657-Y661 PolarHBondContact O-N 3.36Å; Y661-L663 PolarHBondContact O-N 2.62Å; Y661-L663 VanDerWaalsContact O-N 3.08Å; Y661-Q664 PolarHBondContact O-N 2.78Å; Y661-Q665 PolarHBondContact O-N 2.94Å; Y661-I668 HydrophobicContact CD1-CD1 4.31Å; Y661-I668 HydrophobicContact CD2-CD1 4.42Å; Y661-I668 HydrophobicContact CG-CD1 4.25Å
662	A	87	Confident	91.4	Very high	43 Å²	43	50.8 Å²	50.8	36%	0.355	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-27.4	-170.3	0	0	0	0	0	114.2	G658 Q664 F689	G658-A662 WeakPolarHBondContact O-CB 3.44Å; G658-A662 PolarHBondContact O-N 2.82Å; G658-A662 VanDerWaalsContact O-N 3.12Å; A662-Q664 VanDerWaalsContact C-N 3.35Å; A662-F689 HydrophobicContact CB-CB 3.9Å; A662-F689 HydrophobicContact CB-CD1 4.24Å; A662-F689 HydrophobicContact CB-CD2 4.27Å; A662-F689 HydrophobicContact CB-CG 3.89Å
663	L	85.1	Confident	91.5	Very high	180 Å²	180	50 Å²	50	94%	0.942	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-17.2	177.1	-64	178.8	0	0	0	113.7	Y661	Y661-L663 PolarHBondContact O-N 2.62Å; Y661-L663 VanDerWaalsContact O-N 3.08Å
664	Q	87.5	Confident	91.3	Very high	155 Å²	155	50.2 Å²	50.2	72%	0.724	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	-31.7	-174	-61.1	-177.9	6.4	0	0	112.5	Y661 A662	Y661-Q664 PolarHBondContact O-N 2.78Å; A662-Q664 VanDerWaalsContact C-N 3.35Å
665	Q	89.5	Confident	90.6	Very high	87 Å²	87	51.6 Å²	51.6	41%	0.407	28%	0.278	S	S	.	.			trans	-137.5	139.2	-175.6	-64.8	-176	-15.2	0	0	109.7	Y661 F689	Y661-Q665 PolarHBondContact O-N 2.94Å; Q665-F689 WeakPolarHBondContact O-CD2 3.05Å
666	S	91.8	Very high	90.2	Very high	69 Å²	69	51.1 Å²	51.1	48%	0.483	28%	0.276	S	S	.	.	S	Bend	trans	-79	-30.4	172.7	57.1	0	0	0	0	112.1	F689	S666-F689 PolarHBondContact O-N 3.19Å
667	T	94.9	Very high	89.5	Confident	70 Å²	70	51.9 Å²	51.9	43%	0.429	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	145.6	179.2	55.4	0	0	0	0	110.9	C687 D688	T667-C687 CarbonylContact C-O 3.59Å; T667-C687 WeakPolarHBondContact CA-O 3.33Å; T667-D688 HydrophobicContact CG2-CB 3.94Å
668	I	95.5	Very high	88.9	Confident	30 Å²	30	52.9 Å²	52.9	15%	0.154	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	142.5	179.4	-167.6	177.9	0	0	0	111	Y661 I670 T686 C687 F689	Y661-I668 HydrophobicContact CD1-CD1 4.31Å; Y661-I668 HydrophobicContact CD2-CD1 4.42Å; Y661-I668 HydrophobicContact CG-CD1 4.25Å; I668-I670 HydrophobicContact CB-CG2 4.5Å; I668-I670 HydrophobicContact CD1-CG2 3.71Å; I668-I670 HydrophobicContact CG1-CG2 3.81Å; I668-I670 HydrophobicContact CG2-CG2 4.04Å; I668-T686 CarbonylContact O-C 3.58Å; I668-T686 WeakPolarHBondContact O-CA 3.07Å; I668-C687 HydrophobicContact CG2-CB 3.91Å; I668-C687 PolarHBondContact N-O 3.08Å; I668-C687 PolarHBondContact O-N 2.79Å; I668-F689 HydrophobicContact CG2-CE2 3.6Å; I668-F689 HydrophobicContact CG2-CZ 3.95Å
669	N	95.8	Very high	88.1	Confident	122 Å²	122	57.5 Å²	57.5	65%	0.652	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	122.6	169.6	-68.1	-17	0	0	0	109.3	V685 T686	N669-V685 WeakPolarHBondContact CA-O 3.25Å; N669-T686 VanDerWaalsContact OD1-CB 3.29Å; N669-T686 WeakPolarHBondContact OD1-CB 3.21Å; N669-T686 VanDerWaalsContact OD1-CG2 3.26Å; N669-T686 WeakPolarHBondContact OD1-CG2 3.4Å; N669-T686 PolarHBondContact OD1-OG1 2.86Å
670	I	94.7	Very high	87.8	Confident	27 Å²	27	55.6 Å²	55.6	14%	0.138	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	163	-179.4	62.7	168.8	0	0	0	111.1	F651 A657 I668 I672 V685 C687	F651-I670 HydrophobicContact CD2-CD1 4.13Å; A657-I670 HydrophobicContact CB-CD1 3.43Å; A657-I670 VanDerWaalsContact CB-CD1 3.43Å; I668-I670 HydrophobicContact CB-CG2 4.5Å; I668-I670 HydrophobicContact CD1-CG2 3.71Å; I668-I670 HydrophobicContact CG1-CG2 3.81Å; I668-I670 HydrophobicContact CG2-CG2 4.04Å; I670-I672 HydrophobicContact CD1-CG2 3.67Å; I670-I672 HydrophobicContact CG1-CG2 3.98Å; I670-V685 HydrophobicContact CG1-CG2 4.22Å; I670-V685 PolarHBondContact N-O 3.19Å; I670-V685 PolarHBondContact O-N 2.75Å; I670-C687 WeakPolarHBondContact CD1-SG 3.25Å; I670-C687 VanDerWaalsContact CG1-SG 3.51Å
671	T	93.9	Very high	87.5	Confident	30 Å²	30	57.6 Å²	57.6	18%	0.184	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	133.2	164.7	-50.5	0	0	0	0	108.8	Y650 P682 I683	Y650-T671 HydrophobicContact CD1-CG2 3.86Å; Y650-T671 HydrophobicContact CD2-CG2 3.88Å; Y650-T671 HydrophobicContact CE1-CG2 3.84Å; Y650-T671 HydrophobicContact CE2-CG2 3.84Å; Y650-T671 HydrophobicContact CG-CG2 3.88Å; T671-P682 HydrophobicContact CG2-CB 3.64Å; T671-I683 CarbonylContact C-O 3.14Å; T671-I683 VanDerWaalsContact CA-O 3.29Å; T671-I683 WeakPolarHBondContact CA-O 3.48Å
672	I	93.1	Very high	87.5	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	151	172.3	63.7	169.8	0	0	0	110	F651 I670 M674 P682 I683 V685 T697	F651-I672 CarbonylContact O-C 3.6Å; F651-I672 WeakPolarHBondContact O-CA 3.31Å; F651-I672 WeakPolarHBondContact O-CB 3.31Å; I670-I672 HydrophobicContact CD1-CG2 3.67Å; I670-I672 HydrophobicContact CG1-CG2 3.98Å; I672-M674 HydrophobicContact CD1-CG 4.34Å; I672-P682 WeakPolarHBondContact O-CA 3.37Å; I672-I683 HydrophobicContact CD1-CD1 4.31Å; I672-I683 HydrophobicContact CD1-CG1 4.33Å; I672-I683 HydrophobicContact CG1-CD1 4.25Å; I672-I683 HydrophobicContact CG1-CG1 3.73Å; I672-I683 PolarHBondContact N-O 2.89Å; I672-I683 PolarHBondContact O-N 2.75Å; I672-V685 HydrophobicContact CB-CG2 4.4Å; I672-V685 HydrophobicContact CD1-CG1 4.07Å; I672-V685 HydrophobicContact CD1-CG2 3.91Å; I672-V685 HydrophobicContact CG1-CG1 4.12Å; I672-V685 HydrophobicContact CG1-CG2 3.8Å; I672-V685 HydrophobicContact CG2-CG2 3.81Å; I672-T697 HydrophobicContact CD1-CG2 4.17Å
673	D	91.3	Very high	87.8	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	29%	0.292	C	S	.	.			trans	-131.9	98	-179.5	-179.4	-10.1	0	0	0	108.9	Y640 S648 Y650 F651 T652 D675 G676 P682	Y640-D673 VanDerWaalsContact CE1-OD2 3.31Å; Y640-D673 WeakPolarHBondContact CE1-OD2 3.46Å; Y640-D673 PolarHBondContact OH-OD2 2.9Å; S648-D673 WeakPolarHBondContact CB-OD2 3.4Å; S648-D673 VanDerWaalsContact OG-CB 3.31Å; S648-D673 WeakPolarHBondContact OG-CB 3.36Å; S648-D673 PolarHBondContact OG-OD2 2.86Å; Y650-D673 HydrophobicContact CD2-CB 4.25Å; F651-D673 PolarHBondContact O-N 2.97Å; T652-D673 VanDerWaalsContact CA-O 3.25Å; T652-D673 WeakPolarHBondContact CA-O 3.44Å; D673-D675 PolarHBondContact O-N 2.75Å; D673-G676 PolarHBondContact O-N 2.85Å; D673-G676 WeakPolarHBondContact OD1-CA 3.26Å; D673-G676 PolarHBondContact OD1-N 2.76Å; D673-P682 HydrophobicContact CB-CB 4.26Å; D673-P682 HydrophobicContact CB-CG 4.26Å
674	M	87.4	Confident	88.2	Confident	10 Å²	10	51.9 Å²	51.9	5%	0.049	28%	0.283	C	S	.	.	S	Bend	trans	-67.8	-37.1	-164.2	-73	178.7	-68.9	0	0	113.6	T652 I672 I683 T731 E734 L735 R738	T652-M674 WeakPolarHBondContact O-CA 3.11Å; I672-M674 HydrophobicContact CD1-CG 4.34Å; M674-I683 HydrophobicContact CE-CD1 3.91Å; M674-T731 HydrophobicContact CE-CG2 3.35Å; M674-T731 VanDerWaalsContact CE-O 3.26Å; M674-T731 WeakPolarHBondContact CE-O 3.33Å; M674-E734 HydrophobicContact CE-CB 4.46Å; M674-L735 HydrophobicContact CE-CB 3.89Å; M674-L735 WeakPolarHBondContact SD-CA 3.37Å; M674-L735 HydrophobicContact SD-CB 3.64Å; M674-L735 HydrophobicContact SD-CD1 3.86Å; M674-L735 HydrophobicContact SD-CG 4.36Å; M674-R738 PolarHBondContact O-NH1 2.97Å
675	D	81.1	Confident	88.6	Confident	28 Å²	28	44.6 Å²	44.6	15%	0.15	25%	0.249	C	C	.	.	S	Bend	trans	-98.8	-3	177.7	63.3	-12.7	0	0	0	112.9	D673 S677 G678 V679 L680	D673-D675 PolarHBondContact O-N 2.75Å; D675-S677 PolarHBondContact O-N 3.36Å; D675-S677 VanDerWaalsContact O-N 3.11Å; D675-G678 VanDerWaalsContact CG-CA 3.5Å; D675-G678 PolarHBondContact O-N 3.1Å; D675-G678 VanDerWaalsContact OD2-C 3.23Å; D675-G678 WeakPolarHBondContact OD2-CA 3.46Å; D675-V679 PolarHBondContact OD2-N 3.45Å; D675-L680 HydrophobicContact CB-CD1 4.27Å; D675-L680 WeakPolarHBondContact OD1-CB 3.28Å; D675-L680 WeakPolarHBondContact OD2-CB 3.39Å; D675-L680 VanDerWaalsContact OD2-CG 3.3Å; D675-L680 WeakPolarHBondContact OD2-CG 3.16Å; D675-L680 PolarHBondContact OD2-N 2.95Å
676	G	82.8	Confident	88.9	Confident	8 Å²	8	41.4 Å²	41.4	8%	0.082	24%	0.236	C	C	.	.	S	Bend	trans	67.7	-108.2	177.1	0	0	0	0	0	109.6	Y640 D673 G678	Y640-G676 WeakPolarHBondContact CE1-O 3.17Å; D673-G676 PolarHBondContact O-N 2.85Å; D673-G676 WeakPolarHBondContact OD1-CA 3.26Å; D673-G676 PolarHBondContact OD1-N 2.76Å; G676-G678 PolarHBondContact O-N 2.9Å; G676-G678 VanDerWaalsContact O-N 3.12Å
677	S	75.6	Confident	89.2	Confident	21 Å²	21	38.1 Å²	38.1	15%	0.147	21%	0.213	C	C	.	.	S	Bend	trans	-78.8	13.4	-180	-47.5	0	0	0	0	114.2	H646 D675	H646-S677 WeakPolarHBondContact NE2-CB 3.27Å; H646-S677 WeakPolarHBondContact O-CA 3.42Å; H646-S677 WeakPolarHBondContact O-CB 3.38Å; H646-S677 PolarHBondContact O-OG 2.64Å; D675-S677 PolarHBondContact O-N 3.36Å; D675-S677 VanDerWaalsContact O-N 3.11Å
678	G	78.8	Confident	89.2	Confident	21 Å²	21	36.1 Å²	36.1	22%	0.216	20%	0.199	C	C	.	.	S	Bend	trans	-78.4	-147.5	-174	0	0	0	0	0	113.1	H620 D675 G676	H620-G678 PolarHBondContact NE2-O 3.16Å; H620-G678 VanDerWaalsContact NE2-O 3.16Å; D675-G678 VanDerWaalsContact CG-CA 3.5Å; D675-G678 PolarHBondContact O-N 3.1Å; D675-G678 VanDerWaalsContact OD2-C 3.23Å; D675-G678 WeakPolarHBondContact OD2-CA 3.46Å; G676-G678 PolarHBondContact O-N 2.9Å; G676-G678 VanDerWaalsContact O-N 3.12Å
679	V	76.2	Confident	89.2	Confident	111 Å²	111	35.4 Å²	35.4	67%	0.673	20%	0.195	S	C	*	.	S	Bend	trans	-109.4	-11.4	-175.6	-63	0	0	0	0	113.1	W306 D675	W306-V679 HydrophobicContact CZ2-CG1 4.32Å; D675-V679 PolarHBondContact OD2-N 3.45Å
680	L	81.9	Confident	89	Confident	22 Å²	22	34.2 Å²	34.2	12%	0.115	19%	0.192	C	C	.	.	S	Bend	trans	-74.3	147.4	179.5	-57.5	177.6	0	0	0	110.4	D675 E730 E734	D675-L680 HydrophobicContact CB-CD1 4.27Å; D675-L680 WeakPolarHBondContact OD1-CB 3.28Å; D675-L680 WeakPolarHBondContact OD2-CB 3.39Å; D675-L680 VanDerWaalsContact OD2-CG 3.3Å; D675-L680 WeakPolarHBondContact OD2-CG 3.16Å; D675-L680 PolarHBondContact OD2-N 2.95Å; L680-E730 HydrophobicContact CD2-CB 3.87Å; L680-E734 HydrophobicContact CD1-CB 3.72Å; L680-E734 HydrophobicContact CD1-CG 3.71Å
681	E	82.8	Confident	88.7	Confident	94 Å²	94	36.1 Å²	36.1	44%	0.439	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-80.2	143.4	177.8	-68.3	-166.8	-177.2	0	0	111.2
682	P	90.6	Very high	87.8	Confident	20 Å²	20	40.3 Å²	40.3	13%	0.13	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-63.7	139.2	171.8	-22.5	33.4	0	0	0	112.3	Y640 Y650 T671 I672 D673	Y640-P682 HydrophobicContact CE2-CG 4.24Å; Y640-P682 WeakPolarHBondContact OH-CD 3.15Å; Y640-P682 WeakPolarHBondContact OH-CG 3.44Å; Y650-P682 HydrophobicContact CD2-CB 3.64Å; Y650-P682 HydrophobicContact CD2-CG 3.86Å; Y650-P682 HydrophobicContact CE2-CB 3.71Å; Y650-P682 HydrophobicContact CE2-CG 3.87Å; T671-P682 HydrophobicContact CG2-CB 3.64Å; I672-P682 WeakPolarHBondContact O-CA 3.37Å; D673-P682 HydrophobicContact CB-CB 4.26Å; D673-P682 HydrophobicContact CB-CG 4.26Å
683	I	92.5	Very high	87.2	Confident	3 Å²	3	47.2 Å²	47.2	2%	0.015	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	141.5	-175.3	57.9	169.6	0	0	0	112.3	T671 I672 M674 V685 A727 T731 L735	T671-I683 CarbonylContact C-O 3.14Å; T671-I683 VanDerWaalsContact CA-O 3.29Å; T671-I683 WeakPolarHBondContact CA-O 3.48Å; I672-I683 HydrophobicContact CD1-CD1 4.31Å; I672-I683 HydrophobicContact CD1-CG1 4.33Å; I672-I683 HydrophobicContact CG1-CD1 4.25Å; I672-I683 HydrophobicContact CG1-CG1 3.73Å; I672-I683 PolarHBondContact N-O 2.89Å; I672-I683 PolarHBondContact O-N 2.75Å; M674-I683 HydrophobicContact CE-CD1 3.91Å; I683-V685 HydrophobicContact CD1-CG1 3.93Å; I683-V685 HydrophobicContact CG1-CG1 4.07Å; I683-A727 HydrophobicContact CB-CB 4.49Å; I683-A727 HydrophobicContact CG2-CB 3.51Å; I683-T731 HydrophobicContact CD1-CG2 4.31Å; I683-T731 HydrophobicContact CG2-CG2 3.56Å; I683-L735 HydrophobicContact CD1-CD2 4.12Å
684	E	93.8	Very high	87.1	Confident	159 Å²	159	49.4 Å²	49.4	74%	0.743	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.9	174	-66.8	-176.7	174.2	0	0	110.5	L699	E684-L699 WeakPolarHBondContact O-CD1 3.45Å
685	V	95.8	Very high	87.3	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	158.4	-176.8	-62	0	0	0	0	111.1	N669 I670 I672 I683 T697 M698 L699	N669-V685 WeakPolarHBondContact CA-O 3.25Å; I670-V685 HydrophobicContact CG1-CG2 4.22Å; I670-V685 PolarHBondContact N-O 3.19Å; I670-V685 PolarHBondContact O-N 2.75Å; I672-V685 HydrophobicContact CB-CG2 4.4Å; I672-V685 HydrophobicContact CD1-CG1 4.07Å; I672-V685 HydrophobicContact CD1-CG2 3.91Å; I672-V685 HydrophobicContact CG1-CG1 4.12Å; I672-V685 HydrophobicContact CG1-CG2 3.8Å; I672-V685 HydrophobicContact CG2-CG2 3.81Å; I683-V685 HydrophobicContact CD1-CG1 3.93Å; I683-V685 HydrophobicContact CG1-CG1 4.07Å; V685-T697 HydrophobicContact CB-CG2 3.84Å; V685-T697 HydrophobicContact CG1-CG2 3.8Å; V685-T697 HydrophobicContact CG2-CG2 4.06Å; V685-M698 WeakPolarHBondContact CA-O 3.46Å; V685-L699 HydrophobicContact CG1-CD1 4.05Å
686	T	96.9	Very high	88	Confident	20 Å²	20	49.9 Å²	49.9	12%	0.123	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	119.4	164.1	-53.7	0	0	0	0	108.9	I668 N669 M698 H700	I668-T686 CarbonylContact O-C 3.58Å; I668-T686 WeakPolarHBondContact O-CA 3.07Å; N669-T686 VanDerWaalsContact OD1-CB 3.29Å; N669-T686 WeakPolarHBondContact OD1-CB 3.21Å; N669-T686 VanDerWaalsContact OD1-CG2 3.26Å; N669-T686 WeakPolarHBondContact OD1-CG2 3.4Å; N669-T686 PolarHBondContact OD1-OG1 2.86Å; T686-M698 PolarHBondContact N-O 2.84Å; T686-M698 PolarHBondContact O-N 3.19Å; T686-H700 PolarHBondContact OG1-NE2 3.19Å
687	C	96.9	Very high	88.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	135.1	171.8	-55.2	0	0	0	0	110.4	C654 T667 I668 I670 F689 M696	C654-C687 WeakPolarHBondContact CA-SG 3.4Å; C654-C687 HydrophobicContact CB-CB 3.59Å; C654-C687 WeakPolarHBondContact CB-SG 2.87Å; C654-C687 WeakPolarHBondContact SG-CA 3.35Å; C654-C687 WeakPolarHBondContact SG-CB 2.85Å; C654-C687 CovalentContact SG-SG 2.03Å; C654-C687 PolarHBondContact SG-SG 2.85Å; T667-C687 CarbonylContact C-O 3.59Å; T667-C687 WeakPolarHBondContact CA-O 3.33Å; I668-C687 HydrophobicContact CG2-CB 3.91Å; I668-C687 PolarHBondContact N-O 3.08Å; I668-C687 PolarHBondContact O-N 2.79Å; I670-C687 WeakPolarHBondContact CD1-SG 3.25Å; I670-C687 VanDerWaalsContact CG1-SG 3.51Å; C687-F689 HydrophobicContact CB-CE1 3.88Å; C687-F689 HydrophobicContact CB-CE2 4.23Å; C687-F689 HydrophobicContact CB-CZ 3.58Å; C687-M696 CarbonylContact C-O 3.54Å; C687-M696 WeakPolarHBondContact CA-O 3.12Å
688	D	96.7	Very high	89.7	Confident	27 Å²	27	50.7 Å²	50.7	14%	0.144	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122	176.1	-175.1	-16.2	0	0	0	110.2	T667 T690 M696	T667-D688 HydrophobicContact CG2-CB 3.94Å; D688-T690 VanDerWaalsContact OD1-CB 3.26Å; D688-T690 WeakPolarHBondContact OD1-CB 3.46Å; D688-T690 WeakPolarHBondContact OD1-CG2 3.41Å; D688-T690 PolarHBondContact OD1-N 2.98Å; D688-T690 PolarHBondContact OD1-OG1 2.82Å; D688-M696 HydrophobicContact CB-CB 4.2Å; D688-M696 HydrophobicContact CB-CE 3.58Å; D688-M696 HydrophobicContact CB-SD 4.04Å; D688-M696 PolarHBondContact N-O 3.1Å; D688-M696 PolarHBondContact O-N 2.82Å; D688-M696 WeakPolarHBondContact OD2-CE 3.38Å
689	F	94.3	Very high	90.5	Very high	16 Å²	16	49.8 Å²	49.8	7%	0.07	28%	0.275	C	S	.	.			trans	-111.1	13.8	-175.3	-48.5	-57.6	0	0	0	112.1	C654 A657 G658 A662 Q665 S666 I668 C687 D691 V695	C654-F689 WeakPolarHBondContact O-CE1 3.03Å; A657-F689 HydrophobicContact CB-CZ 4.34Å; G658-F689 VanDerWaalsContact CA-CE1 3.41Å; A662-F689 HydrophobicContact CB-CB 3.9Å; A662-F689 HydrophobicContact CB-CD1 4.24Å; A662-F689 HydrophobicContact CB-CD2 4.27Å; A662-F689 HydrophobicContact CB-CG 3.89Å; Q665-F689 WeakPolarHBondContact O-CD2 3.05Å; S666-F689 PolarHBondContact O-N 3.19Å; I668-F689 HydrophobicContact CG2-CE2 3.6Å; I668-F689 HydrophobicContact CG2-CZ 3.95Å; C687-F689 HydrophobicContact CB-CE1 3.88Å; C687-F689 HydrophobicContact CB-CE2 4.23Å; C687-F689 HydrophobicContact CB-CZ 3.58Å; F689-D691 VanDerWaalsContact C-N 3.3Å; F689-D691 PolarHBondContact O-N 3.42Å; F689-V695 HydrophobicContact CD1-CB 4.5Å; F689-V695 HydrophobicContact CD1-CG1 3.72Å; F689-V695 HydrophobicContact CD1-CG2 4.06Å; F689-V695 HydrophobicContact CE1-CG1 3.7Å; F689-V695 HydrophobicContact CE1-CG2 4.49Å
690	T	91.8	Very high	91.4	Very high	96 Å²	96	49 Å²	49	59%	0.589	26%	0.264	S	S	*	.	S	Bend	trans	-62.6	-34.7	-178.9	51.1	0	0	0	0	113.2	D688	D688-T690 VanDerWaalsContact OD1-CB 3.26Å; D688-T690 WeakPolarHBondContact OD1-CB 3.46Å; D688-T690 WeakPolarHBondContact OD1-CG2 3.41Å; D688-T690 PolarHBondContact OD1-N 2.98Å; D688-T690 PolarHBondContact OD1-OG1 2.82Å
691	D	87.6	Confident	92	Very high	67 Å²	67	49.5 Å²	49.5	36%	0.358	27%	0.265	S	S	.	.	S	Bend	trans	-89.6	115.4	168.2	-178.1	1.1	0	0	0	109.9	F689 N693 T694	F689-D691 VanDerWaalsContact C-N 3.3Å; F689-D691 PolarHBondContact O-N 3.42Å; D691-N693 PolarHBondContact O-N 3.11Å; D691-N693 WeakPolarHBondContact OD1-CB 3.12Å; D691-N693 PolarHBondContact OD1-N 3.49Å; D691-T694 PolarHBondContact O-N 2.94Å
692	P	75.8	Confident	92.5	Very high	118 Å²	118	49 Å²	49	77%	0.766	27%	0.265	S	S	*	.	S	Bend	trans	-67	-17.1	179.4	28.1	-35.6	0	0	0	113.6
693	N	81.4	Confident	92.4	Very high	146 Å²	146	48.6 Å²	48.6	78%	0.781	26%	0.264	S	S	*	.	S	Bend	trans	-92.3	-30.3	-178.6	-60.7	-52.6	0	0	0	112.8	D691	D691-N693 PolarHBondContact O-N 3.11Å; D691-N693 WeakPolarHBondContact OD1-CB 3.12Å; D691-N693 PolarHBondContact OD1-N 3.49Å
694	T	88.2	Confident	92.1	Very high	47 Å²	47	51.9 Å²	51.9	29%	0.288	29%	0.285	S	S	.	.			trans	-138.6	104.4	-171.8	-42.6	0	0	0	0	110.9	D691	D691-T694 PolarHBondContact O-N 2.94Å
695	V	92.7	Very high	91.9	Very high	26 Å²	26	48.9 Å²	48.9	16%	0.158	27%	0.274	C	S	.	.			trans	-70.1	132.9	174.2	-179.9	0	0	0	0	109.8	C654 F689 G864	C654-V695 HydrophobicContact CB-CG1 3.59Å; F689-V695 HydrophobicContact CD1-CB 4.5Å; F689-V695 HydrophobicContact CD1-CG1 3.72Å; F689-V695 HydrophobicContact CD1-CG2 4.06Å; F689-V695 HydrophobicContact CE1-CG1 3.7Å; F689-V695 HydrophobicContact CE1-CG2 4.49Å; V695-G864 PolarHBondContact O-N 3.24Å
696	M	95.8	Very high	91.7	Very high	22 Å²	22	53.6 Å²	53.6	11%	0.108	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	133.6	177.3	178.4	-104.7	-69.1	0	0	110.9	C687 D688 M698 C862 Y863	C687-M696 CarbonylContact C-O 3.54Å; C687-M696 WeakPolarHBondContact CA-O 3.12Å; D688-M696 HydrophobicContact CB-CB 4.2Å; D688-M696 HydrophobicContact CB-CE 3.58Å; D688-M696 HydrophobicContact CB-SD 4.04Å; D688-M696 PolarHBondContact N-O 3.1Å; D688-M696 PolarHBondContact O-N 2.82Å; D688-M696 WeakPolarHBondContact OD2-CE 3.38Å; M696-M698 HydrophobicContact CE-CE 3.81Å; M696-M698 HydrophobicContact SD-CB 3.83Å; M696-M698 HydrophobicContact SD-CE 3.71Å; M696-C862 CarbonylContact C-O 3.52Å; M696-C862 WeakPolarHBondContact CA-O 3.24Å; M696-Y863 HydrophobicContact CB-CD1 3.76Å; M696-Y863 HydrophobicContact CB-CE1 3.98Å; M696-Y863 HydrophobicContact CG-CD1 3.77Å; M696-Y863 HydrophobicContact CG-CE1 3.61Å; M696-Y863 HydrophobicContact CG-CG 4.49Å
697	T	96.6	Very high	91.6	Very high	7 Å²	7	53.6 Å²	53.6	4%	0.043	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	117.6	174	-54	0	0	0	0	108.3	C654 I672 V685 L735 C862	C654-T697 WeakPolarHBondContact CB-OG1 3.27Å; C654-T697 PolarHBondContact SG-OG1 2.69Å; C654-T697 VanDerWaalsContact SG-OG1 3.4Å; I672-T697 HydrophobicContact CD1-CG2 4.17Å; V685-T697 HydrophobicContact CB-CG2 3.84Å; V685-T697 HydrophobicContact CG1-CG2 3.8Å; V685-T697 HydrophobicContact CG2-CG2 4.06Å; T697-L735 HydrophobicContact CG2-CD1 4.06Å; T697-C862 PolarHBondContact N-O 3.15Å; T697-C862 PolarHBondContact O-N 2.84Å
698	M	96.6	Very high	91.4	Very high	39 Å²	39	58.1 Å²	58.1	19%	0.192	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	122.6	179.9	-175.5	-177	-53.2	0	0	110.4	V685 T686 M696 H700 P859 L860 R861	V685-M698 WeakPolarHBondContact CA-O 3.46Å; T686-M698 PolarHBondContact N-O 2.84Å; T686-M698 PolarHBondContact O-N 3.19Å; M696-M698 HydrophobicContact CE-CE 3.81Å; M696-M698 HydrophobicContact SD-CB 3.83Å; M696-M698 HydrophobicContact SD-CE 3.71Å; M698-H700 PolarHBondContact SD-CE1 3.26Å; M698-P859 HydrophobicContact CG-CB 3.68Å; M698-P859 HydrophobicContact CG-CG 3.81Å; M698-P859 HydrophobicContact SD-CB 4.19Å; M698-P859 HydrophobicContact SD-CG 3.74Å; M698-L860 CarbonylContact C-O 3.02Å; M698-L860 WeakPolarHBondContact CA-O 3.41Å; M698-R861 HydrophobicContact CE-CG 4.36Å; M698-R861 HydrophobicContact CG-CG 4.3Å
699	L	95.5	Very high	91.2	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.01	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.3	178.7	-176.4	70.5	0	0	0	110.4	E684 V685 Y724 L732 L735 P859 L860	E684-L699 WeakPolarHBondContact O-CD1 3.45Å; V685-L699 HydrophobicContact CG1-CD1 4.05Å; L699-Y724 HydrophobicContact CD2-CD1 3.84Å; L699-Y724 HydrophobicContact CD2-CG 4.23Å; L699-Y724 HydrophobicContact CG-CD1 3.94Å; L699-L732 HydrophobicContact CD2-CD2 3.22Å; L699-L735 HydrophobicContact CB-CD2 4.38Å; L699-L735 HydrophobicContact CD2-CD2 4.13Å; L699-P859 WeakPolarHBondContact O-CA 3.41Å; L699-P859 VanDerWaalsContact O-CB 3.3Å; L699-P859 WeakPolarHBondContact O-CB 3.14Å; L699-L860 HydrophobicContact CB-CB 4.32Å; L699-L860 HydrophobicContact CD2-CD2 4.43Å; L699-L860 PolarHBondContact N-O 2.83Å; L699-L860 PolarHBondContact O-N 2.89Å
700	H	95	Very high	91	Very high	96 Å²	96	60.3 Å²	60.3	44%	0.444	34%	0.339	S	S	.	.			trans	-90.9	157.1	-177.5	-60.2	-80.3	0	0	0	111.8	T686 M698 Y724	T686-H700 PolarHBondContact OG1-NE2 3.19Å; M698-H700 PolarHBondContact SD-CE1 3.26Å; H700-Y724 WeakPolarHBondContact O-CD1 3.41Å
701	H	94.4	Very high	90.9	Very high	32 Å²	32	57.7 Å²	57.7	15%	0.148	33%	0.331	C	S	.	.			trans	-123.9	165.2	175.4	59.4	50.5	0	0	0	111.8	A703 L722 N723 Y724 V857 G858	H701-A703 VanDerWaalsContact C-N 3.29Å; H701-A703 PolarHBondContact CE1-O 2.79Å; H701-A703 WeakPolarHBondContact ND1-CB 3.44Å; H701-A703 PolarHBondContact ND1-N 2.94Å; H701-A703 VanDerWaalsContact ND1-N 3.18Å; H701-A703 PolarHBondContact ND1-O 2.85Å; H701-A703 PolarHBondContact O-N 3.1Å; H701-L722 HydrophobicContact CB-CB 4.47Å; H701-L722 HydrophobicContact CB-CD2 4.41Å; H701-N723 CarbonylContact C-O 3.49Å; H701-N723 VanDerWaalsContact CA-O 3.3Å; H701-N723 WeakPolarHBondContact CA-O 3.38Å; H701-Y724 HydrophobicContact CB-CD1 3.82Å; H701-Y724 HydrophobicContact CB-CE1 3.69Å; H701-Y724 HydrophobicContact CB-CG 4.34Å; H701-V857 PolarHBondContact CE1-O 2.59Å; H701-V857 VanDerWaalsContact CE1-O 3.26Å; H701-V857 PolarHBondContact NE2-O 3.1Å; H701-G858 PolarHBondContact NE2-O 2.89Å
702	D	92.6	Very high	91.1	Very high	83 Å²	83	58.9 Å²	58.9	44%	0.444	33%	0.332	S	S	.	.	S	Bend	trans	-73.5	-9.5	-179.4	79.7	-39.1	0	0	0	115.3	R720 N723	D702-R720 PolarHBondContact O-NH2 2.99Å; D702-R720 IonicContact OD1-NH2 3.93Å; D702-R720 PolarHBondContact OD1-NH2 3.28Å; D702-R720 IonicContact OD2-CZ 3.78Å; D702-R720 IonicContact OD2-NH2 3.06Å; D702-R720 PolarHBondContact OD2-NH2 2.83Å; D702-N723 HydrophobicContact CB-CB 4.2Å; D702-N723 PolarHBondContact N-O 2.72Å; D702-N723 PolarHBondContact OD1-N 3.04Å
703	A	89	Confident	91.6	Very high	11 Å²	11	57.6 Å²	57.6	9%	0.091	32%	0.315	C	S	.	.	S	Bend	trans	-69.6	131.1	179.7	0	0	0	0	0	111.9	H701 R720 L722	H701-A703 VanDerWaalsContact C-N 3.29Å; H701-A703 PolarHBondContact CE1-O 2.79Å; H701-A703 WeakPolarHBondContact ND1-CB 3.44Å; H701-A703 PolarHBondContact ND1-N 2.94Å; H701-A703 VanDerWaalsContact ND1-N 3.18Å; H701-A703 PolarHBondContact ND1-O 2.85Å; H701-A703 PolarHBondContact O-N 3.1Å; A703-R720 VanDerWaalsContact CA-NH2 3.34Å; A703-L722 HydrophobicContact CB-CG 4.37Å
704	P	87.3	Confident	91.9	Very high	73 Å²	73	53.3 Å²	53.3	47%	0.474	30%	0.3	S	S	.	.			trans	-59.4	158	172	-20.6	31.3	0	0	0	111.7	V707	P704-V707 HydrophobicContact CB-CG2 4.11Å; P704-V707 HydrophobicContact CG-CG2 4.17Å
705	D	88.1	Confident	92	Very high	96 Å²	96	52.5 Å²	52.5	51%	0.513	30%	0.296	S	S	.	.	S	Bend	trans	-56.8	-57.3	178.2	-78.4	-45.7	0	0	0	112.4	R856	D705-R856 VanDerWaalsContact CG-NH2 3.29Å; D705-R856 VanDerWaalsContact O-CA 3.23Å; D705-R856 WeakPolarHBondContact O-CA 3.31Å; D705-R856 WeakPolarHBondContact O-CB 3.5Å; D705-R856 VanDerWaalsContact O-CD 3.26Å; D705-R856 WeakPolarHBondContact O-CD 3.47Å; D705-R856 WeakPolarHBondContact O-CG 3.48Å; D705-R856 IonicContact OD1-CZ 3.5Å; D705-R856 IonicContact OD1-NE 2.77Å; D705-R856 PolarHBondContact OD1-NE 3.26Å; D705-R856 IonicContact OD1-NH2 3.9Å; D705-R856 PolarHBondContact OD1-NH2 2.85Å; D705-R856 IonicContact OD2-NH2 2.9Å
706	D	92.7	Very high	91.8	Very high	101 Å²	101	51.6 Å²	51.6	54%	0.54	29%	0.292	S	S	.	.	S	Bend	trans	-114.3	116.9	179.2	-70.4	-26.9	0	0	0	110.6	I854	D706-I854 HydrophobicContact CB-CG2 3.89Å
707	V	94.3	Very high	91.6	Very high	21 Å²	21	52.9 Å²	52.9	13%	0.127	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	119.8	178.5	-178.5	0	0	0	0	110.5	P704 Y718 I854 Y855	P704-V707 HydrophobicContact CB-CG2 4.11Å; P704-V707 HydrophobicContact CG-CG2 4.17Å; V707-Y718 WeakPolarHBondContact CG1-OH 3.36Å; V707-I854 WeakPolarHBondContact O-CA 3.35Å; V707-Y855 HydrophobicContact CB-CD1 4.06Å; V707-Y855 HydrophobicContact CB-CE1 3.54Å; V707-Y855 HydrophobicContact CB-CE2 4.31Å; V707-Y855 HydrophobicContact CG1-CD1 4.4Å; V707-Y855 HydrophobicContact CG1-CE1 3.54Å; V707-Y855 HydrophobicContact CG2-CE1 4.45Å; V707-Y855 HydrophobicContact CG2-CE2 4.48Å; V707-Y855 PolarHBondContact N-O 2.96Å; V707-Y855 PolarHBondContact O-N 2.95Å
708	V	92.7	Very high	91.4	Very high	94 Å²	94	53.6 Å²	53.6	57%	0.57	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	132.7	176.1	-173.9	0	0	0	0	110.3	I854	V708-I854 HydrophobicContact CG2-CD1 4.47Å; V708-I854 HydrophobicContact CG2-CG1 4.14Å
709	V	92.2	Very high	91.2	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	116.5	174.9	-173.5	0	0	0	0	108.5	Y712 Y718 F841 T844 A853 Y855	V709-Y712 HydrophobicContact CG1-CD2 3.8Å; V709-Y712 HydrophobicContact CG1-CE2 4.35Å; V709-Y718 HydrophobicContact CB-CD2 4.49Å; V709-Y718 HydrophobicContact CG1-CD1 4.1Å; V709-Y718 HydrophobicContact CG1-CD2 3.66Å; V709-Y718 HydrophobicContact CG1-CE2 4.27Å; V709-Y718 HydrophobicContact CG1-CG 3.53Å; V709-Y718 HydrophobicContact CG2-CD1 4Å; V709-Y718 HydrophobicContact CG2-CD2 4.15Å; V709-Y718 HydrophobicContact CG2-CE1 3.8Å; V709-Y718 HydrophobicContact CG2-CE2 3.95Å; V709-Y718 HydrophobicContact CG2-CG 4.14Å; V709-F841 HydrophobicContact CG1-CB 4.46Å; V709-F841 HydrophobicContact CG2-CD2 4.26Å; V709-T844 HydrophobicContact CB-CG2 4.24Å; V709-T844 HydrophobicContact CG1-CG2 3.87Å; V709-T844 WeakPolarHBondContact O-CB 3.29Å; V709-A853 PolarHBondContact N-O 3.02Å; V709-A853 PolarHBondContact O-N 3.31Å; V709-Y855 HydrophobicContact CG2-CD1 3.62Å; V709-Y855 HydrophobicContact CG2-CE1 3.56Å
710	D	90.9	Very high	91.1	Very high	88 Å²	88	62.4 Å²	62.4	47%	0.471	34%	0.336	S	S	.	.			trans	-146.1	139.7	-176.2	-173.2	4.7	0	0	0	109.1	Y712 R852	D710-Y712 VanDerWaalsContact O-CD2 3.27Å; D710-Y712 WeakPolarHBondContact O-CD2 3.36Å; D710-Y712 WeakPolarHBondContact O-CE2 3.29Å; D710-R852 HydrophobicContact CB-CB 4.31Å
711	G	89.8	Confident	90.9	Very high	41 Å²	41	64 Å²	64	42%	0.423	34%	0.341	S	S	.	.	S	Bend	trans	88.5	14.2	176.7	0	0	0	0	0	116.5	T844 G845	G711-T844 PolarHBondContact N-O 2.87Å; G711-G845 CarbonylContact C-O 3.54Å; G711-G845 VanDerWaalsContact CA-O 3.28Å; G711-G845 WeakPolarHBondContact CA-O 3.32Å
712	Y	90.6	Very high	90.8	Very high	93 Å²	93	62.9 Å²	62.9	37%	0.365	34%	0.337	S	S	.	.			trans	-110	94	-178.2	-63.8	-93.8	0	0	0	111.6	V709 D710 S717 Y718 G842 D843 T844 G845	V709-Y712 HydrophobicContact CG1-CD2 3.8Å; V709-Y712 HydrophobicContact CG1-CE2 4.35Å; D710-Y712 VanDerWaalsContact O-CD2 3.27Å; D710-Y712 WeakPolarHBondContact O-CD2 3.36Å; D710-Y712 WeakPolarHBondContact O-CE2 3.29Å; Y712-S717 WeakPolarHBondContact CB-OG 3.42Å; Y712-Y718 HydrophobicContact CD2-CD2 4.02Å; Y712-Y718 HydrophobicContact CD2-CG 4.45Å; Y712-Y718 HydrophobicContact CE1-CD2 4.17Å; Y712-Y718 AromaticContact CE2-CD2 3.65Å; Y712-Y718 HydrophobicContact CE2-CD2 3.65Å; Y712-Y718 HydrophobicContact CE2-CE2 4.49Å; Y712-Y718 HydrophobicContact CE2-CG 4.49Å; Y712-Y718 HydrophobicContact CG-CD2 4.45Å; Y712-Y718 AromaticContact CZ-CD2 3.73Å; Y712-G842 CarbonylContact O-C 3.52Å; Y712-G842 VanDerWaalsContact O-C 3.32Å; Y712-G842 WeakPolarHBondContact O-CA 3.48Å; Y712-D843 PolarHBondContact O-N 2.62Å; Y712-T844 WeakPolarHBondContact CA-OG1 2.94Å; Y712-T844 WeakPolarHBondContact CB-OG1 3.3Å; Y712-T844 PolarHBondContact N-OG1 3.29Å; Y712-T844 PolarHBondContact O-N 2.87Å; Y712-T844 PolarHBondContact O-OG1 3.29Å; Y712-G845 PolarHBondContact N-O 3.18Å
713	Q	87.3	Confident	90.8	Very high	91 Å²	91	63 Å²	63	43%	0.425	34%	0.337	S	S	.	.			trans	-82.4	-35.8	-172.8	-171.7	56.3	44.5	0	0	114.4	W771 D843	Q713-W771 WeakPolarHBondContact O-CZ3 3.35Å; Q713-D843 PolarHBondContact NE2-OD1 3.32Å; Q713-D843 VanDerWaalsContact NE2-OD1 3.14Å
714	A	88.3	Confident	90.9	Very high	55 Å²	55	63 Å²	63	46%	0.455	34%	0.335	S	S	.	.	S	Bend	trans	-77.9	148.5	-177.5	0	0	0	0	0	111.3	G716 S717 G842	A714-G716 PolarHBondContact O-N 3.18Å; A714-S717 PolarHBondContact N-OG 3.35Å; A714-S717 VanDerWaalsContact O-CB 3.24Å; A714-S717 WeakPolarHBondContact O-CB 3.45Å; A714-S717 PolarHBondContact O-N 3.01Å; A714-S717 VanDerWaalsContact O-N 3.12Å; A714-S717 PolarHBondContact O-OG 3.46Å; A714-G842 VanDerWaalsContact O-CA 3.29Å; A714-G842 WeakPolarHBondContact O-CA 3.38Å
715	P	89.1	Confident	90.9	Very high	31 Å²	31	62.2 Å²	62.2	20%	0.201	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	130	177.7	-23.2	32	0	0	0	112.2	S717 P759 E767 A770 W771 W773	P715-S717 PolarHBondContact O-N 3.49Å; P715-S717 VanDerWaalsContact O-N 3.08Å; P715-P759 HydrophobicContact CB-CG 4.36Å; P715-P759 HydrophobicContact CG-CB 4.21Å; P715-P759 HydrophobicContact CG-CG 3.88Å; P715-E767 WeakPolarHBondContact CB-O 3.27Å; P715-E767 WeakPolarHBondContact CG-O 3.26Å; P715-A770 WeakPolarHBondContact CB-O 3.46Å; P715-W771 HydrophobicContact CB-CE3 4.25Å; P715-W771 HydrophobicContact CG-CE3 3.82Å; P715-W771 HydrophobicContact CG-CZ3 3.86Å; P715-W773 HydrophobicContact CB-CZ3 4.45Å
716	G	89.6	Confident	90.4	Very high	7 Å²	7	66.4 Å²	66.4	7%	0.072	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	20.4	-178.6	0	0	0	0	0	116	A714 Y718 W771 F841	A714-G716 PolarHBondContact O-N 3.18Å; G716-Y718 CarbonylContact C-O 3.55Å; G716-W771 PolarHBondContact N-O 3.1Å; G716-F841 CarbonylContact C-O 3.52Å; G716-F841 WeakPolarHBondContact CA-O 3.25Å
717	S	90.1	Very high	90	Very high	49 Å²	49	62.1 Å²	62.1	34%	0.343	33%	0.327	S	S	.	.			trans	-73.2	-29.3	-178.7	57.5	0	0	0	0	113.5	Y712 A714 P715 F841	Y712-S717 WeakPolarHBondContact CB-OG 3.42Å; A714-S717 PolarHBondContact N-OG 3.35Å; A714-S717 VanDerWaalsContact O-CB 3.24Å; A714-S717 WeakPolarHBondContact O-CB 3.45Å; A714-S717 PolarHBondContact O-N 3.01Å; A714-S717 VanDerWaalsContact O-N 3.12Å; A714-S717 PolarHBondContact O-OG 3.46Å; P715-S717 PolarHBondContact O-N 3.49Å; P715-S717 VanDerWaalsContact O-N 3.08Å; S717-F841 PolarHBondContact N-O 3.18Å
718	Y	93	Very high	89.3	Confident	22 Å²	22	63.9 Å²	63.9	9%	0.086	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	135.9	160.8	177.4	-95.7	0	0	0	108.9	V707 V709 Y712 G716 R720 V839 R840 F841 Y855	V707-Y718 WeakPolarHBondContact CG1-OH 3.36Å; V709-Y718 HydrophobicContact CB-CD2 4.49Å; V709-Y718 HydrophobicContact CG1-CD1 4.1Å; V709-Y718 HydrophobicContact CG1-CD2 3.66Å; V709-Y718 HydrophobicContact CG1-CE2 4.27Å; V709-Y718 HydrophobicContact CG1-CG 3.53Å; V709-Y718 HydrophobicContact CG2-CD1 4Å; V709-Y718 HydrophobicContact CG2-CD2 4.15Å; V709-Y718 HydrophobicContact CG2-CE1 3.8Å; V709-Y718 HydrophobicContact CG2-CE2 3.95Å; V709-Y718 HydrophobicContact CG2-CG 4.14Å; Y712-Y718 HydrophobicContact CD2-CD2 4.02Å; Y712-Y718 HydrophobicContact CD2-CG 4.45Å; Y712-Y718 HydrophobicContact CE1-CD2 4.17Å; Y712-Y718 AromaticContact CE2-CD2 3.65Å; Y712-Y718 HydrophobicContact CE2-CD2 3.65Å; Y712-Y718 HydrophobicContact CE2-CE2 4.49Å; Y712-Y718 HydrophobicContact CE2-CG 4.49Å; Y712-Y718 HydrophobicContact CG-CD2 4.45Å; Y712-Y718 AromaticContact CZ-CD2 3.73Å; G716-Y718 CarbonylContact C-O 3.55Å; Y718-R720 HydrophobicContact CE1-CB 4Å; Y718-V839 HydrophobicContact CE1-CG2 4.38Å; Y718-R840 WeakPolarHBondContact O-CA 3.32Å; Y718-F841 WeakPolarHBondContact CB-O 3.49Å; Y718-F841 HydrophobicContact CD1-CB 4.29Å; Y718-F841 AromaticContact CD1-CD2 3.64Å; Y718-F841 HydrophobicContact CD1-CD2 3.64Å; Y718-F841 HydrophobicContact CD1-CG 4.43Å; Y718-F841 AromaticContact CE1-CD2 4Å; Y718-F841 HydrophobicContact CE1-CD2 4Å; Y718-F841 HydrophobicContact CE1-CE2 4.5Å; Y718-F841 PolarHBondContact N-O 3.39Å; Y718-F841 PolarHBondContact O-N 3.44Å; Y718-F841 VanDerWaalsContact O-N 3.12Å; Y718-Y855 AromaticContact CE1-CE1 3.59Å; Y718-Y855 HydrophobicContact CE1-CE1 3.59Å; Y718-Y855 AromaticContact CE1-CZ 3.98Å; Y718-Y855 AromaticContact CZ-CE1 3.82Å; Y718-Y855 WeakPolarHBondContact OH-CE1 3.4Å; Y718-Y855 PolarHBondContact OH-OH 3.24Å
719	R	92.9	Very high	88.8	Confident	158 Å²	158	65.1 Å²	65.1	60%	0.596	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.9	135.1	177	75.1	-176.7	-170.2	-154.1	3.8	110.7	V839 R840	R719-V839 WeakPolarHBondContact CA-O 3.22Å; R719-R840 HydrophobicContact CB-CG 4.49Å
720	R	93.3	Very high	88.4	Confident	68 Å²	68	70 Å²	70	26%	0.257	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	119.8	168.8	176	150.5	168.3	85.3	15	110.2	D702 A703 Y718 E838 V839 Y855	D702-R720 PolarHBondContact O-NH2 2.99Å; D702-R720 IonicContact OD1-NH2 3.93Å; D702-R720 PolarHBondContact OD1-NH2 3.28Å; D702-R720 IonicContact OD2-CZ 3.78Å; D702-R720 IonicContact OD2-NH2 3.06Å; D702-R720 PolarHBondContact OD2-NH2 2.83Å; A703-R720 VanDerWaalsContact CA-NH2 3.34Å; Y718-R720 HydrophobicContact CE1-CB 4Å; R720-E838 VanDerWaalsContact O-CA 3.26Å; R720-E838 WeakPolarHBondContact O-CA 3.39Å; R720-E838 WeakPolarHBondContact O-CG 3.42Å; R720-V839 HydrophobicContact CB-CG2 4.11Å; R720-V839 PolarHBondContact N-O 3.36Å; R720-V839 PolarHBondContact O-N 3.47Å; R720-Y855 VanDerWaalsContact CD-OH 3.29Å; R720-Y855 WeakPolarHBondContact CD-OH 3.22Å
721	K	91.5	Very high	88.3	Confident	128 Å²	128	65.9 Å²	65.9	56%	0.557	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	138.4	168	-65.5	-172.5	176.3	-171.4	0	109	E267 M837 E838	E267-K721 IonicContact OE1-NZ 2.62Å; E267-K721 PolarHBondContact OE1-NZ 2.99Å; K721-M837 WeakPolarHBondContact CA-O 3.14Å; K721-E838 HydrophobicContact CG-CB 4.44Å
722	L	92.6	Very high	88.4	Confident	10 Å²	10	64 Å²	64	5%	0.052	31%	0.311	C	S	.	.			trans	-93.3	132.6	174	-77.9	73	0	0	0	108.7	H701 A703 Y724 V836 M837 V839 V857	H701-L722 HydrophobicContact CB-CB 4.47Å; H701-L722 HydrophobicContact CB-CD2 4.41Å; A703-L722 HydrophobicContact CB-CG 4.37Å; L722-Y724 HydrophobicContact CB-CE2 3.96Å; L722-V836 HydrophobicContact CD1-CG1 4.27Å; L722-V836 HydrophobicContact CD2-CB 4.4Å; L722-V836 HydrophobicContact CD2-CG1 4.26Å; L722-M837 PolarHBondContact N-O 2.87Å; L722-V839 HydrophobicContact CD1-CG1 4.46Å; L722-V857 HydrophobicContact CD2-CB 4.05Å; L722-V857 HydrophobicContact CD2-CG1 3.71Å; L722-V857 HydrophobicContact CD2-CG2 4.29Å
723	N	90.7	Very high	88.3	Confident	86 Å²	86	60.3 Å²	60.3	46%	0.46	30%	0.302	S	S	.	.			trans	-107.8	121.7	175.3	-172.5	-6	0	0	0	109.9	H701 D702 G725	H701-N723 CarbonylContact C-O 3.49Å; H701-N723 VanDerWaalsContact CA-O 3.3Å; H701-N723 WeakPolarHBondContact CA-O 3.38Å; D702-N723 HydrophobicContact CB-CB 4.2Å; D702-N723 PolarHBondContact N-O 2.72Å; D702-N723 PolarHBondContact OD1-N 3.04Å; N723-G725 VanDerWaalsContact C-N 3.3Å; N723-G725 PolarHBondContact OD1-N 2.88Å; N723-G725 PolarHBondContact OD1-O 2.86Å; N723-G725 VanDerWaalsContact OD1-O 3.1Å
724	Y	92.7	Very high	88.4	Confident	11 Å²	11	58 Å²	58	4%	0.043	29%	0.291	C	S	.	.			trans	-96	31.1	177.8	-65.1	-89.5	0	0	0	112.1	L699 H700 H701 L722 L732 Q744 P835 V836 M837	L699-Y724 HydrophobicContact CD2-CD1 3.84Å; L699-Y724 HydrophobicContact CD2-CG 4.23Å; L699-Y724 HydrophobicContact CG-CD1 3.94Å; H700-Y724 WeakPolarHBondContact O-CD1 3.41Å; H701-Y724 HydrophobicContact CB-CD1 3.82Å; H701-Y724 HydrophobicContact CB-CE1 3.69Å; H701-Y724 HydrophobicContact CB-CG 4.34Å; L722-Y724 HydrophobicContact CB-CE2 3.96Å; Y724-L732 HydrophobicContact CD2-CD1 4.08Å; Y724-L732 HydrophobicContact CG-CD2 4.23Å; Y724-Q744 PolarHBondContact OH-NE2 3.29Å; Y724-P835 HydrophobicContact CE1-CB 4.35Å; Y724-P835 HydrophobicContact CE2-CB 4.15Å; Y724-P835 HydrophobicContact CE2-CG 4.08Å; Y724-V836 WeakPolarHBondContact CE2-O 3.33Å; Y724-V836 PolarHBondContact OH-O 3.47Å; Y724-M837 HydrophobicContact CD2-SD 4.48Å; Y724-M837 HydrophobicContact CE2-SD 4.19Å
725	G	85.6	Confident	88.7	Confident	56 Å²	56	55.8 Å²	55.8	58%	0.577	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	-125.2	178.5	0	0	0	0	0	112.2	N723 A727	N723-G725 VanDerWaalsContact C-N 3.3Å; N723-G725 PolarHBondContact OD1-N 2.88Å; N723-G725 PolarHBondContact OD1-O 2.86Å; N723-G725 VanDerWaalsContact OD1-O 3.1Å; G725-A727 VanDerWaalsContact C-N 3.33Å
726	R	78.5	Confident	88.9	Confident	183 Å²	183	54.5 Å²	54.5	69%	0.691	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-8	176.4	-68.9	-173.5	-180	-176.9	-1.2	113.4	D728	R726-D728 PolarHBondContact O-N 2.98Å
727	A	83.6	Confident	89	Confident	12 Å²	12	61.1 Å²	61.1	10%	0.099	29%	0.286	C	S	.	.			trans	-67.1	104.4	-178.6	0	0	0	0	0	110.8	I683 G725 L732	I683-A727 HydrophobicContact CB-CB 4.49Å; I683-A727 HydrophobicContact CG2-CB 3.51Å; G725-A727 VanDerWaalsContact C-N 3.33Å; A727-L732 HydrophobicContact CB-CD2 3.75Å; A727-L732 HydrophobicContact CB-CG 3.94Å
728	D	81	Confident	88.9	Confident	58 Å²	58	59.7 Å²	59.7	31%	0.31	27%	0.273	S	S	.	.			trans	-71.6	175	170.3	73.6	-1.5	0	0	0	111.3	R726 E730 T731 L732	R726-D728 PolarHBondContact O-N 2.98Å; D728-E730 VanDerWaalsContact C-N 3.29Å; D728-E730 PolarHBondContact O-N 2.54Å; D728-E730 PolarHBondContact OD1-N 2.98Å; D728-T731 PolarHBondContact O-N 2.77Å; D728-T731 WeakPolarHBondContact OD1-CA 3.45Å; D728-T731 WeakPolarHBondContact OD1-CB 3.46Å; D728-T731 PolarHBondContact OD1-N 3.05Å; D728-T731 PolarHBondContact OD1-OG1 3.02Å; D728-L732 WeakPolarHBondContact O-CB 3.03Å; D728-L732 VanDerWaalsContact O-CG 3.24Å; D728-L732 WeakPolarHBondContact O-CG 3.38Å; D728-L732 PolarHBondContact O-N 3.02Å
729	R	81.2	Confident	88.9	Confident	119 Å²	119	58.8 Å²	58.8	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-67.9	-34.3	-172.9	-177.8	172.6	160.8	169.8	-8.9	111.7	G733 Q777 D778	R729-G733 PolarHBondContact O-N 3.23Å; R729-Q777 WeakPolarHBondContact CD-O 3.2Å; R729-Q777 HydrophobicContact CG-CG 4.14Å; R729-Q777 PolarHBondContact NE-O 2.95Å; R729-Q777 PolarHBondContact O-NE2 3.22Å; R729-D778 PolarHBondContact NH2-O 3.37Å
730	E	83.5	Confident	88.9	Confident	105 Å²	105	56 Å²	56	49%	0.491	27%	0.266	S	S	.	.	H	α-helix	trans	-66.4	-47.5	177.4	-71.1	74.7	-174.8	0	0	110.5	L680 D728 G733 E734	L680-E730 HydrophobicContact CD2-CB 3.87Å; D728-E730 VanDerWaalsContact C-N 3.29Å; D728-E730 PolarHBondContact O-N 2.54Å; D728-E730 PolarHBondContact OD1-N 2.98Å; E730-G733 PolarHBondContact O-N 3.24Å; E730-E734 PolarHBondContact O-N 3.4Å
731	T	89.9	Confident	88.9	Confident	0 Å²	0	59 Å²	59	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.1	-45.2	177.2	-56.4	0	0	0	0	111.2	M674 I683 D728 G733 E734 L735	M674-T731 HydrophobicContact CE-CG2 3.35Å; M674-T731 VanDerWaalsContact CE-O 3.26Å; M674-T731 WeakPolarHBondContact CE-O 3.33Å; I683-T731 HydrophobicContact CD1-CG2 4.31Å; I683-T731 HydrophobicContact CG2-CG2 3.56Å; D728-T731 PolarHBondContact O-N 2.77Å; D728-T731 WeakPolarHBondContact OD1-CA 3.45Å; D728-T731 WeakPolarHBondContact OD1-CB 3.46Å; D728-T731 PolarHBondContact OD1-N 3.05Å; D728-T731 PolarHBondContact OD1-OG1 3.02Å; T731-G733 VanDerWaalsContact C-N 3.28Å; T731-G733 PolarHBondContact O-N 3.17Å; T731-E734 PolarHBondContact O-N 3.04Å; T731-L735 PolarHBondContact O-N 3.46Å
732	L	90.9	Very high	89.2	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-41.9	173.9	-70.8	173.2	0	0	0	111.8	L699 Y724 A727 D728 E734 L735 V736 P835 M837	L699-L732 HydrophobicContact CD2-CD2 3.22Å; Y724-L732 HydrophobicContact CD2-CD1 4.08Å; Y724-L732 HydrophobicContact CG-CD2 4.23Å; A727-L732 HydrophobicContact CB-CD2 3.75Å; A727-L732 HydrophobicContact CB-CG 3.94Å; D728-L732 WeakPolarHBondContact O-CB 3.03Å; D728-L732 VanDerWaalsContact O-CG 3.24Å; D728-L732 WeakPolarHBondContact O-CG 3.38Å; D728-L732 PolarHBondContact O-N 3.02Å; L732-E734 VanDerWaalsContact C-N 3.34Å; L732-L735 PolarHBondContact O-N 2.83Å; L732-V736 VanDerWaalsContact O-CG2 3.31Å; L732-V736 WeakPolarHBondContact O-CG2 3.38Å; L732-V736 PolarHBondContact O-N 2.76Å; L732-V736 VanDerWaalsContact O-N 3.08Å; L732-P835 HydrophobicContact CB-CG 4.48Å; L732-P835 HydrophobicContact CD1-CG 4.09Å; L732-P835 HydrophobicContact CD2-CG 4.25Å; L732-M837 HydrophobicContact CD1-CE 4.05Å; L732-M837 HydrophobicContact CD1-SD 3.88Å
733	G	89.7	Confident	89.4	Confident	17 Å²	17	53.3 Å²	53.3	18%	0.175	26%	0.259	C	S	.	.	H	α-helix	trans	-64.4	-40.6	177.7	0	0	0	0	0	112.6	R729 E730 T731 V736 R737	R729-G733 PolarHBondContact O-N 3.23Å; E730-G733 PolarHBondContact O-N 3.24Å; T731-G733 VanDerWaalsContact C-N 3.28Å; T731-G733 PolarHBondContact O-N 3.17Å; G733-V736 PolarHBondContact O-N 3.24Å; G733-R737 WeakPolarHBondContact O-CB 3.3Å; G733-R737 PolarHBondContact O-N 2.74Å
734	E	89.2	Confident	89.7	Confident	43 Å²	43	49.2 Å²	49.2	20%	0.201	24%	0.237	C	C	.	.	H	α-helix	trans	-68	-41.7	178.6	-172.9	58.1	-162.9	0	0	111.9	M674 L680 E730 T731 L732 V736 R737 R738	M674-E734 HydrophobicContact CE-CB 4.46Å; L680-E734 HydrophobicContact CD1-CB 3.72Å; L680-E734 HydrophobicContact CD1-CG 3.71Å; E730-E734 PolarHBondContact O-N 3.4Å; T731-E734 PolarHBondContact O-N 3.04Å; L732-E734 VanDerWaalsContact C-N 3.34Å; E734-V736 PolarHBondContact O-N 3.28Å; E734-R737 VanDerWaalsContact CD-NH2 3.31Å; E734-R737 PolarHBondContact O-N 2.02Å; E734-R737 IonicContact OE1-CZ 3.66Å; E734-R737 IonicContact OE1-NE 3.43Å; E734-R737 IonicContact OE1-NH2 3.66Å; E734-R737 PolarHBondContact OE1-NH2 3.33Å; E734-R737 IonicContact OE2-CZ 3.06Å; E734-R737 IonicContact OE2-NE 2.79Å; E734-R737 PolarHBondContact OE2-NE 2.89Å; E734-R737 IonicContact OE2-NH2 3.94Å; E734-R737 PolarHBondContact OE2-NH2 3.45Å; E734-R737 VanDerWaalsContact OE2-NH2 3.14Å; E734-R738 HydrophobicContact CG-CG 4.46Å; E734-R738 WeakPolarHBondContact O-CB 3.41Å; E734-R738 PolarHBondContact O-N 3.37Å; E734-R738 WeakPolarHBondContact OE1-CD 3.48Å; E734-R738 WeakPolarHBondContact OE1-CG 3.35Å
735	L	93.2	Very high	89.8	Confident	7 Å²	7	50.4 Å²	50.4	4%	0.037	25%	0.247	C	C	.	.	H	α-helix	trans	-56.4	-52.1	173.5	178	62.2	0	0	0	110.9	M674 I683 T697 L699 T731 L732 S739 L860	M674-L735 HydrophobicContact CE-CB 3.89Å; M674-L735 WeakPolarHBondContact SD-CA 3.37Å; M674-L735 HydrophobicContact SD-CB 3.64Å; M674-L735 HydrophobicContact SD-CD1 3.86Å; M674-L735 HydrophobicContact SD-CG 4.36Å; I683-L735 HydrophobicContact CD1-CD2 4.12Å; T697-L735 HydrophobicContact CG2-CD1 4.06Å; L699-L735 HydrophobicContact CB-CD2 4.38Å; L699-L735 HydrophobicContact CD2-CD2 4.13Å; T731-L735 PolarHBondContact O-N 3.46Å; L732-L735 PolarHBondContact O-N 2.83Å; L735-S739 WeakPolarHBondContact O-CB 3.47Å; L735-S739 PolarHBondContact O-N 2.74Å; L735-S739 VanDerWaalsContact O-N 3.07Å; L735-S739 PolarHBondContact O-OG 2.9Å; L735-L860 HydrophobicContact CD2-CD2 4.24Å
736	V	93.9	Very high	90.3	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.024	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-48.9	-179.9	171	0	0	0	0	110.2	L732 G733 E734 R738 S739 K831 L860	L732-V736 VanDerWaalsContact O-CG2 3.31Å; L732-V736 WeakPolarHBondContact O-CG2 3.38Å; L732-V736 PolarHBondContact O-N 2.76Å; L732-V736 VanDerWaalsContact O-N 3.08Å; G733-V736 PolarHBondContact O-N 3.24Å; E734-V736 PolarHBondContact O-N 3.28Å; V736-R738 PolarHBondContact O-N 3.36Å; V736-S739 PolarHBondContact O-N 2.86Å; V736-K831 HydrophobicContact CG1-CB 4.48Å; V736-K831 HydrophobicContact CG1-CD 4.33Å; V736-K831 HydrophobicContact CG1-CG 3.37Å; V736-K831 WeakPolarHBondContact CG1-O 3.26Å; V736-K831 WeakPolarHBondContact O-CD 2.95Å; V736-K831 WeakPolarHBondContact O-CE 2.98Å; V736-K831 PolarHBondContact O-NZ 2.89Å; V736-L860 HydrophobicContact CG2-CD2 3.98Å
737	R	91.1	Very high	91.1	Very high	147 Å²	147	40.5 Å²	40.5	56%	0.555	20%	0.196	S	C	*	.	H	α-helix	trans	-60.5	-43.3	-178.7	-170.6	-168.9	72.9	77.5	-1.4	112.5	G733 E734 K831	G733-R737 WeakPolarHBondContact O-CB 3.3Å; G733-R737 PolarHBondContact O-N 2.74Å; E734-R737 VanDerWaalsContact CD-NH2 3.31Å; E734-R737 PolarHBondContact O-N 2.02Å; E734-R737 IonicContact OE1-CZ 3.66Å; E734-R737 IonicContact OE1-NE 3.43Å; E734-R737 IonicContact OE1-NH2 3.66Å; E734-R737 PolarHBondContact OE1-NH2 3.33Å; E734-R737 IonicContact OE2-CZ 3.06Å; E734-R737 IonicContact OE2-NE 2.79Å; E734-R737 PolarHBondContact OE2-NE 2.89Å; E734-R737 IonicContact OE2-NH2 3.94Å; E734-R737 PolarHBondContact OE2-NH2 3.45Å; E734-R737 VanDerWaalsContact OE2-NH2 3.14Å; R737-K831 PolarHBondContact O-NZ 3.37Å
738	R	89	Confident	91.7	Very high	18 Å²	18	39.9 Å²	39.9	7%	0.068	19%	0.191	C	C	.	.	H	α-helix	trans	-74.6	-29.3	-179.9	-80	-179.2	58.6	177.9	-6.7	114	M674 E734 V736 D865 T866 L867	M674-R738 PolarHBondContact O-NH1 2.97Å; E734-R738 HydrophobicContact CG-CG 4.46Å; E734-R738 WeakPolarHBondContact O-CB 3.41Å; E734-R738 PolarHBondContact O-N 3.37Å; E734-R738 WeakPolarHBondContact OE1-CD 3.48Å; E734-R738 WeakPolarHBondContact OE1-CG 3.35Å; V736-R738 PolarHBondContact O-N 3.36Å; R738-D865 IonicContact CZ-OD1 3.17Å; R738-D865 IonicContact CZ-OD2 2.78Å; R738-D865 IonicContact NE-OD1 2.74Å; R738-D865 PolarHBondContact NE-OD1 2.94Å; R738-D865 VanDerWaalsContact NE-OD1 3.13Å; R738-D865 IonicContact NE-OD2 3.44Å; R738-D865 IonicContact NH2-OD1 3.54Å; R738-D865 PolarHBondContact NH2-OD1 3.16Å; R738-D865 IonicContact NH2-OD2 3.7Å; R738-D865 PolarHBondContact NH2-OD2 2.72Å; R738-T866 WeakPolarHBondContact CA-OG1 3.37Å; R738-T866 WeakPolarHBondContact O-CB 3.49Å; R738-T866 WeakPolarHBondContact O-CG2 3.28Å; R738-T866 PolarHBondContact O-N 2.79Å; R738-T866 PolarHBondContact O-OG1 2.78Å; R738-L867 VanDerWaalsContact NH2-CD2 3.31Å
739	S	93.1	Very high	92.4	Very high	4 Å²	4	39.7 Å²	39.7	3%	0.028	19%	0.188	C	C	.	.	S	Bend	trans	-67.4	148.5	178.9	-58.8	0	0	0	0	111	L735 V736 C742 K831 C862 G864	L735-S739 WeakPolarHBondContact O-CB 3.47Å; L735-S739 PolarHBondContact O-N 2.74Å; L735-S739 VanDerWaalsContact O-N 3.07Å; L735-S739 PolarHBondContact O-OG 2.9Å; V736-S739 PolarHBondContact O-N 2.86Å; S739-C742 VanDerWaalsContact CB-SG 3.55Å; S739-K831 PolarHBondContact O-NZ 3.26Å; S739-C862 VanDerWaalsContact OG-CB 3.27Å; S739-C862 WeakPolarHBondContact OG-CB 3.39Å; S739-G864 WeakPolarHBondContact CA-O 3.33Å
740	I	92.4	Very high	93	Very high	98 Å²	98	34.1 Å²	34.1	50%	0.503	17%	0.167	S	C	.	.	S	Bend	trans	-69.3	-47.7	178.6	-58.1	176.5	0	0	0	108.9	Y863 T866	I740-Y863 WeakPolarHBondContact CB-O 3.36Å; I740-Y863 PolarHBondContact N-O 2.92Å; I740-T866 HydrophobicContact CG1-CG2 4.35Å
741	E	94.2	Very high	93.4	Very high	132 Å²	132	30.1 Å²	30.1	62%	0.617	15%	0.148	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	152.8	177	-66.1	-178.3	-179	0	0	110.2	C862 Y863	E741-C862 CarbonylContact O-C 3.5Å; E741-C862 WeakPolarHBondContact O-CA 3.43Å; E741-Y863 HydrophobicContact CB-CD2 4.45Å; E741-Y863 PolarHBondContact N-O 3.32Å; E741-Y863 PolarHBondContact O-N 2.97Å
742	C	97	Very high	93.4	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.034	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	146.5	169.8	-64.3	0	0	0	0	110.3	S739 L834 L860 R861 C862	S739-C742 VanDerWaalsContact CB-SG 3.55Å; C742-L834 HydrophobicContact CB-CD1 3.99Å; C742-L834 WeakPolarHBondContact O-CD1 3.5Å; C742-L860 HydrophobicContact CB-CD1 4.22Å; C742-R861 CarbonylContact C-O 3.48Å; C742-R861 WeakPolarHBondContact CA-O 3.23Å; C742-C862 HydrophobicContact CB-CB 4.19Å; C742-C862 WeakPolarHBondContact CB-SG 3.46Å; C742-C862 WeakPolarHBondContact SG-CB 3.28Å; C742-C862 CovalentContact SG-SG 2.06Å; C742-C862 PolarHBondContact SG-SG 3.18Å
743	D	96.6	Very high	93.5	Very high	13 Å²	13	32.2 Å²	32.2	7%	0.07	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	158.7	174.3	78.7	58.5	0	0	0	112.4	L828 Q829 R861 Y863	D743-L828 CarbonylContact C-O 3.59Å; D743-L828 WeakPolarHBondContact CA-O 3.46Å; D743-Q829 HydrophobicContact CB-CG 4.19Å; D743-R861 PolarHBondContact N-O 2.86Å; D743-R861 PolarHBondContact O-N 2.89Å; D743-R861 IonicContact OD1-CZ 3.83Å; D743-R861 IonicContact OD1-NE 3.22Å; D743-R861 PolarHBondContact OD1-NE 2.91Å; D743-R861 IonicContact OD1-NH2 3.61Å; D743-R861 PolarHBondContact OD1-NH2 2.78Å; D743-R861 IonicContact OD2-CZ 3.28Å; D743-R861 IonicContact OD2-NE 3.62Å; D743-R861 IonicContact OD2-NH2 2.71Å; D743-R861 PolarHBondContact OD2-NH2 3.22Å; D743-Y863 WeakPolarHBondContact OD2-CE2 3.46Å; D743-Y863 PolarHBondContact OD2-OH 3.36Å
744	Q	96.6	Very high	93.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	134.5	173.8	-167.2	166.8	23.8	0	0	110.8	Y724 L827 L828 L834 V857 G858	Y724-Q744 PolarHBondContact OH-NE2 3.29Å; Q744-L827 WeakPolarHBondContact O-CA 3.45Å; Q744-L828 PolarHBondContact N-O 3.23Å; Q744-L828 PolarHBondContact O-N 3.47Å; Q744-L834 HydrophobicContact CB-CD2 3.76Å; Q744-V857 HydrophobicContact CG-CG1 4.35Å; Q744-G858 VanDerWaalsContact CG-O 3.28Å; Q744-G858 WeakPolarHBondContact CG-O 3.22Å; Q744-G858 PolarHBondContact NE2-O 3.39Å
745	S	96	Very high	93.9	Very high	36 Å²	36	30.8 Å²	30.8	25%	0.252	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	138.4	-179.2	63.5	0	0	0	0	112.7	G826 G858	S745-G826 WeakPolarHBondContact CA-O 3.43Å; S745-G858 PolarHBondContact O-N 2.93Å; S745-G858 WeakPolarHBondContact OG-CA 3.36Å
746	L	95.5	Very high	94	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140.2	166.7	-74	91.6	0	0	0	111	W785 T825 G826 L828 V836 R856 V857	L746-W785 HydrophobicContact CB-CH2 4.45Å; L746-W785 HydrophobicContact CB-CZ2 3.79Å; L746-W785 HydrophobicContact CD2-CD2 4.46Å; L746-W785 HydrophobicContact CD2-CE3 4.28Å; L746-W785 HydrophobicContact CD2-CH2 3.36Å; L746-W785 HydrophobicContact CD2-CZ2 3.59Å; L746-W785 HydrophobicContact CD2-CZ3 3.75Å; L746-W785 HydrophobicContact CG-CZ2 4.31Å; L746-T825 WeakPolarHBondContact O-CA 3.23Å; L746-G826 PolarHBondContact N-O 3.13Å; L746-G826 PolarHBondContact O-N 3.38Å; L746-L828 HydrophobicContact CD1-CD1 3.16Å; L746-L828 HydrophobicContact CD1-CD2 4.17Å; L746-L828 HydrophobicContact CD1-CG 3.36Å; L746-V836 HydrophobicContact CD1-CG2 3.91Å; L746-V836 HydrophobicContact CD2-CG2 4.33Å; L746-R856 WeakPolarHBondContact CA-O 3.37Å; L746-V857 HydrophobicContact CD2-CG2 4.49Å
747	T	95.8	Very high	93.8	Very high	30 Å²	30	34 Å²	34	18%	0.184	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	136	173.3	-53.6	0	0	0	0	109.4	Q749 V823 D824 T825 Y855 R856	T747-Q749 HydrophobicContact CG2-CG 4.39Å; T747-V823 HydrophobicContact CG2-CG1 4.08Å; T747-D824 CarbonylContact C-O 3.57Å; T747-D824 WeakPolarHBondContact CA-O 3.38Å; T747-T825 PolarHBondContact OG1-OG1 3.4Å; T747-T825 VanDerWaalsContact OG1-OG1 3.1Å; T747-Y855 CarbonylContact O-C 3.56Å; T747-Y855 WeakPolarHBondContact O-CA 3.5Å; T747-Y855 WeakPolarHBondContact O-CB 3.27Å; T747-R856 PolarHBondContact N-O 2.75Å; T747-R856 PolarHBondContact O-N 2.78Å
748	Y	95.8	Very high	93.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	119.3	174	-170.7	-106	0	0	0	109	C750 K754 L755 C812 V823 D824 F841 A853	Y748-C750 HydrophobicContact CD1-CB 4.29Å; Y748-C750 HydrophobicContact CE1-CB 3.82Å; Y748-K754 PolarHBondContact OH-O 2.93Å; Y748-L755 HydrophobicContact CD1-CB 4.14Å; Y748-L755 HydrophobicContact CD1-CD1 4.04Å; Y748-L755 HydrophobicContact CD1-CD2 3.92Å; Y748-L755 HydrophobicContact CD1-CG 4.25Å; Y748-L755 HydrophobicContact CD2-CD1 4.3Å; Y748-L755 HydrophobicContact CE1-CB 3.96Å; Y748-L755 HydrophobicContact CE1-CD1 4.04Å; Y748-L755 HydrophobicContact CE1-CG 4.39Å; Y748-L755 HydrophobicContact CE2-CD1 4.32Å; Y748-L755 HydrophobicContact CG-CD1 4.16Å; Y748-L755 HydrophobicContact CG-CD2 4.22Å; Y748-C812 HydrophobicContact CD1-CB 4.05Å; Y748-C812 HydrophobicContact CE1-CB 4.1Å; Y748-V823 CarbonylContact O-C 3.55Å; Y748-V823 WeakPolarHBondContact O-CA 3.42Å; Y748-D824 PolarHBondContact N-O 3.1Å; Y748-D824 PolarHBondContact O-N 2.85Å; Y748-F841 HydrophobicContact CD2-CD1 4.02Å; Y748-F841 AromaticContact CD2-CE1 3.54Å; Y748-F841 HydrophobicContact CD2-CE1 3.54Å; Y748-F841 AromaticContact CD2-CZ 3.83Å; Y748-F841 HydrophobicContact CD2-CZ 3.83Å; Y748-F841 AromaticContact CE2-CD1 3.41Å; Y748-F841 HydrophobicContact CE2-CD1 3.41Å; Y748-F841 VanDerWaalsContact CE2-CD1 3.41Å; Y748-F841 HydrophobicContact CE2-CD2 4.36Å; Y748-F841 AromaticContact CE2-CE1 3.45Å; Y748-F841 HydrophobicContact CE2-CE1 3.45Å; Y748-F841 VanDerWaalsContact CE2-CE1 3.45Å; Y748-F841 HydrophobicContact CE2-CE2 4.4Å; Y748-F841 AromaticContact CE2-CG 3.91Å; Y748-F841 HydrophobicContact CE2-CG 3.91Å; Y748-F841 AromaticContact CE2-CZ 3.96Å; Y748-F841 HydrophobicContact CE2-CZ 3.96Å; Y748-A853 HydrophobicContact CD2-CB 4.4Å; Y748-A853 HydrophobicContact CE1-CB 4.25Å; Y748-A853 HydrophobicContact CE2-CB 3.49Å; Y748-A853 VanDerWaalsContact CE2-CB 3.49Å; Y748-A853 VanDerWaalsContact CZ-CB 3.41Å; Y748-A853 VanDerWaalsContact OH-CB 3.29Å; Y748-A853 WeakPolarHBondContact OH-CB 3.12Å
749	Q	94.9	Very high	93.6	Very high	53 Å²	53	31.2 Å²	31.2	25%	0.248	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	133.7	173.5	-50.8	-178.1	18.8	0	0	108.3	T747 P821 L822 V823 A853 I854	T747-Q749 HydrophobicContact CG2-CG 4.39Å; Q749-P821 HydrophobicContact CB-CB 4.3Å; Q749-L822 CarbonylContact C-O 3.6Å; Q749-L822 WeakPolarHBondContact CA-O 3.16Å; Q749-V823 HydrophobicContact CB-CG2 4.44Å; Q749-V823 HydrophobicContact CG-CG1 4.27Å; Q749-V823 HydrophobicContact CG-CG2 4.05Å; Q749-A853 CarbonylContact O-C 3.55Å; Q749-A853 WeakPolarHBondContact O-CA 3.49Å; Q749-A853 WeakPolarHBondContact O-CB 3.24Å; Q749-I854 HydrophobicContact CB-CB 4.29Å; Q749-I854 PolarHBondContact N-O 2.84Å; Q749-I854 PolarHBondContact O-N 2.72Å
750	C	93.7	Very high	93	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.014	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	149	-176.6	63.3	0	0	0	0	112.6	Y748 A753 C812 P821 L822	Y748-C750 HydrophobicContact CD1-CB 4.29Å; Y748-C750 HydrophobicContact CE1-CB 3.82Å; C750-A753 HydrophobicContact CB-CB 4.16Å; C750-A753 WeakPolarHBondContact CB-O 3.39Å; C750-C812 HydrophobicContact CB-CB 3.89Å; C750-C812 WeakPolarHBondContact CB-SG 3.39Å; C750-C812 WeakPolarHBondContact SG-CA 3.44Å; C750-C812 WeakPolarHBondContact SG-CB 3.47Å; C750-C812 CovalentContact SG-SG 2.02Å; C750-C812 PolarHBondContact SG-SG 3.43Å; C750-P821 WeakPolarHBondContact O-CA 3.4Å; C750-P821 WeakPolarHBondContact O-CB 3.21Å; C750-L822 PolarHBondContact N-O 3.48Å; C750-L822 PolarHBondContact O-N 3.17Å; C750-L822 VanDerWaalsContact O-N 3.11Å
751	W	92.9	Very high	92	Very high	22 Å²	22	35.3 Å²	35.3	8%	0.083	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	106.7	165.8	-71.4	-91.2	0	0	0	106.9	A753 S817 T818 P821 K851 R852 I854	W751-A753 PolarHBondContact O-N 3.49Å; W751-S817 WeakPolarHBondContact CA-O 3.41Å; W751-T818 PolarHBondContact NE1-O 3.18Å; W751-P821 HydrophobicContact CD2-CB 4Å; W751-P821 HydrophobicContact CE3-CB 4.24Å; W751-P821 HydrophobicContact CH2-CB 3.98Å; W751-P821 HydrophobicContact CH2-CG 3.99Å; W751-P821 HydrophobicContact CZ2-CB 3.69Å; W751-P821 HydrophobicContact CZ2-CG 3.64Å; W751-P821 HydrophobicContact CZ3-CB 4.23Å; W751-K851 VanDerWaalsContact O-CA 3.22Å; W751-K851 WeakPolarHBondContact O-CA 3.48Å; W751-R852 HydrophobicContact CB-CG 3.94Å; W751-R852 HydrophobicContact CD2-CG 3.97Å; W751-R852 HydrophobicContact CE3-CG 3.61Å; W751-R852 HydrophobicContact CG-CG 4.14Å; W751-R852 HydrophobicContact CZ3-CG 4.4Å; W751-R852 PolarHBondContact N-O 3.42Å; W751-R852 PolarHBondContact O-N 3.02Å; W751-R852 VanDerWaalsContact O-N 3.13Å; W751-I854 HydrophobicContact CH2-CD1 3.74Å; W751-I854 HydrophobicContact CH2-CG1 4.39Å; W751-I854 HydrophobicContact CZ3-CD1 3.75Å; W751-I854 HydrophobicContact CZ3-CG1 3.88Å
752	N	90.5	Very high	90.6	Very high	45 Å²	45	30.6 Å²	30.6	24%	0.241	20%	0.202	C	C	.	.	S	Bend	trans	53.1	7	-179.4	-63.5	-22.2	0	0	0	117	G816 S817 T818 K851	N752-G816 WeakPolarHBondContact OD1-CA 3.11Å; N752-S817 PolarHBondContact N-O 3.3Å; N752-S817 PolarHBondContact OD1-N 3.27Å; N752-S817 PolarHBondContact OD1-O 2.83Å; N752-T818 WeakPolarHBondContact ND2-CG2 3.46Å; N752-K851 HydrophobicContact CB-CG 3.75Å; N752-K851 WeakPolarHBondContact O-CE 3.43Å
753	A	92.4	Very high	89.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	22%	0.217	C	C	.	.			trans	-93.9	141.8	177.9	0	0	0	0	0	110.7	C750 W751 D843 T844	C750-A753 HydrophobicContact CB-CB 4.16Å; C750-A753 WeakPolarHBondContact CB-O 3.39Å; W751-A753 PolarHBondContact O-N 3.49Å; A753-D843 WeakPolarHBondContact CA-O 3.47Å; A753-D843 WeakPolarHBondContact CB-O 2.95Å; A753-T844 HydrophobicContact CB-CG2 4.19Å
754	K	92.6	Very high	87.9	Confident	30 Å²	30	37.9 Å²	37.9	13%	0.13	25%	0.254	C	S	.	.			trans	-91.5	161.8	-179.9	-58	-59.1	-173.3	169.9	0	112.5	Y748 W771 D813 S814 D843	Y748-K754 PolarHBondContact OH-O 2.93Å; K754-W771 HydrophobicContact CB-CB 4.09Å; K754-W771 HydrophobicContact CB-CD2 4.45Å; K754-W771 HydrophobicContact CB-CG 3.69Å; K754-D813 PolarHBondContact NZ-O 3.14Å; K754-S814 PolarHBondContact NZ-O 3.05Å; K754-D843 HydrophobicContact CB-CB 4.39Å; K754-D843 WeakPolarHBondContact CG-OD2 3.45Å; K754-D843 PolarHBondContact N-OD2 3.16Å
755	L	94.6	Very high	86.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	-123.8	-79.6	179	-175.8	63.1	0	0	0	111.9	Y748 W771 G772 W785 C812 D813 D824 F841	Y748-L755 HydrophobicContact CD1-CB 4.14Å; Y748-L755 HydrophobicContact CD1-CD1 4.04Å; Y748-L755 HydrophobicContact CD1-CD2 3.92Å; Y748-L755 HydrophobicContact CD1-CG 4.25Å; Y748-L755 HydrophobicContact CD2-CD1 4.3Å; Y748-L755 HydrophobicContact CE1-CB 3.96Å; Y748-L755 HydrophobicContact CE1-CD1 4.04Å; Y748-L755 HydrophobicContact CE1-CG 4.39Å; Y748-L755 HydrophobicContact CE2-CD1 4.32Å; Y748-L755 HydrophobicContact CG-CD1 4.16Å; Y748-L755 HydrophobicContact CG-CD2 4.22Å; L755-W771 PolarHBondContact O-N 3.27Å; L755-G772 PolarHBondContact O-N 2.89Å; L755-W785 HydrophobicContact CD1-CE3 4.46Å; L755-W785 HydrophobicContact CD1-CZ3 4.43Å; L755-W785 HydrophobicContact CD2-CD2 3.96Å; L755-W785 HydrophobicContact CD2-CE3 4.38Å; L755-W785 HydrophobicContact CD2-CG 4.02Å; L755-C812 HydrophobicContact CB-CB 4.29Å; L755-D813 PolarHBondContact N-OD1 2.94Å; L755-D824 HydrophobicContact CD2-CB 4.45Å; L755-F841 HydrophobicContact CD1-CD1 3.99Å; L755-F841 HydrophobicContact CD1-CE1 3.78Å
756	L	94.4	Very high	85.5	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	29%	0.292	C	S	.	.	S	Bend	trans	-100.4	-3.5	-174.5	-64.7	-173.5	0	0	0	113.5	A770 G772 F783 W785 Q793 C810 D813	L756-A770 HydrophobicContact CD2-CB 4.43Å; L756-G772 WeakPolarHBondContact CD2-O 3.46Å; L756-F783 VanDerWaalsContact CD1-O 3.31Å; L756-F783 WeakPolarHBondContact CD1-O 3.4Å; L756-F783 WeakPolarHBondContact CD2-O 3.17Å; L756-W785 HydrophobicContact CD1-CB 4.33Å; L756-Q793 HydrophobicContact CB-CG 4.33Å; L756-Q793 PolarHBondContact O-NE2 3.07Å; L756-C810 VanDerWaalsContact CD1-SG 3.56Å; L756-D813 PolarHBondContact N-OD1 3.09Å; L756-D813 VanDerWaalsContact N-OD1 3.15Å; L756-D813 PolarHBondContact N-OD2 2.8Å; L756-D813 VanDerWaalsContact N-OD2 3.14Å
757	Q	90.8	Very high	84.1	Confident	76 Å²	76	53.6 Å²	53.6	36%	0.355	32%	0.324	S	S	.	.	S	Bend	trans	-60	143.4	175.8	-169.3	172.5	25.8	0	0	111.2	P759 D813	Q757-P759 WeakPolarHBondContact O-CD 3.39Å; Q757-D813 HydrophobicContact CB-CB 3.94Å; Q757-D813 WeakPolarHBondContact CB-OD1 3.35Å; Q757-D813 PolarHBondContact N-OD1 2.95Å; Q757-D813 PolarHBondContact N-OD2 2.77Å
758	L	89.1	Confident	83.3	Confident	99 Å²	99	55.4 Å²	55.4	52%	0.518	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-66.3	126.1	175.5	-156	101.1	0	0	0	110.4
759	P	86.7	Confident	82.9	Confident	9 Å²	9	59.5 Å²	59.5	6%	0.058	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-61.5	154	173.5	-23.5	33.9	0	0	0	112.9	P715 Q757 G761 G762 W771	P715-P759 HydrophobicContact CB-CG 4.36Å; P715-P759 HydrophobicContact CG-CB 4.21Å; P715-P759 HydrophobicContact CG-CG 3.88Å; Q757-P759 WeakPolarHBondContact O-CD 3.39Å; P759-G761 PolarHBondContact O-N 3.33Å; P759-G762 WeakPolarHBondContact O-CA 3.43Å; P759-G762 PolarHBondContact O-N 3.28Å; P759-W771 HydrophobicContact CB-CD2 4.38Å; P759-W771 HydrophobicContact CB-CH2 4.27Å; P759-W771 HydrophobicContact CB-CZ2 3.84Å; P759-W771 HydrophobicContact CG-CD2 4.04Å; P759-W771 HydrophobicContact CG-CG 4.31Å; P759-W771 HydrophobicContact CG-CZ2 4.4Å
760	A	79.3	Confident	82.7	Confident	108 Å²	108	57 Å²	57	89%	0.893	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	124.6	177.5	0	0	0	0	0	111.1
761	G	71.7	Confident	82.7	Confident	80 Å²	80	58.7 Å²	58.7	83%	0.825	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.6	14.4	-171.4	0	0	0	0	0	114.8	P759	P759-G761 PolarHBondContact O-N 3.33Å
762	G	65.2	Low	82.7	Confident	32 Å²	32	57.7 Å²	57.7	33%	0.33	34%	0.338	S	S	.	.			trans	-50.1	152.6	-168.7	0	0	0	0	0	117.2	P759	P759-G762 WeakPolarHBondContact O-CA 3.43Å; P759-G762 PolarHBondContact O-N 3.28Å
763	G	68.1	Low	82.9	Confident	33 Å²	33	56.2 Å²	56.2	34%	0.34	33%	0.33	S	S	.	.			trans	-143.9	-177.5	-175.6	0	0	0	0	0	112.5	N768	G763-N768 PolarHBondContact N-O 2.94Å
764	T	68.5	Low	83	Confident	139 Å²	139	56.2 Å²	56.2	85%	0.853	33%	0.33	S	S	*	.	S	Bend	trans	-87.7	-2.2	-178.9	53.7	0	0	0	0	113.9
765	T	73.3	Confident	83.1	Confident	79 Å²	79	55.4 Å²	55.4	49%	0.485	33%	0.327	S	S	.	.	S	Bend	trans	-79.4	150.9	178	54.8	0	0	0	0	111.1	E767 N768 R769	T765-E767 VanDerWaalsContact C-N 3.26Å; T765-E767 PolarHBondContact O-N 3.07Å; T765-N768 PolarHBondContact O-N 2.79Å; T765-N768 VanDerWaalsContact O-N 3.1Å; T765-R769 PolarHBondContact O-N 2.83Å
766	Y	69.3	Low	82.9	Confident	142 Å²	142	55.4 Å²	55.4	56%	0.557	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-54.2	-41.6	-178.1	-61	-45.1	0	0	0	113.1	N768 P781 F783	Y766-N768 PolarHBondContact O-N 2.86Å; Y766-P781 HydrophobicContact CD1-CB 4.47Å; Y766-P781 HydrophobicContact CD1-CG 3.33Å; Y766-P781 HydrophobicContact CD2-CG 4.32Å; Y766-P781 HydrophobicContact CE1-CG 3.35Å; Y766-P781 HydrophobicContact CE2-CG 4.34Å; Y766-P781 HydrophobicContact CG-CG 3.85Å; Y766-F783 HydrophobicContact CD1-CE2 4.19Å; Y766-F783 HydrophobicContact CD1-CZ 4.14Å
767	E	67.5	Low	82.5	Confident	145 Å²	145	56.8 Å²	56.8	68%	0.678	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-69.7	-14.9	-177.5	-61.9	179.6	174	0	0	114.1	P715 T765	P715-E767 WeakPolarHBondContact CB-O 3.27Å; P715-E767 WeakPolarHBondContact CG-O 3.26Å; T765-E767 VanDerWaalsContact C-N 3.26Å; T765-E767 PolarHBondContact O-N 3.07Å
768	N	78.5	Confident	82.1	Confident	69 Å²	69	55.9 Å²	55.9	37%	0.369	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-124.5	13.1	-174.6	-65.1	-13.3	0	0	0	113.4	G763 T765 Y766	G763-N768 PolarHBondContact N-O 2.94Å; T765-N768 PolarHBondContact O-N 2.79Å; T765-N768 VanDerWaalsContact O-N 3.1Å; Y766-N768 PolarHBondContact O-N 2.86Å
769	R	86.4	Confident	81.8	Confident	86 Å²	86	53.3 Å²	53.3	33%	0.325	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-33.5	-174.1	-175.3	168.9	-179.6	175.6	3.1	114.2	T765 F783 Q793	T765-R769 PolarHBondContact O-N 2.83Å; R769-F783 HydrophobicContact CB-CD1 4.43Å; R769-F783 HydrophobicContact CB-CE1 3.87Å; R769-F783 HydrophobicContact CB-CZ 4.06Å; R769-F783 HydrophobicContact CG-CD1 4.1Å; R769-F783 HydrophobicContact CG-CE1 4Å; R769-F783 HydrophobicContact CG-CE2 4.5Å; R769-F783 HydrophobicContact CG-CG 4.4Å; R769-F783 HydrophobicContact CG-CZ 4.21Å; R769-Q793 PolarHBondContact O-NE2 3.31Å
770	A	92.2	Very high	81.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	36%	0.355	C	S	.	.			trans	-153.4	166.8	179.2	0	0	0	0	0	109.2	P715 L756 W773 F783	P715-A770 WeakPolarHBondContact CB-O 3.46Å; L756-A770 HydrophobicContact CD2-CB 4.43Å; A770-W773 HydrophobicContact CB-CE3 4.38Å; A770-W773 WeakPolarHBondContact O-CZ3 3.25Å; A770-F783 HydrophobicContact CB-CD1 3.76Å; A770-F783 HydrophobicContact CB-CE1 4.1Å
771	W	92.5	Very high	82.5	Confident	38 Å²	38	56.5 Å²	56.5	14%	0.144	32%	0.319	C	S	.	.	S	Bend	trans	-79.8	-33.7	174.3	-69.7	101.2	0	0	0	112.7	Q713 P715 G716 K754 L755 P759 F841 G842 D843	Q713-W771 WeakPolarHBondContact O-CZ3 3.35Å; P715-W771 HydrophobicContact CB-CE3 4.25Å; P715-W771 HydrophobicContact CG-CE3 3.82Å; P715-W771 HydrophobicContact CG-CZ3 3.86Å; G716-W771 PolarHBondContact N-O 3.1Å; K754-W771 HydrophobicContact CB-CB 4.09Å; K754-W771 HydrophobicContact CB-CD2 4.45Å; K754-W771 HydrophobicContact CB-CG 3.69Å; L755-W771 PolarHBondContact O-N 3.27Å; P759-W771 HydrophobicContact CB-CD2 4.38Å; P759-W771 HydrophobicContact CB-CH2 4.27Å; P759-W771 HydrophobicContact CB-CZ2 3.84Å; P759-W771 HydrophobicContact CG-CD2 4.04Å; P759-W771 HydrophobicContact CG-CG 4.31Å; P759-W771 HydrophobicContact CG-CZ2 4.4Å; W771-F841 CarbonylContact O-C 3.6Å; W771-G842 PolarHBondContact O-N 3.48Å; W771-D843 HydrophobicContact CD2-CB 3.78Å; W771-D843 HydrophobicContact CE3-CB 3.6Å; W771-D843 HydrophobicContact CG-CB 4.24Å; W771-D843 HydrophobicContact CH2-CB 4.48Å; W771-D843 HydrophobicContact CZ3-CB 3.98Å
772	G	93.5	Very high	83.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.285	C	S	.	.			trans	-143.1	158.1	174.7	0	0	0	0	0	113.1	L755 L756 R840	L755-G772 PolarHBondContact O-N 2.89Å; L756-G772 WeakPolarHBondContact CD2-O 3.46Å; G772-R840 CarbonylContact C-O 3.41Å; G772-R840 WeakPolarHBondContact CA-O 3.42Å
773	W	94.4	Very high	84.9	Confident	15 Å²	15	52.9 Å²	52.9	6%	0.057	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	166.9	179.9	58.4	91.8	0	0	0	109.6	P715 A770 P781 Q782 F783 R840	P715-W773 HydrophobicContact CB-CZ3 4.45Å; A770-W773 HydrophobicContact CB-CE3 4.38Å; A770-W773 WeakPolarHBondContact O-CZ3 3.25Å; W773-P781 VanDerWaalsContact CD1-CB 3.47Å; W773-P781 HydrophobicContact CG-CB 4.27Å; W773-Q782 WeakPolarHBondContact CB-O 2.97Å; W773-F783 HydrophobicContact CB-CD1 4.02Å; W773-F783 HydrophobicContact CB-CE1 4.09Å; W773-F783 AromaticContact CD2-CE1 3.98Å; W773-F783 HydrophobicContact CD2-CE1 3.98Å; W773-F783 HydrophobicContact CE3-CE1 4.02Å; W773-F783 HydrophobicContact CG-CD1 4.46Å; W773-F783 HydrophobicContact CG-CE1 4.04Å; W773-R840 HydrophobicContact CD2-CB 4.21Å; W773-R840 HydrophobicContact CZ2-CB 4.2Å; W773-R840 PolarHBondContact N-O 3.17Å; W773-R840 PolarHBondContact O-N 3.5Å
774	W	95.3	Very high	86.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	165.9	169.8	65.2	-82.3	0	0	0	110.1	Q782 Y784 W785 L828 H833 V836 E838 V839	W774-Q782 HydrophobicContact CD2-CB 3.73Å; W774-Q782 HydrophobicContact CD2-CG 4.13Å; W774-Q782 HydrophobicContact CE3-CB 4.3Å; W774-Q782 HydrophobicContact CE3-CG 4.2Å; W774-Q782 HydrophobicContact CG-CB 4.19Å; W774-Q782 HydrophobicContact CH2-CB 4.24Å; W774-Q782 HydrophobicContact CH2-CG 3.81Å; W774-Q782 HydrophobicContact CZ2-CB 3.6Å; W774-Q782 HydrophobicContact CZ2-CG 3.67Å; W774-Q782 HydrophobicContact CZ3-CG 4.08Å; W774-Q782 PolarHBondContact N-O 2.84Å; W774-Q782 PolarHBondContact O-N 2.86Å; W774-Y784 AromaticContact CZ2-CE1 3.74Å; W774-Y784 HydrophobicContact CZ2-CE1 3.74Å; W774-Y784 HydrophobicContact CZ2-CE2 4.16Å; W774-Y784 AromaticContact CZ2-CZ 3.49Å; W774-Y784 VanDerWaalsContact CZ2-CZ 3.49Å; W774-Y784 WeakPolarHBondContact CZ2-OH 3.47Å; W774-Y784 PolarHBondContact NE1-O 2.75Å; W774-W785 HydrophobicContact CB-CZ3 4.46Å; W774-L828 HydrophobicContact CD2-CD1 4.03Å; W774-L828 HydrophobicContact CE3-CD1 4.26Å; W774-L828 HydrophobicContact CH2-CD1 3.69Å; W774-L828 HydrophobicContact CZ2-CD1 3.45Å; W774-L828 VanDerWaalsContact CZ2-CD1 3.45Å; W774-L828 HydrophobicContact CZ2-CD2 3.83Å; W774-L828 HydrophobicContact CZ2-CG 4.23Å; W774-L828 HydrophobicContact CZ3-CD1 4.08Å; W774-H833 HydrophobicContact CH2-CB 3.64Å; W774-H833 HydrophobicContact CZ2-CB 4.45Å; W774-H833 HydrophobicContact CZ3-CB 4.44Å; W774-H833 WeakPolarHBondContact CZ3-O 3.04Å; W774-V836 HydrophobicContact CB-CG1 4.09Å; W774-V836 HydrophobicContact CD2-CG2 4.13Å; W774-V836 HydrophobicContact CE3-CB 4.18Å; W774-V836 HydrophobicContact CE3-CG1 4.28Å; W774-V836 HydrophobicContact CE3-CG2 3.7Å; W774-V836 HydrophobicContact CZ3-CG2 4.09Å; W774-E838 CarbonylContact C-O 3.51Å; W774-E838 VanDerWaalsContact CA-O 3.26Å; W774-E838 WeakPolarHBondContact CA-O 3.49Å; W774-V839 HydrophobicContact CB-CG1 4.3Å
775	V	93	Very high	87.4	Confident	12 Å²	12	44.8 Å²	44.8	7%	0.073	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.1	-178.2	-175.9	0	0	0	0	108.5	G779 R780 M837 E838	V775-G779 WeakPolarHBondContact CG1-O 3.26Å; V775-R780 WeakPolarHBondContact CA-O 3.48Å; V775-M837 PolarHBondContact O-N 2.81Å; V775-E838 HydrophobicContact CB-CB 3.93Å; V775-E838 HydrophobicContact CG2-CB 3.94Å; V775-E838 HydrophobicContact CG2-CG 4.07Å; V775-E838 PolarHBondContact N-O 2.97Å
776	S	91.1	Very high	88.1	Confident	0 Å²	0	41 Å²	41	0%	0	19%	0.193	C	C	.	.			trans	-70.9	168.9	179	40.2	0	0	0	0	112.8	D778 G779 R780 Q782 H833	S776-D778 WeakPolarHBondContact CB-OD1 3.31Å; S776-D778 PolarHBondContact O-N 2.87Å; S776-D778 VanDerWaalsContact O-N 3.13Å; S776-D778 PolarHBondContact OG-OD1 2.85Å; S776-G779 PolarHBondContact O-N 2.92Å; S776-R780 PolarHBondContact N-O 3.03Å; S776-R780 PolarHBondContact OG-O 2.91Å; S776-Q782 PolarHBondContact OG-NE2 2.98Å; S776-H833 VanDerWaalsContact CA-O 3.26Å; S776-H833 WeakPolarHBondContact CA-O 3.38Å; S776-H833 WeakPolarHBondContact CB-O 3.48Å
777	Q	86.7	Confident	89.1	Confident	31 Å²	31	36 Å²	36	15%	0.145	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-38.2	174.5	-167.3	-159.5	-22.4	0	0	112.5	R729 G779 H833 L834 P835	R729-Q777 WeakPolarHBondContact CD-O 3.2Å; R729-Q777 HydrophobicContact CG-CG 4.14Å; R729-Q777 PolarHBondContact NE-O 2.95Å; R729-Q777 PolarHBondContact O-NE2 3.22Å; Q777-G779 PolarHBondContact O-N 3.01Å; Q777-H833 PolarHBondContact N-O 3.25Å; Q777-L834 WeakPolarHBondContact CB-O 3.46Å; Q777-L834 PolarHBondContact OE1-O 3.02Å; Q777-L834 VanDerWaalsContact OE1-O 3.13Å; Q777-P835 PolarHBondContact N-O 2.81Å
778	D	81	Confident	90.3	Very high	56 Å²	56	29.4 Å²	29.4	30%	0.299	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-2.3	-179.2	72.7	-21.2	0	0	0	114.5	R729 S776 R780	R729-D778 PolarHBondContact NH2-O 3.37Å; S776-D778 WeakPolarHBondContact CB-OD1 3.31Å; S776-D778 PolarHBondContact O-N 2.87Å; S776-D778 VanDerWaalsContact O-N 3.13Å; S776-D778 PolarHBondContact OG-OD1 2.85Å; D778-R780 WeakPolarHBondContact OD1-CB 3.17Å; D778-R780 PolarHBondContact OD1-N 3.46Å; D778-R780 WeakPolarHBondContact OD2-CD 3.19Å; D778-R780 VanDerWaalsContact OD2-CG 3.23Å; D778-R780 WeakPolarHBondContact OD2-CG 3.3Å; D778-R780 IonicContact OD2-CZ 3.77Å; D778-R780 IonicContact OD2-NE 3.19Å; D778-R780 PolarHBondContact OD2-NE 3.21Å; D778-R780 IonicContact OD2-NH1 2.7Å
779	G	84.6	Confident	91	Very high	46 Å²	46	28.8 Å²	28.8	47%	0.474	15%	0.153	S	C	.	.	S	Bend	trans	83.8	9.5	-177	0	0	0	0	0	113.9	V775 S776 Q777	V775-G779 WeakPolarHBondContact CG1-O 3.26Å; S776-G779 PolarHBondContact O-N 2.92Å; Q777-G779 PolarHBondContact O-N 3.01Å
780	R	87.9	Confident	91.3	Very high	161 Å²	161	26.5 Å²	26.5	61%	0.608	15%	0.15	S	C	*	.			trans	-89.6	139.7	179.9	-65.9	-174	-174.9	158	-1.6	112.4	V775 S776 D778 Q782	V775-R780 WeakPolarHBondContact CA-O 3.48Å; S776-R780 PolarHBondContact N-O 3.03Å; S776-R780 PolarHBondContact OG-O 2.91Å; D778-R780 WeakPolarHBondContact OD1-CB 3.17Å; D778-R780 PolarHBondContact OD1-N 3.46Å; D778-R780 WeakPolarHBondContact OD2-CD 3.19Å; D778-R780 VanDerWaalsContact OD2-CG 3.23Å; D778-R780 WeakPolarHBondContact OD2-CG 3.3Å; D778-R780 IonicContact OD2-CZ 3.77Å; D778-R780 IonicContact OD2-NE 3.19Å; D778-R780 PolarHBondContact OD2-NE 3.21Å; D778-R780 IonicContact OD2-NH1 2.7Å; R780-Q782 PolarHBondContact O-N 2.66Å
781	P	91.5	Very high	91.1	Very high	22 Å²	22	29.8 Å²	29.8	14%	0.143	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	130.6	173.8	29.2	-32.5	0	0	0	110.8	Y766 W773 F783	Y766-P781 HydrophobicContact CD1-CB 4.47Å; Y766-P781 HydrophobicContact CD1-CG 3.33Å; Y766-P781 HydrophobicContact CD2-CG 4.32Å; Y766-P781 HydrophobicContact CE1-CG 3.35Å; Y766-P781 HydrophobicContact CE2-CG 4.34Å; Y766-P781 HydrophobicContact CG-CG 3.85Å; W773-P781 VanDerWaalsContact CD1-CB 3.47Å; W773-P781 HydrophobicContact CG-CB 4.27Å; P781-F783 HydrophobicContact CB-CE2 3.96Å; P781-F783 HydrophobicContact CB-CZ 3.93Å; P781-F783 HydrophobicContact CG-CE2 3.99Å; P781-F783 HydrophobicContact CG-CZ 4.17Å
782	Q	94	Very high	91	Very high	21 Å²	21	32.6 Å²	32.6	10%	0.098	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	116.7	-179	-63	-61.4	-20.3	0	0	109.8	W773 W774 S776 R780 Y784	W773-Q782 WeakPolarHBondContact CB-O 2.97Å; W774-Q782 HydrophobicContact CD2-CB 3.73Å; W774-Q782 HydrophobicContact CD2-CG 4.13Å; W774-Q782 HydrophobicContact CE3-CB 4.3Å; W774-Q782 HydrophobicContact CE3-CG 4.2Å; W774-Q782 HydrophobicContact CG-CB 4.19Å; W774-Q782 HydrophobicContact CH2-CB 4.24Å; W774-Q782 HydrophobicContact CH2-CG 3.81Å; W774-Q782 HydrophobicContact CZ2-CB 3.6Å; W774-Q782 HydrophobicContact CZ2-CG 3.67Å; W774-Q782 HydrophobicContact CZ3-CG 4.08Å; W774-Q782 PolarHBondContact N-O 2.84Å; W774-Q782 PolarHBondContact O-N 2.86Å; S776-Q782 PolarHBondContact OG-NE2 2.98Å; R780-Q782 PolarHBondContact O-N 2.66Å; Q782-Y784 VanDerWaalsContact C-N 3.34Å; Q782-Y784 HydrophobicContact CB-CD1 4.15Å; Q782-Y784 HydrophobicContact CB-CE1 3.93Å; Q782-Y784 HydrophobicContact CG-CE1 4.25Å; Q782-Y784 PolarHBondContact O-N 3.15Å
783	F	93.2	Very high	91	Very high	15 Å²	15	34.2 Å²	34.2	7%	0.066	21%	0.208	C	C	.	.			trans	-94.1	19	-174	-63.3	-79	0	0	0	113.4	L756 Y766 R769 A770 W773 P781 Q793	L756-F783 VanDerWaalsContact CD1-O 3.31Å; L756-F783 WeakPolarHBondContact CD1-O 3.4Å; L756-F783 WeakPolarHBondContact CD2-O 3.17Å; Y766-F783 HydrophobicContact CD1-CE2 4.19Å; Y766-F783 HydrophobicContact CD1-CZ 4.14Å; R769-F783 HydrophobicContact CB-CD1 4.43Å; R769-F783 HydrophobicContact CB-CE1 3.87Å; R769-F783 HydrophobicContact CB-CZ 4.06Å; R769-F783 HydrophobicContact CG-CD1 4.1Å; R769-F783 HydrophobicContact CG-CE1 4Å; R769-F783 HydrophobicContact CG-CE2 4.5Å; R769-F783 HydrophobicContact CG-CG 4.4Å; R769-F783 HydrophobicContact CG-CZ 4.21Å; A770-F783 HydrophobicContact CB-CD1 3.76Å; A770-F783 HydrophobicContact CB-CE1 4.1Å; W773-F783 HydrophobicContact CB-CD1 4.02Å; W773-F783 HydrophobicContact CB-CE1 4.09Å; W773-F783 AromaticContact CD2-CE1 3.98Å; W773-F783 HydrophobicContact CD2-CE1 3.98Å; W773-F783 HydrophobicContact CE3-CE1 4.02Å; W773-F783 HydrophobicContact CG-CD1 4.46Å; W773-F783 HydrophobicContact CG-CE1 4.04Å; P781-F783 HydrophobicContact CB-CE2 3.96Å; P781-F783 HydrophobicContact CB-CZ 3.93Å; P781-F783 HydrophobicContact CG-CE2 3.99Å; P781-F783 HydrophobicContact CG-CZ 4.17Å; F783-Q793 HydrophobicContact CB-CB 4.46Å; F783-Q793 HydrophobicContact CB-CG 4.15Å; F783-Q793 WeakPolarHBondContact O-CA 3.3Å
784	Y	94.9	Very high	91	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	22%	0.219	C	C	.	.			trans	-115.6	153.8	172.1	70.8	-79	0	0	0	109.4	W774 Q782 P790 L828 F830 H833	W774-Y784 AromaticContact CZ2-CE1 3.74Å; W774-Y784 HydrophobicContact CZ2-CE1 3.74Å; W774-Y784 HydrophobicContact CZ2-CE2 4.16Å; W774-Y784 AromaticContact CZ2-CZ 3.49Å; W774-Y784 VanDerWaalsContact CZ2-CZ 3.49Å; W774-Y784 WeakPolarHBondContact CZ2-OH 3.47Å; W774-Y784 PolarHBondContact NE1-O 2.75Å; Q782-Y784 VanDerWaalsContact C-N 3.34Å; Q782-Y784 HydrophobicContact CB-CD1 4.15Å; Q782-Y784 HydrophobicContact CB-CE1 3.93Å; Q782-Y784 HydrophobicContact CG-CE1 4.25Å; Q782-Y784 PolarHBondContact O-N 3.15Å; Y784-P790 HydrophobicContact CD1-CB 4.31Å; Y784-P790 HydrophobicContact CD1-CG 4.21Å; Y784-P790 HydrophobicContact CE1-CB 4.15Å; Y784-P790 HydrophobicContact CE1-CG 3.75Å; Y784-P790 HydrophobicContact CE2-CG 4.31Å; Y784-L828 HydrophobicContact CD2-CD2 4.06Å; Y784-L828 HydrophobicContact CE2-CD2 3.52Å; Y784-F830 HydrophobicContact CE2-CD2 4.02Å; Y784-H833 AromaticContact CE1-ND1 3.67Å; Y784-H833 AromaticContact CZ-ND1 3.73Å; Y784-H833 PolarHBondContact OH-ND1 3.11Å
785	W	94.7	Very high	91	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.008	22%	0.219	C	C	.	.			trans	-107.9	-177.4	179.8	-154	-115.5	0	0	0	111.7	L746 L755 L756 W774 G787 G788 K794 C795 D824 F841	L746-W785 HydrophobicContact CB-CH2 4.45Å; L746-W785 HydrophobicContact CB-CZ2 3.79Å; L746-W785 HydrophobicContact CD2-CD2 4.46Å; L746-W785 HydrophobicContact CD2-CE3 4.28Å; L746-W785 HydrophobicContact CD2-CH2 3.36Å; L746-W785 HydrophobicContact CD2-CZ2 3.59Å; L746-W785 HydrophobicContact CD2-CZ3 3.75Å; L746-W785 HydrophobicContact CG-CZ2 4.31Å; L755-W785 HydrophobicContact CD1-CE3 4.46Å; L755-W785 HydrophobicContact CD1-CZ3 4.43Å; L755-W785 HydrophobicContact CD2-CD2 3.96Å; L755-W785 HydrophobicContact CD2-CE3 4.38Å; L755-W785 HydrophobicContact CD2-CG 4.02Å; L756-W785 HydrophobicContact CD1-CB 4.33Å; W774-W785 HydrophobicContact CB-CZ3 4.46Å; W785-G787 PolarHBondContact O-N 3.35Å; W785-G788 WeakPolarHBondContact O-CA 3.19Å; W785-G788 PolarHBondContact O-N 2.69Å; W785-K794 PolarHBondContact N-O 3.26Å; W785-C795 HydrophobicContact CB-CB 4.07Å; W785-C795 WeakPolarHBondContact CB-SG 3.43Å; W785-D824 PolarHBondContact NE1-O 3.03Å; W785-F841 AromaticContact CH2-CE1 3.71Å; W785-F841 HydrophobicContact CH2-CE1 3.71Å; W785-F841 AromaticContact CH2-CZ 3.68Å; W785-F841 HydrophobicContact CH2-CZ 3.68Å; W785-F841 HydrophobicContact CZ2-CE1 4.43Å; W785-F841 HydrophobicContact CZ2-CZ 4.37Å; W785-F841 HydrophobicContact CZ3-CE1 4.21Å; W785-F841 HydrophobicContact CZ3-CZ 4.5Å
786	G	88.7	Confident	91.1	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	129.7	174.7	0	0	0	0	0	112	G788 A796 G826	G786-G788 PolarHBondContact O-N 3.41Å; G786-A796 WeakPolarHBondContact O-CB 2.95Å; G786-A796 PolarHBondContact O-N 2.91Å; G786-G826 VanDerWaalsContact CA-C 3.43Å
787	G	90.6	Very high	91.3	Very high	35 Å²	35	37.5 Å²	37.5	36%	0.361	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	0.2	-173.9	0	0	0	0	0	115.5	W785 L827	W785-G787 PolarHBondContact O-N 3.35Å; G787-L827 PolarHBondContact N-O 3.18Å
788	G	92.4	Very high	91.6	Very high	7 Å²	7	36.2 Å²	36.2	7%	0.072	22%	0.222	C	C	.	.			trans	-80.4	170	172	0	0	0	0	0	113.1	W785 G786 K794	W785-G788 WeakPolarHBondContact O-CA 3.19Å; W785-G788 PolarHBondContact O-N 2.69Å; G786-G788 PolarHBondContact O-N 3.41Å; G788-K794 WeakPolarHBondContact CA-O 3.49Å
789	V	92.8	Very high	92.2	Very high	57 Å²	57	36.5 Å²	36.5	35%	0.345	23%	0.225	S	C	.	.			trans	-113.8	134.7	176.9	-177.2	0	0	0	0	109.8	G791 L792 V799 F830	V789-G791 PolarHBondContact O-N 3.31Å; V789-L792 HydrophobicContact CB-CD1 3.84Å; V789-L792 HydrophobicContact CB-CG 4.16Å; V789-L792 HydrophobicContact CG1-CD1 4.39Å; V789-L792 HydrophobicContact CG1-CG 4.5Å; V789-L792 HydrophobicContact CG2-CD1 4.34Å; V789-L792 PolarHBondContact O-N 2.89Å; V789-V799 HydrophobicContact CG2-CG2 4.39Å; V789-F830 HydrophobicContact CG1-CZ 4.1Å
790	P	92	Very high	92.6	Very high	38 Å²	38	41 Å²	41	25%	0.247	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	136.9	174.8	-29.8	33.4	0	0	0	113.2	Y784 L792 F830	Y784-P790 HydrophobicContact CD1-CB 4.31Å; Y784-P790 HydrophobicContact CD1-CG 4.21Å; Y784-P790 HydrophobicContact CE1-CB 4.15Å; Y784-P790 HydrophobicContact CE1-CG 3.75Å; Y784-P790 HydrophobicContact CE2-CG 4.31Å; P790-L792 VanDerWaalsContact C-N 3.27Å; P790-L792 PolarHBondContact O-N 3.26Å; P790-F830 HydrophobicContact CG-CB 4.28Å; P790-F830 HydrophobicContact CG-CD1 3.7Å; P790-F830 HydrophobicContact CG-CD2 3.67Å; P790-F830 HydrophobicContact CG-CE1 3.91Å; P790-F830 HydrophobicContact CG-CE2 3.91Å; P790-F830 HydrophobicContact CG-CG 3.58Å; P790-F830 HydrophobicContact CG-CZ 4.03Å
791	G	87.8	Confident	92.8	Very high	68 Å²	68	36.6 Å²	36.6	70%	0.701	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.1	-17.6	178.9	0	0	0	0	0	115.7	V789	V789-G791 PolarHBondContact O-N 3.31Å
792	L	91.3	Very high	92.9	Very high	98 Å²	98	39.6 Å²	39.6	51%	0.513	26%	0.257	S	S	.	.	S	Bend	trans	-83.4	-15.4	-179.2	-64.9	-170.2	0	0	0	114.9	V789 P790 K794	V789-L792 HydrophobicContact CB-CD1 3.84Å; V789-L792 HydrophobicContact CB-CG 4.16Å; V789-L792 HydrophobicContact CG1-CD1 4.39Å; V789-L792 HydrophobicContact CG1-CG 4.5Å; V789-L792 HydrophobicContact CG2-CD1 4.34Å; V789-L792 PolarHBondContact O-N 2.89Å; P790-L792 VanDerWaalsContact C-N 3.27Å; P790-L792 PolarHBondContact O-N 3.26Å; L792-K794 HydrophobicContact CB-CB 4.48Å; L792-K794 HydrophobicContact CB-CD 4.23Å; L792-K794 HydrophobicContact CB-CG 4.44Å; L792-K794 WeakPolarHBondContact O-CG 3.45Å
793	Q	92.9	Very high	92.8	Very high	33 Å²	33	39.5 Å²	39.5	15%	0.154	26%	0.259	C	S	.	.			trans	54.8	52.4	-174.6	-169.9	167.1	-22.8	0	0	114.1	L756 R769 F783	L756-Q793 HydrophobicContact CB-CG 4.33Å; L756-Q793 PolarHBondContact O-NE2 3.07Å; R769-Q793 PolarHBondContact O-NE2 3.31Å; F783-Q793 HydrophobicContact CB-CB 4.46Å; F783-Q793 HydrophobicContact CB-CG 4.15Å; F783-Q793 WeakPolarHBondContact O-CA 3.3Å
794	K	95	Very high	92.6	Very high	65 Å²	65	41.7 Å²	41.7	28%	0.283	27%	0.274	S	S	.	.			trans	-139.6	152.1	-172.9	-74.3	175.2	165.3	-151.8	0	112.6	W785 G788 L792 G798 V799 L808	W785-K794 PolarHBondContact N-O 3.26Å; G788-K794 WeakPolarHBondContact CA-O 3.49Å; L792-K794 HydrophobicContact CB-CB 4.48Å; L792-K794 HydrophobicContact CB-CD 4.23Å; L792-K794 HydrophobicContact CB-CG 4.44Å; L792-K794 WeakPolarHBondContact O-CG 3.45Å; K794-G798 WeakPolarHBondContact CD-O 3.44Å; K794-G798 WeakPolarHBondContact CE-O 3.07Å; K794-G798 PolarHBondContact NZ-O 3.38Å; K794-V799 HydrophobicContact CB-CG2 4.01Å; K794-V799 HydrophobicContact CD-CG2 4.49Å; K794-L808 WeakPolarHBondContact CE-O 3.22Å
795	C	95.1	Very high	92.1	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.007	30%	0.302	C	S	.	.			trans	-85.6	173.8	162.7	-63.2	0	0	0	0	110.6	W785 C797 G798 V799 T809 C810 D824	W785-C795 HydrophobicContact CB-CB 4.07Å; W785-C795 WeakPolarHBondContact CB-SG 3.43Å; C795-C797 PolarHBondContact O-N 3.04Å; C795-G798 PolarHBondContact O-N 2.84Å; C795-V799 PolarHBondContact O-N 2.85Å; C795-V799 VanDerWaalsContact O-N 3.13Å; C795-T809 PolarHBondContact N-O 3.22Å; C795-C810 HydrophobicContact CB-CB 3.81Å; C795-C810 WeakPolarHBondContact CB-SG 3.43Å; C795-C810 PolarHBondContact N-SG 3.44Å; C795-C810 WeakPolarHBondContact SG-CB 3.25Å; C795-C810 CovalentContact SG-SG 2.03Å; C795-C810 PolarHBondContact SG-SG 2.98Å; C795-D824 HydrophobicContact CB-CB 4.45Å
796	A	94.9	Very high	91.6	Very high	21 Å²	21	51.9 Å²	51.9	17%	0.174	34%	0.342	C	S	.	.	H	α-helix	trans	-47.2	-53.3	175.6	0	0	0	0	0	113	G786 G798 V799 E800	G786-A796 WeakPolarHBondContact O-CB 2.95Å; G786-A796 PolarHBondContact O-N 2.91Å; A796-G798 PolarHBondContact O-N 2.91Å; A796-V799 PolarHBondContact O-N 2.81Å; A796-V799 VanDerWaalsContact O-N 3.1Å; A796-E800 PolarHBondContact O-N 3.42Å
797	C	94.6	Very high	91.8	Very high	9 Å²	9	52.9 Å²	52.9	6%	0.061	35%	0.349	C	S	.	.	H	α-helix	trans	-62.2	-29.1	-179.6	74.1	0	0	0	0	112.8	C795 G801 T802 C803 N811	C795-C797 PolarHBondContact O-N 3.04Å; C797-G801 CarbonylContact O-C 3.44Å; C797-G801 WeakPolarHBondContact O-CA 3.43Å; C797-G801 PolarHBondContact O-N 2.89Å; C797-T802 WeakPolarHBondContact CA-OG1 3.39Å; C797-T802 PolarHBondContact O-N 2.86Å; C797-C803 HydrophobicContact CB-CB 3.93Å; C797-C803 WeakPolarHBondContact CB-SG 3.41Å; C797-C803 PolarHBondContact O-SG 2.7Å; C797-C803 WeakPolarHBondContact SG-CA 3.35Å; C797-C803 WeakPolarHBondContact SG-CB 3.46Å; C797-C803 CovalentContact SG-SG 2.06Å; C797-C803 PolarHBondContact SG-SG 3.1Å; C797-N811 PolarHBondContact SG-N 2.87Å; C797-N811 VanDerWaalsContact SG-N 3.43Å; C797-N811 PolarHBondContact SG-OD1 3.49Å; C797-N811 VanDerWaalsContact SG-OD1 3.38Å
798	G	94	Very high	91.8	Very high	4 Å²	4	57.8 Å²	57.8	4%	0.041	37%	0.366	C	S	.	.	H	α-helix	trans	-76.3	-28.5	-179.9	0	0	0	0	0	112.2	K794 C795 A796 C803 T809	K794-G798 WeakPolarHBondContact CD-O 3.44Å; K794-G798 WeakPolarHBondContact CE-O 3.07Å; K794-G798 PolarHBondContact NZ-O 3.38Å; C795-G798 PolarHBondContact O-N 2.84Å; A796-G798 PolarHBondContact O-N 2.91Å; G798-C803 VanDerWaalsContact CA-SG 3.55Å; G798-C803 PolarHBondContact N-SG 2.97Å; G798-T809 WeakPolarHBondContact CA-O 3.45Å
799	V	93.1	Very high	91.9	Very high	62 Å²	62	59 Å²	59	38%	0.376	37%	0.372	S	S	.	.	H	α-helix	trans	-72.7	-46.2	170.9	178	0	0	0	0	110	V789 K794 C795 A796 G801	V789-V799 HydrophobicContact CG2-CG2 4.39Å; K794-V799 HydrophobicContact CB-CG2 4.01Å; K794-V799 HydrophobicContact CD-CG2 4.49Å; C795-V799 PolarHBondContact O-N 2.85Å; C795-V799 VanDerWaalsContact O-N 3.13Å; A796-V799 PolarHBondContact O-N 2.81Å; A796-V799 VanDerWaalsContact O-N 3.1Å; V799-G801 VanDerWaalsContact C-N 3.33Å; V799-G801 PolarHBondContact O-N 2.69Å
800	E	93	Very high	92	Very high	140 Å²	140	56.3 Å²	56.3	65%	0.654	36%	0.356	S	S	*	.	H	α-helix	trans	-74.6	-20	-179.6	-67	178.5	176.1	0	0	114	A796 T802	A796-E800 PolarHBondContact O-N 3.42Å; E800-T802 HydrophobicContact CB-CG2 3.92Å; E800-T802 PolarHBondContact OE2-OG1 3.28Å
801	G	91.7	Very high	92.1	Very high	70 Å²	70	55.8 Å²	55.8	72%	0.722	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	26.7	-172.9	0	0	0	0	0	113.6	C797 V799	C797-G801 CarbonylContact O-C 3.44Å; C797-G801 WeakPolarHBondContact O-CA 3.43Å; C797-G801 PolarHBondContact O-N 2.89Å; V799-G801 VanDerWaalsContact C-N 3.33Å; V799-G801 PolarHBondContact O-N 2.69Å
802	T	93.7	Very high	92.4	Very high	85 Å²	85	52.7 Å²	52.7	52%	0.521	32%	0.319	S	S	.	.			trans	-110	10.5	-173.7	54.6	0	0	0	0	113.4	C797 E800	C797-T802 WeakPolarHBondContact CA-OG1 3.39Å; C797-T802 PolarHBondContact O-N 2.86Å; E800-T802 HydrophobicContact CB-CG2 3.92Å; E800-T802 PolarHBondContact OE2-OG1 3.28Å
803	C	92.6	Very high	92.5	Very high	18 Å²	18	48.3 Å²	48.3	12%	0.122	30%	0.295	C	S	.	.			trans	-63.5	150.1	-177.6	-62.2	0	0	0	0	112.9	C797 G798 S807 N811	C797-C803 HydrophobicContact CB-CB 3.93Å; C797-C803 WeakPolarHBondContact CB-SG 3.41Å; C797-C803 PolarHBondContact O-SG 2.7Å; C797-C803 WeakPolarHBondContact SG-CA 3.35Å; C797-C803 WeakPolarHBondContact SG-CB 3.46Å; C797-C803 CovalentContact SG-SG 2.06Å; C797-C803 PolarHBondContact SG-SG 3.1Å; G798-C803 VanDerWaalsContact CA-SG 3.55Å; G798-C803 PolarHBondContact N-SG 2.97Å; C803-S807 WeakPolarHBondContact CB-O 3.35Å; C803-N811 VanDerWaalsContact CA-OD1 3.25Å; C803-N811 WeakPolarHBondContact CA-OD1 3.27Å
804	T	88.8	Confident	92.4	Very high	62 Å²	62	47.5 Å²	47.5	38%	0.38	29%	0.294	S	S	.	.	S	Bend	trans	-71.1	133.2	177.5	54.3	0	0	0	0	111.9	N811 S814	T804-N811 PolarHBondContact N-OD1 2.67Å; T804-N811 PolarHBondContact OG1-OD1 2.75Å; T804-S814 WeakPolarHBondContact O-CB 3.46Å; T804-S814 PolarHBondContact O-OG 2.83Å
805	G	85.3	Confident	91.4	Very high	58 Å²	58	51.9 Å²	51.9	60%	0.598	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	-157.4	-175.2	0	0	0	0	0	112.4	S807	G805-S807 PolarHBondContact O-N 2.94Å
806	D	84.2	Confident	90.2	Very high	159 Å²	159	53.4 Å²	53.4	85%	0.85	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	16.1	-178.8	-67.2	-31.2	0	0	0	113.3
807	S	91.5	Very high	89.3	Confident	20 Å²	20	53.6 Å²	53.6	14%	0.14	34%	0.336	C	S	.	.			trans	-71.7	133.1	-178.5	-177.8	0	0	0	0	112.1	C803 G805 C810 D813	C803-S807 WeakPolarHBondContact CB-O 3.35Å; G805-S807 PolarHBondContact O-N 2.94Å; S807-C810 VanDerWaalsContact CB-O 3.29Å; S807-C810 WeakPolarHBondContact CB-O 3.19Å; S807-C810 PolarHBondContact OG-N 3.29Å; S807-C810 PolarHBondContact OG-O 3.14Å; S807-D813 WeakPolarHBondContact OG-CB 3.22Å
808	L	91.6	Very high	88.2	Confident	139 Å²	139	57 Å²	57	73%	0.728	36%	0.357	S	S	*	.	S	Bend	trans	-100.6	-4.2	178.3	-61.2	177.6	0	0	0	113.7	K794	K794-L808 WeakPolarHBondContact CE-O 3.22Å
809	T	93.3	Very high	87.5	Confident	33 Å²	33	62.1 Å²	62.1	20%	0.202	39%	0.387	C	S	.	.	S	Bend	trans	-115	-61.1	-171.8	48.7	0	0	0	0	112.3	C795 G798 D813	C795-T809 PolarHBondContact N-O 3.22Å; G798-T809 WeakPolarHBondContact CA-O 3.45Å; T809-D813 WeakPolarHBondContact CB-OD2 3.13Å; T809-D813 VanDerWaalsContact OG1-CB 3.26Å; T809-D813 WeakPolarHBondContact OG1-CB 3.44Å; T809-D813 VanDerWaalsContact OG1-CG 3.3Å; T809-D813 PolarHBondContact OG1-OD2 2.64Å
810	C	95.5	Very high	87.2	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	40%	0.4	C	S	.	.			trans	-149.6	159.4	-175.8	-61	0	0	0	0	111.1	L756 C795 S807 C812 D813 D824	L756-C810 VanDerWaalsContact CD1-SG 3.56Å; C795-C810 HydrophobicContact CB-CB 3.81Å; C795-C810 WeakPolarHBondContact CB-SG 3.43Å; C795-C810 PolarHBondContact N-SG 3.44Å; C795-C810 WeakPolarHBondContact SG-CB 3.25Å; C795-C810 CovalentContact SG-SG 2.03Å; C795-C810 PolarHBondContact SG-SG 2.98Å; S807-C810 VanDerWaalsContact CB-O 3.29Å; S807-C810 WeakPolarHBondContact CB-O 3.19Å; S807-C810 PolarHBondContact OG-N 3.29Å; S807-C810 PolarHBondContact OG-O 3.14Å; C810-C812 VanDerWaalsContact C-N 3.32Å; C810-C812 PolarHBondContact O-N 3.46Å; C810-D813 HydrophobicContact CB-CB 4.34Å; C810-D813 WeakPolarHBondContact CB-OD2 3.42Å; C810-D813 WeakPolarHBondContact O-CB 3.36Å; C810-D813 PolarHBondContact O-N 2.06Å; C810-D813 VanDerWaalsContact O-N 3.12Å; C810-D824 WeakPolarHBondContact CB-OD2 3.35Å
811	N	94.7	Very high	87.1	Confident	27 Å²	27	58.9 Å²	58.9	14%	0.144	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-59.6	-45.5	174.8	-69.1	-40.9	0	0	0	110.8	C797 C803 T804 D813 S814 L822 V823 D824	C797-N811 PolarHBondContact SG-N 2.87Å; C797-N811 VanDerWaalsContact SG-N 3.43Å; C797-N811 PolarHBondContact SG-OD1 3.49Å; C797-N811 VanDerWaalsContact SG-OD1 3.38Å; C803-N811 VanDerWaalsContact CA-OD1 3.25Å; C803-N811 WeakPolarHBondContact CA-OD1 3.27Å; T804-N811 PolarHBondContact N-OD1 2.67Å; T804-N811 PolarHBondContact OG1-OD1 2.75Å; N811-D813 PolarHBondContact O-N 2.8Å; N811-D813 VanDerWaalsContact O-N 3.1Å; N811-S814 WeakPolarHBondContact O-CB 3.25Å; N811-S814 PolarHBondContact O-N 3.33Å; N811-L822 HydrophobicContact CB-CB 4.31Å; N811-L822 WeakPolarHBondContact O-CD1 3.4Å; N811-V823 PolarHBondContact ND2-O 3.34Å; N811-D824 PolarHBondContact N-OD1 3.16Å; N811-D824 PolarHBondContact N-OD2 3.49Å
812	C	93.8	Very high	87.2	Confident	3 Å²	3	57 Å²	57	2%	0.02	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-64.7	-12.6	177.7	-79.6	0	0	0	0	114.9	Y748 C750 L755 C810 S814 L822 D824	Y748-C812 HydrophobicContact CD1-CB 4.05Å; Y748-C812 HydrophobicContact CE1-CB 4.1Å; C750-C812 HydrophobicContact CB-CB 3.89Å; C750-C812 WeakPolarHBondContact CB-SG 3.39Å; C750-C812 WeakPolarHBondContact SG-CA 3.44Å; C750-C812 WeakPolarHBondContact SG-CB 3.47Å; C750-C812 CovalentContact SG-SG 2.02Å; C750-C812 PolarHBondContact SG-SG 3.43Å; L755-C812 HydrophobicContact CB-CB 4.29Å; C810-C812 VanDerWaalsContact C-N 3.32Å; C810-C812 PolarHBondContact O-N 3.46Å; C812-S814 VanDerWaalsContact C-N 3.32Å; C812-L822 PolarHBondContact SG-O 2.92Å; C812-D824 WeakPolarHBondContact CB-OD2 3.14Å; C812-D824 PolarHBondContact N-OD2 2.79Å
813	D	93.7	Very high	87.2	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.027	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-86.7	-3.7	175.1	-67.6	-33.5	0	0	0	113.4	K754 L755 L756 Q757 S807 T809 C810 N811	K754-D813 PolarHBondContact NZ-O 3.14Å; L755-D813 PolarHBondContact N-OD1 2.94Å; L756-D813 PolarHBondContact N-OD1 3.09Å; L756-D813 VanDerWaalsContact N-OD1 3.15Å; L756-D813 PolarHBondContact N-OD2 2.8Å; L756-D813 VanDerWaalsContact N-OD2 3.14Å; Q757-D813 HydrophobicContact CB-CB 3.94Å; Q757-D813 WeakPolarHBondContact CB-OD1 3.35Å; Q757-D813 PolarHBondContact N-OD1 2.95Å; Q757-D813 PolarHBondContact N-OD2 2.77Å; S807-D813 WeakPolarHBondContact OG-CB 3.22Å; T809-D813 WeakPolarHBondContact CB-OD2 3.13Å; T809-D813 VanDerWaalsContact OG1-CB 3.26Å; T809-D813 WeakPolarHBondContact OG1-CB 3.44Å; T809-D813 VanDerWaalsContact OG1-CG 3.3Å; T809-D813 PolarHBondContact OG1-OD2 2.64Å; C810-D813 HydrophobicContact CB-CB 4.34Å; C810-D813 WeakPolarHBondContact CB-OD2 3.42Å; C810-D813 WeakPolarHBondContact O-CB 3.36Å; C810-D813 PolarHBondContact O-N 2.06Å; C810-D813 VanDerWaalsContact O-N 3.12Å; N811-D813 PolarHBondContact O-N 2.8Å; N811-D813 VanDerWaalsContact O-N 3.1Å
814	S	89.8	Confident	87.4	Confident	17 Å²	17	55 Å²	55	12%	0.119	34%	0.34	C	S	.	.	S	Bend	trans	-71.2	175	176.1	-158.1	0	0	0	0	113.2	K754 T804 N811 C812 G816	K754-S814 PolarHBondContact NZ-O 3.05Å; T804-S814 WeakPolarHBondContact O-CB 3.46Å; T804-S814 PolarHBondContact O-OG 2.83Å; N811-S814 WeakPolarHBondContact O-CB 3.25Å; N811-S814 PolarHBondContact O-N 3.33Å; C812-S814 VanDerWaalsContact C-N 3.32Å; S814-G816 PolarHBondContact O-N 2.99Å
815	D	75	Confident	87.6	Confident	156 Å²	156	56 Å²	56	83%	0.834	35%	0.346	S	S	*	.	S	Bend	trans	-69.4	26.9	-171.8	-76.7	-17.7	0	0	0	116
816	G	69.4	Low	88.1	Confident	33 Å²	33	54 Å²	54	34%	0.34	33%	0.326	S	S	.	.			trans	83.4	140.1	169.4	0	0	0	0	0	114	N752 S814	N752-G816 WeakPolarHBondContact OD1-CA 3.11Å; S814-G816 PolarHBondContact O-N 2.99Å
817	S	75.3	Confident	88.7	Confident	26 Å²	26	49.3 Å²	49.3	18%	0.182	30%	0.301	C	S	.	.			trans	-130.7	132.2	167.9	-179.6	0	0	0	0	109.1	W751 N752 T819 P820	W751-S817 WeakPolarHBondContact CA-O 3.41Å; N752-S817 PolarHBondContact N-O 3.3Å; N752-S817 PolarHBondContact OD1-N 3.27Å; N752-S817 PolarHBondContact OD1-O 2.83Å; S817-T819 PolarHBondContact OG-N 3.13Å; S817-P820 WeakPolarHBondContact CB-O 3.31Å; S817-P820 PolarHBondContact OG-O 2.86Å
818	T	72.6	Confident	88.9	Confident	81 Å²	81	48.4 Å²	48.4	50%	0.497	29%	0.294	S	S	.	.	S	Bend	trans	-88.3	-25.1	173.7	51.1	0	0	0	0	112.5	W751 N752	W751-T818 PolarHBondContact NE1-O 3.18Å; N752-T818 WeakPolarHBondContact ND2-CG2 3.46Å
819	T	78	Confident	89	Confident	110 Å²	110	48 Å²	48	68%	0.675	29%	0.288	S	S	*	.	S	Bend	trans	-173.3	129.5	172.6	27.2	0	0	0	0	109.9	S817	S817-T819 PolarHBondContact OG-N 3.13Å
820	P	87.3	Confident	89.1	Confident	100 Å²	100	50.5 Å²	50.5	65%	0.649	30%	0.297	S	S	*	.	S	Bend	cis	-73	162.5	-5.6	32.2	-35.7	0	0	0	112.7	S817	S817-P820 WeakPolarHBondContact CB-O 3.31Å; S817-P820 PolarHBondContact OG-O 2.86Å
821	P	91.6	Very high	88.9	Confident	35 Å²	35	52.9 Å²	52.9	23%	0.227	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-61.7	150.5	175.8	26.4	-34	0	0	0	111.8	Q749 C750 W751	Q749-P821 HydrophobicContact CB-CB 4.3Å; C750-P821 WeakPolarHBondContact O-CA 3.4Å; C750-P821 WeakPolarHBondContact O-CB 3.21Å; W751-P821 HydrophobicContact CD2-CB 4Å; W751-P821 HydrophobicContact CE3-CB 4.24Å; W751-P821 HydrophobicContact CH2-CB 3.98Å; W751-P821 HydrophobicContact CH2-CG 3.99Å; W751-P821 HydrophobicContact CZ2-CB 3.69Å; W751-P821 HydrophobicContact CZ2-CG 3.64Å; W751-P821 HydrophobicContact CZ3-CB 4.23Å
822	L	93.7	Very high	88.7	Confident	31 Å²	31	58.3 Å²	58.3	16%	0.162	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	147.3	164.3	-57.7	175.3	0	0	0	108.4	Q749 C750 N811 C812	Q749-L822 CarbonylContact C-O 3.6Å; Q749-L822 WeakPolarHBondContact CA-O 3.16Å; C750-L822 PolarHBondContact N-O 3.48Å; C750-L822 PolarHBondContact O-N 3.17Å; C750-L822 VanDerWaalsContact O-N 3.11Å; N811-L822 HydrophobicContact CB-CB 4.31Å; N811-L822 WeakPolarHBondContact O-CD1 3.4Å; C812-L822 PolarHBondContact SG-O 2.92Å
823	V	94.3	Very high	88.7	Confident	57 Å²	57	60.1 Å²	60.1	35%	0.345	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130	-172.1	-174.6	0	0	0	0	110.3	T747 Y748 Q749 N811	T747-V823 HydrophobicContact CG2-CG1 4.08Å; Y748-V823 CarbonylContact O-C 3.55Å; Y748-V823 WeakPolarHBondContact O-CA 3.42Å; Q749-V823 HydrophobicContact CB-CG2 4.44Å; Q749-V823 HydrophobicContact CG-CG1 4.27Å; Q749-V823 HydrophobicContact CG-CG2 4.05Å; N811-V823 PolarHBondContact ND2-O 3.34Å
824	D	95.2	Very high	88.8	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.016	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.3	168.5	-73.2	-74.2	0	0	0	108.8	T747 Y748 L755 W785 C795 C810 N811 C812	T747-D824 CarbonylContact C-O 3.57Å; T747-D824 WeakPolarHBondContact CA-O 3.38Å; Y748-D824 PolarHBondContact N-O 3.1Å; Y748-D824 PolarHBondContact O-N 2.85Å; L755-D824 HydrophobicContact CD2-CB 4.45Å; W785-D824 PolarHBondContact NE1-O 3.03Å; C795-D824 HydrophobicContact CB-CB 4.45Å; C810-D824 WeakPolarHBondContact CB-OD2 3.35Å; N811-D824 PolarHBondContact N-OD1 3.16Å; N811-D824 PolarHBondContact N-OD2 3.49Å; C812-D824 WeakPolarHBondContact CB-OD2 3.14Å; C812-D824 PolarHBondContact N-OD2 2.79Å
825	T	94.8	Very high	89	Confident	82 Å²	82	59.1 Å²	59.1	50%	0.503	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	151	-178.6	-168.8	0	0	0	0	110.7	L746 T747	L746-T825 WeakPolarHBondContact O-CA 3.23Å; T747-T825 PolarHBondContact OG1-OG1 3.4Å; T747-T825 VanDerWaalsContact OG1-OG1 3.1Å
826	G	94.8	Very high	90	Very high	18 Å²	18	51.7 Å²	51.7	19%	0.186	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.7	-177	171.1	0	0	0	0	0	113.4	S745 L746 G786	S745-G826 WeakPolarHBondContact CA-O 3.43Å; L746-G826 PolarHBondContact N-O 3.13Å; L746-G826 PolarHBondContact O-N 3.38Å; G786-G826 VanDerWaalsContact CA-C 3.43Å
827	L	96.2	Very high	91.2	Very high	60 Å²	60	52.3 Å²	52.3	31%	0.314	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	138.4	178.5	-61.2	178.1	0	0	0	111.1	Q744 G787 Q829 R861	Q744-L827 WeakPolarHBondContact O-CA 3.45Å; G787-L827 PolarHBondContact N-O 3.18Å; L827-Q829 HydrophobicContact CB-CG 4.01Å; L827-R861 VanDerWaalsContact CD2-NH2 3.3Å
828	L	96.3	Very high	92.1	Very high	1 Å²	1	52 Å²	52	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	123.2	159.8	-60	-179.9	0	0	0	107.6	D743 Q744 L746 W774 Y784 L834 V836	D743-L828 CarbonylContact C-O 3.59Å; D743-L828 WeakPolarHBondContact CA-O 3.46Å; Q744-L828 PolarHBondContact N-O 3.23Å; Q744-L828 PolarHBondContact O-N 3.47Å; L746-L828 HydrophobicContact CD1-CD1 3.16Å; L746-L828 HydrophobicContact CD1-CD2 4.17Å; L746-L828 HydrophobicContact CD1-CG 3.36Å; W774-L828 HydrophobicContact CD2-CD1 4.03Å; W774-L828 HydrophobicContact CE3-CD1 4.26Å; W774-L828 HydrophobicContact CH2-CD1 3.69Å; W774-L828 HydrophobicContact CZ2-CD1 3.45Å; W774-L828 VanDerWaalsContact CZ2-CD1 3.45Å; W774-L828 HydrophobicContact CZ2-CD2 3.83Å; W774-L828 HydrophobicContact CZ2-CG 4.23Å; W774-L828 HydrophobicContact CZ3-CD1 4.08Å; Y784-L828 HydrophobicContact CD2-CD2 4.06Å; Y784-L828 HydrophobicContact CE2-CD2 3.52Å; L828-L834 HydrophobicContact CB-CD2 3.74Å; L828-L834 HydrophobicContact CD1-CD2 3.98Å; L828-V836 HydrophobicContact CD1-CG2 3.56Å
829	Q	94.1	Very high	93.2	Very high	129 Å²	129	48.1 Å²	48.1	60%	0.603	26%	0.264	S	S	*	.			trans	-122.4	-1.1	-177.6	-60.8	178.5	-71.2	0	0	112.8	D743 L827 K831	D743-Q829 HydrophobicContact CB-CG 4.19Å; L827-Q829 HydrophobicContact CB-CG 4.01Å; Q829-K831 PolarHBondContact O-N 2.96Å
830	F	94.1	Very high	93.9	Very high	87 Å²	87	45.9 Å²	45.9	38%	0.382	24%	0.243	S	C	.	.			trans	-79.3	93.1	178.1	-68.4	-88.1	0	0	0	109.4	Y784 V789 P790 D832 H833	Y784-F830 HydrophobicContact CE2-CD2 4.02Å; V789-F830 HydrophobicContact CG1-CZ 4.1Å; P790-F830 HydrophobicContact CG-CB 4.28Å; P790-F830 HydrophobicContact CG-CD1 3.7Å; P790-F830 HydrophobicContact CG-CD2 3.67Å; P790-F830 HydrophobicContact CG-CE1 3.91Å; P790-F830 HydrophobicContact CG-CE2 3.91Å; P790-F830 HydrophobicContact CG-CG 3.58Å; P790-F830 HydrophobicContact CG-CZ 4.03Å; F830-D832 VanDerWaalsContact C-N 3.33Å; F830-D832 PolarHBondContact O-N 3.21Å; F830-H833 PolarHBondContact O-N 3.46Å
831	K	91.8	Very high	94.3	Very high	50 Å²	50	41.1 Å²	41.1	22%	0.217	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-45	-50.3	-174.3	-173.1	174.2	129.1	161.7	0	113.5	V736 R737 S739 Q829 H833 L834	V736-K831 HydrophobicContact CG1-CB 4.48Å; V736-K831 HydrophobicContact CG1-CD 4.33Å; V736-K831 HydrophobicContact CG1-CG 3.37Å; V736-K831 WeakPolarHBondContact CG1-O 3.26Å; V736-K831 WeakPolarHBondContact O-CD 2.95Å; V736-K831 WeakPolarHBondContact O-CE 2.98Å; V736-K831 PolarHBondContact O-NZ 2.89Å; R737-K831 PolarHBondContact O-NZ 3.37Å; S739-K831 PolarHBondContact O-NZ 3.26Å; Q829-K831 PolarHBondContact O-N 2.96Å; K831-H833 PolarHBondContact O-N 3.11Å; K831-L834 PolarHBondContact O-N 3.38Å
832	D	90.5	Very high	94.3	Very high	140 Å²	140	39.5 Å²	39.5	75%	0.749	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-63.9	-13	-176.6	-61.6	-19.8	0	0	0	115.1	F830	F830-D832 VanDerWaalsContact C-N 3.33Å; F830-D832 PolarHBondContact O-N 3.21Å
833	H	93.6	Very high	94.1	Very high	42 Å²	42	38.2 Å²	38.2	19%	0.194	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-99	-19.2	175.8	-59.5	162.5	0	0	0	113.3	W774 S776 Q777 Y784 F830 K831	W774-H833 HydrophobicContact CH2-CB 3.64Å; W774-H833 HydrophobicContact CZ2-CB 4.45Å; W774-H833 HydrophobicContact CZ3-CB 4.44Å; W774-H833 WeakPolarHBondContact CZ3-O 3.04Å; S776-H833 VanDerWaalsContact CA-O 3.26Å; S776-H833 WeakPolarHBondContact CA-O 3.38Å; S776-H833 WeakPolarHBondContact CB-O 3.48Å; Q777-H833 PolarHBondContact N-O 3.25Å; Y784-H833 AromaticContact CE1-ND1 3.67Å; Y784-H833 AromaticContact CZ-ND1 3.73Å; Y784-H833 PolarHBondContact OH-ND1 3.11Å; F830-H833 PolarHBondContact O-N 3.46Å; K831-H833 PolarHBondContact O-N 3.11Å
834	L	95.7	Very high	94	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.179	C	C	.	.			trans	-78.9	154.6	-175.8	-71.6	174.9	0	0	0	111.7	C742 Q744 Q777 L828 K831 L860	C742-L834 HydrophobicContact CB-CD1 3.99Å; C742-L834 WeakPolarHBondContact O-CD1 3.5Å; Q744-L834 HydrophobicContact CB-CD2 3.76Å; Q777-L834 WeakPolarHBondContact CB-O 3.46Å; Q777-L834 PolarHBondContact OE1-O 3.02Å; Q777-L834 VanDerWaalsContact OE1-O 3.13Å; L828-L834 HydrophobicContact CB-CD2 3.74Å; L828-L834 HydrophobicContact CD1-CD2 3.98Å; K831-L834 PolarHBondContact O-N 3.38Å; L834-L860 HydrophobicContact CB-CD1 4.04Å; L834-L860 HydrophobicContact CD1-CD1 4.15Å; L834-L860 HydrophobicContact CG-CD1 4.5Å
835	P	95.5	Very high	93.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.178	C	C	.	.	S	Bend	cis	-81.5	174.3	-4.9	32.2	-35.6	0	0	0	113.9	Y724 L732 Q777 M837 L860	Y724-P835 HydrophobicContact CE1-CB 4.35Å; Y724-P835 HydrophobicContact CE2-CB 4.15Å; Y724-P835 HydrophobicContact CE2-CG 4.08Å; L732-P835 HydrophobicContact CB-CG 4.48Å; L732-P835 HydrophobicContact CD1-CG 4.09Å; L732-P835 HydrophobicContact CD2-CG 4.25Å; Q777-P835 PolarHBondContact N-O 2.81Å; P835-M837 HydrophobicContact CG-SD 3.96Å; P835-M837 PolarHBondContact O-N 2.05Å; P835-L860 HydrophobicContact CB-CB 4.41Å; P835-L860 HydrophobicContact CB-CD1 4.2Å; P835-L860 HydrophobicContact CB-CD2 4.1Å; P835-L860 HydrophobicContact CB-CG 4.47Å; P835-L860 HydrophobicContact CG-CD2 4.4Å
836	V	95.7	Very high	92.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.			trans	-66.8	114.4	166.4	179.1	0	0	0	0	109.4	L722 Y724 L746 W774 L828 V839 V857	L722-V836 HydrophobicContact CD1-CG1 4.27Å; L722-V836 HydrophobicContact CD2-CB 4.4Å; L722-V836 HydrophobicContact CD2-CG1 4.26Å; Y724-V836 WeakPolarHBondContact CE2-O 3.33Å; Y724-V836 PolarHBondContact OH-O 3.47Å; L746-V836 HydrophobicContact CD1-CG2 3.91Å; L746-V836 HydrophobicContact CD2-CG2 4.33Å; W774-V836 HydrophobicContact CB-CG1 4.09Å; W774-V836 HydrophobicContact CD2-CG2 4.13Å; W774-V836 HydrophobicContact CE3-CB 4.18Å; W774-V836 HydrophobicContact CE3-CG1 4.28Å; W774-V836 HydrophobicContact CE3-CG2 3.7Å; W774-V836 HydrophobicContact CZ3-CG2 4.09Å; L828-V836 HydrophobicContact CD1-CG2 3.56Å; V836-V839 HydrophobicContact CG1-CG1 3.87Å; V836-V857 HydrophobicContact CB-CG1 4.29Å; V836-V857 HydrophobicContact CG2-CG1 4.42Å
837	M	93.4	Very high	91.3	Very high	47 Å²	47	40.3 Å²	40.3	23%	0.232	20%	0.203	C	C	.	.			trans	-93.3	-29.2	178.4	-63.5	-56.2	-67.9	0	0	112.9	K721 L722 Y724 L732 V775 P835	K721-M837 WeakPolarHBondContact CA-O 3.14Å; L722-M837 PolarHBondContact N-O 2.87Å; Y724-M837 HydrophobicContact CD2-SD 4.48Å; Y724-M837 HydrophobicContact CE2-SD 4.19Å; L732-M837 HydrophobicContact CD1-CE 4.05Å; L732-M837 HydrophobicContact CD1-SD 3.88Å; V775-M837 PolarHBondContact O-N 2.81Å; P835-M837 HydrophobicContact CG-SD 3.96Å; P835-M837 PolarHBondContact O-N 2.05Å
838	E	94.4	Very high	90.2	Very high	18 Å²	18	45.3 Å²	45.3	8%	0.084	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	150.2	179.6	167.3	172.2	-138.9	0	0	110.5	R720 K721 W774 V775 R840	R720-E838 VanDerWaalsContact O-CA 3.26Å; R720-E838 WeakPolarHBondContact O-CA 3.39Å; R720-E838 WeakPolarHBondContact O-CG 3.42Å; K721-E838 HydrophobicContact CG-CB 4.44Å; W774-E838 CarbonylContact C-O 3.51Å; W774-E838 VanDerWaalsContact CA-O 3.26Å; W774-E838 WeakPolarHBondContact CA-O 3.49Å; V775-E838 HydrophobicContact CB-CB 3.93Å; V775-E838 HydrophobicContact CG2-CB 3.94Å; V775-E838 HydrophobicContact CG2-CG 4.07Å; V775-E838 PolarHBondContact N-O 2.97Å; E838-R840 VanDerWaalsContact CD-CZ 3.45Å; E838-R840 HydrophobicContact CG-CG 4.15Å; E838-R840 IonicContact OE1-CZ 3.74Å; E838-R840 IonicContact OE1-NE 3.15Å; E838-R840 PolarHBondContact OE1-NE 3.13Å; E838-R840 IonicContact OE1-NH1 3.99Å; E838-R840 IonicContact OE1-NH2 3.66Å; E838-R840 PolarHBondContact OE1-NH2 3.12Å; E838-R840 IonicContact OE2-CZ 3.01Å; E838-R840 IonicContact OE2-NE 2.74Å; E838-R840 PolarHBondContact OE2-NE 2.67Å; E838-R840 IonicContact OE2-NH2 3.64Å; E838-R840 PolarHBondContact OE2-NH2 2.72Å
839	V	95.3	Very high	89.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	143.8	169	-64.6	0	0	0	0	110.5	Y718 R719 R720 L722 W774 V836 F841 Y855 V857	Y718-V839 HydrophobicContact CE1-CG2 4.38Å; R719-V839 WeakPolarHBondContact CA-O 3.22Å; R720-V839 HydrophobicContact CB-CG2 4.11Å; R720-V839 PolarHBondContact N-O 3.36Å; R720-V839 PolarHBondContact O-N 3.47Å; L722-V839 HydrophobicContact CD1-CG1 4.46Å; W774-V839 HydrophobicContact CB-CG1 4.3Å; V836-V839 HydrophobicContact CG1-CG1 3.87Å; V839-F841 HydrophobicContact CB-CE2 3.86Å; V839-F841 HydrophobicContact CB-CZ 4.09Å; V839-F841 HydrophobicContact CG2-CE2 3.89Å; V839-Y855 HydrophobicContact CG2-CD2 4.3Å; V839-Y855 HydrophobicContact CG2-CE1 4.43Å; V839-Y855 HydrophobicContact CG2-CE2 3.64Å; V839-V857 HydrophobicContact CG1-CG2 4.06Å
840	R	94.4	Very high	89	Confident	64 Å²	64	47.9 Å²	47.9	24%	0.242	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	134.8	177.8	-62	-160.9	-178.7	-104.6	-1	111	Y718 R719 G772 W773 E838	Y718-R840 WeakPolarHBondContact O-CA 3.32Å; R719-R840 HydrophobicContact CB-CG 4.49Å; G772-R840 CarbonylContact C-O 3.41Å; G772-R840 WeakPolarHBondContact CA-O 3.42Å; W773-R840 HydrophobicContact CD2-CB 4.21Å; W773-R840 HydrophobicContact CZ2-CB 4.2Å; W773-R840 PolarHBondContact N-O 3.17Å; W773-R840 PolarHBondContact O-N 3.5Å; E838-R840 VanDerWaalsContact CD-CZ 3.45Å; E838-R840 HydrophobicContact CG-CG 4.15Å; E838-R840 IonicContact OE1-CZ 3.74Å; E838-R840 IonicContact OE1-NE 3.15Å; E838-R840 PolarHBondContact OE1-NE 3.13Å; E838-R840 IonicContact OE1-NH1 3.99Å; E838-R840 IonicContact OE1-NH2 3.66Å; E838-R840 PolarHBondContact OE1-NH2 3.12Å; E838-R840 IonicContact OE2-CZ 3.01Å; E838-R840 IonicContact OE2-NE 2.74Å; E838-R840 PolarHBondContact OE2-NE 2.67Å; E838-R840 IonicContact OE2-NH2 3.64Å; E838-R840 PolarHBondContact OE2-NH2 2.72Å
841	F	94.5	Very high	88.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	158	-179.6	-57.4	-64.6	0	0	0	111.7	V709 G716 S717 Y718 Y748 L755 W771 W785 V839 Y855	V709-F841 HydrophobicContact CG1-CB 4.46Å; V709-F841 HydrophobicContact CG2-CD2 4.26Å; G716-F841 CarbonylContact C-O 3.52Å; G716-F841 WeakPolarHBondContact CA-O 3.25Å; S717-F841 PolarHBondContact N-O 3.18Å; Y718-F841 WeakPolarHBondContact CB-O 3.49Å; Y718-F841 HydrophobicContact CD1-CB 4.29Å; Y718-F841 AromaticContact CD1-CD2 3.64Å; Y718-F841 HydrophobicContact CD1-CD2 3.64Å; Y718-F841 HydrophobicContact CD1-CG 4.43Å; Y718-F841 AromaticContact CE1-CD2 4Å; Y718-F841 HydrophobicContact CE1-CD2 4Å; Y718-F841 HydrophobicContact CE1-CE2 4.5Å; Y718-F841 PolarHBondContact N-O 3.39Å; Y718-F841 PolarHBondContact O-N 3.44Å; Y718-F841 VanDerWaalsContact O-N 3.12Å; Y748-F841 HydrophobicContact CD2-CD1 4.02Å; Y748-F841 AromaticContact CD2-CE1 3.54Å; Y748-F841 HydrophobicContact CD2-CE1 3.54Å; Y748-F841 AromaticContact CD2-CZ 3.83Å; Y748-F841 HydrophobicContact CD2-CZ 3.83Å; Y748-F841 AromaticContact CE2-CD1 3.41Å; Y748-F841 HydrophobicContact CE2-CD1 3.41Å; Y748-F841 VanDerWaalsContact CE2-CD1 3.41Å; Y748-F841 HydrophobicContact CE2-CD2 4.36Å; Y748-F841 AromaticContact CE2-CE1 3.45Å; Y748-F841 HydrophobicContact CE2-CE1 3.45Å; Y748-F841 VanDerWaalsContact CE2-CE1 3.45Å; Y748-F841 HydrophobicContact CE2-CE2 4.4Å; Y748-F841 AromaticContact CE2-CG 3.91Å; Y748-F841 HydrophobicContact CE2-CG 3.91Å; Y748-F841 AromaticContact CE2-CZ 3.96Å; Y748-F841 HydrophobicContact CE2-CZ 3.96Å; L755-F841 HydrophobicContact CD1-CD1 3.99Å; L755-F841 HydrophobicContact CD1-CE1 3.78Å; W771-F841 CarbonylContact O-C 3.6Å; W785-F841 AromaticContact CH2-CE1 3.71Å; W785-F841 HydrophobicContact CH2-CE1 3.71Å; W785-F841 AromaticContact CH2-CZ 3.68Å; W785-F841 HydrophobicContact CH2-CZ 3.68Å; W785-F841 HydrophobicContact CZ2-CE1 4.43Å; W785-F841 HydrophobicContact CZ2-CZ 4.37Å; W785-F841 HydrophobicContact CZ3-CE1 4.21Å; W785-F841 HydrophobicContact CZ3-CZ 4.5Å; V839-F841 HydrophobicContact CB-CE2 3.86Å; V839-F841 HydrophobicContact CB-CZ 4.09Å; V839-F841 HydrophobicContact CG2-CE2 3.89Å; F841-Y855 AromaticContact CD2-CD1 3.98Å; F841-Y855 HydrophobicContact CD2-CD1 3.98Å; F841-Y855 HydrophobicContact CD2-CE1 4.27Å; F841-Y855 HydrophobicContact CD2-CG 4.47Å; F841-Y855 AromaticContact CE2-CD1 3.39Å; F841-Y855 HydrophobicContact CE2-CD1 3.39Å; F841-Y855 HydrophobicContact CE2-CD2 4.04Å; F841-Y855 AromaticContact CE2-CE1 3.84Å; F841-Y855 HydrophobicContact CE2-CE1 3.84Å; F841-Y855 HydrophobicContact CE2-CE2 4.46Å; F841-Y855 AromaticContact CE2-CG 3.48Å; F841-Y855 HydrophobicContact CE2-CG 3.48Å; F841-Y855 VanDerWaalsContact CE2-CG 3.48Å; F841-Y855 HydrophobicContact CZ-CD1 4.26Å; F841-Y855 HydrophobicContact CZ-CD2 4.43Å; F841-Y855 AromaticContact CZ-CG 3.94Å; F841-Y855 HydrophobicContact CZ-CG 3.94Å
842	G	91.4	Very high	88.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.244	C	C	.	.			trans	-151.2	-175.2	178.2	0	0	0	0	0	109.8	Y712 A714 W771 T844	Y712-G842 CarbonylContact O-C 3.52Å; Y712-G842 VanDerWaalsContact O-C 3.32Å; Y712-G842 WeakPolarHBondContact O-CA 3.48Å; A714-G842 VanDerWaalsContact O-CA 3.29Å; A714-G842 WeakPolarHBondContact O-CA 3.38Å; W771-G842 PolarHBondContact O-N 3.48Å; G842-T844 PolarHBondContact O-N 2.87Å; G842-T844 VanDerWaalsContact O-N 3.16Å
843	D	91.1	Very high	89	Confident	5 Å²	5	41 Å²	41	3%	0.027	21%	0.209	C	C	.	.			trans	52.4	29.3	-174.3	-158.5	44.2	0	0	0	114.9	Y712 Q713 A753 K754 W771 G845 K851	Y712-D843 PolarHBondContact O-N 2.62Å; Q713-D843 PolarHBondContact NE2-OD1 3.32Å; Q713-D843 VanDerWaalsContact NE2-OD1 3.14Å; A753-D843 WeakPolarHBondContact CA-O 3.47Å; A753-D843 WeakPolarHBondContact CB-O 2.95Å; K754-D843 HydrophobicContact CB-CB 4.39Å; K754-D843 WeakPolarHBondContact CG-OD2 3.45Å; K754-D843 PolarHBondContact N-OD2 3.16Å; W771-D843 HydrophobicContact CD2-CB 3.78Å; W771-D843 HydrophobicContact CE3-CB 3.6Å; W771-D843 HydrophobicContact CG-CB 4.24Å; W771-D843 HydrophobicContact CH2-CB 4.48Å; W771-D843 HydrophobicContact CZ3-CB 3.98Å; D843-G845 PolarHBondContact O-N 3.12Å; D843-K851 WeakPolarHBondContact O-CD 3.09Å; D843-K851 IonicContact OD1-NZ 2.76Å; D843-K851 PolarHBondContact OD1-NZ 2.9Å; D843-K851 IonicContact OD2-NZ 3.78Å; D843-K851 PolarHBondContact OD2-NZ 3.07Å
844	T	90.2	Very high	89	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.207	C	C	.	.			trans	-93.3	31.7	172.8	55.9	0	0	0	0	111.5	V709 G711 Y712 A753 G842 K851 A853	V709-T844 HydrophobicContact CB-CG2 4.24Å; V709-T844 HydrophobicContact CG1-CG2 3.87Å; V709-T844 WeakPolarHBondContact O-CB 3.29Å; G711-T844 PolarHBondContact N-O 2.87Å; Y712-T844 WeakPolarHBondContact CA-OG1 2.94Å; Y712-T844 WeakPolarHBondContact CB-OG1 3.3Å; Y712-T844 PolarHBondContact N-OG1 3.29Å; Y712-T844 PolarHBondContact O-N 2.87Å; Y712-T844 PolarHBondContact O-OG1 3.29Å; A753-T844 HydrophobicContact CB-CG2 4.19Å; G842-T844 PolarHBondContact O-N 2.87Å; G842-T844 VanDerWaalsContact O-N 3.16Å; T844-K851 CarbonylContact C-O 3.49Å; T844-A853 HydrophobicContact CG2-CB 3.84Å
845	G	82.4	Confident	89	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.207	C	C	.	.			trans	74	-170.7	172	0	0	0	0	0	115.9	G711 Y712 D843	G711-G845 CarbonylContact C-O 3.54Å; G711-G845 VanDerWaalsContact CA-O 3.28Å; G711-G845 WeakPolarHBondContact CA-O 3.32Å; Y712-G845 PolarHBondContact N-O 3.18Å; D843-G845 PolarHBondContact O-N 3.12Å
846	G	78.4	Confident	89.1	Confident	32 Å²	32	45.7 Å²	45.7	33%	0.33	23%	0.227	S	C	.	.			trans	-121.8	-174.7	164.5	0	0	0	0	0	110.2	N848 D849	G846-N848 PolarHBondContact O-N 3.03Å; G846-D849 PolarHBondContact O-N 2.89Å
847	I	67.3	Low	89.1	Confident	171 Å²	171	45.8 Å²	45.8	88%	0.877	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-21.9	-172.9	-58.7	171.3	0	0	0	114.3
848	N	74.2	Confident	89.2	Confident	166 Å²	166	43.8 Å²	43.8	89%	0.888	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.4	18.8	-176.8	-61.7	-28.7	0	0	0	113.9	G846	G846-N848 PolarHBondContact O-N 3.03Å
849	D	82	Confident	89.3	Confident	68 Å²	68	44.6 Å²	44.6	36%	0.364	23%	0.225	S	C	.	.			trans	-105.6	151.8	176.7	-165.6	-5.5	0	0	0	110.4	G846 K851	G846-D849 PolarHBondContact O-N 2.89Å; D849-K851 PolarHBondContact O-N 3.06Å; D849-K851 PolarHBondContact OD1-N 2.96Å; D849-K851 VanDerWaalsContact OD2-CD 3.23Å; D849-K851 WeakPolarHBondContact OD2-CD 3.12Å; D849-K851 WeakPolarHBondContact OD2-CG 3.38Å
850	D	83.4	Confident	89.4	Confident	116 Å²	116	44.7 Å²	44.7	62%	0.62	23%	0.226	S	C	*	.	S	Bend	trans	-82.1	3.9	176.7	-67.7	-31.5	0	0	0	112.2
851	K	90.1	Very high	89.5	Confident	44 Å²	44	44.8 Å²	44.8	19%	0.191	23%	0.226	C	C	.	.			trans	-77.9	128.8	179.8	-70	-173.2	-172.8	-156.2	0	111.9	W751 N752 D843 T844 D849	W751-K851 VanDerWaalsContact O-CA 3.22Å; W751-K851 WeakPolarHBondContact O-CA 3.48Å; N752-K851 HydrophobicContact CB-CG 3.75Å; N752-K851 WeakPolarHBondContact O-CE 3.43Å; D843-K851 WeakPolarHBondContact O-CD 3.09Å; D843-K851 IonicContact OD1-NZ 2.76Å; D843-K851 PolarHBondContact OD1-NZ 2.9Å; D843-K851 IonicContact OD2-NZ 3.78Å; D843-K851 PolarHBondContact OD2-NZ 3.07Å; T844-K851 CarbonylContact C-O 3.49Å; D849-K851 PolarHBondContact O-N 3.06Å; D849-K851 PolarHBondContact OD1-N 2.96Å; D849-K851 VanDerWaalsContact OD2-CD 3.23Å; D849-K851 WeakPolarHBondContact OD2-CD 3.12Å; D849-K851 WeakPolarHBondContact OD2-CG 3.38Å
852	R	91.8	Very high	89.6	Confident	89 Å²	89	44.8 Å²	44.8	34%	0.336	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	165.9	171.5	61.9	173.9	-173	-88.1	-1.4	110.8	D710 W751	D710-R852 HydrophobicContact CB-CB 4.31Å; W751-R852 HydrophobicContact CB-CG 3.94Å; W751-R852 HydrophobicContact CD2-CG 3.97Å; W751-R852 HydrophobicContact CE3-CG 3.61Å; W751-R852 HydrophobicContact CG-CG 4.14Å; W751-R852 HydrophobicContact CZ3-CG 4.4Å; W751-R852 PolarHBondContact N-O 3.42Å; W751-R852 PolarHBondContact O-N 3.02Å; W751-R852 VanDerWaalsContact O-N 3.13Å
853	A	93.5	Very high	89.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	158.2	172.4	0	0	0	0	0	112.5	V709 Y748 Q749 T844	V709-A853 PolarHBondContact N-O 3.02Å; V709-A853 PolarHBondContact O-N 3.31Å; Y748-A853 HydrophobicContact CD2-CB 4.4Å; Y748-A853 HydrophobicContact CE1-CB 4.25Å; Y748-A853 HydrophobicContact CE2-CB 3.49Å; Y748-A853 VanDerWaalsContact CE2-CB 3.49Å; Y748-A853 VanDerWaalsContact CZ-CB 3.41Å; Y748-A853 VanDerWaalsContact OH-CB 3.29Å; Y748-A853 WeakPolarHBondContact OH-CB 3.12Å; Q749-A853 CarbonylContact O-C 3.55Å; Q749-A853 WeakPolarHBondContact O-CA 3.49Å; Q749-A853 WeakPolarHBondContact O-CB 3.24Å; T844-A853 HydrophobicContact CG2-CB 3.84Å
854	I	95	Very high	89.8	Confident	30 Å²	30	47.8 Å²	47.8	15%	0.154	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	130.5	167.2	-62.2	172.9	0	0	0	106.9	D706 V707 V708 Q749 W751	D706-I854 HydrophobicContact CB-CG2 3.89Å; V707-I854 WeakPolarHBondContact O-CA 3.35Å; V708-I854 HydrophobicContact CG2-CD1 4.47Å; V708-I854 HydrophobicContact CG2-CG1 4.14Å; Q749-I854 HydrophobicContact CB-CB 4.29Å; Q749-I854 PolarHBondContact N-O 2.84Å; Q749-I854 PolarHBondContact O-N 2.72Å; W751-I854 HydrophobicContact CH2-CD1 3.74Å; W751-I854 HydrophobicContact CH2-CG1 4.39Å; W751-I854 HydrophobicContact CZ3-CD1 3.75Å; W751-I854 HydrophobicContact CZ3-CG1 3.88Å
855	Y	95.7	Very high	89.7	Confident	3 Å²	3	48.4 Å²	48.4	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	155.7	173.6	76.1	-86	0	0	0	111.5	V707 V709 Y718 R720 T747 V839 F841 V857	V707-Y855 HydrophobicContact CB-CD1 4.06Å; V707-Y855 HydrophobicContact CB-CE1 3.54Å; V707-Y855 HydrophobicContact CB-CE2 4.31Å; V707-Y855 HydrophobicContact CG1-CD1 4.4Å; V707-Y855 HydrophobicContact CG1-CE1 3.54Å; V707-Y855 HydrophobicContact CG2-CE1 4.45Å; V707-Y855 HydrophobicContact CG2-CE2 4.48Å; V707-Y855 PolarHBondContact N-O 2.96Å; V707-Y855 PolarHBondContact O-N 2.95Å; V709-Y855 HydrophobicContact CG2-CD1 3.62Å; V709-Y855 HydrophobicContact CG2-CE1 3.56Å; Y718-Y855 AromaticContact CE1-CE1 3.59Å; Y718-Y855 HydrophobicContact CE1-CE1 3.59Å; Y718-Y855 AromaticContact CE1-CZ 3.98Å; Y718-Y855 AromaticContact CZ-CE1 3.82Å; Y718-Y855 WeakPolarHBondContact OH-CE1 3.4Å; Y718-Y855 PolarHBondContact OH-OH 3.24Å; R720-Y855 VanDerWaalsContact CD-OH 3.29Å; R720-Y855 WeakPolarHBondContact CD-OH 3.22Å; T747-Y855 CarbonylContact O-C 3.56Å; T747-Y855 WeakPolarHBondContact O-CA 3.5Å; T747-Y855 WeakPolarHBondContact O-CB 3.27Å; V839-Y855 HydrophobicContact CG2-CD2 4.3Å; V839-Y855 HydrophobicContact CG2-CE1 4.43Å; V839-Y855 HydrophobicContact CG2-CE2 3.64Å; F841-Y855 AromaticContact CD2-CD1 3.98Å; F841-Y855 HydrophobicContact CD2-CD1 3.98Å; F841-Y855 HydrophobicContact CD2-CE1 4.27Å; F841-Y855 HydrophobicContact CD2-CG 4.47Å; F841-Y855 AromaticContact CE2-CD1 3.39Å; F841-Y855 HydrophobicContact CE2-CD1 3.39Å; F841-Y855 HydrophobicContact CE2-CD2 4.04Å; F841-Y855 AromaticContact CE2-CE1 3.84Å; F841-Y855 HydrophobicContact CE2-CE1 3.84Å; F841-Y855 HydrophobicContact CE2-CE2 4.46Å; F841-Y855 AromaticContact CE2-CG 3.48Å; F841-Y855 HydrophobicContact CE2-CG 3.48Å; F841-Y855 VanDerWaalsContact CE2-CG 3.48Å; F841-Y855 HydrophobicContact CZ-CD1 4.26Å; F841-Y855 HydrophobicContact CZ-CD2 4.43Å; F841-Y855 AromaticContact CZ-CG 3.94Å; F841-Y855 HydrophobicContact CZ-CG 3.94Å; Y855-V857 HydrophobicContact CD2-CG2 4.11Å; Y855-V857 HydrophobicContact CE2-CG2 4.23Å
856	R	96.4	Very high	89.8	Confident	107 Å²	107	51.4 Å²	51.4	40%	0.404	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	133	173.5	179.4	159.2	-171.7	-160	2.5	109.6	D705 L746 T747	D705-R856 VanDerWaalsContact CG-NH2 3.29Å; D705-R856 VanDerWaalsContact O-CA 3.23Å; D705-R856 WeakPolarHBondContact O-CA 3.31Å; D705-R856 WeakPolarHBondContact O-CB 3.5Å; D705-R856 VanDerWaalsContact O-CD 3.26Å; D705-R856 WeakPolarHBondContact O-CD 3.47Å; D705-R856 WeakPolarHBondContact O-CG 3.48Å; D705-R856 IonicContact OD1-CZ 3.5Å; D705-R856 IonicContact OD1-NE 2.77Å; D705-R856 PolarHBondContact OD1-NE 3.26Å; D705-R856 IonicContact OD1-NH2 3.9Å; D705-R856 PolarHBondContact OD1-NH2 2.85Å; D705-R856 IonicContact OD2-NH2 2.9Å; L746-R856 WeakPolarHBondContact CA-O 3.37Å; T747-R856 PolarHBondContact N-O 2.75Å; T747-R856 PolarHBondContact O-N 2.78Å
857	V	96.4	Very high	89.8	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.012	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.6	167.7	-172.6	0	0	0	0	106.8	H701 L722 Q744 L746 V836 V839 Y855	H701-V857 PolarHBondContact CE1-O 2.59Å; H701-V857 VanDerWaalsContact CE1-O 3.26Å; H701-V857 PolarHBondContact NE2-O 3.1Å; L722-V857 HydrophobicContact CD2-CB 4.05Å; L722-V857 HydrophobicContact CD2-CG1 3.71Å; L722-V857 HydrophobicContact CD2-CG2 4.29Å; Q744-V857 HydrophobicContact CG-CG1 4.35Å; L746-V857 HydrophobicContact CD2-CG2 4.49Å; V836-V857 HydrophobicContact CB-CG1 4.29Å; V836-V857 HydrophobicContact CG2-CG1 4.42Å; V839-V857 HydrophobicContact CG1-CG2 4.06Å; Y855-V857 HydrophobicContact CD2-CG2 4.11Å; Y855-V857 HydrophobicContact CE2-CG2 4.23Å
858	G	95.6	Very high	90.4	Very high	4 Å²	4	44.1 Å²	44.1	4%	0.041	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	171.4	174.8	0	0	0	0	0	112.2	H701 Q744 S745	H701-G858 PolarHBondContact NE2-O 2.89Å; Q744-G858 VanDerWaalsContact CG-O 3.28Å; Q744-G858 WeakPolarHBondContact CG-O 3.22Å; Q744-G858 PolarHBondContact NE2-O 3.39Å; S745-G858 PolarHBondContact O-N 2.93Å; S745-G858 WeakPolarHBondContact OG-CA 3.36Å
859	P	96.1	Very high	90.6	Very high	36 Å²	36	40.2 Å²	40.2	23%	0.234	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	156	175.4	30.2	-35.6	0	0	0	111	M698 L699 R861	M698-P859 HydrophobicContact CG-CB 3.68Å; M698-P859 HydrophobicContact CG-CG 3.81Å; M698-P859 HydrophobicContact SD-CB 4.19Å; M698-P859 HydrophobicContact SD-CG 3.74Å; L699-P859 WeakPolarHBondContact O-CA 3.41Å; L699-P859 VanDerWaalsContact O-CB 3.3Å; L699-P859 WeakPolarHBondContact O-CB 3.14Å; P859-R861 PolarHBondContact O-N 3.09Å
860	L	96.8	Very high	90.9	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.8	168.6	176	70.9	0	0	0	108	M698 L699 L735 V736 C742 L834 P835	M698-L860 CarbonylContact C-O 3.02Å; M698-L860 WeakPolarHBondContact CA-O 3.41Å; L699-L860 HydrophobicContact CB-CB 4.32Å; L699-L860 HydrophobicContact CD2-CD2 4.43Å; L699-L860 PolarHBondContact N-O 2.83Å; L699-L860 PolarHBondContact O-N 2.89Å; L735-L860 HydrophobicContact CD2-CD2 4.24Å; V736-L860 HydrophobicContact CG2-CD2 3.98Å; C742-L860 HydrophobicContact CB-CD1 4.22Å; L834-L860 HydrophobicContact CB-CD1 4.04Å; L834-L860 HydrophobicContact CD1-CD1 4.15Å; L834-L860 HydrophobicContact CG-CD1 4.5Å; P835-L860 HydrophobicContact CB-CB 4.41Å; P835-L860 HydrophobicContact CB-CD1 4.2Å; P835-L860 HydrophobicContact CB-CD2 4.1Å; P835-L860 HydrophobicContact CB-CG 4.47Å; P835-L860 HydrophobicContact CG-CD2 4.4Å
861	R	97.4	Very high	91.3	Very high	67 Å²	67	32.5 Å²	32.5	25%	0.253	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122.3	177.3	-61.3	-179.9	-64.8	176.7	3.2	108.7	M698 C742 D743 L827 P859 Y863	M698-R861 HydrophobicContact CE-CG 4.36Å; M698-R861 HydrophobicContact CG-CG 4.3Å; C742-R861 CarbonylContact C-O 3.48Å; C742-R861 WeakPolarHBondContact CA-O 3.23Å; D743-R861 PolarHBondContact N-O 2.86Å; D743-R861 PolarHBondContact O-N 2.89Å; D743-R861 IonicContact OD1-CZ 3.83Å; D743-R861 IonicContact OD1-NE 3.22Å; D743-R861 PolarHBondContact OD1-NE 2.91Å; D743-R861 IonicContact OD1-NH2 3.61Å; D743-R861 PolarHBondContact OD1-NH2 2.78Å; D743-R861 IonicContact OD2-CZ 3.28Å; D743-R861 IonicContact OD2-NE 3.62Å; D743-R861 IonicContact OD2-NH2 2.71Å; D743-R861 PolarHBondContact OD2-NH2 3.22Å; L827-R861 VanDerWaalsContact CD2-NH2 3.3Å; P859-R861 PolarHBondContact O-N 3.09Å; R861-Y863 HydrophobicContact CB-CE2 4.24Å
862	C	96.9	Very high	91.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	137.9	-179.3	-74.1	0	0	0	0	110.4	M696 T697 S739 E741 C742	M696-C862 CarbonylContact C-O 3.52Å; M696-C862 WeakPolarHBondContact CA-O 3.24Å; T697-C862 PolarHBondContact N-O 3.15Å; T697-C862 PolarHBondContact O-N 2.84Å; S739-C862 VanDerWaalsContact OG-CB 3.27Å; S739-C862 WeakPolarHBondContact OG-CB 3.39Å; E741-C862 CarbonylContact O-C 3.5Å; E741-C862 WeakPolarHBondContact O-CA 3.43Å; C742-C862 HydrophobicContact CB-CB 4.19Å; C742-C862 WeakPolarHBondContact CB-SG 3.46Å; C742-C862 WeakPolarHBondContact SG-CB 3.28Å; C742-C862 CovalentContact SG-SG 2.06Å; C742-C862 PolarHBondContact SG-SG 3.18Å
863	Y	95	Very high	91.6	Very high	59 Å²	59	26.1 Å²	26.1	23%	0.231	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.7	-170.6	-54.3	-93.8	0	0	0	110.5	M696 I740 E741 D743 R861	M696-Y863 HydrophobicContact CB-CD1 3.76Å; M696-Y863 HydrophobicContact CB-CE1 3.98Å; M696-Y863 HydrophobicContact CG-CD1 3.77Å; M696-Y863 HydrophobicContact CG-CE1 3.61Å; M696-Y863 HydrophobicContact CG-CG 4.49Å; I740-Y863 WeakPolarHBondContact CB-O 3.36Å; I740-Y863 PolarHBondContact N-O 2.92Å; E741-Y863 HydrophobicContact CB-CD2 4.45Å; E741-Y863 PolarHBondContact N-O 3.32Å; E741-Y863 PolarHBondContact O-N 2.97Å; D743-Y863 WeakPolarHBondContact OD2-CE2 3.46Å; D743-Y863 PolarHBondContact OD2-OH 3.36Å; R861-Y863 HydrophobicContact CB-CE2 4.24Å
864	G	90.5	Very high	91.7	Very high	9 Å²	9	26.9 Å²	26.9	9%	0.093	13%	0.132	C	C	.	.			trans	68.3	172.4	-179.9	0	0	0	0	0	114	V695 S739	V695-G864 PolarHBondContact O-N 3.24Å; S739-G864 WeakPolarHBondContact CA-O 3.33Å
865	D	88.8	Confident	91.6	Very high	12 Å²	12	28 Å²	28	6%	0.064	13%	0.134	C	C	.	.			trans	-142.9	116.9	176.8	-178.3	-3.9	0	0	0	109.5	S653 R738 L867 F868	S653-D865 WeakPolarHBondContact CB-OD2 3.39Å; S653-D865 PolarHBondContact OG-OD2 2.89Å; R738-D865 IonicContact CZ-OD1 3.17Å; R738-D865 IonicContact CZ-OD2 2.78Å; R738-D865 IonicContact NE-OD1 2.74Å; R738-D865 PolarHBondContact NE-OD1 2.94Å; R738-D865 VanDerWaalsContact NE-OD1 3.13Å; R738-D865 IonicContact NE-OD2 3.44Å; R738-D865 IonicContact NH2-OD1 3.54Å; R738-D865 PolarHBondContact NH2-OD1 3.16Å; R738-D865 IonicContact NH2-OD2 3.7Å; R738-D865 PolarHBondContact NH2-OD2 2.72Å; D865-L867 PolarHBondContact O-N 3.36Å; D865-L867 WeakPolarHBondContact OD1-CB 3.48Å; D865-L867 PolarHBondContact OD1-N 2.86Å; D865-F868 HydrophobicContact CB-CD2 4.01Å; D865-F868 WeakPolarHBondContact O-CB 3.44Å; D865-F868 PolarHBondContact O-N 3.17Å; D865-F868 WeakPolarHBondContact OD2-CD2 3.33Å
866	T	84.5	Confident	91.3	Very high	63 Å²	63	30.7 Å²	30.7	39%	0.387	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-62	-23.5	-179.3	52.8	0	0	0	0	113.3	R738 I740 F868 D869	R738-T866 WeakPolarHBondContact CA-OG1 3.37Å; R738-T866 WeakPolarHBondContact O-CB 3.49Å; R738-T866 WeakPolarHBondContact O-CG2 3.28Å; R738-T866 PolarHBondContact O-N 2.79Å; R738-T866 PolarHBondContact O-OG1 2.78Å; I740-T866 HydrophobicContact CG1-CG2 4.35Å; T866-F868 VanDerWaalsContact C-N 3.28Å; T866-F868 PolarHBondContact O-N 2.89Å; T866-D869 WeakPolarHBondContact O-CB 3.41Å; T866-D869 PolarHBondContact O-N 2.6Å; T866-D869 VanDerWaalsContact O-N 3.16Å
867	L	79.3	Confident	90.9	Very high	14 Å²	14	30 Å²	30	7%	0.073	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-63.8	-36.5	173.3	-178.3	61.7	0	0	0	111.7	R738 D865 D869 N870 N1009 V1016	R738-L867 VanDerWaalsContact NH2-CD2 3.31Å; D865-L867 PolarHBondContact O-N 3.36Å; D865-L867 WeakPolarHBondContact OD1-CB 3.48Å; D865-L867 PolarHBondContact OD1-N 2.86Å; L867-D869 PolarHBondContact O-N 3.13Å; L867-N870 WeakPolarHBondContact O-CB 3.47Å; L867-N870 PolarHBondContact O-N 3.5Å; L867-N1009 HydrophobicContact CG-CB 4.29Å; L867-N1009 PolarHBondContact O-OD1 3.46Å; L867-V1016 HydrophobicContact CD1-CB 4.16Å; L867-V1016 HydrophobicContact CD1-CG1 3.46Å; L867-V1016 VanDerWaalsContact CD1-CG1 3.46Å; L867-V1016 HydrophobicContact CD1-CG2 3.58Å
868	F	78.6	Confident	90.4	Very high	36 Å²	36	32.9 Å²	32.9	16%	0.158	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-73.6	-15.3	176.4	-80.7	-99.2	0	0	0	113.3	S653 E656 L659 D865 T866 T871 I897 N1009	S653-F868 WeakPolarHBondContact OG-CE2 3.36Å; E656-F868 VanDerWaalsContact CA-CZ 3.42Å; E656-F868 HydrophobicContact CB-CE1 4.33Å; E656-F868 HydrophobicContact CB-CE2 4.16Å; E656-F868 HydrophobicContact CB-CZ 3.45Å; E656-F868 VanDerWaalsContact CB-CZ 3.45Å; E656-F868 HydrophobicContact CG-CZ 3.95Å; E656-F868 VanDerWaalsContact N-CZ 3.31Å; L659-F868 HydrophobicContact CD1-CE1 4.36Å; D865-F868 HydrophobicContact CB-CD2 4.01Å; D865-F868 WeakPolarHBondContact O-CB 3.44Å; D865-F868 PolarHBondContact O-N 3.17Å; D865-F868 WeakPolarHBondContact OD2-CD2 3.33Å; T866-F868 VanDerWaalsContact C-N 3.28Å; T866-F868 PolarHBondContact O-N 2.89Å; F868-T871 PolarHBondContact O-OG1 2.92Å; F868-I897 HydrophobicContact CD1-CD1 4.1Å; F868-I897 HydrophobicContact CE1-CD1 3.81Å; F868-N1009 WeakPolarHBondContact CA-OD1 3Å; F868-N1009 WeakPolarHBondContact CD2-ND2 3.27Å; F868-N1009 WeakPolarHBondContact CE1-ND2 3.49Å; F868-N1009 WeakPolarHBondContact CE2-ND2 3.24Å; F868-N1009 WeakPolarHBondContact CG-ND2 2.92Å; F868-N1009 WeakPolarHBondContact CZ-ND2 3.48Å
869	D	78.8	Confident	90	Very high	84 Å²	84	33.2 Å²	33.2	45%	0.449	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-86.2	-10	176.6	-161.8	32.5	0	0	0	113	T866 L867 T871 R1020	T866-D869 WeakPolarHBondContact O-CB 3.41Å; T866-D869 PolarHBondContact O-N 2.6Å; T866-D869 VanDerWaalsContact O-N 3.16Å; L867-D869 PolarHBondContact O-N 3.13Å; D869-T871 PolarHBondContact O-N 2.79Å; D869-R1020 WeakPolarHBondContact O-CD 2.97Å; D869-R1020 PolarHBondContact O-NH1 3Å; D869-R1020 IonicContact OD1-CZ 2.83Å; D869-R1020 IonicContact OD1-NH1 3.73Å; D869-R1020 PolarHBondContact OD1-NH1 3.06Å; D869-R1020 IonicContact OD2-CZ 3.99Å; D869-R1020 IonicContact OD2-NH1 3.91Å; D869-R1020 PolarHBondContact OD2-NH1 3.01Å
870	N	87.9	Confident	89.5	Confident	11 Å²	11	33.7 Å²	33.7	6%	0.059	17%	0.168	C	C	.	.			trans	-80.9	56.4	176.9	-176.9	29.6	0	0	0	112.2	L867 S1008 Q1017 M1019 R1020	L867-N870 WeakPolarHBondContact O-CB 3.47Å; L867-N870 PolarHBondContact O-N 3.5Å; N870-S1008 PolarHBondContact O-OG 3.05Å; N870-Q1017 PolarHBondContact ND2-O 2.75Å; N870-M1019 WeakPolarHBondContact O-CE 3.39Å; N870-M1019 PolarHBondContact OD1-N 3Å; N870-M1019 VanDerWaalsContact OD1-N 3.12Å; N870-R1020 WeakPolarHBondContact OD1-CB 3.33Å; N870-R1020 PolarHBondContact OD1-N 3.3Å
871	T	92.1	Very high	89	Confident	11 Å²	11	35 Å²	35	7%	0.067	18%	0.175	C	C	.	.			trans	-104.7	144	-177	-48.9	0	0	0	0	112.3	F868 D869 W955 C1006 L1007 S1008 G1035 C1036	F868-T871 PolarHBondContact O-OG1 2.92Å; D869-T871 PolarHBondContact O-N 2.79Å; T871-W955 HydrophobicContact CG2-CH2 3.75Å; T871-W955 HydrophobicContact CG2-CZ2 4.3Å; T871-C1006 HydrophobicContact CG2-CB 4.14Å; T871-L1007 WeakPolarHBondContact CA-O 3.38Å; T871-S1008 WeakPolarHBondContact OG1-CB 3.43Å; T871-S1008 PolarHBondContact OG1-OG 2.87Å; T871-G1035 WeakPolarHBondContact O-CA 3.33Å; T871-G1035 PolarHBondContact O-N 3.3Å; T871-C1036 HydrophobicContact CG2-CB 3.74Å
872	V	93.8	Very high	88.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.9	171.4	175.6	0	0	0	0	110.3	F874 C1006 L1007 M1019 V1023 L1032 S1033	V872-F874 HydrophobicContact CG1-CE2 4.32Å; V872-C1006 CarbonylContact O-C 3.52Å; V872-C1006 WeakPolarHBondContact O-CA 3.41Å; V872-L1007 PolarHBondContact N-O 3Å; V872-L1007 PolarHBondContact O-N 3.13Å; V872-M1019 HydrophobicContact CG2-CB 3.77Å; V872-V1023 HydrophobicContact CG1-CG2 3.97Å; V872-V1023 HydrophobicContact CG2-CG2 3.91Å; V872-L1032 HydrophobicContact CG1-CB 4.28Å; V872-L1032 HydrophobicContact CG1-CD2 4.08Å; V872-S1033 WeakPolarHBondContact CA-O 3.23Å
873	T	94.8	Very high	87.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.6	171.6	-51.1	0	0	0	0	111.1	R875 G1005 L1032 S1033 G1035 C1036 K1037 Y1055	T873-R875 HydrophobicContact CG2-CG 3.95Å; T873-G1005 CarbonylContact C-O 3.53Å; T873-G1005 WeakPolarHBondContact CA-O 3.41Å; T873-L1032 CarbonylContact O-C 3.55Å; T873-L1032 WeakPolarHBondContact O-CA 3.48Å; T873-S1033 WeakPolarHBondContact CB-OG 3.26Å; T873-S1033 PolarHBondContact N-O 3.44Å; T873-S1033 PolarHBondContact O-N 3.11Å; T873-G1035 PolarHBondContact N-O 2.84Å; T873-G1035 PolarHBondContact OG1-O 3.06Å; T873-C1036 WeakPolarHBondContact OG1-CA 3.29Å; T873-K1037 PolarHBondContact OG1-N 2.83Å; T873-Y1055 HydrophobicContact CG2-CD1 3.58Å; T873-Y1055 HydrophobicContact CG2-CE1 4.01Å
874	F	94.6	Very high	86.2	Confident	16 Å²	16	39.6 Å²	39.6	7%	0.07	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	108.8	168.9	-68.3	-106	0	0	0	109.1	V872 A879 L881 Y1003 V1004 G1005 L1007 L1032	V872-F874 HydrophobicContact CG1-CE2 4.32Å; F874-A879 HydrophobicContact CD1-CB 4.08Å; F874-L881 HydrophobicContact CE1-CB 4.38Å; F874-L881 HydrophobicContact CZ-CB 4.05Å; F874-Y1003 HydrophobicContact CB-CD1 4.03Å; F874-Y1003 HydrophobicContact CB-CE1 4.46Å; F874-Y1003 WeakPolarHBondContact CB-O 3.19Å; F874-Y1003 HydrophobicContact CD1-CD1 4.48Å; F874-Y1003 AromaticContact CD2-CD1 3.87Å; F874-Y1003 HydrophobicContact CD2-CD1 3.87Å; F874-Y1003 AromaticContact CD2-CE1 3.99Å; F874-Y1003 HydrophobicContact CD2-CE1 3.99Å; F874-Y1003 HydrophobicContact CE2-CD1 4.49Å; F874-Y1003 AromaticContact CG-CD1 3.88Å; F874-Y1003 HydrophobicContact CG-CD1 3.88Å; F874-Y1003 HydrophobicContact CG-CE1 4.38Å; F874-V1004 WeakPolarHBondContact O-CA 3.25Å; F874-G1005 PolarHBondContact N-O 2.79Å; F874-G1005 PolarHBondContact O-N 2.86Å; F874-L1007 HydrophobicContact CE2-CB 4.06Å; F874-L1007 HydrophobicContact CE2-CD2 4.36Å; F874-L1032 HydrophobicContact CD1-CD2 3.45Å; F874-L1032 VanDerWaalsContact CD1-CD2 3.45Å; F874-L1032 HydrophobicContact CD2-CD2 4.25Å; F874-L1032 HydrophobicContact CE1-CD2 3.55Å; F874-L1032 HydrophobicContact CE2-CD2 4.33Å; F874-L1032 HydrophobicContact CG-CD2 3.81Å; F874-L1032 HydrophobicContact CZ-CD2 3.99Å
875	R	92.6	Very high	84.8	Confident	53 Å²	53	43 Å²	43	20%	0.2	23%	0.23	C	C	.	.			trans	-97.5	-11.4	-176.4	-60.7	177.5	-68.1	113.7	1.3	112.9	T873 G1031 L1032 S1056 E1278	T873-R875 HydrophobicContact CG2-CG 3.95Å; R875-G1031 PolarHBondContact N-O 2.02Å; R875-L1032 PolarHBondContact NH2-O 3.03Å; R875-S1056 WeakPolarHBondContact O-CA 3.18Å; R875-S1056 VanDerWaalsContact O-CB 3.26Å; R875-S1056 WeakPolarHBondContact O-CB 3.22Å; R875-E1278 IonicContact CZ-OE1 3.68Å; R875-E1278 VanDerWaalsContact CZ-OE1 3.28Å; R875-E1278 IonicContact CZ-OE2 2.72Å; R875-E1278 IonicContact NH1-OE1 2.64Å; R875-E1278 PolarHBondContact NH1-OE1 3.26Å; R875-E1278 IonicContact NH1-OE2 3.45Å; R875-E1278 IonicContact NH2-OE1 2.67Å; R875-E1278 PolarHBondContact NH2-OE1 2.75Å; R875-E1278 IonicContact NH2-OE2 3.48Å; R875-E1278 PolarHBondContact NH2-OE2 3.43Å
876	K	89.7	Confident	83.4	Confident	60 Å²	60	44.8 Å²	44.8	26%	0.261	24%	0.239	S	C	.	.	S	Bend	trans	-132.1	141.9	177.7	-63.5	-166.5	173.8	-145.3	0	110.3	D878 A879 Y1030 E1278	K876-D878 WeakPolarHBondContact CB-OD1 3.24Å; K876-D878 PolarHBondContact O-N 3.15Å; K876-A879 HydrophobicContact CB-CB 4.31Å; K876-A879 WeakPolarHBondContact O-CB 3.26Å; K876-A879 PolarHBondContact O-N 3.41Å; K876-Y1030 HydrophobicContact CD-CE1 4.38Å; K876-Y1030 HydrophobicContact CD-CE2 3.97Å; K876-E1278 PolarHBondContact NZ-O 3.31Å
877	L	88.4	Confident	81.9	Confident	92 Å²	92	49.7 Å²	49.7	48%	0.482	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-32.6	179	-68.6	167	0	0	0	111.9	A879 I902 G1002 V1004	L877-A879 VanDerWaalsContact C-N 3.34Å; L877-I902 HydrophobicContact CD2-CD1 3.57Å; L877-G1002 WeakPolarHBondContact CD2-O 3.43Å; L877-G1002 WeakPolarHBondContact O-CA 3.45Å; L877-V1004 HydrophobicContact CD2-CG1 3.84Å; L877-V1004 HydrophobicContact CD2-CG2 4.35Å; L877-V1004 HydrophobicContact CG-CG1 4.11Å
878	D	86.1	Confident	80.7	Confident	62 Å²	62	49.4 Å²	49.4	33%	0.332	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	11.9	178.4	68.8	-34.6	0	0	0	113.3	K876 Y1030 R1280	K876-D878 WeakPolarHBondContact CB-OD1 3.24Å; K876-D878 PolarHBondContact O-N 3.15Å; D878-Y1030 VanDerWaalsContact CG-OH 3.23Å; D878-Y1030 WeakPolarHBondContact OD1-CE1 3.15Å; D878-Y1030 PolarHBondContact OD1-OH 3.29Å; D878-Y1030 VanDerWaalsContact OD2-CE1 3.28Å; D878-Y1030 WeakPolarHBondContact OD2-CE1 3.39Å; D878-Y1030 PolarHBondContact OD2-OH 3.47Å; D878-R1280 PolarHBondContact O-NH2 3.38Å
879	A	87.8	Confident	79.3	Confident	12 Å²	12	53.1 Å²	53.1	10%	0.099	27%	0.269	C	S	.	.			trans	-71.7	142.2	171.4	0	0	0	0	0	110.5	F874 K876 L877 L1032	F874-A879 HydrophobicContact CD1-CB 4.08Å; K876-A879 HydrophobicContact CB-CB 4.31Å; K876-A879 WeakPolarHBondContact O-CB 3.26Å; K876-A879 PolarHBondContact O-N 3.41Å; L877-A879 VanDerWaalsContact C-N 3.34Å; A879-L1032 HydrophobicContact CB-CD2 4.02Å; A879-L1032 HydrophobicContact CB-CG 4.49Å
880	N	85.4	Confident	78.1	Confident	46 Å²	46	50.2 Å²	50.2	25%	0.246	25%	0.252	C	S	.	.			trans	-138.6	149.6	175.9	62.7	20.9	0	0	0	110.8
881	L	86.1	Confident	77.1	Confident	28 Å²	28	51.9 Å²	51.9	15%	0.147	27%	0.267	C	S	.	.			trans	-122.7	108.8	171.9	-179	66.8	0	0	0	107.4	F874 L883 M1019 L1022 V1023 Y1028 L1032	F874-L881 HydrophobicContact CE1-CB 4.38Å; F874-L881 HydrophobicContact CZ-CB 4.05Å; L881-L883 HydrophobicContact CD2-CD2 4.31Å; L881-L883 HydrophobicContact CG-CD2 4.38Å; L881-M1019 HydrophobicContact CD2-CB 3.73Å; L881-M1019 HydrophobicContact CD2-CG 3.7Å; L881-M1019 HydrophobicContact CD2-SD 4.24Å; L881-L1022 HydrophobicContact CD1-CB 4.23Å; L881-L1022 HydrophobicContact CD1-CD1 4.16Å; L881-V1023 HydrophobicContact CD1-CG2 4.48Å; L881-Y1028 HydrophobicContact CD1-CD2 3.7Å; L881-Y1028 HydrophobicContact CD1-CE2 4.44Å; L881-Y1028 HydrophobicContact CD1-CG 4.17Å; L881-L1032 HydrophobicContact CB-CD1 4.19Å; L881-L1032 HydrophobicContact CD1-CD1 4.08Å
882	E	81.1	Confident	76.5	Confident	95 Å²	95	52.3 Å²	52.3	44%	0.444	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-84.9	118.5	177.9	-67.6	-178.2	-176.9	0	0	109.8	Y1028	E882-Y1028 HydrophobicContact CB-CE1 4.09Å; E882-Y1028 WeakPolarHBondContact CB-OH 3.43Å; E882-Y1028 WeakPolarHBondContact O-CE2 3.2Å
883	L	78.6	Confident	76	Confident	49 Å²	49	53.1 Å²	53.1	26%	0.257	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-88.2	155.2	175.9	-59.6	175.1	0	0	0	110.4	L881 M908 L1010 I1012 Q1017 M1019 L1022	L881-L883 HydrophobicContact CD2-CD2 4.31Å; L881-L883 HydrophobicContact CG-CD2 4.38Å; L883-M908 HydrophobicContact CD1-CE 4.1Å; L883-L1010 HydrophobicContact CD1-CD2 3.43Å; L883-L1010 VanDerWaalsContact CD1-CD2 3.43Å; L883-I1012 HydrophobicContact CD1-CD1 4.37Å; L883-Q1017 HydrophobicContact CD2-CB 4.44Å; L883-M1019 HydrophobicContact CD2-CG 4.43Å; L883-L1022 HydrophobicContact CD2-CD1 4.32Å
884	P	69.8	Low	75.6	Confident	78 Å²	78	53.3 Å²	53.3	51%	0.506	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-54	150.5	173.1	-24.3	34.2	0	0	0	112.3	L886	P884-L886 PolarHBondContact O-N 3.1Å
885	P	62.2	Low	75.4	Confident	80 Å²	80	53.7 Å²	53.7	52%	0.519	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-62.3	127	175	25.8	-32.8	0	0	0	110.1
886	L	58.5	Low	75.4	Confident	51 Å²	51	51.2 Å²	51.2	27%	0.267	27%	0.269	S	S	.	.			trans	-105.6	127.1	179.8	-69.4	157.4	0	0	0	109.2	P884 V989 I1012	P884-L886 PolarHBondContact O-N 3.1Å; L886-V989 WeakPolarHBondContact O-CB 3.43Å; L886-V989 VanDerWaalsContact O-CG2 3.28Å; L886-V989 WeakPolarHBondContact O-CG2 3.49Å; L886-I1012 HydrophobicContact CD1-CB 4.17Å; L886-I1012 HydrophobicContact CD1-CD1 3.42Å; L886-I1012 VanDerWaalsContact CD1-CD1 3.42Å; L886-I1012 HydrophobicContact CD1-CG1 4.37Å; L886-I1012 HydrophobicContact CD1-CG2 3.84Å
887	Y	52.8	Low	75.6	Confident	165 Å²	165	48.7 Å²	48.7	65%	0.647	26%	0.258	S	S	*	.			trans	-92.5	116.8	171.8	-59.7	-83.9	0	0	0	108.2	N991	Y887-N991 PolarHBondContact OH-ND2 2.96Å; Y887-N991 VanDerWaalsContact OH-ND2 3.16Å
888	S	54.1	Low	75.9	Confident	8 Å²	8	44.3 Å²	44.3	6%	0.056	24%	0.235	C	C	.	.			trans	-129.6	113.7	168.8	161.8	0	0	0	0	107	A891 F987	S888-A891 PolarHBondContact OG-O 3.13Å; S888-F987 CarbonylContact O-C 3.42Å; S888-F987 WeakPolarHBondContact O-CB 3.31Å; S888-F987 WeakPolarHBondContact O-CD1 3.39Å
889	E	49.6	Very low	76.4	Confident	115 Å²	115	44.2 Å²	44.2	54%	0.537	23%	0.23	S	C	.	.	S	Bend	trans	-83.4	-44.7	-179.2	-70.8	-169.5	170.4	0	0	112.3	S986 F987	E889-S986 CarbonylContact O-C 3.51Å; E889-S986 VanDerWaalsContact O-C 3.24Å; E889-S986 WeakPolarHBondContact O-CA 3.38Å; E889-S986 WeakPolarHBondContact O-CB 3.48Å; E889-F987 CarbonylContact C-O 3.58Å; E889-F987 VanDerWaalsContact CA-O 3.24Å; E889-F987 WeakPolarHBondContact CA-O 3.17Å; E889-F987 PolarHBondContact O-N 2.8Å; E889-F987 VanDerWaalsContact O-O 3.07Å
890	F	54.4	Low	76.7	Confident	23 Å²	23	43.6 Å²	43.6	10%	0.101	23%	0.225	C	C	.	.	S	Bend	trans	-138.3	-18.9	-170.6	-63.1	-85.3	0	0	0	115.7	D136 S986	D136-F890 HydrophobicContact CB-CE2 4.13Å; D136-F890 WeakPolarHBondContact OD2-CD2 3.1Å; D136-F890 WeakPolarHBondContact OD2-CE2 3.05Å; D136-F890 WeakPolarHBondContact OD2-CZ 3.45Å; F890-S986 VanDerWaalsContact CD1-CA 3.5Å
891	A	66.4	Low	77.2	Confident	45 Å²	45	42.5 Å²	42.5	37%	0.372	22%	0.22	S	C	.	.			trans	-132.8	129.4	178	0	0	0	0	0	108.4	S888 R962	S888-A891 PolarHBondContact OG-O 3.13Å; A891-R962 VanDerWaalsContact CA-O 3.3Å; A891-R962 WeakPolarHBondContact CA-O 3.31Å
892	F	79	Confident	77.5	Confident	21 Å²	21	42.8 Å²	42.8	9%	0.092	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	113.5	177	175.9	-94.5	0	0	0	107.7	M894 F919 F960 E961 R962 I1012 N1013	F892-M894 HydrophobicContact CE1-CB 3.78Å; F892-M894 HydrophobicContact CE1-CE 4.36Å; F892-M894 HydrophobicContact CZ-CB 3.86Å; F892-M894 HydrophobicContact CZ-CE 4.49Å; F892-M894 HydrophobicContact CZ-SD 4.18Å; F892-F919 HydrophobicContact CD1-CE2 4.39Å; F892-F919 HydrophobicContact CE1-CD2 4.42Å; F892-F919 HydrophobicContact CE1-CE1 4.29Å; F892-F919 AromaticContact CE1-CE2 3.72Å; F892-F919 HydrophobicContact CE1-CE2 3.72Å; F892-F919 AromaticContact CE1-CZ 3.66Å; F892-F919 HydrophobicContact CE1-CZ 3.66Å; F892-F919 HydrophobicContact CZ-CE1 4.27Å; F892-F919 HydrophobicContact CZ-CE2 4.4Å; F892-F919 HydrophobicContact CZ-CZ 4.09Å; F892-F960 AromaticContact CD1-CD1 3.62Å; F892-F960 HydrophobicContact CD1-CD1 3.62Å; F892-F960 AromaticContact CD1-CE1 3.54Å; F892-F960 HydrophobicContact CD1-CE1 3.54Å; F892-F960 AromaticContact CE1-CD1 3.62Å; F892-F960 HydrophobicContact CE1-CD1 3.62Å; F892-F960 AromaticContact CE1-CE1 3.82Å; F892-F960 HydrophobicContact CE1-CE1 3.82Å; F892-E961 CarbonylContact O-C 3.52Å; F892-E961 WeakPolarHBondContact O-CA 3.29Å; F892-R962 PolarHBondContact N-O 2.02Å; F892-R962 PolarHBondContact O-N 3.38Å; F892-I1012 HydrophobicContact CD2-CG2 4.36Å; F892-I1012 HydrophobicContact CE2-CG2 3.74Å; F892-I1012 HydrophobicContact CZ-CG2 4.41Å; F892-N1013 WeakPolarHBondContact CA-OD1 3.49Å
893	D	83.3	Confident	78.1	Confident	17 Å²	17	41.1 Å²	41.1	9%	0.091	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	142.1	168.2	61.3	86.8	0	0	0	109.6	H646 F960 E961 I1012 N1013 G1014	H646-D893 IonicContact CE1-OD2 3.19Å; D893-F960 CarbonylContact C-O 3.55Å; D893-F960 WeakPolarHBondContact CA-O 3.49Å; D893-E961 HydrophobicContact CB-CG 4.41Å; D893-I1012 WeakPolarHBondContact O-CA 3.29Å; D893-N1013 PolarHBondContact N-OD1 2.93Å; D893-N1013 PolarHBondContact O-N 3.22Å; D893-N1013 WeakPolarHBondContact OD1-CA 3.42Å; D893-N1013 PolarHBondContact OD1-N 3.39Å; D893-N1013 VanDerWaalsContact OD1-N 3.15Å; D893-N1013 WeakPolarHBondContact OD2-CA 3.47Å; D893-G1014 PolarHBondContact OD1-N 2.76Å
894	M	87.5	Confident	78.8	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.015	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	132.4	176.6	177.4	176.8	63.4	0	0	109.2	F892 F896 M908 F919 V921 F960 L1010 L1011 I1012	F892-M894 HydrophobicContact CE1-CB 3.78Å; F892-M894 HydrophobicContact CE1-CE 4.36Å; F892-M894 HydrophobicContact CZ-CB 3.86Å; F892-M894 HydrophobicContact CZ-CE 4.49Å; F892-M894 HydrophobicContact CZ-SD 4.18Å; M894-F896 HydrophobicContact CE-CD1 4.34Å; M894-F896 HydrophobicContact CE-CE1 3.97Å; M894-F896 HydrophobicContact CG-CD1 4.21Å; M894-F896 HydrophobicContact SD-CD1 4.31Å; M894-F896 HydrophobicContact SD-CE1 4.44Å; M894-M908 HydrophobicContact CE-SD 4.31Å; M894-M908 HydrophobicContact SD-CE 3.92Å; M894-M908 HydrophobicContact SD-SD 3.4Å; M894-F919 HydrophobicContact CE-CE1 3.67Å; M894-F919 HydrophobicContact CE-CZ 3.45Å; M894-F919 VanDerWaalsContact CE-CZ 3.45Å; M894-F919 HydrophobicContact SD-CE1 4.39Å; M894-V921 HydrophobicContact CE-CG2 3.71Å; M894-F960 PolarHBondContact N-O 2.59Å; M894-F960 PolarHBondContact O-N 3.35Å; M894-L1010 HydrophobicContact CG-CD1 3.98Å; M894-L1010 HydrophobicContact SD-CD1 4.13Å; M894-L1011 CarbonylContact C-O 3.55Å; M894-L1011 VanDerWaalsContact CA-O 3.27Å; M894-L1011 WeakPolarHBondContact CA-O 3.38Å; M894-I1012 HydrophobicContact CG-CG1 4.09Å; M894-I1012 HydrophobicContact SD-CG1 4.48Å
895	S	90	Very high	79.9	Confident	24 Å²	24	38.1 Å²	38.1	17%	0.168	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	146	168.7	64.6	0	0	0	0	110.6	V958 N1009 L1010 L1011	S895-V958 WeakPolarHBondContact CA-O 3.16Å; S895-N1009 VanDerWaalsContact O-O 3.12Å; S895-L1010 CarbonylContact O-C 3.5Å; S895-L1010 WeakPolarHBondContact O-CA 3.23Å; S895-L1011 PolarHBondContact N-O 3.12Å; S895-L1011 PolarHBondContact O-N 2.7Å; S895-L1011 WeakPolarHBondContact OG-CB 3.37Å
896	F	92.6	Very high	81.3	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.009	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	163.9	174.2	63	-90.3	0	0	0	109.4	M894 F898 I907 V921 V958 L1007 L1010	M894-F896 HydrophobicContact CE-CD1 4.34Å; M894-F896 HydrophobicContact CE-CE1 3.97Å; M894-F896 HydrophobicContact CG-CD1 4.21Å; M894-F896 HydrophobicContact SD-CD1 4.31Å; M894-F896 HydrophobicContact SD-CE1 4.44Å; F896-F898 HydrophobicContact CD2-CB 4.32Å; F896-F898 HydrophobicContact CD2-CD1 4.34Å; F896-F898 HydrophobicContact CE2-CB 4.23Å; F896-F898 AromaticContact CE2-CD1 3.77Å; F896-F898 HydrophobicContact CE2-CD1 3.77Å; F896-F898 HydrophobicContact CE2-CG 4.36Å; F896-I907 HydrophobicContact CE2-CD1 4.17Å; F896-I907 HydrophobicContact CE2-CG2 4.02Å; F896-I907 HydrophobicContact CZ-CD1 4.23Å; F896-I907 HydrophobicContact CZ-CG2 4.15Å; F896-V921 HydrophobicContact CE1-CG1 4.42Å; F896-V921 HydrophobicContact CZ-CG1 4.04Å; F896-V958 HydrophobicContact CD1-CB 4.24Å; F896-V958 HydrophobicContact CD1-CG1 4.44Å; F896-V958 HydrophobicContact CD2-CB 4.34Å; F896-V958 HydrophobicContact CD2-CG2 4.46Å; F896-V958 HydrophobicContact CE1-CB 3.86Å; F896-V958 HydrophobicContact CE1-CG1 3.74Å; F896-V958 HydrophobicContact CE1-CG2 4.46Å; F896-V958 HydrophobicContact CE2-CB 3.98Å; F896-V958 HydrophobicContact CE2-CG2 3.81Å; F896-V958 HydrophobicContact CG-CB 4.47Å; F896-V958 HydrophobicContact CZ-CB 3.72Å; F896-V958 HydrophobicContact CZ-CG1 3.81Å; F896-V958 HydrophobicContact CZ-CG2 3.81Å; F896-V958 PolarHBondContact N-O 2.86Å; F896-V958 PolarHBondContact O-N 3.47Å; F896-L1007 HydrophobicContact CB-CD1 4.21Å; F896-L1007 HydrophobicContact CD2-CD1 3.42Å; F896-L1007 VanDerWaalsContact CD2-CD1 3.42Å; F896-L1007 HydrophobicContact CE2-CD1 4.03Å; F896-L1007 HydrophobicContact CG-CD1 4.04Å; F896-L1010 HydrophobicContact CB-CB 4.42Å; F896-L1010 HydrophobicContact CB-CD1 3.94Å; F896-L1010 HydrophobicContact CD1-CD1 4.34Å
897	I	94.1	Very high	82.9	Confident	7 Å²	7	33.8 Å²	33.8	4%	0.036	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	144.1	170	69.3	177.1	0	0	0	109.9	L659 F868 W955 H956 V957 S1008 N1009	L659-I897 HydrophobicContact CD1-CD1 4.39Å; F868-I897 HydrophobicContact CD1-CD1 4.1Å; F868-I897 HydrophobicContact CE1-CD1 3.81Å; I897-W955 HydrophobicContact CB-CE3 4.19Å; I897-W955 HydrophobicContact CD1-CD2 4.25Å; I897-W955 HydrophobicContact CD1-CE3 3.87Å; I897-W955 HydrophobicContact CD1-CZ3 4.17Å; I897-W955 HydrophobicContact CG1-CE3 3.76Å; I897-W955 HydrophobicContact CG1-CZ3 3.85Å; I897-H956 CarbonylContact C-O 3.52Å; I897-H956 WeakPolarHBondContact CA-O 3.45Å; I897-H956 WeakPolarHBondContact CB-O 3.42Å; I897-V957 HydrophobicContact CG2-CB 4.25Å; I897-V957 HydrophobicContact CG2-CG1 4.29Å; I897-V957 HydrophobicContact CG2-CG2 3.78Å; I897-S1008 PolarHBondContact N-O 2.85Å; I897-S1008 PolarHBondContact O-N 2.84Å; I897-N1009 HydrophobicContact CD1-CB 4.49Å; I897-N1009 HydrophobicContact CG1-CB 4.19Å
898	F	95.5	Very high	84.6	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	154.3	-179.7	76.5	-87.2	0	0	0	111.3	F896 T900 I907 I923 L929 L950 W955 H956 V958 C1006 L1007	F896-F898 HydrophobicContact CD2-CB 4.32Å; F896-F898 HydrophobicContact CD2-CD1 4.34Å; F896-F898 HydrophobicContact CE2-CB 4.23Å; F896-F898 AromaticContact CE2-CD1 3.77Å; F896-F898 HydrophobicContact CE2-CD1 3.77Å; F896-F898 HydrophobicContact CE2-CG 4.36Å; F898-T900 HydrophobicContact CD2-CG2 3.87Å; F898-T900 HydrophobicContact CE2-CG2 3.82Å; F898-I907 HydrophobicContact CD1-CD1 4.49Å; F898-I923 HydrophobicContact CD2-CD1 3.93Å; F898-I923 HydrophobicContact CE2-CD1 3.39Å; F898-I923 HydrophobicContact CE2-CG1 4.25Å; F898-I923 HydrophobicContact CZ-CD1 3.95Å; F898-I923 HydrophobicContact CZ-CG1 4.33Å; F898-L929 HydrophobicContact CE1-CD1 4.22Å; F898-L929 HydrophobicContact CZ-CD1 4.42Å; F898-L950 HydrophobicContact CE2-CB 4.34Å; F898-L950 WeakPolarHBondContact CE2-O 3.35Å; F898-L950 HydrophobicContact CZ-CB 4.05Å; F898-L950 HydrophobicContact CZ-CD1 4.47Å; F898-L950 HydrophobicContact CZ-CD2 4.48Å; F898-W955 CarbonylContact O-C 3.29Å; F898-W955 WeakPolarHBondContact O-CA 3.29Å; F898-H956 HydrophobicContact CD1-CB 4.1Å; F898-H956 HydrophobicContact CE1-CB 3.64Å; F898-H956 HydrophobicContact CE2-CB 4.3Å; F898-H956 HydrophobicContact CZ-CB 3.76Å; F898-H956 PolarHBondContact N-O 2.83Å; F898-H956 PolarHBondContact O-N 2.83Å; F898-V958 HydrophobicContact CD1-CG2 3.77Å; F898-V958 HydrophobicContact CE1-CG2 3.53Å; F898-C1006 WeakPolarHBondContact CA-O 2.99Å; F898-L1007 HydrophobicContact CB-CD1 4.24Å
899	R	94.6	Very high	86.1	Confident	59 Å²	59	29.8 Å²	29.8	22%	0.223	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	121.7	175.2	175.8	-175.4	173.5	162.3	12.6	107.9	N953 R954 W955 Y1003 G1005 C1006 Y1055	R899-N953 PolarHBondContact NE-O 2.92Å; R899-N953 PolarHBondContact NE-OD1 3.22Å; R899-N953 PolarHBondContact NH2-ND2 2.98Å; R899-N953 PolarHBondContact NH2-O 2.76Å; R899-N953 PolarHBondContact NH2-OD1 3.1Å; R899-R954 WeakPolarHBondContact CA-O 3.27Å; R899-R954 WeakPolarHBondContact CB-O 3.18Å; R899-R954 WeakPolarHBondContact CG-O 3.05Å; R899-W955 HydrophobicContact CB-CD2 3.81Å; R899-W955 HydrophobicContact CB-CE3 3.66Å; R899-W955 HydrophobicContact CB-CG 4.39Å; R899-W955 HydrophobicContact CB-CH2 4.39Å; R899-W955 HydrophobicContact CB-CZ3 3.96Å; R899-Y1003 PolarHBondContact O-OH 3.44Å; R899-G1005 CarbonylContact O-C 3.59Å; R899-G1005 WeakPolarHBondContact O-CA 3.16Å; R899-C1006 HydrophobicContact CB-CB 4.3Å; R899-C1006 PolarHBondContact N-O 3.04Å; R899-C1006 PolarHBondContact O-N 3.04Å; R899-Y1055 VanDerWaalsContact CD-OH 3.26Å; R899-Y1055 WeakPolarHBondContact CD-OH 3.29Å; R899-Y1055 VanDerWaalsContact CG-OH 3.28Å; R899-Y1055 WeakPolarHBondContact CG-OH 3.49Å; R899-Y1055 PolarHBondContact NE-OH 3.39Å
900	T	95.7	Very high	87.4	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.146	C	C	.	.			trans	-149.7	168	-173.9	-171.6	0	0	0	0	112	F898 I902 I923 N951 N953 Y1003 V1004	F898-T900 HydrophobicContact CD2-CG2 3.87Å; F898-T900 HydrophobicContact CE2-CG2 3.82Å; T900-I902 HydrophobicContact CG2-CG2 4.4Å; T900-I902 WeakPolarHBondContact OG1-CG2 3.49Å; T900-I902 PolarHBondContact OG1-N 3.43Å; T900-I923 HydrophobicContact CG2-CD1 3.61Å; T900-N951 HydrophobicContact CG2-CB 4.32Å; T900-N951 CarbonylContact O-C 3.29Å; T900-N951 VanDerWaalsContact O-CA 3.26Å; T900-N951 WeakPolarHBondContact O-CA 3.32Å; T900-N953 WeakPolarHBondContact O-CA 3.33Å; T900-N953 PolarHBondContact O-N 2.89Å; T900-N953 VanDerWaalsContact O-N 3.08Å; T900-Y1003 HydrophobicContact CG2-CE2 4.2Å; T900-V1004 WeakPolarHBondContact CB-O 3.36Å; T900-V1004 PolarHBondContact OG1-O 2.88Å
901	T	95.2	Very high	88.1	Confident	23 Å²	23	28.8 Å²	28.8	14%	0.141	16%	0.157	C	C	.	.			trans	-120.9	-0.8	172	52.3	0	0	0	0	112.7	N951 N953 E1053 Y1054 Y1055	T901-N951 WeakPolarHBondContact CA-O 3.16Å; T901-N951 PolarHBondContact O-ND2 2.89Å; T901-N953 HydrophobicContact CG2-CB 3.69Å; T901-E1053 WeakPolarHBondContact CG2-O 3.33Å; T901-E1053 PolarHBondContact OG1-O 2.89Å; T901-Y1054 WeakPolarHBondContact OG1-CA 3.22Å; T901-Y1055 HydrophobicContact CG2-CE2 4.43Å
902	I	93.6	Very high	87.9	Confident	33 Å²	33	27 Å²	27	17%	0.169	14%	0.143	C	C	.	.			trans	-84.4	140.3	178.6	-158.1	164	0	0	0	111.9	L877 T900 A905 N951 V1004	L877-I902 HydrophobicContact CD2-CD1 3.57Å; T900-I902 HydrophobicContact CG2-CG2 4.4Å; T900-I902 WeakPolarHBondContact OG1-CG2 3.49Å; T900-I902 PolarHBondContact OG1-N 3.43Å; I902-A905 HydrophobicContact CD1-CB 4.26Å; I902-A905 HydrophobicContact CG2-CB 3.54Å; I902-N951 WeakPolarHBondContact O-CB 3.45Å; I902-V1004 HydrophobicContact CB-CG2 4.09Å; I902-V1004 HydrophobicContact CD1-CG2 4.16Å
903	T	92.9	Very high	86.5	Confident	61 Å²	61	32.7 Å²	32.7	37%	0.374	16%	0.164	S	C	.	.	S	Bend	trans	-82.5	-31.9	-179	59.5	0	0	0	0	113.3	R924 N925 G926	T903-R924 CarbonylContact O-C 3.45Å; T903-N925 PolarHBondContact O-N 3.1Å; T903-G926 WeakPolarHBondContact O-CA 3.21Å; T903-G926 PolarHBondContact O-N 2.92Å
904	D	93.3	Very high	85	Confident	63 Å²	63	34.6 Å²	34.6	34%	0.337	18%	0.182	S	C	.	.	S	Bend	trans	-139.9	115.1	-174.4	-63.6	-86.6	0	0	0	109.9	I923 R924 N925	D904-I923 WeakPolarHBondContact CA-O 3.37Å; D904-R924 VanDerWaalsContact OD1-CA 3.31Å; D904-R924 WeakPolarHBondContact OD1-CA 3.4Å; D904-N925 PolarHBondContact OD1-N 3.49Å
905	A	92	Very high	83.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	145.2	-178.5	0	0	0	0	0	112.4	I902 R922 I923 G1002 Y1003	I902-A905 HydrophobicContact CD1-CB 4.26Å; I902-A905 HydrophobicContact CG2-CB 3.54Å; A905-R922 CarbonylContact O-C 3.51Å; A905-R922 VanDerWaalsContact O-CA 3.23Å; A905-R922 WeakPolarHBondContact O-CA 2.97Å; A905-R922 WeakPolarHBondContact O-CG 3.49Å; A905-I923 PolarHBondContact N-O 2.83Å; A905-I923 VanDerWaalsContact N-O 3.16Å; A905-I923 PolarHBondContact O-N 2.82Å; A905-G1002 WeakPolarHBondContact CB-O 3.37Å; A905-Y1003 HydrophobicContact CB-CD2 4.15Å
906	V	91.9	Very high	81.9	Confident	18 Å²	18	43.2 Å²	43.2	11%	0.109	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	115.1	165.5	178.2	0	0	0	0	108.4	Q909 E920 D1001 Y1003	V906-Q909 HydrophobicContact CG1-CB 3.98Å; V906-Q909 HydrophobicContact CG1-CG 4.2Å; V906-E920 HydrophobicContact CG1-CG 4.05Å; V906-E920 HydrophobicContact CG2-CG 4.36Å; V906-D1001 HydrophobicContact CG2-CB 4.11Å; V906-D1001 PolarHBondContact N-O 3.49Å; V906-Y1003 WeakPolarHBondContact O-CB 3.36Å
907	I	91.6	Very high	80.5	Confident	22 Å²	22	44.5 Å²	44.5	11%	0.113	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	-45.1	177	-62.4	163.9	0	0	0	110	F896 F898 V921 I923 L929 Y1003 L1007	F896-I907 HydrophobicContact CE2-CD1 4.17Å; F896-I907 HydrophobicContact CE2-CG2 4.02Å; F896-I907 HydrophobicContact CZ-CD1 4.23Å; F896-I907 HydrophobicContact CZ-CG2 4.15Å; F898-I907 HydrophobicContact CD1-CD1 4.49Å; I907-V921 HydrophobicContact CD1-CG1 4.42Å; I907-V921 PolarHBondContact N-O 3.46Å; I907-I923 HydrophobicContact CD1-CD1 3.87Å; I907-I923 HydrophobicContact CD1-CG1 3.57Å; I907-I923 HydrophobicContact CG1-CD1 4.28Å; I907-I923 HydrophobicContact CG1-CG1 4.15Å; I907-L929 HydrophobicContact CD1-CD1 3.85Å; I907-Y1003 HydrophobicContact CG1-CD2 3.86Å; I907-Y1003 HydrophobicContact CG1-CE2 4.09Å; I907-L1007 HydrophobicContact CG2-CD1 4.18Å
908	M	89.1	Confident	79.6	Confident	34 Å²	34	46.5 Å²	46.5	17%	0.167	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	142.3	-176.5	-175.1	176.9	-71.3	0	0	110.2	L883 M894 F919 E920 V921 L1010	L883-M908 HydrophobicContact CD1-CE 4.1Å; M894-M908 HydrophobicContact CE-SD 4.31Å; M894-M908 HydrophobicContact SD-CE 3.92Å; M894-M908 HydrophobicContact SD-SD 3.4Å; M908-F919 HydrophobicContact SD-CE1 4.32Å; M908-E920 CarbonylContact O-C 3.45Å; M908-E920 WeakPolarHBondContact O-CA 3.38Å; M908-V921 HydrophobicContact CB-CB 4.42Å; M908-V921 HydrophobicContact CB-CG2 4.5Å; M908-V921 PolarHBondContact N-O 2.95Å; M908-V921 PolarHBondContact O-N 3.49Å; M908-L1010 HydrophobicContact CE-CD1 3.78Å; M908-L1010 HydrophobicContact CE-CD2 3.66Å; M908-L1010 HydrophobicContact CE-CG 4.4Å
909	Q	85.1	Confident	79	Confident	55 Å²	55	47 Å²	47	26%	0.257	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	157	173.3	64.6	174.7	29.9	0	0	112.9	V906 N911 F919 F999	V906-Q909 HydrophobicContact CG1-CB 3.98Å; V906-Q909 HydrophobicContact CG1-CG 4.2Å; Q909-N911 PolarHBondContact NE2-ND2 3.12Å; Q909-N911 VanDerWaalsContact NE2-ND2 3.11Å; Q909-F919 CarbonylContact C-O 3.54Å; Q909-F919 WeakPolarHBondContact CA-O 3.2Å; Q909-F999 HydrophobicContact CG-CE1 4.19Å
910	N	78	Confident	78.6	Confident	55 Å²	55	46.3 Å²	46.3	29%	0.294	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	123.3	169.2	-171.6	-32.8	0	0	0	109.2	F918 F919 V989	N910-F918 VanDerWaalsContact O-CA 3.23Å; N910-F918 WeakPolarHBondContact O-CA 3.44Å; N910-F918 WeakPolarHBondContact O-CB 3.49Å; N910-F919 HydrophobicContact CB-CB 4.19Å; N910-F919 PolarHBondContact N-O 2.03Å; N910-F919 PolarHBondContact O-N 2.97Å; N910-F919 VanDerWaalsContact O-N 3.11Å; N910-V989 WeakPolarHBondContact ND2-CG1 3.44Å
911	N	69.2	Low	78.5	Confident	63 Å²	63	46.3 Å²	46.3	34%	0.337	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	84	-174.9	-68.9	-26.8	0	0	0	111.3	Q909 R913	Q909-N911 PolarHBondContact NE2-ND2 3.12Å; Q909-N911 VanDerWaalsContact NE2-ND2 3.11Å; N911-R913 VanDerWaalsContact C-N 3.29Å; N911-R913 PolarHBondContact O-N 2.77Å
912	G	61	Low	78.4	Confident	6 Å²	6	47.3 Å²	47.3	6%	0.062	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	70.9	172.7	0	0	0	0	0	112.2	A914 S915 K916 Q917	G912-A914 VanDerWaalsContact C-N 3.27Å; G912-A914 PolarHBondContact O-N 2.74Å; G912-S915 PolarHBondContact O-N 2.87Å; G912-S915 PolarHBondContact O-OG 2.62Å; G912-K916 WeakPolarHBondContact O-CA 3.06Å; G912-K916 PolarHBondContact O-N 2.83Å; G912-Q917 WeakPolarHBondContact CA-O 3.3Å; G912-Q917 PolarHBondContact N-O 2.68Å; G912-Q917 PolarHBondContact O-N 2.86Å
913	R	50.4	Low	78.4	Confident	142 Å²	142	45.7 Å²	45.7	54%	0.536	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-37.1	-177.4	-84	-174	176.9	164.5	3.5	113.5	N911 Y995	N911-R913 VanDerWaalsContact C-N 3.29Å; N911-R913 PolarHBondContact O-N 2.77Å; R913-Y995 PolarHBondContact NH1-O 3.34Å
914	A	50.8	Low	78.4	Confident	57 Å²	57	47.7 Å²	47.7	47%	0.471	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-37.5	-180	0	0	0	0	0	113	G912 N992	G912-A914 VanDerWaalsContact C-N 3.27Å; G912-A914 PolarHBondContact O-N 2.74Å; A914-N992 HydrophobicContact CB-CB 4.47Å
915	S	54.7	Low	78.4	Confident	40 Å²	40	48.6 Å²	48.6	28%	0.28	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-11.1	-179.7	65.3	0	0	0	0	114.3	G912 Q917 A990	G912-S915 PolarHBondContact O-N 2.87Å; G912-S915 PolarHBondContact O-OG 2.62Å; S915-Q917 PolarHBondContact O-N 2.77Å; S915-Q917 WeakPolarHBondContact OG-CB 3.48Å; S915-Q917 PolarHBondContact OG-N 3.35Å; S915-Q917 PolarHBondContact OG-OE1 2.84Å; S915-A990 WeakPolarHBondContact OG-CB 3.42Å
916	K	58.6	Low	78.4	Confident	168 Å²	168	48.6 Å²	48.6	73%	0.73	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.8	12	-166.3	-55.7	-178.1	177	180	0	114.1	G912 N934	G912-K916 WeakPolarHBondContact O-CA 3.06Å; G912-K916 PolarHBondContact O-N 2.83Å; K916-N934 PolarHBondContact O-ND2 3.1Å
917	Q	63.4	Low	78.5	Confident	28 Å²	28	50 Å²	50	13%	0.131	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	137.1	173.2	-63.2	157	-30.2	0	0	108.7	G912 S915 N934 S988	G912-Q917 WeakPolarHBondContact CA-O 3.3Å; G912-Q917 PolarHBondContact N-O 2.68Å; G912-Q917 PolarHBondContact O-N 2.86Å; S915-Q917 PolarHBondContact O-N 2.77Å; S915-Q917 WeakPolarHBondContact OG-CB 3.48Å; S915-Q917 PolarHBondContact OG-N 3.35Å; S915-Q917 PolarHBondContact OG-OE1 2.84Å; Q917-N934 WeakPolarHBondContact CA-O 3.35Å; Q917-N934 WeakPolarHBondContact CB-O 3.13Å; Q917-N934 WeakPolarHBondContact CG-O 3.32Å; Q917-S988 PolarHBondContact OE1-O 2.83Å
918	F	74.5	Confident	78.7	Confident	49 Å²	49	49.2 Å²	49.2	22%	0.215	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	164.2	178.4	77.5	-91	0	0	0	110.6	N910 E920 A932 F933 N934 I939	N910-F918 VanDerWaalsContact O-CA 3.23Å; N910-F918 WeakPolarHBondContact O-CA 3.44Å; N910-F918 WeakPolarHBondContact O-CB 3.49Å; F918-E920 HydrophobicContact CD2-CB 4.47Å; F918-A932 HydrophobicContact CE2-CB 3.84Å; F918-A932 HydrophobicContact CZ-CB 4.34Å; F918-F933 CarbonylContact O-C 3.44Å; F918-F933 WeakPolarHBondContact O-CA 3.19Å; F918-F933 WeakPolarHBondContact O-CB 3.43Å; F918-N934 HydrophobicContact CD1-CB 3.71Å; F918-N934 HydrophobicContact CE1-CB 3.72Å; F918-N934 PolarHBondContact N-O 3.39Å; F918-N934 PolarHBondContact O-N 3.27Å; F918-I939 HydrophobicContact CE1-CD1 4.06Å; F918-I939 HydrophobicContact CE1-CG1 3.94Å; F918-I939 HydrophobicContact CE1-CG2 4.36Å; F918-I939 HydrophobicContact CZ-CD1 4.27Å; F918-I939 HydrophobicContact CZ-CG1 4.27Å; F918-I939 HydrophobicContact CZ-CG2 3.86Å
919	F	82.9	Confident	79	Confident	12 Å²	12	47.6 Å²	47.6	5%	0.053	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	133.4	173.4	177.4	-96.3	0	0	0	107.9	F892 M894 M908 Q909 N910 V921 V931 A932 F933 F960	F892-F919 HydrophobicContact CD1-CE2 4.39Å; F892-F919 HydrophobicContact CE1-CD2 4.42Å; F892-F919 HydrophobicContact CE1-CE1 4.29Å; F892-F919 AromaticContact CE1-CE2 3.72Å; F892-F919 HydrophobicContact CE1-CE2 3.72Å; F892-F919 AromaticContact CE1-CZ 3.66Å; F892-F919 HydrophobicContact CE1-CZ 3.66Å; F892-F919 HydrophobicContact CZ-CE1 4.27Å; F892-F919 HydrophobicContact CZ-CE2 4.4Å; F892-F919 HydrophobicContact CZ-CZ 4.09Å; M894-F919 HydrophobicContact CE-CE1 3.67Å; M894-F919 HydrophobicContact CE-CZ 3.45Å; M894-F919 VanDerWaalsContact CE-CZ 3.45Å; M894-F919 HydrophobicContact SD-CE1 4.39Å; M908-F919 HydrophobicContact SD-CE1 4.32Å; Q909-F919 CarbonylContact C-O 3.54Å; Q909-F919 WeakPolarHBondContact CA-O 3.2Å; N910-F919 HydrophobicContact CB-CB 4.19Å; N910-F919 PolarHBondContact N-O 2.03Å; N910-F919 PolarHBondContact O-N 2.97Å; N910-F919 VanDerWaalsContact O-N 3.11Å; F919-V921 HydrophobicContact CE1-CG2 3.51Å; F919-V921 HydrophobicContact CZ-CG2 3.53Å; F919-V931 HydrophobicContact CD2-CG1 4.34Å; F919-V931 HydrophobicContact CE2-CG1 3.55Å; F919-V931 HydrophobicContact CZ-CG1 3.94Å; F919-A932 CarbonylContact C-O 3.25Å; F919-A932 WeakPolarHBondContact CA-O 3.42Å; F919-F933 HydrophobicContact CD2-CB 4.04Å; F919-F960 HydrophobicContact CE2-CD1 4.02Å; F919-F960 AromaticContact CE2-CE1 3.6Å; F919-F960 HydrophobicContact CE2-CE1 3.6Å; F919-F960 HydrophobicContact CE2-CZ 4.07Å; F919-F960 HydrophobicContact CZ-CD1 4.25Å; F919-F960 HydrophobicContact CZ-CE1 4.29Å
920	E	87.4	Confident	79.4	Confident	44 Å²	44	49 Å²	49	21%	0.206	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	133	179.4	-176.1	-177.4	119.3	0	0	109.8	V906 M908 F918 R922 V931 A932	V906-E920 HydrophobicContact CG1-CG 4.05Å; V906-E920 HydrophobicContact CG2-CG 4.36Å; M908-E920 CarbonylContact O-C 3.45Å; M908-E920 WeakPolarHBondContact O-CA 3.38Å; F918-E920 HydrophobicContact CD2-CB 4.47Å; E920-R922 IonicContact OE1-CZ 3.98Å; E920-R922 IonicContact OE1-NE 3.66Å; E920-R922 PolarHBondContact OE1-NE 2.83Å; E920-R922 IonicContact OE1-NH2 3.05Å; E920-V931 CarbonylContact O-C 3.59Å; E920-V931 VanDerWaalsContact O-CA 3.28Å; E920-V931 WeakPolarHBondContact O-CA 3.36Å; E920-A932 HydrophobicContact CB-CB 4.47Å; E920-A932 PolarHBondContact N-O 3.41Å; E920-A932 PolarHBondContact O-N 3.18Å
921	V	92.8	Very high	80.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.1	168.3	-173.4	0	0	0	0	109.1	M894 F896 I907 M908 F919 L929 R930 V931	M894-V921 HydrophobicContact CE-CG2 3.71Å; F896-V921 HydrophobicContact CE1-CG1 4.42Å; F896-V921 HydrophobicContact CZ-CG1 4.04Å; I907-V921 HydrophobicContact CD1-CG1 4.42Å; I907-V921 PolarHBondContact N-O 3.46Å; M908-V921 HydrophobicContact CB-CB 4.42Å; M908-V921 HydrophobicContact CB-CG2 4.5Å; M908-V921 PolarHBondContact N-O 2.95Å; M908-V921 PolarHBondContact O-N 3.49Å; F919-V921 HydrophobicContact CE1-CG2 3.51Å; F919-V921 HydrophobicContact CZ-CG2 3.53Å; V921-L929 HydrophobicContact CG1-CD1 4.24Å; V921-L929 HydrophobicContact CG1-CD2 4.33Å; V921-L929 HydrophobicContact CG1-CG 4.33Å; V921-R930 WeakPolarHBondContact CA-O 3.44Å; V921-V931 HydrophobicContact CG1-CG2 4.17Å; V921-V931 HydrophobicContact CG2-CG1 4.37Å; V921-V931 HydrophobicContact CG2-CG2 3.99Å
922	R	93.2	Very high	81	Confident	43 Å²	43	43.8 Å²	43.8	16%	0.162	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	142.1	-172.3	168.7	-177.3	-67	-109.5	5.5	111.9	A905 E920 L929 R930 D1001	A905-R922 CarbonylContact O-C 3.51Å; A905-R922 VanDerWaalsContact O-CA 3.23Å; A905-R922 WeakPolarHBondContact O-CA 2.97Å; A905-R922 WeakPolarHBondContact O-CG 3.49Å; E920-R922 IonicContact OE1-CZ 3.98Å; E920-R922 IonicContact OE1-NE 3.66Å; E920-R922 PolarHBondContact OE1-NE 2.83Å; E920-R922 IonicContact OE1-NH2 3.05Å; R922-L929 WeakPolarHBondContact O-CA 3.22Å; R922-R930 PolarHBondContact N-O 3.47Å; R922-R930 PolarHBondContact O-N 2.77Å; R922-D1001 IonicContact CZ-OD2 3.19Å; R922-D1001 IonicContact NH1-OD2 2.97Å; R922-D1001 PolarHBondContact NH1-OD2 2.85Å; R922-D1001 IonicContact NH2-OD2 2.65Å; R922-D1001 PolarHBondContact NH2-OD2 3.02Å
923	I	93.8	Very high	82	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	137.7	162.6	-53.4	171.5	0	0	0	108.1	F898 T900 D904 A905 I907 S928 L929 Y1003	F898-I923 HydrophobicContact CD2-CD1 3.93Å; F898-I923 HydrophobicContact CE2-CD1 3.39Å; F898-I923 HydrophobicContact CE2-CG1 4.25Å; F898-I923 HydrophobicContact CZ-CD1 3.95Å; F898-I923 HydrophobicContact CZ-CG1 4.33Å; T900-I923 HydrophobicContact CG2-CD1 3.61Å; D904-I923 WeakPolarHBondContact CA-O 3.37Å; A905-I923 PolarHBondContact N-O 2.83Å; A905-I923 VanDerWaalsContact N-O 3.16Å; A905-I923 PolarHBondContact O-N 2.82Å; I907-I923 HydrophobicContact CD1-CD1 3.87Å; I907-I923 HydrophobicContact CD1-CG1 3.57Å; I907-I923 HydrophobicContact CG1-CD1 4.28Å; I907-I923 HydrophobicContact CG1-CG1 4.15Å; I923-S928 CarbonylContact C-O 3.57Å; I923-S928 WeakPolarHBondContact CA-O 3.26Å; I923-L929 HydrophobicContact CG1-CD1 3.99Å; I923-Y1003 HydrophobicContact CD1-CE2 4.37Å
924	R	92.7	Very high	83.1	Confident	103 Å²	103	38 Å²	38	39%	0.389	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.1	179.9	-168.9	178.7	177.9	-120.8	-5.9	110.9	T903 D904 G926 N927 S928 E943	T903-R924 CarbonylContact O-C 3.45Å; D904-R924 VanDerWaalsContact OD1-CA 3.31Å; D904-R924 WeakPolarHBondContact OD1-CA 3.4Å; R924-G926 PolarHBondContact O-N 2.76Å; R924-N927 PolarHBondContact O-N 2.91Å; R924-S928 PolarHBondContact N-O 3.46Å; R924-S928 PolarHBondContact O-N 3.12Å; R924-E943 IonicContact NH1-OE1 3.92Å
925	N	92.4	Very high	83.8	Confident	81 Å²	81	35.7 Å²	35.7	43%	0.433	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	16.6	180	-53	-43.5	0	0	0	114.7	T903 D904 N927 W949	T903-N925 PolarHBondContact O-N 3.1Å; D904-N925 PolarHBondContact OD1-N 3.49Å; N925-N927 PolarHBondContact O-N 2.85Å; N925-N927 PolarHBondContact O-OD1 2.76Å; N925-W949 VanDerWaalsContact O-CZ3 3.3Å; N925-W949 WeakPolarHBondContact O-CZ3 3.38Å
926	G	93	Very high	83.9	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	-2.9	-175.6	0	0	0	0	0	115.8	T903 R924 W949 L950 N951	T903-G926 WeakPolarHBondContact O-CA 3.21Å; T903-G926 PolarHBondContact O-N 2.92Å; R924-G926 PolarHBondContact O-N 2.76Å; G926-W949 CarbonylContact O-C 3.52Å; G926-L950 PolarHBondContact O-N 3.31Å; G926-N951 PolarHBondContact O-OD1 2.81Å
927	N	94.9	Very high	83.9	Confident	47 Å²	47	29.3 Å²	29.3	25%	0.251	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137.6	7.4	-176.4	72.6	-23.7	0	0	0	114.4	R924 N925 T945 T946	R924-N927 PolarHBondContact O-N 2.91Å; N925-N927 PolarHBondContact O-N 2.85Å; N925-N927 PolarHBondContact O-OD1 2.76Å; N927-T945 CarbonylContact O-C 3.53Å; N927-T945 WeakPolarHBondContact O-CA 3.16Å; N927-T946 PolarHBondContact O-N 2.96Å; N927-T946 PolarHBondContact O-OG1 3.49Å; N927-T946 VanDerWaalsContact O-OG1 3.12Å
928	S	95.2	Very high	83.8	Confident	6 Å²	6	29.5 Å²	29.5	4%	0.042	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	139.5	175.1	-58.1	0	0	0	0	110.2	I923 R924 V944 T945	I923-S928 CarbonylContact C-O 3.57Å; I923-S928 WeakPolarHBondContact CA-O 3.26Å; R924-S928 PolarHBondContact N-O 3.46Å; R924-S928 PolarHBondContact O-N 3.12Å; S928-V944 CarbonylContact C-O 3.56Å; S928-V944 VanDerWaalsContact CA-O 3.29Å; S928-V944 WeakPolarHBondContact CA-O 3.39Å; S928-T945 PolarHBondContact OG-OG1 2.93Å
929	L	95.7	Very high	84	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.2	168.4	-167.5	93.2	0	0	0	108.9	F898 I907 V921 R922 I923 E943 V944 L950 V958 L969 V971	F898-L929 HydrophobicContact CE1-CD1 4.22Å; F898-L929 HydrophobicContact CZ-CD1 4.42Å; I907-L929 HydrophobicContact CD1-CD1 3.85Å; V921-L929 HydrophobicContact CG1-CD1 4.24Å; V921-L929 HydrophobicContact CG1-CD2 4.33Å; V921-L929 HydrophobicContact CG1-CG 4.33Å; R922-L929 WeakPolarHBondContact O-CA 3.22Å; I923-L929 HydrophobicContact CG1-CD1 3.99Å; L929-E943 WeakPolarHBondContact O-CA 3.26Å; L929-V944 PolarHBondContact N-O 3.13Å; L929-V944 PolarHBondContact O-N 2.89Å; L929-L950 HydrophobicContact CB-CD1 4.18Å; L929-V958 HydrophobicContact CD1-CG2 4.33Å; L929-V958 HydrophobicContact CD2-CB 4.19Å; L929-V958 HydrophobicContact CD2-CG1 3.43Å; L929-V958 VanDerWaalsContact CD2-CG1 3.43Å; L929-V958 HydrophobicContact CD2-CG2 3.63Å; L929-L969 HydrophobicContact CD2-CD1 4.04Å; L929-L969 HydrophobicContact CD2-CD2 4.48Å; L929-V971 HydrophobicContact CB-CG2 3.76Å; L929-V971 HydrophobicContact CD2-CG2 3.65Å; L929-V971 HydrophobicContact CG-CG2 4.35Å
930	R	93.8	Very high	83.9	Confident	84 Å²	84	33 Å²	33	32%	0.317	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133.1	-175.6	-177.5	179.7	174.4	-173.8	5.2	110.6	V921 R922 L941 T942 E943	V921-R930 WeakPolarHBondContact CA-O 3.44Å; R922-R930 PolarHBondContact N-O 3.47Å; R922-R930 PolarHBondContact O-N 2.77Å; R930-L941 HydrophobicContact CG-CD2 4.21Å; R930-T942 CarbonylContact C-O 3.5Å; R930-T942 WeakPolarHBondContact CA-O 3.4Å; R930-E943 HydrophobicContact CB-CB 4.33Å; R930-E943 HydrophobicContact CB-CG 4.12Å; R930-E943 HydrophobicContact CG-CB 4.32Å
931	V	92.3	Very high	84	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	124	170.2	-176.3	0	0	0	0	109.3	F919 E920 V921 F933 T942 F960 L969	F919-V931 HydrophobicContact CD2-CG1 4.34Å; F919-V931 HydrophobicContact CE2-CG1 3.55Å; F919-V931 HydrophobicContact CZ-CG1 3.94Å; E920-V931 CarbonylContact O-C 3.59Å; E920-V931 VanDerWaalsContact O-CA 3.28Å; E920-V931 WeakPolarHBondContact O-CA 3.36Å; V921-V931 HydrophobicContact CG1-CG2 4.17Å; V921-V931 HydrophobicContact CG2-CG1 4.37Å; V921-V931 HydrophobicContact CG2-CG2 3.99Å; V931-F933 HydrophobicContact CG1-CD1 4.25Å; V931-T942 PolarHBondContact N-O 3.19Å; V931-T942 PolarHBondContact O-N 3.19Å; V931-F960 HydrophobicContact CB-CD2 4.06Å; V931-F960 HydrophobicContact CB-CE2 3.92Å; V931-F960 HydrophobicContact CG1-CD2 3.83Å; V931-F960 HydrophobicContact CG1-CE1 4.33Å; V931-F960 HydrophobicContact CG1-CE2 3.46Å; V931-F960 VanDerWaalsContact CG1-CE2 3.46Å; V931-F960 HydrophobicContact CG1-CG 4.39Å; V931-F960 HydrophobicContact CG1-CZ 3.74Å; V931-F960 HydrophobicContact CG2-CD2 3.95Å; V931-F960 HydrophobicContact CG2-CE2 4.34Å; V931-L969 HydrophobicContact CB-CD2 4.38Å; V931-L969 HydrophobicContact CG2-CD1 3.73Å; V931-L969 HydrophobicContact CG2-CD2 3.83Å; V931-L969 HydrophobicContact CG2-CG 4.38Å
932	A	87.7	Confident	83.9	Confident	8 Å²	8	34.5 Å²	34.5	7%	0.066	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134.1	179.1	0	0	0	0	0	109.8	F918 F919 E920 Q940 L941	F918-A932 HydrophobicContact CE2-CB 3.84Å; F918-A932 HydrophobicContact CZ-CB 4.34Å; F919-A932 CarbonylContact C-O 3.25Å; F919-A932 WeakPolarHBondContact CA-O 3.42Å; E920-A932 HydrophobicContact CB-CB 4.47Å; E920-A932 PolarHBondContact N-O 3.41Å; E920-A932 PolarHBondContact O-N 3.18Å; A932-Q940 WeakPolarHBondContact CA-O 3.35Å; A932-L941 HydrophobicContact CB-CD2 3.49Å; A932-L941 VanDerWaalsContact CB-CD2 3.49Å; A932-L941 HydrophobicContact CB-CG 4.26Å
933	F	82.8	Confident	83.9	Confident	3 Å²	3	36 Å²	36	1%	0.013	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	159.2	178.3	58.5	-84.6	0	0	0	112.3	F918 F919 V931 V935 Q940 F960 T967	F918-F933 CarbonylContact O-C 3.44Å; F918-F933 WeakPolarHBondContact O-CA 3.19Å; F918-F933 WeakPolarHBondContact O-CB 3.43Å; F919-F933 HydrophobicContact CD2-CB 4.04Å; V931-F933 HydrophobicContact CG1-CD1 4.25Å; F933-V935 HydrophobicContact CD2-CG1 4.03Å; F933-Q940 HydrophobicContact CD1-CB 4.49Å; F933-Q940 HydrophobicContact CD2-CB 4.12Å; F933-Q940 HydrophobicContact CE1-CB 3.98Å; F933-Q940 HydrophobicContact CE2-CB 3.59Å; F933-Q940 HydrophobicContact CE2-CG 4.16Å; F933-Q940 HydrophobicContact CZ-CB 3.51Å; F933-Q940 HydrophobicContact CZ-CG 4.35Å; F933-Q940 PolarHBondContact N-O 2.92Å; F933-Q940 PolarHBondContact O-N 2.94Å; F933-F960 HydrophobicContact CD1-CZ 4.07Å; F933-F960 HydrophobicContact CE1-CE2 4.28Å; F933-F960 AromaticContact CE1-CZ 3.9Å; F933-F960 HydrophobicContact CE1-CZ 3.9Å; F933-T967 HydrophobicContact CE1-CG2 3.8Å; F933-T967 HydrophobicContact CZ-CG2 3.85Å; F933-T967 WeakPolarHBondContact CZ-OG1 3.22Å
934	N	73.3	Confident	84	Confident	24 Å²	24	36.4 Å²	36.4	13%	0.128	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	118.5	172.9	179.4	10.5	0	0	0	109.6	K916 Q917 F918 G936 G938	K916-N934 PolarHBondContact O-ND2 3.1Å; Q917-N934 WeakPolarHBondContact CA-O 3.35Å; Q917-N934 WeakPolarHBondContact CB-O 3.13Å; Q917-N934 WeakPolarHBondContact CG-O 3.32Å; F918-N934 HydrophobicContact CD1-CB 3.71Å; F918-N934 HydrophobicContact CE1-CB 3.72Å; F918-N934 PolarHBondContact N-O 3.39Å; F918-N934 PolarHBondContact O-N 3.27Å; N934-G936 PolarHBondContact OD1-N 2.98Å; N934-G938 PolarHBondContact OD1-N 2.88Å; N934-G938 PolarHBondContact OD1-O 2.84Å; N934-G938 VanDerWaalsContact OD1-O 3.05Å
935	V	65.2	Low	84	Confident	9 Å²	9	35.4 Å²	35.4	6%	0.055	19%	0.194	C	C	.	.	S	Bend	trans	-109.7	14.8	178.7	-59.1	0	0	0	0	112.8	F933 N937 F987	F933-V935 HydrophobicContact CD2-CG1 4.03Å; V935-N937 WeakPolarHBondContact CG2-OD1 3.5Å; V935-F987 HydrophobicContact CB-CD2 4.45Å; V935-F987 HydrophobicContact CG1-CB 4.25Å; V935-F987 HydrophobicContact CG1-CD2 3.52Å; V935-F987 HydrophobicContact CG1-CE2 4.26Å; V935-F987 HydrophobicContact CG1-CG 4.28Å
936	G	57.4	Low	84.1	Confident	11 Å²	11	31.9 Å²	31.9	11%	0.113	18%	0.175	C	C	.	.	S	Bend	trans	105.5	-8.4	179	0	0	0	0	0	115.1	R173 N934	R173-G936 VanDerWaalsContact CZ-O 3.3Å; R173-G936 PolarHBondContact NE-O 2.87Å; N934-G936 PolarHBondContact OD1-N 2.98Å
937	N	57.1	Low	84.1	Confident	63 Å²	63	36.8 Å²	36.8	34%	0.337	22%	0.216	S	C	.	.	S	Bend	trans	-96.6	5.4	173.2	63.1	-11.2	0	0	0	113.8	V935 Q940	V935-N937 WeakPolarHBondContact CG2-OD1 3.5Å; N937-Q940 PolarHBondContact ND2-NE2 3.07Å
938	G	62.6	Low	84	Confident	32 Å²	32	37 Å²	37	33%	0.33	22%	0.215	S	C	.	.			trans	109.3	179.9	-173.5	0	0	0	0	0	111.8	N934 Q940	N934-G938 PolarHBondContact OD1-N 2.88Å; N934-G938 PolarHBondContact OD1-O 2.84Å; N934-G938 VanDerWaalsContact OD1-O 3.05Å; G938-Q940 PolarHBondContact O-N 2.95Å
939	I	77	Confident	84	Confident	107 Å²	107	44 Å²	44	55%	0.549	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	120.4	-179	-56.3	-177.7	0	0	0	108.9	F918 L941	F918-I939 HydrophobicContact CE1-CD1 4.06Å; F918-I939 HydrophobicContact CE1-CG1 3.94Å; F918-I939 HydrophobicContact CE1-CG2 4.36Å; F918-I939 HydrophobicContact CZ-CD1 4.27Å; F918-I939 HydrophobicContact CZ-CG1 4.27Å; F918-I939 HydrophobicContact CZ-CG2 3.86Å; I939-L941 HydrophobicContact CG2-CD1 3.78Å; I939-L941 HydrophobicContact CG2-CG 3.95Å
940	Q	82.7	Confident	84	Confident	27 Å²	27	44 Å²	44	13%	0.126	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	146.8	169.8	-68.6	-166.4	2.5	0	0	110.7	A932 F933 N937 G938 E981	A932-Q940 WeakPolarHBondContact CA-O 3.35Å; F933-Q940 HydrophobicContact CD1-CB 4.49Å; F933-Q940 HydrophobicContact CD2-CB 4.12Å; F933-Q940 HydrophobicContact CE1-CB 3.98Å; F933-Q940 HydrophobicContact CE2-CB 3.59Å; F933-Q940 HydrophobicContact CE2-CG 4.16Å; F933-Q940 HydrophobicContact CZ-CB 3.51Å; F933-Q940 HydrophobicContact CZ-CG 4.35Å; F933-Q940 PolarHBondContact N-O 2.92Å; F933-Q940 PolarHBondContact O-N 2.94Å; N937-Q940 PolarHBondContact ND2-NE2 3.07Å; G938-Q940 PolarHBondContact O-N 2.95Å; Q940-E981 PolarHBondContact NE2-OE2 2.91Å; Q940-E981 PolarHBondContact OE1-OE1 2.8Å
941	L	87.7	Confident	84.1	Confident	71 Å²	71	41.4 Å²	41.4	37%	0.372	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	110.3	-161.2	-88.8	161.6	0	0	0	111.2	R930 A932 I939 I979	R930-L941 HydrophobicContact CG-CD2 4.21Å; A932-L941 HydrophobicContact CB-CD2 3.49Å; A932-L941 VanDerWaalsContact CB-CD2 3.49Å; A932-L941 HydrophobicContact CB-CG 4.26Å; I939-L941 HydrophobicContact CG2-CD1 3.78Å; I939-L941 HydrophobicContact CG2-CG 3.95Å; L941-I979 VanDerWaalsContact O-CD1 3.27Å; L941-I979 WeakPolarHBondContact O-CD1 3.43Å
942	T	90.7	Very high	84.2	Confident	4 Å²	4	43.8 Å²	43.8	3%	0.025	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.4	178.4	-46.3	0	0	0	0	109.1	R930 V931 L969 A977 I979	R930-T942 CarbonylContact C-O 3.5Å; R930-T942 WeakPolarHBondContact CA-O 3.4Å; V931-T942 PolarHBondContact N-O 3.19Å; V931-T942 PolarHBondContact O-N 3.19Å; T942-L969 HydrophobicContact CG2-CB 3.59Å; T942-L969 HydrophobicContact CG2-CD2 4.19Å; T942-A977 HydrophobicContact CG2-CB 3.44Å; T942-A977 VanDerWaalsContact CG2-CB 3.44Å; T942-A977 WeakPolarHBondContact CG2-O 3.41Å; T942-I979 WeakPolarHBondContact OG1-CD1 3.34Å
943	E	93.8	Very high	84.4	Confident	74 Å²	74	45.1 Å²	45.1	35%	0.346	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	133.4	-179.3	-174.7	171.1	-129.6	0	0	109.9	R924 L929 R930	R924-E943 IonicContact NH1-OE1 3.92Å; L929-E943 WeakPolarHBondContact O-CA 3.26Å; R930-E943 HydrophobicContact CB-CB 4.33Å; R930-E943 HydrophobicContact CB-CG 4.12Å; R930-E943 HydrophobicContact CG-CB 4.32Å
944	V	95.3	Very high	84.9	Confident	9 Å²	9	51.8 Å²	51.8	6%	0.055	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.6	171.7	174.4	0	0	0	0	107.5	S928 L929 L969 V971 Q974 A977	S928-V944 CarbonylContact C-O 3.56Å; S928-V944 VanDerWaalsContact CA-O 3.29Å; S928-V944 WeakPolarHBondContact CA-O 3.39Å; L929-V944 PolarHBondContact N-O 3.13Å; L929-V944 PolarHBondContact O-N 2.89Å; V944-L969 HydrophobicContact CG2-CB 4.24Å; V944-L969 HydrophobicContact CG2-CD2 4.01Å; V944-L969 HydrophobicContact CG2-CG 3.88Å; V944-L969 WeakPolarHBondContact CG2-O 3.04Å; V944-V971 HydrophobicContact CB-CB 4.39Å; V944-V971 HydrophobicContact CB-CG2 3.78Å; V944-V971 HydrophobicContact CG1-CB 3.95Å; V944-V971 HydrophobicContact CG1-CG2 3.91Å; V944-V971 HydrophobicContact CG2-CG2 4.28Å; V944-Q974 HydrophobicContact CG1-CB 4.31Å; V944-A977 HydrophobicContact CG2-CB 3.6Å
945	T	94.2	Very high	85.8	Confident	83 Å²	83	53.6 Å²	53.6	51%	0.509	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.5	174.3	-59.6	0	0	0	0	109.1	N927 S928	N927-T945 CarbonylContact O-C 3.53Å; N927-T945 WeakPolarHBondContact O-CA 3.16Å; S928-T945 PolarHBondContact OG-OG1 2.93Å
946	T	93.7	Very high	87.2	Confident	6 Å²	6	53.4 Å²	53.4	4%	0.037	28%	0.28	C	S	.	.			trans	-92.9	153.2	-178.7	54.5	0	0	0	0	111.3	N927 H948 L950 V971 Q974	N927-T946 PolarHBondContact O-N 2.96Å; N927-T946 PolarHBondContact O-OG1 3.49Å; N927-T946 VanDerWaalsContact O-OG1 3.12Å; T946-H948 VanDerWaalsContact C-N 3.34Å; T946-H948 WeakPolarHBondContact CB-O 3.42Å; T946-H948 PolarHBondContact OG1-O 2.95Å; T946-L950 HydrophobicContact CG2-CD2 3.93Å; T946-L950 HydrophobicContact CG2-CG 4.47Å; T946-V971 HydrophobicContact CG2-CB 4.33Å; T946-V971 HydrophobicContact CG2-CG1 4Å; T946-Q974 HydrophobicContact CG2-CG 4.15Å
947	A	92.6	Very high	89	Confident	103 Å²	103	53 Å²	53	85%	0.851	28%	0.276	S	S	*	.	S	Bend	trans	-74	-29	174.7	0	0	0	0	0	112.3
948	H	93.1	Very high	90.7	Very high	53 Å²	53	50 Å²	50	25%	0.245	26%	0.26	C	S	.	.	S	Bend	trans	-95.7	164.5	172.7	56.4	-78.1	0	0	0	111.4	T946 H956 D972	T946-H948 VanDerWaalsContact C-N 3.34Å; T946-H948 WeakPolarHBondContact CB-O 3.42Å; T946-H948 PolarHBondContact OG1-O 2.95Å; H948-H956 AromaticContact CD2-CE1 3.73Å; H948-H956 AromaticContact NE2-CE1 3.91Å; H948-H956 AromaticContact NE2-ND1 3.92Å; H948-D972 IonicContact CD2-OD2 3.72Å; H948-D972 IonicContact CE1-OD2 3.7Å; H948-D972 PolarHBondContact CE1-OD2 2.52Å; H948-D972 IonicContact NE2-OD2 3.75Å; H948-D972 PolarHBondContact NE2-OD2 2.82Å
949	W	95.9	Very high	92.1	Very high	152 Å²	152	49.9 Å²	49.9	58%	0.576	25%	0.25	S	C	*	.			trans	-77.2	138.5	175.2	-62.7	90.3	0	0	0	110.3	N925 G926 D952	N925-W949 VanDerWaalsContact O-CZ3 3.3Å; N925-W949 WeakPolarHBondContact O-CZ3 3.38Å; G926-W949 CarbonylContact O-C 3.52Å; W949-D952 HydrophobicContact CB-CB 4.25Å; W949-D952 VanDerWaalsContact O-CG 3.3Å
950	L	95.4	Very high	92.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	-87.9	-11.2	174.4	-63.3	178.9	0	0	0	112.5	F898 G926 L929 T946 H956 V971	F898-L950 HydrophobicContact CE2-CB 4.34Å; F898-L950 WeakPolarHBondContact CE2-O 3.35Å; F898-L950 HydrophobicContact CZ-CB 4.05Å; F898-L950 HydrophobicContact CZ-CD1 4.47Å; F898-L950 HydrophobicContact CZ-CD2 4.48Å; G926-L950 PolarHBondContact O-N 3.31Å; L929-L950 HydrophobicContact CB-CD1 4.18Å; T946-L950 HydrophobicContact CG2-CD2 3.93Å; T946-L950 HydrophobicContact CG2-CG 4.47Å; L950-H956 WeakPolarHBondContact CA-NE2 3.33Å; L950-H956 HydrophobicContact CD2-CB 4.44Å; L950-H956 PolarHBondContact O-CD2 2.8Å; L950-H956 VanDerWaalsContact O-CD2 3.24Å; L950-H956 PolarHBondContact O-NE2 2.68Å; L950-V971 HydrophobicContact CD1-CG1 4.43Å; L950-V971 HydrophobicContact CD2-CG1 3.84Å
951	N	95	Very high	93.1	Very high	29 Å²	29	43.6 Å²	43.6	16%	0.155	22%	0.218	C	C	.	.			trans	-106.4	28.3	177.8	75	-56.6	0	0	0	112.1	T900 T901 I902 G926 N953	T900-N951 HydrophobicContact CG2-CB 4.32Å; T900-N951 CarbonylContact O-C 3.29Å; T900-N951 VanDerWaalsContact O-CA 3.26Å; T900-N951 WeakPolarHBondContact O-CA 3.32Å; T901-N951 WeakPolarHBondContact CA-O 3.16Å; T901-N951 PolarHBondContact O-ND2 2.89Å; I902-N951 WeakPolarHBondContact O-CB 3.45Å; G926-N951 PolarHBondContact O-OD1 2.81Å; N951-N953 PolarHBondContact O-N 2.96Å
952	D	94.1	Very high	92.9	Very high	52 Å²	52	40.7 Å²	40.7	28%	0.278	20%	0.202	S	C	.	.	S	Bend	trans	-85.1	13	-176.8	67.7	8.5	0	0	0	113.7	W949 R954 H956	W949-D952 HydrophobicContact CB-CB 4.25Å; W949-D952 VanDerWaalsContact O-CG 3.3Å; D952-R954 PolarHBondContact O-N 2.81Å; D952-R954 WeakPolarHBondContact OD1-CB 2.88Å; D952-R954 PolarHBondContact OD1-N 2.84Å; D952-R954 IonicContact OD1-NE 2.7Å; D952-R954 IonicContact OD2-CZ 3.09Å; D952-R954 IonicContact OD2-NE 2.91Å; D952-R954 PolarHBondContact OD2-NE 2.81Å; D952-R954 IonicContact OD2-NH2 2.63Å; D952-R954 PolarHBondContact OD2-NH2 3.19Å; D952-H956 IonicContact OD1-CE1 3.11Å; D952-H956 IonicContact OD1-NE2 2.89Å; D952-H956 PolarHBondContact OD1-NE2 3.28Å; D952-H956 VanDerWaalsContact OD1-NE2 3.09Å; D952-H956 IonicContact OD2-CE1 3.06Å; D952-H956 IonicContact OD2-NE2 3.8Å
953	N	93.7	Very high	92.3	Very high	36 Å²	36	40.9 Å²	40.9	19%	0.193	20%	0.203	C	C	.	.	S	Bend	trans	58.7	28.2	-175	-160.2	22.5	0	0	0	114.3	R899 T900 T901 N951 Y1055	R899-N953 PolarHBondContact NE-O 2.92Å; R899-N953 PolarHBondContact NE-OD1 3.22Å; R899-N953 PolarHBondContact NH2-ND2 2.98Å; R899-N953 PolarHBondContact NH2-O 2.76Å; R899-N953 PolarHBondContact NH2-OD1 3.1Å; T900-N953 WeakPolarHBondContact O-CA 3.33Å; T900-N953 PolarHBondContact O-N 2.89Å; T900-N953 VanDerWaalsContact O-N 3.08Å; T901-N953 HydrophobicContact CG2-CB 3.69Å; N951-N953 PolarHBondContact O-N 2.96Å; N953-Y1055 PolarHBondContact OD1-OH 3.43Å
954	R	92.5	Very high	91	Very high	143 Å²	143	39.4 Å²	39.4	54%	0.54	19%	0.194	S	C	.	.	S	Bend	trans	-111	168.2	167.2	-56.1	-175.4	-64.9	164.4	1.9	110.8	R899 D952 H956	R899-R954 WeakPolarHBondContact CA-O 3.27Å; R899-R954 WeakPolarHBondContact CB-O 3.18Å; R899-R954 WeakPolarHBondContact CG-O 3.05Å; D952-R954 PolarHBondContact O-N 2.81Å; D952-R954 WeakPolarHBondContact OD1-CB 2.88Å; D952-R954 PolarHBondContact OD1-N 2.84Å; D952-R954 IonicContact OD1-NE 2.7Å; D952-R954 IonicContact OD2-CZ 3.09Å; D952-R954 IonicContact OD2-NE 2.91Å; D952-R954 PolarHBondContact OD2-NE 2.81Å; D952-R954 IonicContact OD2-NH2 2.63Å; D952-R954 PolarHBondContact OD2-NH2 3.19Å; R954-H956 PolarHBondContact O-CD2 2.67Å
955	W	93.1	Very high	90.2	Very high	62 Å²	62	40.6 Å²	40.6	24%	0.235	20%	0.198	C	C	.	.			trans	-78.2	131.1	176.9	-72.6	112.2	0	0	0	110.5	L659 T871 I897 F898 R899 C1006 C1036	L659-W955 HydrophobicContact CD1-CB 4.05Å; L659-W955 HydrophobicContact CD2-CB 3.97Å; L659-W955 HydrophobicContact CD2-CG 4.19Å; T871-W955 HydrophobicContact CG2-CH2 3.75Å; T871-W955 HydrophobicContact CG2-CZ2 4.3Å; I897-W955 HydrophobicContact CB-CE3 4.19Å; I897-W955 HydrophobicContact CD1-CD2 4.25Å; I897-W955 HydrophobicContact CD1-CE3 3.87Å; I897-W955 HydrophobicContact CD1-CZ3 4.17Å; I897-W955 HydrophobicContact CG1-CE3 3.76Å; I897-W955 HydrophobicContact CG1-CZ3 3.85Å; F898-W955 CarbonylContact O-C 3.29Å; F898-W955 WeakPolarHBondContact O-CA 3.29Å; R899-W955 HydrophobicContact CB-CD2 3.81Å; R899-W955 HydrophobicContact CB-CE3 3.66Å; R899-W955 HydrophobicContact CB-CG 4.39Å; R899-W955 HydrophobicContact CB-CH2 4.39Å; R899-W955 HydrophobicContact CB-CZ3 3.96Å; W955-C1006 HydrophobicContact CH2-CB 3.44Å; W955-C1006 VanDerWaalsContact CH2-CB 3.44Å; W955-C1006 HydrophobicContact CZ2-CB 4.11Å; W955-C1006 HydrophobicContact CZ3-CB 4Å; W955-C1036 HydrophobicContact CH2-CB 4.45Å; W955-C1036 HydrophobicContact CZ2-CB 4.03Å
956	H	94.5	Very high	89.9	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.019	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	144.8	174.2	-64.8	-73.2	0	0	0	110.5	I897 F898 H948 L950 D952 R954 D972	I897-H956 CarbonylContact C-O 3.52Å; I897-H956 WeakPolarHBondContact CA-O 3.45Å; I897-H956 WeakPolarHBondContact CB-O 3.42Å; F898-H956 HydrophobicContact CD1-CB 4.1Å; F898-H956 HydrophobicContact CE1-CB 3.64Å; F898-H956 HydrophobicContact CE2-CB 4.3Å; F898-H956 HydrophobicContact CZ-CB 3.76Å; F898-H956 PolarHBondContact N-O 2.83Å; F898-H956 PolarHBondContact O-N 2.83Å; H948-H956 AromaticContact CD2-CE1 3.73Å; H948-H956 AromaticContact NE2-CE1 3.91Å; H948-H956 AromaticContact NE2-ND1 3.92Å; L950-H956 WeakPolarHBondContact CA-NE2 3.33Å; L950-H956 HydrophobicContact CD2-CB 4.44Å; L950-H956 PolarHBondContact O-CD2 2.8Å; L950-H956 VanDerWaalsContact O-CD2 3.24Å; L950-H956 PolarHBondContact O-NE2 2.68Å; D952-H956 IonicContact OD1-CE1 3.11Å; D952-H956 IonicContact OD1-NE2 2.89Å; D952-H956 PolarHBondContact OD1-NE2 3.28Å; D952-H956 VanDerWaalsContact OD1-NE2 3.09Å; D952-H956 IonicContact OD2-CE1 3.06Å; D952-H956 IonicContact OD2-NE2 3.8Å; R954-H956 PolarHBondContact O-CD2 2.67Å; H956-D972 WeakPolarHBondContact CA-OD1 3.5Å; H956-D972 WeakPolarHBondContact CB-OD1 3.46Å; H956-D972 IonicContact CE1-OD2 2.67Å; H956-D972 IonicContact CG-OD1 3.83Å; H956-D972 IonicContact CG-OD2 3.19Å; H956-D972 IonicContact ND1-OD1 2.83Å; H956-D972 IonicContact ND1-OD2 3.55Å; H956-D972 PolarHBondContact ND1-OD2 2.93Å
957	V	93.8	Very high	89.5	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.018	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132.6	-178.9	-177.5	0	0	0	0	110	E656 L659 F660 I897 R959 V971 D972	E656-V957 HydrophobicContact CG-CG2 4.43Å; E656-V957 WeakPolarHBondContact OE1-CG1 3.46Å; L659-V957 HydrophobicContact CD1-CG2 4.29Å; F660-V957 HydrophobicContact CE2-CG2 3.87Å; F660-V957 HydrophobicContact CZ-CB 4.32Å; F660-V957 HydrophobicContact CZ-CG2 3.63Å; I897-V957 HydrophobicContact CG2-CB 4.25Å; I897-V957 HydrophobicContact CG2-CG1 4.29Å; I897-V957 HydrophobicContact CG2-CG2 3.78Å; V957-R959 HydrophobicContact CG1-CG 4.25Å; V957-V971 CarbonylContact O-C 3.55Å; V957-V971 WeakPolarHBondContact O-CA 3.35Å; V957-D972 PolarHBondContact N-OD1 3.4Å; V957-D972 PolarHBondContact O-N 2.83Å
958	V	94	Very high	89.4	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130.1	175	-179.7	0	0	0	0	109.1	S895 F896 F898 L929 L969 I970	S895-V958 WeakPolarHBondContact CA-O 3.16Å; F896-V958 HydrophobicContact CD1-CB 4.24Å; F896-V958 HydrophobicContact CD1-CG1 4.44Å; F896-V958 HydrophobicContact CD2-CB 4.34Å; F896-V958 HydrophobicContact CD2-CG2 4.46Å; F896-V958 HydrophobicContact CE1-CB 3.86Å; F896-V958 HydrophobicContact CE1-CG1 3.74Å; F896-V958 HydrophobicContact CE1-CG2 4.46Å; F896-V958 HydrophobicContact CE2-CB 3.98Å; F896-V958 HydrophobicContact CE2-CG2 3.81Å; F896-V958 HydrophobicContact CG-CB 4.47Å; F896-V958 HydrophobicContact CZ-CB 3.72Å; F896-V958 HydrophobicContact CZ-CG1 3.81Å; F896-V958 HydrophobicContact CZ-CG2 3.81Å; F896-V958 PolarHBondContact N-O 2.86Å; F896-V958 PolarHBondContact O-N 3.47Å; F898-V958 HydrophobicContact CD1-CG2 3.77Å; F898-V958 HydrophobicContact CE1-CG2 3.53Å; L929-V958 HydrophobicContact CD1-CG2 4.33Å; L929-V958 HydrophobicContact CD2-CB 4.19Å; L929-V958 HydrophobicContact CD2-CG1 3.43Å; L929-V958 VanDerWaalsContact CD2-CG1 3.43Å; L929-V958 HydrophobicContact CD2-CG2 3.63Å; V958-L969 HydrophobicContact CG1-CD1 4.12Å; V958-I970 WeakPolarHBondContact CA-O 3.37Å
959	R	92.1	Very high	89.5	Confident	30 Å²	30	31.8 Å²	31.8	11%	0.113	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	122.6	171	-52	-173.3	-174.4	105.6	-9.8	109	E656 V957 I970	E656-R959 IonicContact OE1-CZ 2.74Å; E656-R959 IonicContact OE1-NE 3.94Å; E656-R959 IonicContact OE1-NH2 3.81Å; E656-R959 PolarHBondContact OE1-NH2 2.88Å; E656-R959 IonicContact OE2-NH2 3.61Å; V957-R959 HydrophobicContact CG1-CG 4.25Å; R959-I970 HydrophobicContact CB-CB 4.3Å; R959-I970 PolarHBondContact N-O 3.14Å; R959-I970 PolarHBondContact O-N 3.25Å
960	F	91.4	Very high	89.3	Confident	2 Å²	2	25.2 Å²	25.2	1%	0.009	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	131.7	177.7	177.1	-100	0	0	0	109	F892 D893 M894 F919 V931 F933 R962 T967 R968 L969	F892-F960 AromaticContact CD1-CD1 3.62Å; F892-F960 HydrophobicContact CD1-CD1 3.62Å; F892-F960 AromaticContact CD1-CE1 3.54Å; F892-F960 HydrophobicContact CD1-CE1 3.54Å; F892-F960 AromaticContact CE1-CD1 3.62Å; F892-F960 HydrophobicContact CE1-CD1 3.62Å; F892-F960 AromaticContact CE1-CE1 3.82Å; F892-F960 HydrophobicContact CE1-CE1 3.82Å; D893-F960 CarbonylContact C-O 3.55Å; D893-F960 WeakPolarHBondContact CA-O 3.49Å; M894-F960 PolarHBondContact N-O 2.59Å; M894-F960 PolarHBondContact O-N 3.35Å; F919-F960 HydrophobicContact CE2-CD1 4.02Å; F919-F960 AromaticContact CE2-CE1 3.6Å; F919-F960 HydrophobicContact CE2-CE1 3.6Å; F919-F960 HydrophobicContact CE2-CZ 4.07Å; F919-F960 HydrophobicContact CZ-CD1 4.25Å; F919-F960 HydrophobicContact CZ-CE1 4.29Å; V931-F960 HydrophobicContact CB-CD2 4.06Å; V931-F960 HydrophobicContact CB-CE2 3.92Å; V931-F960 HydrophobicContact CG1-CD2 3.83Å; V931-F960 HydrophobicContact CG1-CE1 4.33Å; V931-F960 HydrophobicContact CG1-CE2 3.46Å; V931-F960 VanDerWaalsContact CG1-CE2 3.46Å; V931-F960 HydrophobicContact CG1-CG 4.39Å; V931-F960 HydrophobicContact CG1-CZ 3.74Å; V931-F960 HydrophobicContact CG2-CD2 3.95Å; V931-F960 HydrophobicContact CG2-CE2 4.34Å; F933-F960 HydrophobicContact CD1-CZ 4.07Å; F933-F960 HydrophobicContact CE1-CE2 4.28Å; F933-F960 AromaticContact CE1-CZ 3.9Å; F933-F960 HydrophobicContact CE1-CZ 3.9Å; F960-R962 HydrophobicContact CE1-CB 4.21Å; F960-R962 HydrophobicContact CZ-CB 4.27Å; F960-T967 HydrophobicContact CD2-CG2 4.33Å; F960-T967 HydrophobicContact CE2-CG2 3.31Å; F960-T967 HydrophobicContact CZ-CG2 3.6Å; F960-R968 CarbonylContact C-O 3.6Å; F960-R968 WeakPolarHBondContact CA-O 3.41Å; F960-L969 HydrophobicContact CB-CD1 4.17Å; F960-L969 HydrophobicContact CD2-CB 4.35Å; F960-L969 HydrophobicContact CD2-CD1 4.12Å
961	E	88.1	Confident	89.3	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	136	175.2	-167.8	-157.3	160.6	0	0	109.1	H646 Q647 F892 D893 N963 T967 R968	H646-E961 WeakPolarHBondContact CB-OE1 3.19Å; H646-E961 IonicContact CG-OE1 3.76Å; H646-E961 IonicContact ND1-OE1 3.52Å; H646-E961 PolarHBondContact ND1-OE1 2.91Å; Q647-E961 WeakPolarHBondContact CB-OE2 3.09Å; F892-E961 CarbonylContact O-C 3.52Å; F892-E961 WeakPolarHBondContact O-CA 3.29Å; D893-E961 HydrophobicContact CB-CG 4.41Å; E961-N963 PolarHBondContact OE1-ND2 2.83Å; E961-T967 CarbonylContact O-C 3.58Å; E961-T967 WeakPolarHBondContact O-CA 3.38Å; E961-R968 HydrophobicContact CB-CB 4.42Å; E961-R968 PolarHBondContact N-O 3.44Å; E961-R968 PolarHBondContact O-N 3.22Å
962	R	84.6	Confident	89.1	Confident	10 Å²	10	24.3 Å²	24.3	4%	0.038	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	126.8	164.4	177	177.5	175.3	-85.2	-12.6	108.8	A891 F892 F960 E981 R985	A891-R962 VanDerWaalsContact CA-O 3.3Å; A891-R962 WeakPolarHBondContact CA-O 3.31Å; F892-R962 PolarHBondContact N-O 2.02Å; F892-R962 PolarHBondContact O-N 3.38Å; F960-R962 HydrophobicContact CE1-CB 4.21Å; F960-R962 HydrophobicContact CZ-CB 4.27Å; R962-E981 IonicContact CZ-OE1 3.27Å; R962-E981 IonicContact NE-OE1 3.96Å; R962-E981 PolarHBondContact NE-OE1 2.94Å; R962-E981 IonicContact NH2-OE1 3.39Å; R962-E981 PolarHBondContact NH2-OE1 2.95Å; R962-E981 VanDerWaalsContact NH2-OE1 3.14Å; R962-R985 PolarHBondContact NH2-O 3.5Å; R962-R985 VanDerWaalsContact NH2-O 3.14Å
963	N	77.2	Confident	88.6	Confident	7 Å²	7	26.4 Å²	26.4	4%	0.037	12%	0.118	C	C	.	.			trans	-133.7	-166.6	177.5	65.8	50.1	0	0	0	111.4	V644 E961 K965 E966	V644-N963 HydrophobicContact CG2-CB 4.02Å; V644-N963 WeakPolarHBondContact CG2-ND2 3.12Å; E961-N963 PolarHBondContact OE1-ND2 2.83Å; N963-K965 PolarHBondContact O-N 3.02Å; N963-K965 PolarHBondContact OD1-N 2.82Å; N963-E966 PolarHBondContact N-O 3.32Å; N963-E966 PolarHBondContact OD1-N 3.47Å; N963-E966 PolarHBondContact OD1-O 2.81Å
964	R	67.6	Low	88.3	Confident	43 Å²	43	28.3 Å²	28.3	16%	0.162	13%	0.126	C	C	.	.	S	Bend	trans	-70.2	-14.1	-175.8	-63.7	178.5	175.3	-177	-7.9	114.8	D136 L138 Q140	D136-R964 IonicContact OD2-NH2 3.52Å; L138-R964 VanDerWaalsContact CD1-NH2 3.28Å; Q140-R964 VanDerWaalsContact CG-CZ 3.44Å
965	K	78.7	Confident	88	Confident	35 Å²	35	29.3 Å²	29.3	15%	0.152	14%	0.137	C	C	.	.	S	Bend	trans	-116.8	-36.7	-172.8	-69.4	-51.5	-148.6	107	0	112.3	T630 F631 A643 V644 N963 E981	T630-K965 WeakPolarHBondContact OG1-CE 3.34Å; T630-K965 PolarHBondContact OG1-NZ 2.76Å; F631-K965 HydrophobicContact CE1-CD 4.19Å; F631-K965 HydrophobicContact CE2-CG 4.27Å; F631-K965 HydrophobicContact CZ-CD 3.99Å; F631-K965 VanDerWaalsContact CZ-CE 3.45Å; F631-K965 HydrophobicContact CZ-CG 3.91Å; F631-K965 VanDerWaalsContact O-CE 3.27Å; F631-K965 WeakPolarHBondContact O-CE 3.42Å; F631-K965 PolarHBondContact O-NZ 2.64Å; A643-K965 HydrophobicContact CB-CB 3.46Å; A643-K965 VanDerWaalsContact CB-CB 3.46Å; A643-K965 HydrophobicContact CB-CG 3.99Å; V644-K965 HydrophobicContact CG1-CG 4.03Å; N963-K965 PolarHBondContact O-N 3.02Å; N963-K965 PolarHBondContact OD1-N 2.82Å; K965-E981 PolarHBondContact O-N 2.83Å
966	E	85.9	Confident	87.8	Confident	26 Å²	26	28 Å²	28	12%	0.121	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	161.3	-174.2	65.3	-170.7	-166.3	0	0	112.8	G642 A643 N963 V978 I979	G642-E966 WeakPolarHBondContact CA-OE1 3.3Å; A643-E966 HydrophobicContact CB-CG 4.02Å; A643-E966 PolarHBondContact N-OE1 2.89Å; N963-E966 PolarHBondContact N-O 3.32Å; N963-E966 PolarHBondContact OD1-N 3.47Å; N963-E966 PolarHBondContact OD1-O 2.81Å; E966-V978 HydrophobicContact CB-CG1 3.81Å; E966-V978 HydrophobicContact CG-CG1 4.24Å; E966-V978 WeakPolarHBondContact OE2-CG1 3.38Å; E966-I979 CarbonylContact C-O 3.35Å; E966-I979 WeakPolarHBondContact CA-O 3.26Å; E966-I979 WeakPolarHBondContact CB-O 3.28Å
967	T	87.1	Confident	87.7	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	134.8	160.4	-62.7	0	0	0	0	108.5	F933 F960 E961 V978 I979	F933-T967 HydrophobicContact CE1-CG2 3.8Å; F933-T967 HydrophobicContact CZ-CG2 3.85Å; F933-T967 WeakPolarHBondContact CZ-OG1 3.22Å; F960-T967 HydrophobicContact CD2-CG2 4.33Å; F960-T967 HydrophobicContact CE2-CG2 3.31Å; F960-T967 HydrophobicContact CZ-CG2 3.6Å; E961-T967 CarbonylContact O-C 3.58Å; E961-T967 WeakPolarHBondContact O-CA 3.38Å; T967-V978 CarbonylContact O-C 3.44Å; T967-V978 VanDerWaalsContact O-CA 3.26Å; T967-V978 WeakPolarHBondContact O-CA 3.35Å; T967-I979 PolarHBondContact N-O 2.83Å; T967-I979 PolarHBondContact O-N 3.3Å
968	R	90.4	Very high	87.5	Confident	33 Å²	33	32 Å²	32	13%	0.125	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	127.7	-174.8	-167.5	171.1	-177.2	-128.8	-3.6	110	F960 E961 P976 A977 V978	F960-R968 CarbonylContact C-O 3.6Å; F960-R968 WeakPolarHBondContact CA-O 3.41Å; E961-R968 HydrophobicContact CB-CB 4.42Å; E961-R968 PolarHBondContact N-O 3.44Å; E961-R968 PolarHBondContact O-N 3.22Å; R968-P976 HydrophobicContact CG-CB 3.62Å; R968-P976 VanDerWaalsContact NE-CB 3.3Å; R968-A977 WeakPolarHBondContact CA-O 3.36Å; R968-V978 HydrophobicContact CG-CG2 4.22Å
969	L	94.1	Very high	87.1	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	127.3	174.9	179	62.6	0	0	0	109.9	L929 V931 T942 V944 V958 F960 P976 A977	L929-L969 HydrophobicContact CD2-CD1 4.04Å; L929-L969 HydrophobicContact CD2-CD2 4.48Å; V931-L969 HydrophobicContact CB-CD2 4.38Å; V931-L969 HydrophobicContact CG2-CD1 3.73Å; V931-L969 HydrophobicContact CG2-CD2 3.83Å; V931-L969 HydrophobicContact CG2-CG 4.38Å; T942-L969 HydrophobicContact CG2-CB 3.59Å; T942-L969 HydrophobicContact CG2-CD2 4.19Å; V944-L969 HydrophobicContact CG2-CB 4.24Å; V944-L969 HydrophobicContact CG2-CD2 4.01Å; V944-L969 HydrophobicContact CG2-CG 3.88Å; V944-L969 WeakPolarHBondContact CG2-O 3.04Å; V958-L969 HydrophobicContact CG1-CD1 4.12Å; F960-L969 HydrophobicContact CB-CD1 4.17Å; F960-L969 HydrophobicContact CD2-CB 4.35Å; F960-L969 HydrophobicContact CD2-CD1 4.12Å; L969-P976 CarbonylContact O-C 3.57Å; L969-P976 VanDerWaalsContact O-CA 3.3Å; L969-P976 WeakPolarHBondContact O-CA 3.48Å; L969-A977 HydrophobicContact CB-CB 4.5Å; L969-A977 PolarHBondContact N-O 2.86Å; L969-A977 PolarHBondContact O-N 2.88Å
970	I	92.9	Very high	86.4	Confident	15 Å²	15	39.6 Å²	39.6	8%	0.077	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.7	177.7	-56.1	166.9	0	0	0	108.2	Q647 V958 R959 P976	Q647-I970 HydrophobicContact CG-CD1 4.2Å; V958-I970 WeakPolarHBondContact CA-O 3.37Å; R959-I970 HydrophobicContact CB-CB 4.3Å; R959-I970 PolarHBondContact N-O 3.14Å; R959-I970 PolarHBondContact O-N 3.25Å; I970-P976 HydrophobicContact CG1-CB 3.86Å
971	V	94.1	Very high	85.4	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125.1	172.6	-174.8	0	0	0	0	108.1	L929 V944 T946 L950 V957 T973 Q974	L929-V971 HydrophobicContact CB-CG2 3.76Å; L929-V971 HydrophobicContact CD2-CG2 3.65Å; L929-V971 HydrophobicContact CG-CG2 4.35Å; V944-V971 HydrophobicContact CB-CB 4.39Å; V944-V971 HydrophobicContact CB-CG2 3.78Å; V944-V971 HydrophobicContact CG1-CB 3.95Å; V944-V971 HydrophobicContact CG1-CG2 3.91Å; V944-V971 HydrophobicContact CG2-CG2 4.28Å; T946-V971 HydrophobicContact CG2-CB 4.33Å; T946-V971 HydrophobicContact CG2-CG1 4Å; L950-V971 HydrophobicContact CD1-CG1 4.43Å; L950-V971 HydrophobicContact CD2-CG1 3.84Å; V957-V971 CarbonylContact O-C 3.55Å; V957-V971 WeakPolarHBondContact O-CA 3.35Å; V971-T973 PolarHBondContact O-N 3.25Å; V971-Q974 WeakPolarHBondContact O-CB 3.38Å; V971-Q974 PolarHBondContact O-N 2.87Å; V971-Q974 VanDerWaalsContact O-N 3.08Å
972	D	91.8	Very high	83.9	Confident	9 Å²	9	45.7 Å²	45.7	5%	0.048	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	-117.4	-173	-61.2	-29.5	0	0	0	111.4	F660 H948 H956 V957	F660-D972 HydrophobicContact CE1-CB 4.1Å; F660-D972 HydrophobicContact CZ-CB 4.48Å; H948-D972 IonicContact CD2-OD2 3.72Å; H948-D972 IonicContact CE1-OD2 3.7Å; H948-D972 PolarHBondContact CE1-OD2 2.52Å; H948-D972 IonicContact NE2-OD2 3.75Å; H948-D972 PolarHBondContact NE2-OD2 2.82Å; H956-D972 WeakPolarHBondContact CA-OD1 3.5Å; H956-D972 WeakPolarHBondContact CB-OD1 3.46Å; H956-D972 IonicContact CE1-OD2 2.67Å; H956-D972 IonicContact CG-OD1 3.83Å; H956-D972 IonicContact CG-OD2 3.19Å; H956-D972 IonicContact ND1-OD1 2.83Å; H956-D972 IonicContact ND1-OD2 3.55Å; H956-D972 PolarHBondContact ND1-OD2 2.93Å; V957-D972 PolarHBondContact N-OD1 3.4Å; V957-D972 PolarHBondContact O-N 2.83Å
973	T	83.8	Confident	82.4	Confident	97 Å²	97	47.5 Å²	47.5	60%	0.595	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	17.6	178.9	57.3	0	0	0	0	112.6	F660 V971	F660-T973 HydrophobicContact CD1-CG2 4.13Å; F660-T973 HydrophobicContact CE1-CG2 4.03Å; F660-T973 HydrophobicContact CZ-CG2 4.41Å; V971-T973 PolarHBondContact O-N 3.25Å
974	Q	86.2	Confident	81	Confident	76 Å²	76	50.6 Å²	50.6	36%	0.355	27%	0.274	S	S	.	.	S	Bend	trans	-75.2	157.9	179.5	-65.9	-62.4	-48.9	0	0	112.6	V944 T946 V971	V944-Q974 HydrophobicContact CG1-CB 4.31Å; T946-Q974 HydrophobicContact CG2-CG 4.15Å; V971-Q974 WeakPolarHBondContact O-CB 3.38Å; V971-Q974 PolarHBondContact O-N 2.87Å; V971-Q974 VanDerWaalsContact O-N 3.08Å
975	E	87	Confident	80	Confident	164 Å²	164	50.8 Å²	50.8	77%	0.766	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-56.1	139.2	171.4	-70.9	-66	162.2	0	0	110.9
976	P	89.3	Confident	78.1	Confident	34 Å²	34	50.3 Å²	50.3	22%	0.221	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-66.3	137.9	-178.9	27.9	-35.3	0	0	0	111.7	R968 L969 I970 V978	R968-P976 HydrophobicContact CG-CB 3.62Å; R968-P976 VanDerWaalsContact NE-CB 3.3Å; L969-P976 CarbonylContact O-C 3.57Å; L969-P976 VanDerWaalsContact O-CA 3.3Å; L969-P976 WeakPolarHBondContact O-CA 3.48Å; I970-P976 HydrophobicContact CG1-CB 3.86Å; P976-V978 HydrophobicContact CB-CG2 4.02Å; P976-V978 HydrophobicContact CG-CG2 4.15Å
977	A	91.8	Very high	75.8	Confident	24 Å²	24	49.9 Å²	49.9	20%	0.198	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	120.7	160.9	0	0	0	0	0	109	T942 V944 R968 L969	T942-A977 HydrophobicContact CG2-CB 3.44Å; T942-A977 VanDerWaalsContact CG2-CB 3.44Å; T942-A977 WeakPolarHBondContact CG2-O 3.41Å; V944-A977 HydrophobicContact CG2-CB 3.6Å; R968-A977 WeakPolarHBondContact CA-O 3.36Å; L969-A977 HydrophobicContact CB-CB 4.5Å; L969-A977 PolarHBondContact N-O 2.86Å; L969-A977 PolarHBondContact O-N 2.88Å
978	V	89.8	Confident	73.4	Confident	68 Å²	68	52 Å²	52	41%	0.412	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	131.4	-173.8	-175.8	0	0	0	0	111.3	E966 T967 R968 P976	E966-V978 HydrophobicContact CB-CG1 3.81Å; E966-V978 HydrophobicContact CG-CG1 4.24Å; E966-V978 WeakPolarHBondContact OE2-CG1 3.38Å; T967-V978 CarbonylContact O-C 3.44Å; T967-V978 VanDerWaalsContact O-CA 3.26Å; T967-V978 WeakPolarHBondContact O-CA 3.35Å; R968-V978 HydrophobicContact CG-CG2 4.22Å; P976-V978 HydrophobicContact CB-CG2 4.02Å; P976-V978 HydrophobicContact CG-CG2 4.15Å
979	I	84.6	Confident	70.8	Confident	47 Å²	47	51.2 Å²	51.2	24%	0.241	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.7	169.8	-57.5	-180	0	0	0	108.4	L941 T942 E966 T967	L941-I979 VanDerWaalsContact O-CD1 3.27Å; L941-I979 WeakPolarHBondContact O-CD1 3.43Å; T942-I979 WeakPolarHBondContact OG1-CD1 3.34Å; E966-I979 CarbonylContact C-O 3.35Å; E966-I979 WeakPolarHBondContact CA-O 3.26Å; E966-I979 WeakPolarHBondContact CB-O 3.28Å; T967-I979 PolarHBondContact N-O 2.83Å; T967-I979 PolarHBondContact O-N 3.3Å
980	I	78.9	Confident	67.9	Low	141 Å²	141	52.6 Å²	52.6	72%	0.723	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	125.2	175	-57.6	175.1	0	0	0	109.1	S982	I980-S982 PolarHBondContact O-N 2.92Å
981	E	70.8	Confident	64.9	Low	16 Å²	16	55.8 Å²	55.8	8%	0.075	32%	0.315	C	S	.	.			trans	-78.1	119.6	177	-74.4	-81.2	-147.7	0	0	110.1	Q940 R962 K965 S983	Q940-E981 PolarHBondContact NE2-OE2 2.91Å; Q940-E981 PolarHBondContact OE1-OE1 2.8Å; R962-E981 IonicContact CZ-OE1 3.27Å; R962-E981 IonicContact NE-OE1 3.96Å; R962-E981 PolarHBondContact NE-OE1 2.94Å; R962-E981 IonicContact NH2-OE1 3.39Å; R962-E981 PolarHBondContact NH2-OE1 2.95Å; R962-E981 VanDerWaalsContact NH2-OE1 3.14Å; K965-E981 PolarHBondContact O-N 2.83Å; E981-S983 VanDerWaalsContact C-N 3.35Å; E981-S983 PolarHBondContact O-N 2.94Å
982	S	56.3	Low	62	Low	114 Å²	114	60.7 Å²	60.7	80%	0.797	34%	0.341	S	S	*	.	S	Bend	trans	-77.9	-16.3	-174.9	60.8	0	0	0	0	114.2	I980	I980-S982 PolarHBondContact O-N 2.92Å
983	S	51.7	Low	59	Low	48 Å²	48	67.9 Å²	67.9	34%	0.336	38%	0.379	S	S	.	.	S	Bend	trans	-148.8	136.7	176.9	73.5	0	0	0	0	111.2	E981 R985	E981-S983 VanDerWaalsContact C-N 3.35Å; E981-S983 PolarHBondContact O-N 2.94Å; S983-R985 PolarHBondContact O-N 2.78Å; S983-R985 VanDerWaalsContact O-N 3.11Å
984	Q	48.1	Very low	56.5	Low	73 Å²	73	69.2 Å²	69.2	34%	0.341	38%	0.379	S	S	.	.			trans	-66.1	104.3	174.2	-62.7	171.4	-12.2	0	0	109.4
985	R	47.4	Very low	53.9	Low	47 Å²	47	72.8 Å²	72.8	18%	0.177	39%	0.39	C	S	.	.			trans	-142.9	150.4	176.5	-80.1	-167	180	-147.1	1.2	113.3	D117 R962 S983	D117-R985 IonicContact OD2-NH1 2.86Å; D117-R985 PolarHBondContact OD2-NH1 2.92Å; R962-R985 PolarHBondContact NH2-O 3.5Å; R962-R985 VanDerWaalsContact NH2-O 3.14Å; S983-R985 PolarHBondContact O-N 2.78Å; S983-R985 VanDerWaalsContact O-N 3.11Å
986	S	38.3	Very low	51.3	Low	25 Å²	25	67.8 Å²	67.8	18%	0.175	37%	0.373	C	S	.	.			trans	-74.5	151.6	178.3	32	0	0	0	0	114.7	E889 F890	E889-S986 CarbonylContact O-C 3.51Å; E889-S986 VanDerWaalsContact O-C 3.24Å; E889-S986 WeakPolarHBondContact O-CA 3.38Å; E889-S986 WeakPolarHBondContact O-CB 3.48Å; F890-S986 VanDerWaalsContact CD1-CA 3.5Å
987	F	38.5	Very low	48.8	Very low	16 Å²	16	69 Å²	69	7%	0.07	39%	0.386	C	S	.	.			trans	-90.6	148	157.2	-174.9	-130.2	0	0	0	108.9	S888 E889 V935 V989	S888-F987 CarbonylContact O-C 3.42Å; S888-F987 WeakPolarHBondContact O-CB 3.31Å; S888-F987 WeakPolarHBondContact O-CD1 3.39Å; E889-F987 CarbonylContact C-O 3.58Å; E889-F987 VanDerWaalsContact CA-O 3.24Å; E889-F987 WeakPolarHBondContact CA-O 3.17Å; E889-F987 PolarHBondContact O-N 2.8Å; E889-F987 VanDerWaalsContact O-O 3.07Å; V935-F987 HydrophobicContact CB-CD2 4.45Å; V935-F987 HydrophobicContact CG1-CB 4.25Å; V935-F987 HydrophobicContact CG1-CD2 3.52Å; V935-F987 HydrophobicContact CG1-CE2 4.26Å; V935-F987 HydrophobicContact CG1-CG 4.28Å; F987-V989 HydrophobicContact CD1-CG2 4Å; F987-V989 HydrophobicContact CE1-CG2 3.18Å; F987-V989 HydrophobicContact CZ-CG2 3.52Å
988	S	35.8	Very low	46.3	Very low	44 Å²	44	72.4 Å²	72.4	31%	0.308	41%	0.414	S	S	.	.			trans	-139.1	120.6	162.7	177.3	0	0	0	0	104.8	Q917 A990	Q917-S988 PolarHBondContact OE1-O 2.83Å; S988-A990 VanDerWaalsContact C-N 3.32Å; S988-A990 PolarHBondContact O-N 3.31Å
989	V	35.4	Very low	44.5	Very low	17 Å²	17	73 Å²	73	10%	0.103	41%	0.411	C	S	.	.			trans	-72.6	97.4	169.5	174.1	0	0	0	0	106.1	L886 N910 F987 N991	L886-V989 WeakPolarHBondContact O-CB 3.43Å; L886-V989 VanDerWaalsContact O-CG2 3.28Å; L886-V989 WeakPolarHBondContact O-CG2 3.49Å; N910-V989 WeakPolarHBondContact ND2-CG1 3.44Å; F987-V989 HydrophobicContact CD1-CG2 4Å; F987-V989 HydrophobicContact CE1-CG2 3.18Å; F987-V989 HydrophobicContact CZ-CG2 3.52Å; V989-N991 PolarHBondContact O-N 2.75Å
990	A	33.3	Very low	43.1	Very low	29 Å²	29	76.8 Å²	76.8	24%	0.24	44%	0.437	C	S	.	.			trans	-62.9	114.4	176.6	0	0	0	0	0	109.9	S915 S988 N992	S915-A990 WeakPolarHBondContact OG-CB 3.42Å; S988-A990 VanDerWaalsContact C-N 3.32Å; S988-A990 PolarHBondContact O-N 3.31Å; A990-N992 PolarHBondContact O-N 2.88Å
991	N	30.1	Very low	43	Very low	82 Å²	82	72.9 Å²	72.9	44%	0.439	42%	0.417	S	S	.	.			trans	-62.9	114.8	162.4	-82.6	-28.6	0	0	0	108.8	Y887 V989	Y887-N991 PolarHBondContact OH-ND2 2.96Å; Y887-N991 VanDerWaalsContact OH-ND2 3.16Å; V989-N991 PolarHBondContact O-N 2.75Å
992	N	33.5	Very low	43.7	Very low	103 Å²	103	72.6 Å²	72.6	55%	0.551	42%	0.419	S	S	*	.			trans	-161.3	103	140.7	-91.4	-19.5	0	0	0	106.2	A914 A990 E994	A914-N992 HydrophobicContact CB-CB 4.47Å; A990-N992 PolarHBondContact O-N 2.88Å; N992-E994 PolarHBondContact O-N 3.44Å
993	L	28.8	Very low	45.4	Very low	160 Å²	160	67.6 Å²	67.6	84%	0.838	38%	0.382	S	S	*	.			trans	-62.5	78.2	165.2	-94.9	140.1	0	0	0	108.4
994	E	30.9	Very low	47.4	Very low	125 Å²	125	65.6 Å²	65.6	58%	0.584	37%	0.368	S	S	*	.			trans	-100.6	118.4	159.4	-79.5	-173	169.6	0	0	107.6	N992 S996	N992-E994 PolarHBondContact O-N 3.44Å; E994-S996 PolarHBondContact O-N 2.84Å; E994-S996 VanDerWaalsContact O-N 3.08Å
995	Y	30.9	Very low	49.6	Very low	151 Å²	151	62.1 Å²	62.1	59%	0.592	35%	0.352	S	S	*	.			trans	-28.7	108.8	-176.8	-58.8	-89.2	0	0	0	113.2	R913 A997 P1283	R913-Y995 PolarHBondContact NH1-O 3.34Å; Y995-A997 PolarHBondContact O-N 3.31Å; Y995-P1283 HydrophobicContact CE1-CB 4.48Å
996	S	32.6	Very low	51.9	Low	59 Å²	59	59.9 Å²	59.9	41%	0.413	34%	0.344	S	S	.	.			trans	-47.6	125.1	165.7	-51.2	0	0	0	0	108.7	E994	E994-S996 PolarHBondContact O-N 2.84Å; E994-S996 VanDerWaalsContact O-N 3.08Å
997	A	37.5	Very low	54.6	Low	59 Å²	59	59.1 Å²	59.1	49%	0.488	34%	0.337	S	S	.	.			trans	-54.7	154.4	170.3	0	0	0	0	0	110.3	Y995 F999	Y995-A997 PolarHBondContact O-N 3.31Å; A997-F999 PolarHBondContact O-N 3.47Å; A997-F999 VanDerWaalsContact O-N 3.12Å
998	A	38.7	Very low	57.2	Low	96 Å²	96	58.4 Å²	58.4	79%	0.793	33%	0.334	S	S	*	.			trans	-44.9	119.6	175.8	0	0	0	0	0	110.9	T1000	A998-T1000 PolarHBondContact O-N 3.5Å
999	F	52.7	Low	59.7	Low	81 Å²	81	56.6 Å²	56.6	36%	0.355	32%	0.321	S	S	.	.			trans	-67.2	117	178.5	-61.7	-106.9	0	0	0	108	Q909 A997	Q909-F999 HydrophobicContact CG-CE1 4.19Å; A997-F999 PolarHBondContact O-N 3.47Å; A997-F999 VanDerWaalsContact O-N 3.12Å
1000	T	55.8	Low	62.3	Low	126 Å²	126	55.9 Å²	55.9	77%	0.773	32%	0.317	S	S	*	.	S	Bend	trans	-83.2	-21.3	176	55.1	0	0	0	0	112.5	A998	A998-T1000 PolarHBondContact O-N 3.5Å
1001	D	75.9	Confident	64.7	Low	59 Å²	59	55.2 Å²	55.2	32%	0.316	31%	0.309	S	S	.	.	S	Bend	trans	-125.9	59.8	-164.4	-56.5	-6.9	0	0	0	111	V906 R922	V906-D1001 HydrophobicContact CG2-CB 4.11Å; V906-D1001 PolarHBondContact N-O 3.49Å; R922-D1001 IonicContact CZ-OD2 3.19Å; R922-D1001 IonicContact NH1-OD2 2.97Å; R922-D1001 PolarHBondContact NH1-OD2 2.85Å; R922-D1001 IonicContact NH2-OD2 2.65Å; R922-D1001 PolarHBondContact NH2-OD2 3.02Å
1002	G	84.8	Confident	67.2	Low	10 Å²	10	51.5 Å²	51.5	10%	0.103	29%	0.289	C	S	.	.			trans	-63.9	149.6	-176.6	0	0	0	0	0	116.1	L877 A905	L877-G1002 WeakPolarHBondContact CD2-O 3.43Å; L877-G1002 WeakPolarHBondContact O-CA 3.45Å; A905-G1002 WeakPolarHBondContact CB-O 3.37Å
1003	Y	91.8	Very high	69.2	Low	10 Å²	10	49.1 Å²	49.1	4%	0.039	28%	0.277	C	S	.	.			trans	-94.2	137.9	173.8	178.6	-101.7	0	0	0	111.8	F874 R899 T900 A905 V906 I907 I923 C1006	F874-Y1003 HydrophobicContact CB-CD1 4.03Å; F874-Y1003 HydrophobicContact CB-CE1 4.46Å; F874-Y1003 WeakPolarHBondContact CB-O 3.19Å; F874-Y1003 HydrophobicContact CD1-CD1 4.48Å; F874-Y1003 AromaticContact CD2-CD1 3.87Å; F874-Y1003 HydrophobicContact CD2-CD1 3.87Å; F874-Y1003 AromaticContact CD2-CE1 3.99Å; F874-Y1003 HydrophobicContact CD2-CE1 3.99Å; F874-Y1003 HydrophobicContact CE2-CD1 4.49Å; F874-Y1003 AromaticContact CG-CD1 3.88Å; F874-Y1003 HydrophobicContact CG-CD1 3.88Å; F874-Y1003 HydrophobicContact CG-CE1 4.38Å; R899-Y1003 PolarHBondContact O-OH 3.44Å; T900-Y1003 HydrophobicContact CG2-CE2 4.2Å; A905-Y1003 HydrophobicContact CB-CD2 4.15Å; V906-Y1003 WeakPolarHBondContact O-CB 3.36Å; I907-Y1003 HydrophobicContact CG1-CD2 3.86Å; I907-Y1003 HydrophobicContact CG1-CE2 4.09Å; I923-Y1003 HydrophobicContact CD1-CE2 4.37Å; Y1003-C1006 PolarHBondContact OH-O 2.79Å
1004	V	93.8	Very high	71.3	Confident	6 Å²	6	43.1 Å²	43.1	4%	0.036	25%	0.253	C	S	.	.			trans	-126.6	143.2	165.6	-70.3	0	0	0	0	108.7	F874 L877 T900 I902	F874-V1004 WeakPolarHBondContact O-CA 3.25Å; L877-V1004 HydrophobicContact CD2-CG1 3.84Å; L877-V1004 HydrophobicContact CD2-CG2 4.35Å; L877-V1004 HydrophobicContact CG-CG1 4.11Å; T900-V1004 WeakPolarHBondContact CB-O 3.36Å; T900-V1004 PolarHBondContact OG1-O 2.88Å; I902-V1004 HydrophobicContact CB-CG2 4.09Å; I902-V1004 HydrophobicContact CD1-CG2 4.16Å
1005	G	95.7	Very high	73.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	134.1	-175.6	-173.6	0	0	0	0	0	113.1	T873 F874 R899	T873-G1005 CarbonylContact C-O 3.53Å; T873-G1005 WeakPolarHBondContact CA-O 3.41Å; F874-G1005 PolarHBondContact N-O 2.79Å; F874-G1005 PolarHBondContact O-N 2.86Å; R899-G1005 CarbonylContact O-C 3.59Å; R899-G1005 WeakPolarHBondContact O-CA 3.16Å
1006	C	95.7	Very high	75.8	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	141.4	175.2	-57.7	0	0	0	0	110.6	T871 V872 F898 R899 W955 Y1003 C1036 Y1055	T871-C1006 HydrophobicContact CG2-CB 4.14Å; V872-C1006 CarbonylContact O-C 3.52Å; V872-C1006 WeakPolarHBondContact O-CA 3.41Å; F898-C1006 WeakPolarHBondContact CA-O 2.99Å; R899-C1006 HydrophobicContact CB-CB 4.3Å; R899-C1006 PolarHBondContact N-O 3.04Å; R899-C1006 PolarHBondContact O-N 3.04Å; W955-C1006 HydrophobicContact CH2-CB 3.44Å; W955-C1006 VanDerWaalsContact CH2-CB 3.44Å; W955-C1006 HydrophobicContact CZ2-CB 4.11Å; W955-C1006 HydrophobicContact CZ3-CB 4Å; Y1003-C1006 PolarHBondContact OH-O 2.79Å; C1006-C1036 HydrophobicContact CB-CB 3.88Å; C1006-C1036 WeakPolarHBondContact CB-SG 3.44Å; C1006-C1036 WeakPolarHBondContact SG-CA 3.47Å; C1006-C1036 WeakPolarHBondContact SG-CB 2.97Å; C1006-C1036 CovalentContact SG-SG 2.05Å; C1006-C1036 PolarHBondContact SG-SG 3.19Å; C1006-Y1055 WeakPolarHBondContact SG-CE1 3.45Å
1007	L	94.7	Very high	78.3	Confident	8 Å²	8	35.4 Å²	35.4	4%	0.042	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133	170.2	-173.7	70.3	0	0	0	107.9	T871 V872 F874 F896 F898 I907 M1019	T871-L1007 WeakPolarHBondContact CA-O 3.38Å; V872-L1007 PolarHBondContact N-O 3Å; V872-L1007 PolarHBondContact O-N 3.13Å; F874-L1007 HydrophobicContact CE2-CB 4.06Å; F874-L1007 HydrophobicContact CE2-CD2 4.36Å; F896-L1007 HydrophobicContact CB-CD1 4.21Å; F896-L1007 HydrophobicContact CD2-CD1 3.42Å; F896-L1007 VanDerWaalsContact CD2-CD1 3.42Å; F896-L1007 HydrophobicContact CE2-CD1 4.03Å; F896-L1007 HydrophobicContact CG-CD1 4.04Å; F898-L1007 HydrophobicContact CB-CD1 4.24Å; I907-L1007 HydrophobicContact CG2-CD1 4.18Å; L1007-M1019 HydrophobicContact CD2-SD 3.69Å; L1007-M1019 HydrophobicContact CG-CE 4.28Å; L1007-M1019 HydrophobicContact CG-SD 4.1Å
1008	S	92.5	Very high	80.7	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.007	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	167.4	-180	-164.1	0	0	0	0	111.3	N870 T871 I897 L1010	N870-S1008 PolarHBondContact O-OG 3.05Å; T871-S1008 WeakPolarHBondContact OG1-CB 3.43Å; T871-S1008 PolarHBondContact OG1-OG 2.87Å; I897-S1008 PolarHBondContact N-O 2.85Å; I897-S1008 PolarHBondContact O-N 2.84Å; S1008-L1010 PolarHBondContact O-N 2.76Å; S1008-L1010 VanDerWaalsContact O-N 3.17Å
1009	N	87.7	Confident	83.1	Confident	7 Å²	7	31.3 Å²	31.3	4%	0.037	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	56.4	35.3	169.8	-58.4	41.9	0	0	0	113.5	L867 F868 S895 I897 L1011	L867-N1009 HydrophobicContact CG-CB 4.29Å; L867-N1009 PolarHBondContact O-OD1 3.46Å; F868-N1009 WeakPolarHBondContact CA-OD1 3Å; F868-N1009 WeakPolarHBondContact CD2-ND2 3.27Å; F868-N1009 WeakPolarHBondContact CE1-ND2 3.49Å; F868-N1009 WeakPolarHBondContact CE2-ND2 3.24Å; F868-N1009 WeakPolarHBondContact CG-ND2 2.92Å; F868-N1009 WeakPolarHBondContact CZ-ND2 3.48Å; S895-N1009 VanDerWaalsContact O-O 3.12Å; I897-N1009 HydrophobicContact CD1-CB 4.49Å; I897-N1009 HydrophobicContact CG1-CB 4.19Å; N1009-L1011 PolarHBondContact O-N 2.78Å
1010	L	89.9	Confident	84.9	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	107.9	178.9	179.6	61.7	0	0	0	110.1	L883 M894 S895 F896 M908 S1008 I1012 Q1017 M1019	L883-L1010 HydrophobicContact CD1-CD2 3.43Å; L883-L1010 VanDerWaalsContact CD1-CD2 3.43Å; M894-L1010 HydrophobicContact CG-CD1 3.98Å; M894-L1010 HydrophobicContact SD-CD1 4.13Å; S895-L1010 CarbonylContact O-C 3.5Å; S895-L1010 WeakPolarHBondContact O-CA 3.23Å; F896-L1010 HydrophobicContact CB-CB 4.42Å; F896-L1010 HydrophobicContact CB-CD1 3.94Å; F896-L1010 HydrophobicContact CD1-CD1 4.34Å; M908-L1010 HydrophobicContact CE-CD1 3.78Å; M908-L1010 HydrophobicContact CE-CD2 3.66Å; M908-L1010 HydrophobicContact CE-CG 4.4Å; S1008-L1010 PolarHBondContact O-N 2.76Å; S1008-L1010 VanDerWaalsContact O-N 3.17Å; L1010-I1012 HydrophobicContact CD1-CD1 4.23Å; L1010-I1012 HydrophobicContact CD1-CG1 4.02Å; L1010-I1012 HydrophobicContact CD2-CD1 4.3Å; L1010-I1012 HydrophobicContact CG-CD1 4.3Å; L1010-I1012 HydrophobicContact CG-CG1 4.26Å; L1010-Q1017 HydrophobicContact CB-CB 4.26Å; L1010-Q1017 HydrophobicContact CD2-CB 3.9Å; L1010-Q1017 HydrophobicContact CD2-CG 3.92Å; L1010-Q1017 HydrophobicContact CG-CB 4Å; L1010-Q1017 HydrophobicContact CG-CG 3.84Å; L1010-Q1017 PolarHBondContact O-N 3.38Å; L1010-M1019 HydrophobicContact CB-CE 3.56Å; L1010-M1019 HydrophobicContact CB-SD 3.71Å; L1010-M1019 HydrophobicContact CD2-CG 4.41Å; L1010-M1019 HydrophobicContact CD2-SD 3.83Å; L1010-M1019 HydrophobicContact CG-SD 4.44Å
1011	L	84.7	Confident	86.4	Confident	16 Å²	16	24.6 Å²	24.6	8%	0.084	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.4	172.3	-155.7	78.5	0	0	0	108.3	M894 S895 N1009 V1016	M894-L1011 CarbonylContact C-O 3.55Å; M894-L1011 VanDerWaalsContact CA-O 3.27Å; M894-L1011 WeakPolarHBondContact CA-O 3.38Å; S895-L1011 PolarHBondContact N-O 3.12Å; S895-L1011 PolarHBondContact O-N 2.7Å; S895-L1011 WeakPolarHBondContact OG-CB 3.37Å; N1009-L1011 PolarHBondContact O-N 2.78Å; L1011-V1016 HydrophobicContact CD1-CB 4.4Å; L1011-V1016 HydrophobicContact CD1-CG2 3.61Å
1012	I	82.4	Confident	87	Confident	4 Å²	4	23.2 Å²	23.2	2%	0.021	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	122.9	172.1	-56.8	171.7	0	0	0	108.6	L883 L886 F892 D893 M894 L1010 G1014 V1015 Q1017	L883-I1012 HydrophobicContact CD1-CD1 4.37Å; L886-I1012 HydrophobicContact CD1-CB 4.17Å; L886-I1012 HydrophobicContact CD1-CD1 3.42Å; L886-I1012 VanDerWaalsContact CD1-CD1 3.42Å; L886-I1012 HydrophobicContact CD1-CG1 4.37Å; L886-I1012 HydrophobicContact CD1-CG2 3.84Å; F892-I1012 HydrophobicContact CD2-CG2 4.36Å; F892-I1012 HydrophobicContact CE2-CG2 3.74Å; F892-I1012 HydrophobicContact CZ-CG2 4.41Å; D893-I1012 WeakPolarHBondContact O-CA 3.29Å; M894-I1012 HydrophobicContact CG-CG1 4.09Å; M894-I1012 HydrophobicContact SD-CG1 4.48Å; L1010-I1012 HydrophobicContact CD1-CD1 4.23Å; L1010-I1012 HydrophobicContact CD1-CG1 4.02Å; L1010-I1012 HydrophobicContact CD2-CD1 4.3Å; L1010-I1012 HydrophobicContact CG-CD1 4.3Å; L1010-I1012 HydrophobicContact CG-CG1 4.26Å; I1012-G1014 PolarHBondContact O-N 3.03Å; I1012-V1015 PolarHBondContact N-O 2.88Å; I1012-V1015 WeakPolarHBondContact O-CB 3.4Å; I1012-V1015 PolarHBondContact O-N 2.85Å; I1012-Q1017 HydrophobicContact CD1-CG 3.9Å; I1012-Q1017 HydrophobicContact CG1-CG 4.1Å
1013	N	75	Confident	87.2	Confident	53 Å²	53	23.5 Å²	23.5	28%	0.283	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	45.7	-175.4	-57.8	-27.7	0	0	0	112.3	F892 D893 V1015	F892-N1013 WeakPolarHBondContact CA-OD1 3.49Å; D893-N1013 PolarHBondContact N-OD1 2.93Å; D893-N1013 PolarHBondContact O-N 3.22Å; D893-N1013 WeakPolarHBondContact OD1-CA 3.42Å; D893-N1013 PolarHBondContact OD1-N 3.39Å; D893-N1013 VanDerWaalsContact OD1-N 3.15Å; D893-N1013 WeakPolarHBondContact OD2-CA 3.47Å; N1013-V1015 PolarHBondContact O-N 3.12Å; N1013-V1015 VanDerWaalsContact O-N 3.17Å
1014	G	73.2	Confident	87.1	Confident	34 Å²	34	28.5 Å²	28.5	35%	0.351	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	-2	-175.5	0	0	0	0	0	116.3	D893 I1012	D893-G1014 PolarHBondContact OD1-N 2.76Å; I1012-G1014 PolarHBondContact O-N 3.03Å
1015	V	76.2	Confident	86.8	Confident	87 Å²	87	36 Å²	36	53%	0.527	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	123.9	-179.1	-177.5	0	0	0	0	111.2	I1012 N1013 Q1017	I1012-V1015 PolarHBondContact N-O 2.88Å; I1012-V1015 WeakPolarHBondContact O-CB 3.4Å; I1012-V1015 PolarHBondContact O-N 2.85Å; N1013-V1015 PolarHBondContact O-N 3.12Å; N1013-V1015 VanDerWaalsContact O-N 3.17Å; V1015-Q1017 PolarHBondContact O-N 2.8Å; V1015-Q1017 PolarHBondContact O-NE2 2.83Å
1016	V	80.7	Confident	86.1	Confident	71 Å²	71	38 Å²	38	43%	0.43	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	122.6	173.4	-177.5	0	0	0	0	110	L867 L1011	L867-V1016 HydrophobicContact CD1-CB 4.16Å; L867-V1016 HydrophobicContact CD1-CG1 3.46Å; L867-V1016 VanDerWaalsContact CD1-CG1 3.46Å; L867-V1016 HydrophobicContact CD1-CG2 3.58Å; L1011-V1016 HydrophobicContact CD1-CB 4.4Å; L1011-V1016 HydrophobicContact CD1-CG2 3.61Å
1017	Q	85.4	Confident	85.1	Confident	14 Å²	14	42.4 Å²	42.4	7%	0.065	23%	0.229	C	C	.	.			trans	-87	113.3	176.4	-56	-55.9	-54.7	0	0	109.8	N870 L883 L1010 I1012 V1015 M1019	N870-Q1017 PolarHBondContact ND2-O 2.75Å; L883-Q1017 HydrophobicContact CD2-CB 4.44Å; L1010-Q1017 HydrophobicContact CB-CB 4.26Å; L1010-Q1017 HydrophobicContact CD2-CB 3.9Å; L1010-Q1017 HydrophobicContact CD2-CG 3.92Å; L1010-Q1017 HydrophobicContact CG-CB 4Å; L1010-Q1017 HydrophobicContact CG-CG 3.84Å; L1010-Q1017 PolarHBondContact O-N 3.38Å; I1012-Q1017 HydrophobicContact CD1-CG 3.9Å; I1012-Q1017 HydrophobicContact CG1-CG 4.1Å; V1015-Q1017 PolarHBondContact O-N 2.8Å; V1015-Q1017 PolarHBondContact O-NE2 2.83Å; Q1017-M1019 PolarHBondContact O-N 3.14Å
1018	D	86.4	Confident	84.2	Confident	68 Å²	68	45.1 Å²	45.1	36%	0.364	24%	0.24	S	C	.	.			trans	-70.1	64.8	-177.1	-178.3	22.8	0	0	0	113.3	G1021 L1022 R1025	D1018-G1021 WeakPolarHBondContact OD1-CA 3.41Å; D1018-G1021 PolarHBondContact OD1-N 3.16Å; D1018-L1022 VanDerWaalsContact O-CG 3.26Å; D1018-L1022 WeakPolarHBondContact O-CG 3.26Å; D1018-L1022 PolarHBondContact O-N 3.06Å; D1018-L1022 VanDerWaalsContact O-N 3.13Å; D1018-R1025 IonicContact OD2-CZ 3.34Å; D1018-R1025 VanDerWaalsContact OD2-CZ 3.27Å; D1018-R1025 IonicContact OD2-NH1 3.06Å; D1018-R1025 PolarHBondContact OD2-NH1 3.15Å; D1018-R1025 IonicContact OD2-NH2 2.78Å; D1018-R1025 PolarHBondContact OD2-NH2 2.8Å
1019	M	89.9	Confident	83.4	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-44.8	-178.7	-63.1	-176.7	-65.8	0	0	111.5	N870 V872 L881 L883 L1007 L1010 Q1017 L1022 V1023	N870-M1019 WeakPolarHBondContact O-CE 3.39Å; N870-M1019 PolarHBondContact OD1-N 3Å; N870-M1019 VanDerWaalsContact OD1-N 3.12Å; V872-M1019 HydrophobicContact CG2-CB 3.77Å; L881-M1019 HydrophobicContact CD2-CB 3.73Å; L881-M1019 HydrophobicContact CD2-CG 3.7Å; L881-M1019 HydrophobicContact CD2-SD 4.24Å; L883-M1019 HydrophobicContact CD2-CG 4.43Å; L1007-M1019 HydrophobicContact CD2-SD 3.69Å; L1007-M1019 HydrophobicContact CG-CE 4.28Å; L1007-M1019 HydrophobicContact CG-SD 4.1Å; L1010-M1019 HydrophobicContact CB-CE 3.56Å; L1010-M1019 HydrophobicContact CB-SD 3.71Å; L1010-M1019 HydrophobicContact CD2-CG 4.41Å; L1010-M1019 HydrophobicContact CD2-SD 3.83Å; L1010-M1019 HydrophobicContact CG-SD 4.44Å; Q1017-M1019 PolarHBondContact O-N 3.14Å; M1019-L1022 PolarHBondContact O-N 3.07Å; M1019-V1023 PolarHBondContact O-N 2.61Å
1020	R	90.4	Very high	83.4	Confident	61 Å²	61	50.2 Å²	50.2	23%	0.23	27%	0.267	C	S	.	.	H	α-helix	trans	-64.4	-46.8	-179.9	176.8	170.5	173	-176.2	-11.3	111.5	D869 N870 L1022 V1023 E1024 A1034	D869-R1020 WeakPolarHBondContact O-CD 2.97Å; D869-R1020 PolarHBondContact O-NH1 3Å; D869-R1020 IonicContact OD1-CZ 2.83Å; D869-R1020 IonicContact OD1-NH1 3.73Å; D869-R1020 PolarHBondContact OD1-NH1 3.06Å; D869-R1020 IonicContact OD2-CZ 3.99Å; D869-R1020 IonicContact OD2-NH1 3.91Å; D869-R1020 PolarHBondContact OD2-NH1 3.01Å; N870-R1020 WeakPolarHBondContact OD1-CB 3.33Å; N870-R1020 PolarHBondContact OD1-N 3.3Å; R1020-L1022 VanDerWaalsContact C-N 3.28Å; R1020-L1022 PolarHBondContact O-N 2.93Å; R1020-V1023 PolarHBondContact O-N 2.82Å; R1020-V1023 VanDerWaalsContact O-N 3.09Å; R1020-E1024 HydrophobicContact CG-CG 4.11Å; R1020-E1024 IonicContact CZ-OE1 2.7Å; R1020-E1024 IonicContact NE-OE1 2.66Å; R1020-E1024 PolarHBondContact NE-OE1 3.15Å; R1020-E1024 IonicContact NE-OE2 3.11Å; R1020-E1024 IonicContact NH2-OE1 2.91Å; R1020-E1024 PolarHBondContact NH2-OE1 3.01Å; R1020-E1024 WeakPolarHBondContact O-CG 3.32Å; R1020-E1024 PolarHBondContact O-N 3.47Å; R1020-A1034 HydrophobicContact CG-CB 4.04Å
1021	G	88.1	Confident	83.4	Confident	6 Å²	6	50.1 Å²	50.1	6%	0.062	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-32.5	178.7	0	0	0	0	0	112.9	D1018 V1023 R1025	D1018-G1021 WeakPolarHBondContact OD1-CA 3.41Å; D1018-G1021 PolarHBondContact OD1-N 3.16Å; G1021-V1023 VanDerWaalsContact C-N 3.33Å; G1021-V1023 PolarHBondContact O-N 2.78Å; G1021-R1025 VanDerWaalsContact O-CB 3.23Å; G1021-R1025 WeakPolarHBondContact O-CB 3.26Å; G1021-R1025 WeakPolarHBondContact O-CD 3.49Å; G1021-R1025 WeakPolarHBondContact O-CG 3.26Å; G1021-R1025 PolarHBondContact O-N 3.34Å
1022	L	87.3	Confident	83.8	Confident	30 Å²	30	49.7 Å²	49.7	16%	0.157	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-40	172	-71	173.8	0	0	0	112.3	L881 L883 D1018 M1019 R1020 I1027 Y1028	L881-L1022 HydrophobicContact CD1-CB 4.23Å; L881-L1022 HydrophobicContact CD1-CD1 4.16Å; L883-L1022 HydrophobicContact CD2-CD1 4.32Å; D1018-L1022 VanDerWaalsContact O-CG 3.26Å; D1018-L1022 WeakPolarHBondContact O-CG 3.26Å; D1018-L1022 PolarHBondContact O-N 3.06Å; D1018-L1022 VanDerWaalsContact O-N 3.13Å; M1019-L1022 PolarHBondContact O-N 3.07Å; R1020-L1022 VanDerWaalsContact C-N 3.28Å; R1020-L1022 PolarHBondContact O-N 2.93Å; L1022-I1027 HydrophobicContact CD2-CD1 3.69Å; L1022-I1027 WeakPolarHBondContact O-CB 3.3Å; L1022-I1027 PolarHBondContact O-N 3.27Å; L1022-I1027 VanDerWaalsContact O-N 3.1Å; L1022-Y1028 HydrophobicContact CB-CD2 4.43Å
1023	V	89.4	Confident	84.2	Confident	15 Å²	15	50.5 Å²	50.5	9%	0.091	27%	0.271	C	S	.	.	H	α-helix	trans	-75.3	-43.9	178.4	178.5	0	0	0	0	111.3	V872 L881 M1019 R1020 G1021 R1025 G1026 L1032 A1034	V872-V1023 HydrophobicContact CG1-CG2 3.97Å; V872-V1023 HydrophobicContact CG2-CG2 3.91Å; L881-V1023 HydrophobicContact CD1-CG2 4.48Å; M1019-V1023 PolarHBondContact O-N 2.61Å; R1020-V1023 PolarHBondContact O-N 2.82Å; R1020-V1023 VanDerWaalsContact O-N 3.09Å; G1021-V1023 VanDerWaalsContact C-N 3.33Å; G1021-V1023 PolarHBondContact O-N 2.78Å; V1023-R1025 PolarHBondContact O-N 2.78Å; V1023-G1026 WeakPolarHBondContact O-CA 2.99Å; V1023-G1026 PolarHBondContact O-N 3.44Å; V1023-L1032 HydrophobicContact CG1-CB 4.33Å; V1023-L1032 HydrophobicContact CG2-CB 4.14Å; V1023-L1032 HydrophobicContact CG2-CD1 4.02Å; V1023-A1034 HydrophobicContact CG1-CB 4.4Å
1024	E	90.4	Very high	85	Confident	115 Å²	115	48.9 Å²	48.9	54%	0.537	27%	0.265	S	S	.	.	H	α-helix	trans	-66.3	-35.7	179.6	-72.3	-175.9	161.9	0	0	113	R1020 G1026 A1034	R1020-E1024 HydrophobicContact CG-CG 4.11Å; R1020-E1024 IonicContact CZ-OE1 2.7Å; R1020-E1024 IonicContact NE-OE1 2.66Å; R1020-E1024 PolarHBondContact NE-OE1 3.15Å; R1020-E1024 IonicContact NE-OE2 3.11Å; R1020-E1024 IonicContact NH2-OE1 2.91Å; R1020-E1024 PolarHBondContact NH2-OE1 3.01Å; R1020-E1024 WeakPolarHBondContact O-CG 3.32Å; R1020-E1024 PolarHBondContact O-N 3.47Å; E1024-G1026 PolarHBondContact O-N 2.85Å; E1024-A1034 HydrophobicContact CG-CB 3.65Å
1025	R	87.7	Confident	85.9	Confident	164 Å²	164	48 Å²	48	62%	0.619	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-5.7	172.6	-67.6	173.8	-162.3	121.8	7.6	112.8	D1018 G1021 V1023 I1027	D1018-R1025 IonicContact OD2-CZ 3.34Å; D1018-R1025 VanDerWaalsContact OD2-CZ 3.27Å; D1018-R1025 IonicContact OD2-NH1 3.06Å; D1018-R1025 PolarHBondContact OD2-NH1 3.15Å; D1018-R1025 IonicContact OD2-NH2 2.78Å; D1018-R1025 PolarHBondContact OD2-NH2 2.8Å; G1021-R1025 VanDerWaalsContact O-CB 3.23Å; G1021-R1025 WeakPolarHBondContact O-CB 3.26Å; G1021-R1025 WeakPolarHBondContact O-CD 3.49Å; G1021-R1025 WeakPolarHBondContact O-CG 3.26Å; G1021-R1025 PolarHBondContact O-N 3.34Å; V1023-R1025 PolarHBondContact O-N 2.78Å; R1025-I1027 VanDerWaalsContact C-N 3.34Å; R1025-I1027 HydrophobicContact CB-CD1 4.22Å; R1025-I1027 HydrophobicContact CB-CG1 4.14Å; R1025-I1027 PolarHBondContact O-N 2.88Å
1026	G	80.2	Confident	86.7	Confident	41 Å²	41	45.7 Å²	45.7	42%	0.423	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	20.8	178.5	0	0	0	0	0	114.5	V1023 E1024	V1023-G1026 WeakPolarHBondContact O-CA 2.99Å; V1023-G1026 PolarHBondContact O-N 3.44Å; E1024-G1026 PolarHBondContact O-N 2.85Å
1027	I	75.6	Confident	87.2	Confident	93 Å²	93	48.7 Å²	48.7	48%	0.477	25%	0.25	S	S	.	.	S	Bend	trans	-70.2	-41.1	178.8	-59.9	171.5	0	0	0	109.7	L1022 R1025	L1022-I1027 HydrophobicContact CD2-CD1 3.69Å; L1022-I1027 WeakPolarHBondContact O-CB 3.3Å; L1022-I1027 PolarHBondContact O-N 3.27Å; L1022-I1027 VanDerWaalsContact O-N 3.1Å; R1025-I1027 VanDerWaalsContact C-N 3.34Å; R1025-I1027 HydrophobicContact CB-CD1 4.22Å; R1025-I1027 HydrophobicContact CB-CG1 4.14Å; R1025-I1027 PolarHBondContact O-N 2.88Å
1028	Y	74.2	Confident	87.5	Confident	66 Å²	66	49.2 Å²	49.2	26%	0.259	26%	0.255	S	S	.	.	S	Bend	trans	-131	120.1	173.1	-56.1	-78.3	0	0	0	109.4	L881 E882 L1022	L881-Y1028 HydrophobicContact CD1-CD2 3.7Å; L881-Y1028 HydrophobicContact CD1-CE2 4.44Å; L881-Y1028 HydrophobicContact CD1-CG 4.17Å; E882-Y1028 HydrophobicContact CB-CE1 4.09Å; E882-Y1028 WeakPolarHBondContact CB-OH 3.43Å; E882-Y1028 WeakPolarHBondContact O-CE2 3.2Å; L1022-Y1028 HydrophobicContact CB-CD2 4.43Å
1029	T	75.9	Confident	87.7	Confident	80 Å²	80	47.5 Å²	47.5	49%	0.491	24%	0.244	S	C	.	.			trans	-125.4	-21.6	-174.3	54.3	0	0	0	0	113.9	G1031 L1032	T1029-G1031 PolarHBondContact O-N 3.19Å; T1029-L1032 PolarHBondContact O-N 3.22Å
1030	Y	88.7	Confident	87.9	Confident	34 Å²	34	48.5 Å²	48.5	13%	0.133	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	116.3	-174.1	176.4	-105.1	0	0	0	112.1	K876 D878 L1032 E1278 R1280	K876-Y1030 HydrophobicContact CD-CE1 4.38Å; K876-Y1030 HydrophobicContact CD-CE2 3.97Å; D878-Y1030 VanDerWaalsContact CG-OH 3.23Å; D878-Y1030 WeakPolarHBondContact OD1-CE1 3.15Å; D878-Y1030 PolarHBondContact OD1-OH 3.29Å; D878-Y1030 VanDerWaalsContact OD2-CE1 3.28Å; D878-Y1030 WeakPolarHBondContact OD2-CE1 3.39Å; D878-Y1030 PolarHBondContact OD2-OH 3.47Å; Y1030-L1032 PolarHBondContact O-N 3.19Å; Y1030-L1032 VanDerWaalsContact O-N 3.14Å; Y1030-E1278 HydrophobicContact CE2-CB 4.49Å; Y1030-R1280 HydrophobicContact CD1-CB 4.25Å; Y1030-R1280 HydrophobicContact CD1-CG 4.03Å; Y1030-R1280 VanDerWaalsContact CD2-CA 3.45Å; Y1030-R1280 HydrophobicContact CD2-CB 4.12Å; Y1030-R1280 HydrophobicContact CE1-CB 4.03Å; Y1030-R1280 HydrophobicContact CE1-CG 4.13Å; Y1030-R1280 HydrophobicContact CE2-CB 3.89Å; Y1030-R1280 HydrophobicContact CG-CB 4.27Å; Y1030-R1280 HydrophobicContact CG-CG 4.26Å
1031	G	89.9	Confident	87.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	65	11.4	178.6	0	0	0	0	0	114.8	R875 T1029 E1278	R875-G1031 PolarHBondContact N-O 2.02Å; T1029-G1031 PolarHBondContact O-N 3.19Å; G1031-E1278 PolarHBondContact N-OE2 2.94Å; G1031-E1278 VanDerWaalsContact N-OE2 3.16Å
1032	L	91.9	Very high	87.9	Confident	7 Å²	7	53 Å²	53	4%	0.037	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	153.4	178.8	-60.9	-179.6	0	0	0	110.9	V872 T873 F874 R875 A879 L881 V1023 T1029 Y1030	V872-L1032 HydrophobicContact CG1-CB 4.28Å; V872-L1032 HydrophobicContact CG1-CD2 4.08Å; T873-L1032 CarbonylContact O-C 3.55Å; T873-L1032 WeakPolarHBondContact O-CA 3.48Å; F874-L1032 HydrophobicContact CD1-CD2 3.45Å; F874-L1032 VanDerWaalsContact CD1-CD2 3.45Å; F874-L1032 HydrophobicContact CD2-CD2 4.25Å; F874-L1032 HydrophobicContact CE1-CD2 3.55Å; F874-L1032 HydrophobicContact CE2-CD2 4.33Å; F874-L1032 HydrophobicContact CG-CD2 3.81Å; F874-L1032 HydrophobicContact CZ-CD2 3.99Å; R875-L1032 PolarHBondContact NH2-O 3.03Å; A879-L1032 HydrophobicContact CB-CD2 4.02Å; A879-L1032 HydrophobicContact CB-CG 4.49Å; L881-L1032 HydrophobicContact CB-CD1 4.19Å; L881-L1032 HydrophobicContact CD1-CD1 4.08Å; V1023-L1032 HydrophobicContact CG1-CB 4.33Å; V1023-L1032 HydrophobicContact CG2-CB 4.14Å; V1023-L1032 HydrophobicContact CG2-CD1 4.02Å; T1029-L1032 PolarHBondContact O-N 3.22Å; Y1030-L1032 PolarHBondContact O-N 3.19Å; Y1030-L1032 VanDerWaalsContact O-N 3.14Å
1033	S	92.1	Very high	88.1	Confident	21 Å²	21	57.9 Å²	57.9	15%	0.147	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	142.2	166.5	57.3	0	0	0	0	111.4	V872 T873	V872-S1033 WeakPolarHBondContact CA-O 3.23Å; T873-S1033 WeakPolarHBondContact CB-OG 3.26Å; T873-S1033 PolarHBondContact N-O 3.44Å; T873-S1033 PolarHBondContact O-N 3.11Å
1034	A	92.3	Very high	88.3	Confident	19 Å²	19	58 Å²	58	16%	0.157	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	138.7	174.5	0	0	0	0	0	111.7	R1020 V1023 E1024 K1037	R1020-A1034 HydrophobicContact CG-CB 4.04Å; V1023-A1034 HydrophobicContact CG1-CB 4.4Å; E1024-A1034 HydrophobicContact CG-CB 3.65Å; A1034-K1037 VanDerWaalsContact O-CE 3.28Å; A1034-K1037 WeakPolarHBondContact O-CE 3.14Å
1035	G	91.5	Very high	88.5	Confident	15 Å²	15	53.3 Å²	53.3	16%	0.155	30%	0.302	C	S	.	.	S	Bend	trans	81.1	173.5	-172.3	0	0	0	0	0	113.3	T871 T873	T871-G1035 WeakPolarHBondContact O-CA 3.33Å; T871-G1035 PolarHBondContact O-N 3.3Å; T873-G1035 PolarHBondContact N-O 2.84Å; T873-G1035 PolarHBondContact OG1-O 3.06Å
1036	C	92.1	Very high	88.7	Confident	39 Å²	39	48.1 Å²	48.1	26%	0.264	29%	0.286	S	S	.	.			trans	-89.4	102.6	167.4	-167	0	0	0	0	109.5	T871 T873 W955 C1006 P1038	T871-C1036 HydrophobicContact CG2-CB 3.74Å; T873-C1036 WeakPolarHBondContact OG1-CA 3.29Å; W955-C1036 HydrophobicContact CH2-CB 4.45Å; W955-C1036 HydrophobicContact CZ2-CB 4.03Å; C1006-C1036 HydrophobicContact CB-CB 3.88Å; C1006-C1036 WeakPolarHBondContact CB-SG 3.44Å; C1006-C1036 WeakPolarHBondContact SG-CA 3.47Å; C1006-C1036 WeakPolarHBondContact SG-CB 2.97Å; C1006-C1036 CovalentContact SG-SG 2.05Å; C1006-C1036 PolarHBondContact SG-SG 3.19Å; C1036-P1038 VanDerWaalsContact C-CD 3.44Å; C1036-P1038 VanDerWaalsContact O-CD 3.22Å; C1036-P1038 WeakPolarHBondContact O-CD 3.48Å
1037	K	91	Very high	89.2	Confident	134 Å²	134	49.2 Å²	49.2	58%	0.583	28%	0.282	S	S	*	.			trans	-116.9	76.3	-177.8	-66.4	-176	-179.7	177.3	0	110.1	T873 A1034	T873-K1037 PolarHBondContact OG1-N 2.83Å; A1034-K1037 VanDerWaalsContact O-CE 3.28Å; A1034-K1037 WeakPolarHBondContact O-CE 3.14Å
1038	P	92.1	Very high	89.8	Confident	24 Å²	24	55 Å²	55	16%	0.156	30%	0.298	C	S	.	.			trans	-62.4	145.3	171.3	26.9	-30.5	0	0	0	109.5	C1036 C1040 A1041 E1053 Y1055	C1036-P1038 VanDerWaalsContact C-CD 3.44Å; C1036-P1038 VanDerWaalsContact O-CD 3.22Å; C1036-P1038 WeakPolarHBondContact O-CD 3.48Å; P1038-C1040 VanDerWaalsContact C-N 3.26Å; P1038-C1040 PolarHBondContact O-N 2.92Å; P1038-A1041 HydrophobicContact CG-CB 4.1Å; P1038-A1041 VanDerWaalsContact O-CB 3.29Å; P1038-A1041 WeakPolarHBondContact O-CB 3.21Å; P1038-A1041 PolarHBondContact O-N 3.4Å; P1038-A1041 VanDerWaalsContact O-N 3.14Å; P1038-E1053 VanDerWaalsContact C-OE2 3.3Å; P1038-E1053 HydrophobicContact CB-CG 4.02Å; P1038-E1053 WeakPolarHBondContact CB-OE2 3.37Å; P1038-Y1055 HydrophobicContact CB-CE1 4.12Å
1039	K	91.8	Very high	90.6	Very high	32 Å²	32	52.5 Å²	52.5	14%	0.139	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-64.6	-31.3	-178.9	-73.5	-178.8	172.1	-115.9	0	112.3	A1041 S1042 E1053 Y1055 S1056 Y1058 E1275	K1039-A1041 PolarHBondContact O-N 2.79Å; K1039-S1042 PolarHBondContact O-N 2.78Å; K1039-S1042 PolarHBondContact O-OG 2.72Å; K1039-E1053 VanDerWaalsContact N-CD 3.33Å; K1039-E1053 PolarHBondContact N-OE1 2.73Å; K1039-E1053 PolarHBondContact N-OE2 2.82Å; K1039-Y1055 WeakPolarHBondContact CD-O 3.13Å; K1039-Y1055 WeakPolarHBondContact CE-O 3.45Å; K1039-S1056 VanDerWaalsContact CE-O 3.24Å; K1039-S1056 WeakPolarHBondContact CE-O 3.45Å; K1039-S1056 PolarHBondContact NZ-O 3.08Å; K1039-Y1058 HydrophobicContact CB-CD1 3.84Å; K1039-Y1058 HydrophobicContact CB-CG 4.45Å; K1039-Y1058 HydrophobicContact CD-CD1 4.07Å; K1039-E1275 IonicContact NZ-OE1 2.84Å; K1039-E1275 PolarHBondContact NZ-OE1 2.82Å; K1039-E1275 IonicContact NZ-OE2 3.16Å; K1039-E1275 PolarHBondContact NZ-OE2 3.12Å
1040	C	93.7	Very high	91.5	Very high	22 Å²	22	54.5 Å²	54.5	15%	0.149	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-67.9	-14.2	176	-70.3	0	0	0	0	113.9	P1038 S1042 N1043 C1051 E1053	P1038-C1040 VanDerWaalsContact C-N 3.26Å; P1038-C1040 PolarHBondContact O-N 2.92Å; C1040-S1042 PolarHBondContact O-N 3.13Å; C1040-N1043 PolarHBondContact O-N 2.92Å; C1040-C1051 WeakPolarHBondContact CA-SG 3.37Å; C1040-C1051 HydrophobicContact CB-CB 3.73Å; C1040-C1051 WeakPolarHBondContact CB-SG 3.2Å; C1040-C1051 WeakPolarHBondContact SG-CB 3.24Å; C1040-C1051 CovalentContact SG-SG 2.04Å; C1040-C1051 PolarHBondContact SG-SG 2.79Å; C1040-E1053 WeakPolarHBondContact CB-OE2 3.32Å; C1040-E1053 PolarHBondContact N-OE2 2.99Å
1041	A	90.4	Very high	91.8	Very high	70 Å²	70	54.6 Å²	54.6	58%	0.579	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-64	-24.7	177.2	0	0	0	0	0	113.5	P1038 K1039 N1043	P1038-A1041 HydrophobicContact CG-CB 4.1Å; P1038-A1041 VanDerWaalsContact O-CB 3.29Å; P1038-A1041 WeakPolarHBondContact O-CB 3.21Å; P1038-A1041 PolarHBondContact O-N 3.4Å; P1038-A1041 VanDerWaalsContact O-N 3.14Å; K1039-A1041 PolarHBondContact O-N 2.79Å; A1041-N1043 PolarHBondContact O-N 2.93Å
1042	S	88.6	Confident	92	Very high	93 Å²	93	56.4 Å²	56.4	65%	0.65	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-78.6	-1.3	175.4	60.9	0	0	0	0	113.5	K1039 C1040	K1039-S1042 PolarHBondContact O-N 2.78Å; K1039-S1042 PolarHBondContact O-OG 2.72Å; C1040-S1042 PolarHBondContact O-N 3.13Å
1043	N	91.3	Very high	92.1	Very high	131 Å²	131	56.5 Å²	56.5	70%	0.701	31%	0.313	S	S	*	.			trans	49.7	58.7	-170	-59.2	-60.4	0	0	0	112.2	C1040 A1041 C1045	C1040-N1043 PolarHBondContact O-N 2.92Å; A1041-N1043 PolarHBondContact O-N 2.93Å; N1043-C1045 PolarHBondContact O-N 2.92Å
1044	P	92.3	Very high	92.2	Very high	19 Å²	19	59.7 Å²	59.7	12%	0.123	32%	0.322	C	S	.	.			trans	-69.3	-21.1	-173.6	29.7	-36	0	0	0	113.2	L1046 Y1058	P1044-L1046 PolarHBondContact O-N 2.93Å; P1044-Y1058 HydrophobicContact CB-CD2 4.25Å; P1044-Y1058 HydrophobicContact CB-CE1 4.18Å; P1044-Y1058 HydrophobicContact CB-CE2 3.57Å; P1044-Y1058 HydrophobicContact CG-CD1 4.37Å; P1044-Y1058 HydrophobicContact CG-CD2 3.7Å; P1044-Y1058 HydrophobicContact CG-CE1 4.24Å; P1044-Y1058 HydrophobicContact CG-CE2 3.55Å; P1044-Y1058 HydrophobicContact CG-CG 4.12Å
1045	C	94.2	Very high	92.3	Very high	15 Å²	15	58.8 Å²	58.8	10%	0.101	32%	0.315	C	S	.	.			trans	-78.6	119.6	179.1	-53	0	0	0	0	110.6	N1043 G1049 C1051 C1060	N1043-C1045 PolarHBondContact O-N 2.92Å; C1045-G1049 VanDerWaalsContact CB-O 3.29Å; C1045-G1049 WeakPolarHBondContact CB-O 3.47Å; C1045-C1051 HydrophobicContact CB-CB 4.49Å; C1045-C1051 WeakPolarHBondContact SG-CA 3.26Å; C1045-C1051 WeakPolarHBondContact SG-CB 3.36Å; C1045-C1060 WeakPolarHBondContact CA-SG 3.33Å; C1045-C1060 HydrophobicContact CB-CB 3.75Å; C1045-C1060 WeakPolarHBondContact CB-SG 3.25Å; C1045-C1060 WeakPolarHBondContact SG-CA 3.33Å; C1045-C1060 WeakPolarHBondContact SG-CB 3.43Å; C1045-C1060 CovalentContact SG-SG 2.02Å; C1045-C1060 PolarHBondContact SG-SG 2.82Å
1046	L	92.2	Very high	92.2	Very high	55 Å²	55	60.1 Å²	60.1	29%	0.288	32%	0.321	S	S	.	.			trans	-80.4	167.8	177.8	-58.4	179.7	0	0	0	110.7	P1044 R1048 G1049 I1071 C1072 I1270	P1044-L1046 PolarHBondContact O-N 2.93Å; L1046-R1048 VanDerWaalsContact C-N 3.25Å; L1046-R1048 PolarHBondContact O-N 3.33Å; L1046-R1048 VanDerWaalsContact O-N 3.1Å; L1046-G1049 PolarHBondContact O-N 2.72Å; L1046-I1071 WeakPolarHBondContact CB-O 3.01Å; L1046-I1071 HydrophobicContact CD1-CD1 3.89Å; L1046-I1071 HydrophobicContact CD1-CG1 4.35Å; L1046-I1071 HydrophobicContact CG-CD1 4.26Å; L1046-I1071 PolarHBondContact N-O 3.06Å; L1046-C1072 WeakPolarHBondContact O-CB 3.24Å; L1046-I1270 HydrophobicContact CD1-CB 3.94Å; L1046-I1270 HydrophobicContact CD1-CD1 4Å; L1046-I1270 HydrophobicContact CD1-CG2 3.77Å
1047	N	90.5	Very high	92.2	Very high	64 Å²	64	61.6 Å²	61.6	34%	0.342	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	35.6	167.1	-55.9	-51.7	0	0	0	115.5	G1049 T1065 Y1067 C1072	N1047-G1049 VanDerWaalsContact C-N 3.29Å; N1047-G1049 PolarHBondContact O-N 2.74Å; N1047-T1065 WeakPolarHBondContact O-CG2 3.26Å; N1047-Y1067 HydrophobicContact CB-CD1 4.05Å; N1047-Y1067 HydrophobicContact CB-CD2 3.31Å; N1047-Y1067 HydrophobicContact CB-CE1 4.16Å; N1047-Y1067 HydrophobicContact CB-CE2 3.46Å; N1047-Y1067 VanDerWaalsContact CB-CE2 3.46Å; N1047-Y1067 HydrophobicContact CB-CG 3.63Å; N1047-Y1067 VanDerWaalsContact CG-CE1 3.46Å; N1047-Y1067 VanDerWaalsContact CG-CZ 3.48Å; N1047-Y1067 WeakPolarHBondContact ND2-CD1 3.36Å; N1047-Y1067 WeakPolarHBondContact ND2-CE1 3.26Å; N1047-C1072 PolarHBondContact ND2-O 2.73Å
1048	R	89	Confident	92.3	Very high	216 Å²	216	56.5 Å²	56.5	82%	0.815	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	22.1	-177.9	-50.1	177.2	-179.6	168.3	0.9	114.7	L1046	L1046-R1048 VanDerWaalsContact C-N 3.25Å; L1046-R1048 PolarHBondContact O-N 3.33Å; L1046-R1048 VanDerWaalsContact O-N 3.1Å
1049	G	91.5	Very high	92.4	Very high	13 Å²	13	60 Å²	60	13%	0.134	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-62.4	144.2	169.6	0	0	0	0	0	111.9	C1045 L1046 N1047	C1045-G1049 VanDerWaalsContact CB-O 3.29Å; C1045-G1049 WeakPolarHBondContact CB-O 3.47Å; L1046-G1049 PolarHBondContact O-N 2.72Å; N1047-G1049 VanDerWaalsContact C-N 3.29Å; N1047-G1049 PolarHBondContact O-N 2.74Å
1050	E	94.1	Very high	92.5	Very high	121 Å²	121	59.3 Å²	59.3	57%	0.565	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	126.8	177.8	-178.7	174.1	175.3	0	0	110.2	C1060 E1061	E1050-C1060 CarbonylContact O-C 3.59Å; E1050-C1060 WeakPolarHBondContact O-CA 3.22Å; E1050-E1061 HydrophobicContact CB-CB 4.32Å; E1050-E1061 PolarHBondContact N-O 2.84Å; E1050-E1061 VanDerWaalsContact N-O 3.11Å; E1050-E1061 PolarHBondContact O-N 2.8Å
1051	C	95.1	Very high	92.5	Very high	36 Å²	36	63.9 Å²	63.9	24%	0.243	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	121.7	-179.6	-168.1	0	0	0	0	111.4	C1040 C1045	C1040-C1051 WeakPolarHBondContact CA-SG 3.37Å; C1040-C1051 HydrophobicContact CB-CB 3.73Å; C1040-C1051 WeakPolarHBondContact CB-SG 3.2Å; C1040-C1051 WeakPolarHBondContact SG-CB 3.24Å; C1040-C1051 CovalentContact SG-SG 2.04Å; C1040-C1051 PolarHBondContact SG-SG 2.79Å; C1045-C1051 HydrophobicContact CB-CB 4.49Å; C1045-C1051 WeakPolarHBondContact SG-CA 3.26Å; C1045-C1051 WeakPolarHBondContact SG-CB 3.36Å
1052	V	94.4	Very high	92.6	Very high	39 Å²	39	61.2 Å²	61.2	24%	0.236	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	121	174.4	-170.5	0	0	0	0	109.7	Y1054 Y1058 F1059 E1061	V1052-Y1054 HydrophobicContact CB-CE2 4.19Å; V1052-Y1054 HydrophobicContact CG1-CD2 4.41Å; V1052-Y1054 HydrophobicContact CG1-CE2 3.56Å; V1052-Y1058 CarbonylContact O-C 3.55Å; V1052-Y1058 VanDerWaalsContact O-CA 3.28Å; V1052-Y1058 WeakPolarHBondContact O-CA 3.35Å; V1052-Y1058 WeakPolarHBondContact O-CB 3.47Å; V1052-F1059 PolarHBondContact N-O 2.84Å; V1052-F1059 PolarHBondContact O-N 2.85Å; V1052-E1061 HydrophobicContact CG2-CG 4.05Å
1053	E	94.7	Very high	92.6	Very high	8 Å²	8	59.2 Å²	59.2	4%	0.037	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	137.4	-172.2	-177.8	60.2	-120.7	0	0	113.2	T901 P1038 K1039 C1040 Y1055	T901-E1053 WeakPolarHBondContact CG2-O 3.33Å; T901-E1053 PolarHBondContact OG1-O 2.89Å; P1038-E1053 VanDerWaalsContact C-OE2 3.3Å; P1038-E1053 HydrophobicContact CB-CG 4.02Å; P1038-E1053 WeakPolarHBondContact CB-OE2 3.37Å; K1039-E1053 VanDerWaalsContact N-CD 3.33Å; K1039-E1053 PolarHBondContact N-OE1 2.73Å; K1039-E1053 PolarHBondContact N-OE2 2.82Å; C1040-E1053 WeakPolarHBondContact CB-OE2 3.32Å; C1040-E1053 PolarHBondContact N-OE2 2.99Å; E1053-Y1055 HydrophobicContact CG-CD2 4.09Å; E1053-Y1055 HydrophobicContact CG-CE2 4.09Å; E1053-Y1055 HydrophobicContact CG-CG 4.48Å; E1053-Y1055 WeakPolarHBondContact OE1-CA 3.49Å; E1053-Y1055 PolarHBondContact OE1-N 2.81Å
1054	Y	94	Very high	92.4	Very high	88 Å²	88	59.4 Å²	59.4	35%	0.345	30%	0.304	S	S	.	.			trans	-135.6	8.6	171.2	-68.4	-89	0	0	0	114.5	T901 V1052 S1056 H1057 F1059	T901-Y1054 WeakPolarHBondContact OG1-CA 3.22Å; V1052-Y1054 HydrophobicContact CB-CE2 4.19Å; V1052-Y1054 HydrophobicContact CG1-CD2 4.41Å; V1052-Y1054 HydrophobicContact CG1-CE2 3.56Å; Y1054-S1056 PolarHBondContact O-N 2.94Å; Y1054-S1056 PolarHBondContact O-OG 3.03Å; Y1054-H1057 CarbonylContact C-O 3.59Å; Y1054-H1057 VanDerWaalsContact CA-O 3.25Å; Y1054-H1057 WeakPolarHBondContact CA-O 3.01Å; Y1054-H1057 VanDerWaalsContact CB-CE1 3.41Å; Y1054-H1057 WeakPolarHBondContact CB-CE1 3.02Å; Y1054-H1057 VanDerWaalsContact CB-O 3.26Å; Y1054-H1057 WeakPolarHBondContact CB-O 3.36Å; Y1054-H1057 AromaticContact CD2-NE2 3.93Å; Y1054-H1057 AromaticContact CG-CE1 3.77Å; Y1054-H1057 AromaticContact CG-NE2 3.68Å; Y1054-H1057 PolarHBondContact N-O 2.83Å; Y1054-F1059 AromaticContact CD2-CD2 3.84Å; Y1054-F1059 HydrophobicContact CD2-CD2 3.84Å; Y1054-F1059 HydrophobicContact CD2-CE2 4.31Å; Y1054-F1059 AromaticContact CE2-CD2 3.54Å; Y1054-F1059 HydrophobicContact CE2-CD2 3.54Å; Y1054-F1059 HydrophobicContact CE2-CE2 4.16Å
1055	Y	93.2	Very high	92.3	Very high	1 Å²	1	58.8 Å²	58.8	0%	0.004	30%	0.3	C	S	.	.	S	Bend	trans	61.4	-47.3	-179.3	-73.4	-82.9	0	0	0	115.8	T873 R899 T901 N953 C1006 P1038 K1039 E1053 H1057	T873-Y1055 HydrophobicContact CG2-CD1 3.58Å; T873-Y1055 HydrophobicContact CG2-CE1 4.01Å; R899-Y1055 VanDerWaalsContact CD-OH 3.26Å; R899-Y1055 WeakPolarHBondContact CD-OH 3.29Å; R899-Y1055 VanDerWaalsContact CG-OH 3.28Å; R899-Y1055 WeakPolarHBondContact CG-OH 3.49Å; R899-Y1055 PolarHBondContact NE-OH 3.39Å; T901-Y1055 HydrophobicContact CG2-CE2 4.43Å; N953-Y1055 PolarHBondContact OD1-OH 3.43Å; C1006-Y1055 WeakPolarHBondContact SG-CE1 3.45Å; P1038-Y1055 HydrophobicContact CB-CE1 4.12Å; K1039-Y1055 WeakPolarHBondContact CD-O 3.13Å; K1039-Y1055 WeakPolarHBondContact CE-O 3.45Å; E1053-Y1055 HydrophobicContact CG-CD2 4.09Å; E1053-Y1055 HydrophobicContact CG-CE2 4.09Å; E1053-Y1055 HydrophobicContact CG-CG 4.48Å; E1053-Y1055 WeakPolarHBondContact OE1-CA 3.49Å; E1053-Y1055 PolarHBondContact OE1-N 2.81Å; Y1055-H1057 PolarHBondContact N-O 3.02Å
1056	S	90.6	Very high	92.2	Very high	42 Å²	42	58.4 Å²	58.4	29%	0.294	30%	0.297	S	S	.	.	S	Bend	trans	-74.3	-32.7	168.4	58	0	0	0	0	112.8	R875 K1039 Y1054	R875-S1056 WeakPolarHBondContact O-CA 3.18Å; R875-S1056 VanDerWaalsContact O-CB 3.26Å; R875-S1056 WeakPolarHBondContact O-CB 3.22Å; K1039-S1056 VanDerWaalsContact CE-O 3.24Å; K1039-S1056 WeakPolarHBondContact CE-O 3.45Å; K1039-S1056 PolarHBondContact NZ-O 3.08Å; Y1054-S1056 PolarHBondContact O-N 2.94Å; Y1054-S1056 PolarHBondContact O-OG 3.03Å
1057	H	91.7	Very high	92.2	Very high	71 Å²	71	57.4 Å²	57.4	33%	0.329	29%	0.29	S	S	.	.			trans	-150.2	179.9	177.5	62.2	-70.4	0	0	0	109.4	Y1054 Y1055 F1059	Y1054-H1057 CarbonylContact C-O 3.59Å; Y1054-H1057 VanDerWaalsContact CA-O 3.25Å; Y1054-H1057 WeakPolarHBondContact CA-O 3.01Å; Y1054-H1057 VanDerWaalsContact CB-CE1 3.41Å; Y1054-H1057 WeakPolarHBondContact CB-CE1 3.02Å; Y1054-H1057 VanDerWaalsContact CB-O 3.26Å; Y1054-H1057 WeakPolarHBondContact CB-O 3.36Å; Y1054-H1057 AromaticContact CD2-NE2 3.93Å; Y1054-H1057 AromaticContact CG-CE1 3.77Å; Y1054-H1057 AromaticContact CG-NE2 3.68Å; Y1054-H1057 PolarHBondContact N-O 2.83Å; Y1055-H1057 PolarHBondContact N-O 3.02Å; H1057-F1059 AromaticContact CD2-CD2 3.98Å; H1057-F1059 AromaticContact CD2-CE2 3.37Å; H1057-F1059 WeakPolarHBondContact CD2-CE2 3.46Å; H1057-F1059 AromaticContact CD2-CZ 3.6Å; H1057-F1059 AromaticContact NE2-CE2 3.23Å; H1057-F1059 WeakPolarHBondContact NE2-CE2 3.47Å; H1057-F1059 AromaticContact NE2-CZ 3.71Å
1058	Y	92.9	Very high	92.1	Very high	26 Å²	26	57.7 Å²	57.7	10%	0.102	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	162.1	171	62.7	-86.5	0	0	0	108.4	K1039 P1044 V1052 F1070 I1071	K1039-Y1058 HydrophobicContact CB-CD1 3.84Å; K1039-Y1058 HydrophobicContact CB-CG 4.45Å; K1039-Y1058 HydrophobicContact CD-CD1 4.07Å; P1044-Y1058 HydrophobicContact CB-CD2 4.25Å; P1044-Y1058 HydrophobicContact CB-CE1 4.18Å; P1044-Y1058 HydrophobicContact CB-CE2 3.57Å; P1044-Y1058 HydrophobicContact CG-CD1 4.37Å; P1044-Y1058 HydrophobicContact CG-CD2 3.7Å; P1044-Y1058 HydrophobicContact CG-CE1 4.24Å; P1044-Y1058 HydrophobicContact CG-CE2 3.55Å; P1044-Y1058 HydrophobicContact CG-CG 4.12Å; V1052-Y1058 CarbonylContact O-C 3.55Å; V1052-Y1058 VanDerWaalsContact O-CA 3.28Å; V1052-Y1058 WeakPolarHBondContact O-CA 3.35Å; V1052-Y1058 WeakPolarHBondContact O-CB 3.47Å; Y1058-F1070 HydrophobicContact CD2-CE1 4.48Å; Y1058-F1070 HydrophobicContact CE1-CE1 4.42Å; Y1058-F1070 AromaticContact CE2-CE1 3.81Å; Y1058-F1070 HydrophobicContact CE2-CE1 3.81Å; Y1058-F1070 HydrophobicContact CE2-CZ 4.31Å; Y1058-F1070 AromaticContact CZ-CE1 3.77Å; Y1058-F1070 WeakPolarHBondContact O-CZ 3.38Å; Y1058-I1071 HydrophobicContact CE2-CG2 4.03Å; Y1058-I1071 WeakPolarHBondContact OH-CG2 3.24Å
1059	F	93.7	Very high	92.1	Very high	98 Å²	98	48.8 Å²	48.8	43%	0.43	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	142.2	167.8	-70	-66.5	0	0	0	109.5	V1052 Y1054 H1057 F1070	V1052-F1059 PolarHBondContact N-O 2.84Å; V1052-F1059 PolarHBondContact O-N 2.85Å; Y1054-F1059 AromaticContact CD2-CD2 3.84Å; Y1054-F1059 HydrophobicContact CD2-CD2 3.84Å; Y1054-F1059 HydrophobicContact CD2-CE2 4.31Å; Y1054-F1059 AromaticContact CE2-CD2 3.54Å; Y1054-F1059 HydrophobicContact CE2-CD2 3.54Å; Y1054-F1059 HydrophobicContact CE2-CE2 4.16Å; H1057-F1059 AromaticContact CD2-CD2 3.98Å; H1057-F1059 AromaticContact CD2-CE2 3.37Å; H1057-F1059 WeakPolarHBondContact CD2-CE2 3.46Å; H1057-F1059 AromaticContact CD2-CZ 3.6Å; H1057-F1059 AromaticContact NE2-CE2 3.23Å; H1057-F1059 WeakPolarHBondContact NE2-CE2 3.47Å; H1057-F1059 AromaticContact NE2-CZ 3.71Å; F1059-F1070 AromaticContact CD1-CE2 3.83Å; F1059-F1070 HydrophobicContact CD1-CE2 3.83Å; F1059-F1070 HydrophobicContact CE1-CE2 4.06Å
1060	C	95.1	Very high	92.1	Very high	17 Å²	17	52.6 Å²	52.6	12%	0.115	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	122.7	170.3	-61.9	0	0	0	0	110	C1045 E1050 C1062 F1070	C1045-C1060 WeakPolarHBondContact CA-SG 3.33Å; C1045-C1060 HydrophobicContact CB-CB 3.75Å; C1045-C1060 WeakPolarHBondContact CB-SG 3.25Å; C1045-C1060 WeakPolarHBondContact SG-CA 3.33Å; C1045-C1060 WeakPolarHBondContact SG-CB 3.43Å; C1045-C1060 CovalentContact SG-SG 2.02Å; C1045-C1060 PolarHBondContact SG-SG 2.82Å; E1050-C1060 CarbonylContact O-C 3.59Å; E1050-C1060 WeakPolarHBondContact O-CA 3.22Å; C1060-C1062 PolarHBondContact O-N 2.75Å; C1060-F1070 VanDerWaalsContact CB-O 3.29Å; C1060-F1070 WeakPolarHBondContact CB-O 3.39Å
1061	E	93.4	Very high	92	Very high	119 Å²	119	47.3 Å²	47.3	56%	0.556	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	107.2	168.4	-67.3	-164.9	-176.1	0	0	109.5	E1050 V1052	E1050-E1061 HydrophobicContact CB-CB 4.32Å; E1050-E1061 PolarHBondContact N-O 2.84Å; E1050-E1061 VanDerWaalsContact N-O 3.11Å; E1050-E1061 PolarHBondContact O-N 2.8Å; V1052-E1061 HydrophobicContact CG2-CG 4.05Å
1062	C	91.9	Very high	92	Very high	13 Å²	13	45.6 Å²	45.6	9%	0.088	24%	0.239	C	C	.	.			trans	-95.8	-2.9	-179.4	-45.9	0	0	0	0	113.4	C1060 L1064 T1065 Y1067 G1069 C1072	C1060-C1062 PolarHBondContact O-N 2.75Å; C1062-L1064 PolarHBondContact O-N 3.27Å; C1062-L1064 VanDerWaalsContact O-N 3.14Å; C1062-T1065 PolarHBondContact O-N 3.33Å; C1062-T1065 VanDerWaalsContact O-O 3.1Å; C1062-T1065 PolarHBondContact O-OG1 3.35Å; C1062-Y1067 VanDerWaalsContact CB-O 3.24Å; C1062-Y1067 WeakPolarHBondContact CB-O 3.22Å; C1062-G1069 PolarHBondContact SG-O 2.8Å; C1062-G1069 VanDerWaalsContact SG-O 3.35Å; C1062-C1072 WeakPolarHBondContact CA-SG 3.48Å; C1062-C1072 HydrophobicContact CB-CB 3.83Å; C1062-C1072 WeakPolarHBondContact CB-SG 3.16Å; C1062-C1072 WeakPolarHBondContact SG-CA 3.47Å; C1062-C1072 WeakPolarHBondContact SG-CB 3.45Å; C1062-C1072 PolarHBondContact SG-N 3.1Å; C1062-C1072 VanDerWaalsContact SG-N 3.39Å; C1062-C1072 CovalentContact SG-SG 2.04Å; C1062-C1072 PolarHBondContact SG-SG 2.75Å
1063	G	87.8	Confident	91.8	Very high	51 Å²	51	44.1 Å²	44.1	53%	0.526	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.6	-169.4	0	0	0	0	0	115.3
1064	L	87.4	Confident	91.7	Very high	136 Å²	136	46.8 Å²	46.8	71%	0.712	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.3	23	173.8	-61.4	-179.9	0	0	0	112.8	C1062 F1238	C1062-L1064 PolarHBondContact O-N 3.27Å; C1062-L1064 VanDerWaalsContact O-N 3.14Å; L1064-F1238 WeakPolarHBondContact O-CZ 3.17Å
1065	T	90.9	Very high	91.5	Very high	5 Å²	5	43.6 Å²	43.6	3%	0.031	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.3	156.2	178.6	77.2	0	0	0	0	108.8	N1047 C1062 Y1067 F1238 H1241	N1047-T1065 WeakPolarHBondContact O-CG2 3.26Å; C1062-T1065 PolarHBondContact O-N 3.33Å; C1062-T1065 VanDerWaalsContact O-O 3.1Å; C1062-T1065 PolarHBondContact O-OG1 3.35Å; T1065-Y1067 PolarHBondContact O-N 3.46Å; T1065-Y1067 PolarHBondContact OG1-N 2.88Å; T1065-Y1067 PolarHBondContact OG1-O 3.01Å; T1065-F1238 VanDerWaalsContact C-CD1 3.48Å; T1065-F1238 VanDerWaalsContact C-CE1 3.45Å; T1065-H1241 PolarHBondContact O-NE2 3.17Å
1066	P	91.3	Very high	91.5	Very high	7 Å²	7	43.7 Å²	43.7	5%	0.045	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	24.9	175.7	33.9	-34.9	0	0	0	113.3	I1076 A1231 F1238	P1066-I1076 PolarHBondContact O-N 3.3Å; P1066-A1231 HydrophobicContact CB-CB 4.24Å; P1066-A1231 HydrophobicContact CG-CB 4.24Å; P1066-F1238 HydrophobicContact CB-CD1 3.95Å; P1066-F1238 HydrophobicContact CB-CE1 4.48Å
1067	Y	92.1	Very high	91.6	Very high	35 Å²	35	41.8 Å²	41.8	14%	0.137	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	161.9	-175	-59.4	-96.9	0	0	0	110.5	N1047 C1062 T1065 C1072 R1074 Q1075 H1241	N1047-Y1067 HydrophobicContact CB-CD1 4.05Å; N1047-Y1067 HydrophobicContact CB-CD2 3.31Å; N1047-Y1067 HydrophobicContact CB-CE1 4.16Å; N1047-Y1067 HydrophobicContact CB-CE2 3.46Å; N1047-Y1067 VanDerWaalsContact CB-CE2 3.46Å; N1047-Y1067 HydrophobicContact CB-CG 3.63Å; N1047-Y1067 VanDerWaalsContact CG-CE1 3.46Å; N1047-Y1067 VanDerWaalsContact CG-CZ 3.48Å; N1047-Y1067 WeakPolarHBondContact ND2-CD1 3.36Å; N1047-Y1067 WeakPolarHBondContact ND2-CE1 3.26Å; C1062-Y1067 VanDerWaalsContact CB-O 3.24Å; C1062-Y1067 WeakPolarHBondContact CB-O 3.22Å; T1065-Y1067 PolarHBondContact O-N 3.46Å; T1065-Y1067 PolarHBondContact OG1-N 2.88Å; T1065-Y1067 PolarHBondContact OG1-O 3.01Å; Y1067-C1072 WeakPolarHBondContact CB-O 3.37Å; Y1067-R1074 CarbonylContact C-O 3.52Å; Y1067-R1074 VanDerWaalsContact CA-O 3.31Å; Y1067-R1074 WeakPolarHBondContact CA-O 2.99Å; Y1067-Q1075 HydrophobicContact CD1-CB 4.04Å; Y1067-Q1075 HydrophobicContact CD1-CG 4.1Å; Y1067-Q1075 HydrophobicContact CE1-CB 4.07Å; Y1067-Q1075 HydrophobicContact CE1-CG 3.83Å; Y1067-H1241 PolarHBondContact O-CE1 2.99Å; Y1067-H1241 PolarHBondContact O-NE2 2.6Å
1068	R	90.1	Very high	91.7	Very high	69 Å²	69	38.4 Å²	38.4	26%	0.26	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	-169.5	176.7	70.9	-179.2	-162.9	170.2	2.7	111.6	C1072 G1073 R1074 I1076 E1262	R1068-C1072 CarbonylContact O-C 3.28Å; R1068-C1072 VanDerWaalsContact O-C 3.25Å; R1068-C1072 WeakPolarHBondContact O-CA 3.3Å; R1068-G1073 PolarHBondContact O-N 3.06Å; R1068-R1074 HydrophobicContact CG-CB 3.93Å; R1068-R1074 HydrophobicContact CG-CG 3.99Å; R1068-R1074 PolarHBondContact N-O 2.86Å; R1068-R1074 WeakPolarHBondContact O-CA 3.5Å; R1068-R1074 VanDerWaalsContact O-CB 3.23Å; R1068-R1074 WeakPolarHBondContact O-CB 3.23Å; R1068-R1074 PolarHBondContact O-N 3.34Å; R1068-I1076 HydrophobicContact CB-CD1 4.03Å; R1068-I1076 HydrophobicContact CB-CG1 4.2Å; R1068-I1076 HydrophobicContact CG-CD1 4.03Å; R1068-I1076 HydrophobicContact CG-CG1 3.83Å; R1068-E1262 IonicContact CZ-OE1 2.64Å; R1068-E1262 IonicContact CZ-OE2 3.62Å; R1068-E1262 IonicContact NE-OE1 3.83Å; R1068-E1262 PolarHBondContact NE-OE1 3.17Å; R1068-E1262 VanDerWaalsContact NE-OE1 3.11Å; R1068-E1262 IonicContact NH1-OE1 2.81Å; R1068-E1262 PolarHBondContact NH1-OE1 2.88Å; R1068-E1262 IonicContact NH1-OE2 3.52Å; R1068-E1262 PolarHBondContact NH1-OE2 3.35Å; R1068-E1262 IonicContact NH2-OE1 3.69Å; R1068-E1262 PolarHBondContact NH2-OE1 2.88Å; R1068-E1262 IonicContact NH2-OE2 2.7Å; R1068-E1262 PolarHBondContact NH2-OE2 3.45Å
1069	G	88.4	Confident	91.7	Very high	29 Å²	29	38.1 Å²	38.1	30%	0.299	20%	0.202	S	C	.	.	S	Bend	trans	90.7	169.8	-175.1	0	0	0	0	0	111.3	C1062 I1071 C1072	C1062-G1069 PolarHBondContact SG-O 2.8Å; C1062-G1069 VanDerWaalsContact SG-O 3.35Å; G1069-I1071 PolarHBondContact O-N 2.96Å; G1069-C1072 PolarHBondContact O-N 2.93Å; G1069-C1072 VanDerWaalsContact O-N 3.14Å
1070	F	90.9	Very high	91.8	Very high	94 Å²	94	33.5 Å²	33.5	41%	0.412	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-34.1	-171.4	-179.5	-104.4	0	0	0	113.6	Y1058 F1059 C1060 P1272	Y1058-F1070 HydrophobicContact CD2-CE1 4.48Å; Y1058-F1070 HydrophobicContact CE1-CE1 4.42Å; Y1058-F1070 AromaticContact CE2-CE1 3.81Å; Y1058-F1070 HydrophobicContact CE2-CE1 3.81Å; Y1058-F1070 HydrophobicContact CE2-CZ 4.31Å; Y1058-F1070 AromaticContact CZ-CE1 3.77Å; Y1058-F1070 WeakPolarHBondContact O-CZ 3.38Å; F1059-F1070 AromaticContact CD1-CE2 3.83Å; F1059-F1070 HydrophobicContact CD1-CE2 3.83Å; F1059-F1070 HydrophobicContact CE1-CE2 4.06Å; C1060-F1070 VanDerWaalsContact CB-O 3.29Å; C1060-F1070 WeakPolarHBondContact CB-O 3.39Å; F1070-P1272 HydrophobicContact CD1-CG 4.11Å
1071	I	93.1	Very high	91.4	Very high	10 Å²	10	37.5 Å²	37.5	5%	0.051	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	18.6	177.5	63.7	171.3	0	0	0	113.7	L1046 Y1058 G1069 G1073 I1270 P1272	L1046-I1071 WeakPolarHBondContact CB-O 3.01Å; L1046-I1071 HydrophobicContact CD1-CD1 3.89Å; L1046-I1071 HydrophobicContact CD1-CG1 4.35Å; L1046-I1071 HydrophobicContact CG-CD1 4.26Å; L1046-I1071 PolarHBondContact N-O 3.06Å; Y1058-I1071 HydrophobicContact CE2-CG2 4.03Å; Y1058-I1071 WeakPolarHBondContact OH-CG2 3.24Å; G1069-I1071 PolarHBondContact O-N 2.96Å; I1071-G1073 PolarHBondContact O-N 2.84Å; I1071-I1270 HydrophobicContact CD1-CG2 4.3Å; I1071-P1272 HydrophobicContact CD1-CB 4.46Å; I1071-P1272 HydrophobicContact CG2-CB 4.11Å; I1071-P1272 HydrophobicContact CG2-CG 4.22Å
1072	C	93.4	Very high	91	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	58.2	25.8	-171.7	-42.9	0	0	0	0	113.6	L1046 N1047 C1062 Y1067 R1068 G1069	L1046-C1072 WeakPolarHBondContact O-CB 3.24Å; N1047-C1072 PolarHBondContact ND2-O 2.73Å; C1062-C1072 WeakPolarHBondContact CA-SG 3.48Å; C1062-C1072 HydrophobicContact CB-CB 3.83Å; C1062-C1072 WeakPolarHBondContact CB-SG 3.16Å; C1062-C1072 WeakPolarHBondContact SG-CA 3.47Å; C1062-C1072 WeakPolarHBondContact SG-CB 3.45Å; C1062-C1072 PolarHBondContact SG-N 3.1Å; C1062-C1072 VanDerWaalsContact SG-N 3.39Å; C1062-C1072 CovalentContact SG-SG 2.04Å; C1062-C1072 PolarHBondContact SG-SG 2.75Å; Y1067-C1072 WeakPolarHBondContact CB-O 3.37Å; R1068-C1072 CarbonylContact O-C 3.28Å; R1068-C1072 VanDerWaalsContact O-C 3.25Å; R1068-C1072 WeakPolarHBondContact O-CA 3.3Å; G1069-C1072 PolarHBondContact O-N 2.93Å; G1069-C1072 VanDerWaalsContact O-N 3.14Å
1073	G	91.4	Very high	90.7	Very high	8 Å²	8	36.1 Å²	36.1	8%	0.082	21%	0.206	C	C	.	.			trans	-85.9	-4	-178.2	0	0	0	0	0	114.8	R1068 I1071 I1270	R1068-G1073 PolarHBondContact O-N 3.06Å; I1071-G1073 PolarHBondContact O-N 2.84Å; G1073-I1270 PolarHBondContact O-N 2.92Å
1074	R	91.3	Very high	91	Very high	63 Å²	63	33.7 Å²	33.7	24%	0.238	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	117.2	178.3	-175	174	174.4	167.5	8	110.5	Y1067 R1068 L1264 E1269	Y1067-R1074 CarbonylContact C-O 3.52Å; Y1067-R1074 VanDerWaalsContact CA-O 3.31Å; Y1067-R1074 WeakPolarHBondContact CA-O 2.99Å; R1068-R1074 HydrophobicContact CG-CB 3.93Å; R1068-R1074 HydrophobicContact CG-CG 3.99Å; R1068-R1074 PolarHBondContact N-O 2.86Å; R1068-R1074 WeakPolarHBondContact O-CA 3.5Å; R1068-R1074 VanDerWaalsContact O-CB 3.23Å; R1068-R1074 WeakPolarHBondContact O-CB 3.23Å; R1068-R1074 PolarHBondContact O-N 3.34Å; R1074-L1264 HydrophobicContact CG-CD2 3.7Å; R1074-E1269 HydrophobicContact CB-CB 4.29Å; R1074-E1269 HydrophobicContact CB-CG 3.83Å; R1074-E1269 WeakPolarHBondContact CD-OE2 3.5Å; R1074-E1269 HydrophobicContact CG-CB 4.46Å; R1074-E1269 HydrophobicContact CG-CG 4.44Å
1075	Q	90.3	Very high	91.3	Very high	21 Å²	21	27.3 Å²	27.3	10%	0.098	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	136.7	172.5	-159.4	163	40.9	0	0	110.7	Y1067 Y1230 A1231 F1267	Y1067-Q1075 HydrophobicContact CD1-CB 4.04Å; Y1067-Q1075 HydrophobicContact CD1-CG 4.1Å; Y1067-Q1075 HydrophobicContact CE1-CB 4.07Å; Y1067-Q1075 HydrophobicContact CE1-CG 3.83Å; Q1075-Y1230 HydrophobicContact CG-CD2 4.11Å; Q1075-A1231 HydrophobicContact CG-CB 3.9Å; Q1075-A1231 VanDerWaalsContact NE2-CB 3.31Å; Q1075-F1267 VanDerWaalsContact OE1-CZ 3.28Å
1076	I	93	Very high	91.5	Very high	4 Å²	4	27 Å²	27	2%	0.021	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-87.2	123.2	174.9	-53.6	-165.2	0	0	0	108.8	P1066 R1068 Y1230 A1231 L1240 H1241 Y1244	P1066-I1076 PolarHBondContact O-N 3.3Å; R1068-I1076 HydrophobicContact CB-CD1 4.03Å; R1068-I1076 HydrophobicContact CB-CG1 4.2Å; R1068-I1076 HydrophobicContact CG-CD1 4.03Å; R1068-I1076 HydrophobicContact CG-CG1 3.83Å; I1076-Y1230 CarbonylContact O-C 3.53Å; I1076-Y1230 VanDerWaalsContact O-CA 3.27Å; I1076-Y1230 WeakPolarHBondContact O-CA 3.29Å; I1076-Y1230 WeakPolarHBondContact O-CB 3.36Å; I1076-A1231 PolarHBondContact O-N 2.82Å; I1076-L1240 HydrophobicContact CB-CB 4.39Å; I1076-L1240 HydrophobicContact CG2-CB 3.65Å; I1076-L1240 HydrophobicContact CG2-CD1 4.49Å; I1076-L1240 VanDerWaalsContact O-CD1 3.23Å; I1076-L1240 WeakPolarHBondContact O-CD1 3.47Å; I1076-H1241 VanDerWaalsContact CD1-CD2 3.42Å; I1076-H1241 WeakPolarHBondContact CD1-CD2 3.27Å; I1076-H1241 WeakPolarHBondContact CD1-CE1 3.28Å; I1076-H1241 WeakPolarHBondContact CD1-NE2 3.16Å; I1076-Y1244 HydrophobicContact CG2-CD2 3.63Å; I1076-Y1244 HydrophobicContact CG2-CE2 3.6Å
1077	G	93.8	Very high	91.7	Very high	1 Å²	1	28 Å²	28	1%	0.01	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	157.5	178.4	0	0	0	0	0	111.9	I1229 Y1244 E1262 D1263	G1077-I1229 CarbonylContact C-O 3.55Å; G1077-I1229 WeakPolarHBondContact CA-O 3.45Å; G1077-Y1244 WeakPolarHBondContact O-CE2 3.44Å; G1077-Y1244 PolarHBondContact O-OH 2.84Å; G1077-E1262 WeakPolarHBondContact O-CA 3.42Å; G1077-D1263 CarbonylContact C-O 3.57Å; G1077-D1263 WeakPolarHBondContact CA-O 3.35Å; G1077-D1263 PolarHBondContact N-O 3.41Å; G1077-D1263 PolarHBondContact O-N 2.82Å
1078	G	93.6	Very high	91.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	137.1	173.6	0	0	0	0	0	110.8	F1080 C1228 I1229 Y1244 R1261	G1078-F1080 VanDerWaalsContact O-CD2 3.27Å; G1078-F1080 WeakPolarHBondContact O-CD2 3.48Å; G1078-C1228 WeakPolarHBondContact O-CA 3.47Å; G1078-C1228 PolarHBondContact O-SG 2.89Å; G1078-I1229 PolarHBondContact N-O 3.18Å; G1078-I1229 PolarHBondContact O-N 2.81Å; G1078-Y1244 WeakPolarHBondContact CA-OH 3.44Å; G1078-R1261 WeakPolarHBondContact CA-O 3.5Å
1079	T	93.7	Very high	92	Very high	21 Å²	21	25.6 Å²	25.6	13%	0.129	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	116.8	176.2	-69.6	0	0	0	0	109.9	N1081 C1228 R1261 D1263	T1079-N1081 VanDerWaalsContact CG2-CG 3.5Å; T1079-N1081 WeakPolarHBondContact CG2-ND2 3.29Å; T1079-N1081 WeakPolarHBondContact CG2-OD1 3.26Å; T1079-C1228 PolarHBondContact OG1-SG 2.98Å; T1079-R1261 PolarHBondContact N-O 3.49Å; T1079-D1263 WeakPolarHBondContact OG1-CB 3.42Å; T1079-D1263 PolarHBondContact OG1-OD2 2.7Å
1080	F	93.8	Very high	92.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	78.9	-179.7	-74.2	-109.3	0	0	0	108.7	G1078 P1084 V1086 M1213 F1225 D1226 G1227 I1229 V1260	G1078-F1080 VanDerWaalsContact O-CD2 3.27Å; G1078-F1080 WeakPolarHBondContact O-CD2 3.48Å; F1080-P1084 HydrophobicContact CB-CG 3.75Å; F1080-P1084 HydrophobicContact CD1-CG 3.72Å; F1080-P1084 HydrophobicContact CG-CG 4.04Å; F1080-V1086 HydrophobicContact CE1-CB 4.36Å; F1080-V1086 HydrophobicContact CE1-CG2 3.61Å; F1080-V1086 HydrophobicContact CZ-CG2 3.82Å; F1080-M1213 HydrophobicContact CE1-CB 3.95Å; F1080-M1213 HydrophobicContact CZ-CB 3.92Å; F1080-M1213 HydrophobicContact CZ-CE 4.47Å; F1080-F1225 HydrophobicContact CB-CD1 3.9Å; F1080-F1225 HydrophobicContact CG-CD1 4.32Å; F1080-D1226 VanDerWaalsContact O-CA 3.32Å; F1080-D1226 WeakPolarHBondContact O-CA 3.33Å; F1080-G1227 WeakPolarHBondContact CA-O 3.28Å; F1080-G1227 PolarHBondContact N-O 2.66Å; F1080-G1227 PolarHBondContact O-N 3.01Å; F1080-G1227 VanDerWaalsContact O-N 3.13Å; F1080-I1229 HydrophobicContact CD1-CD1 4.29Å; F1080-I1229 HydrophobicContact CD2-CB 4.06Å; F1080-I1229 HydrophobicContact CD2-CD1 3.92Å; F1080-I1229 HydrophobicContact CD2-CG1 3.84Å; F1080-I1229 HydrophobicContact CE1-CD1 4.2Å; F1080-I1229 HydrophobicContact CE2-CB 3.81Å; F1080-I1229 HydrophobicContact CE2-CD1 3.84Å; F1080-I1229 HydrophobicContact CE2-CG1 3.95Å; F1080-I1229 HydrophobicContact CG-CD1 4.18Å; F1080-I1229 HydrophobicContact CG-CG1 4.42Å; F1080-I1229 HydrophobicContact CZ-CD1 3.99Å; F1080-V1260 HydrophobicContact CD1-CG2 3.98Å; F1080-V1260 HydrophobicContact CD2-CG1 4.2Å; F1080-V1260 HydrophobicContact CD2-CG2 4.49Å; F1080-V1260 HydrophobicContact CE1-CG2 3.88Å; F1080-V1260 HydrophobicContact CE2-CG1 3.83Å; F1080-V1260 HydrophobicContact CE2-CG2 4.39Å; F1080-V1260 HydrophobicContact CG-CG2 4.26Å; F1080-V1260 HydrophobicContact CZ-CG1 4.1Å; F1080-V1260 HydrophobicContact CZ-CG2 4.09Å
1081	N	87.9	Confident	91.6	Very high	101 Å²	101	24.4 Å²	24.4	54%	0.54	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	132.2	-179.6	-73.6	-30.2	0	0	0	111.8	T1079 G1083 P1084	T1079-N1081 VanDerWaalsContact CG2-CG 3.5Å; T1079-N1081 WeakPolarHBondContact CG2-ND2 3.29Å; T1079-N1081 WeakPolarHBondContact CG2-OD1 3.26Å; N1081-G1083 VanDerWaalsContact C-N 3.32Å; N1081-G1083 PolarHBondContact O-N 3.29Å; N1081-P1084 WeakPolarHBondContact O-CD 3.48Å
1082	S	84.7	Confident	91	Very high	100 Å²	100	31.5 Å²	31.5	70%	0.699	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.3	32.8	175.4	-51.6	0	0	0	0	114.6	D1226	S1082-D1226 PolarHBondContact N-OD1 2.82Å
1083	G	86	Confident	90.3	Very high	3 Å²	3	36.8 Å²	36.8	3%	0.031	19%	0.193	C	C	.	.	S	Bend	trans	65.9	54	174.3	0	0	0	0	0	115.8	N1081 R1215 P1221 F1225	N1081-G1083 VanDerWaalsContact C-N 3.32Å; N1081-G1083 PolarHBondContact O-N 3.29Å; G1083-R1215 VanDerWaalsContact O-CD 3.26Å; G1083-R1215 WeakPolarHBondContact O-CD 3.26Å; G1083-R1215 PolarHBondContact O-NE 2.64Å; G1083-P1221 WeakPolarHBondContact CA-O 3.48Å; G1083-F1225 WeakPolarHBondContact CA-O 3Å
1084	P	93.4	Very high	89.5	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.006	23%	0.226	C	C	.	.			trans	-70.3	157.5	173.2	30.2	-27.3	0	0	0	111.1	F1080 N1081 S1259 V1260	F1080-P1084 HydrophobicContact CB-CG 3.75Å; F1080-P1084 HydrophobicContact CD1-CG 3.72Å; F1080-P1084 HydrophobicContact CG-CG 4.04Å; N1081-P1084 WeakPolarHBondContact O-CD 3.48Å; P1084-S1259 WeakPolarHBondContact CB-OG 3.43Å; P1084-V1260 HydrophobicContact CB-CG2 4.11Å; P1084-V1260 HydrophobicContact CG-CG2 3.86Å
1085	M	94.8	Very high	88.8	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.3	171.5	177.2	174.3	86.7	0	0	109.5	K1087 Y1212 R1215 D1217 M1254 L1255	M1085-K1087 HydrophobicContact CE-CB 4.21Å; M1085-K1087 HydrophobicContact CE-CD 4.35Å; M1085-Y1212 HydrophobicContact CG-CD1 4.19Å; M1085-Y1212 HydrophobicContact SD-CD1 3.97Å; M1085-Y1212 HydrophobicContact SD-CE1 4.03Å; M1085-R1215 HydrophobicContact CB-CG 3.69Å; M1085-R1215 HydrophobicContact CG-CG 4.35Å; M1085-R1215 VanDerWaalsContact CG-O 3.24Å; M1085-R1215 WeakPolarHBondContact CG-O 3.34Å; M1085-D1217 WeakPolarHBondContact CE-OD1 3.39Å; M1085-D1217 VanDerWaalsContact SD-OD1 3.33Å; M1085-M1254 CarbonylContact O-C 3.21Å; M1085-M1254 WeakPolarHBondContact O-CA 3.36Å; M1085-L1255 HydrophobicContact CB-CB 4.41Å; M1085-L1255 HydrophobicContact CE-CB 4.2Å; M1085-L1255 HydrophobicContact CE-CD1 3.44Å; M1085-L1255 VanDerWaalsContact CE-CD1 3.44Å; M1085-L1255 HydrophobicContact CE-CG 4.24Å; M1085-L1255 PolarHBondContact N-O 2.59Å; M1085-L1255 PolarHBondContact O-N 3.39Å
1086	V	95.2	Very high	88.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.3	162.2	177.8	0	0	0	0	107.4	F1080 I1088 Y1212 M1213 I1243 V1252 M1254 V1260	F1080-V1086 HydrophobicContact CE1-CB 4.36Å; F1080-V1086 HydrophobicContact CE1-CG2 3.61Å; F1080-V1086 HydrophobicContact CZ-CG2 3.82Å; V1086-I1088 HydrophobicContact CG1-CD1 4.39Å; V1086-I1088 HydrophobicContact CG1-CG1 4.02Å; V1086-Y1212 CarbonylContact O-C 3.54Å; V1086-Y1212 VanDerWaalsContact O-CA 3.27Å; V1086-Y1212 WeakPolarHBondContact O-CA 3.33Å; V1086-M1213 HydrophobicContact CB-CB 4.2Å; V1086-M1213 PolarHBondContact N-O 2.89Å; V1086-M1213 PolarHBondContact O-N 3.33Å; V1086-I1243 HydrophobicContact CB-CD1 4.45Å; V1086-I1243 HydrophobicContact CG1-CD1 3.7Å; V1086-I1243 HydrophobicContact CG1-CG1 3.88Å; V1086-I1243 HydrophobicContact CG2-CD1 4.11Å; V1086-V1252 HydrophobicContact CG1-CG1 4.22Å; V1086-M1254 HydrophobicContact CG2-CG 4.27Å; V1086-V1260 HydrophobicContact CG2-CB 4.36Å; V1086-V1260 HydrophobicContact CG2-CG2 3.62Å
1087	K	95	Very high	87.6	Confident	26 Å²	26	51.9 Å²	51.9	11%	0.113	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	120.5	178.2	-177.5	178.1	-167.9	162.2	0	108.5	M1085 F1089 V1210 L1211 Y1212 D1217 E1253	M1085-K1087 HydrophobicContact CE-CB 4.21Å; M1085-K1087 HydrophobicContact CE-CD 4.35Å; K1087-F1089 HydrophobicContact CD-CE1 4.33Å; K1087-F1089 HydrophobicContact CD-CE2 4.35Å; K1087-F1089 HydrophobicContact CD-CZ 3.84Å; K1087-F1089 HydrophobicContact CG-CE2 4.44Å; K1087-F1089 HydrophobicContact CG-CZ 4.29Å; K1087-V1210 HydrophobicContact CD-CG2 4.26Å; K1087-V1210 HydrophobicContact CG-CG2 3.49Å; K1087-V1210 VanDerWaalsContact CG-CG2 3.49Å; K1087-L1211 CarbonylContact C-O 3.59Å; K1087-L1211 WeakPolarHBondContact CA-O 3.48Å; K1087-Y1212 HydrophobicContact CB-CD1 4.11Å; K1087-Y1212 HydrophobicContact CB-CE1 4.06Å; K1087-Y1212 HydrophobicContact CD-CE1 3.72Å; K1087-Y1212 VanDerWaalsContact CE-OH 3.26Å; K1087-Y1212 WeakPolarHBondContact CE-OH 3.47Å; K1087-Y1212 HydrophobicContact CG-CD1 4.09Å; K1087-Y1212 HydrophobicContact CG-CE1 3.63Å; K1087-Y1212 PolarHBondContact NZ-OH 3.3Å; K1087-D1217 IonicContact NZ-OD2 2.76Å; K1087-D1217 PolarHBondContact NZ-OD2 3.19Å; K1087-E1253 HydrophobicContact CB-CB 4.25Å; K1087-E1253 PolarHBondContact N-O 3.14Å; K1087-E1253 PolarHBondContact O-N 3.48Å
1088	I	94.4	Very high	87.1	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	116.6	-179.8	-54.4	-175.7	0	0	0	108.4	V1086 V1210 L1211 P1239 L1242 I1243 S1251 V1252	V1086-I1088 HydrophobicContact CG1-CD1 4.39Å; V1086-I1088 HydrophobicContact CG1-CG1 4.02Å; I1088-V1210 CarbonylContact O-C 3.54Å; I1088-V1210 WeakPolarHBondContact O-CA 3.44Å; I1088-L1211 HydrophobicContact CB-CB 4.27Å; I1088-L1211 HydrophobicContact CD1-CD2 4.08Å; I1088-L1211 PolarHBondContact N-O 3.19Å; I1088-L1211 PolarHBondContact O-N 2.84Å; I1088-P1239 HydrophobicContact CD1-CB 3.75Å; I1088-L1242 HydrophobicContact CD1-CB 4.31Å; I1088-L1242 HydrophobicContact CD1-CD1 4.21Å; I1088-L1242 HydrophobicContact CG2-CD1 3.83Å; I1088-I1243 HydrophobicContact CD1-CG1 4.46Å; I1088-S1251 CarbonylContact C-O 3.42Å; I1088-S1251 WeakPolarHBondContact CA-O 3.42Å; I1088-V1252 HydrophobicContact CD1-CG2 4.19Å; I1088-V1252 HydrophobicContact CG1-CG1 4.34Å; I1088-V1252 HydrophobicContact CG1-CG2 3.92Å; I1088-V1252 HydrophobicContact CG2-CG2 4.21Å
1089	F	93.3	Very high	86.9	Confident	52 Å²	52	54.6 Å²	54.6	23%	0.228	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.4	173.7	-61.7	-80.3	0	0	0	110.4	K1087 D1091 S1251 E1253	K1087-F1089 HydrophobicContact CD-CE1 4.33Å; K1087-F1089 HydrophobicContact CD-CE2 4.35Å; K1087-F1089 HydrophobicContact CD-CZ 3.84Å; K1087-F1089 HydrophobicContact CG-CE2 4.44Å; K1087-F1089 HydrophobicContact CG-CZ 4.29Å; F1089-D1091 PolarHBondContact O-N 2.79Å; F1089-S1251 WeakPolarHBondContact CD2-O 3.2Å; F1089-S1251 PolarHBondContact N-O 3.44Å; F1089-S1251 VanDerWaalsContact O-CB 3.29Å; F1089-S1251 WeakPolarHBondContact O-CB 3.4Å; F1089-E1253 VanDerWaalsContact CE2-CD 3.48Å; F1089-E1253 HydrophobicContact CE2-CG 3.87Å
1090	L	90.5	Very high	86.7	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.026	29%	0.293	C	S	.	.			trans	-94.2	77	178.6	-58	173.4	0	0	0	108.1	D1095 R1096 P1208 Y1209 W1234 I1237	L1090-D1095 HydrophobicContact CB-CB 4.18Å; L1090-D1095 HydrophobicContact CD2-CB 4.44Å; L1090-R1096 VanDerWaalsContact O-CG 3.31Å; L1090-R1096 WeakPolarHBondContact O-CG 3.26Å; L1090-R1096 PolarHBondContact O-NE 2.88Å; L1090-P1208 HydrophobicContact CD1-CB 4.02Å; L1090-P1208 WeakPolarHBondContact CD1-O 2.9Å; L1090-Y1209 PolarHBondContact N-O 3.39Å; L1090-W1234 HydrophobicContact CD1-CH2 4.16Å; L1090-W1234 HydrophobicContact CD1-CZ3 3.63Å; L1090-I1237 HydrophobicContact CD2-CD1 3.9Å
1091	D	81.3	Confident	86.5	Confident	93 Å²	93	60.9 Å²	60.9	50%	0.497	32%	0.317	S	S	.	.			trans	-83.5	-17.7	-170.7	-69.4	-29.9	0	0	0	114.1	F1089 R1096	F1089-D1091 PolarHBondContact O-N 2.79Å; D1091-R1096 IonicContact OD1-NH2 3.13Å
1092	R	81.3	Confident	86.7	Confident	159 Å²	159	56.4 Å²	56.4	60%	0.6	29%	0.293	S	S	*	.	S	Bend	trans	-80.4	135.3	-178	-53.8	177.4	177.4	166.7	0.9	109.7	K1094 D1095 R1096	R1092-K1094 PolarHBondContact O-N 3.15Å; R1092-D1095 HydrophobicContact CB-CB 4.45Å; R1092-D1095 WeakPolarHBondContact CB-OD2 3.3Å; R1092-D1095 WeakPolarHBondContact CD-OD2 3.47Å; R1092-D1095 PolarHBondContact O-N 2.92Å; R1092-R1096 PolarHBondContact O-N 3.41Å
1093	P	76.8	Confident	87.2	Confident	112 Å²	112	54.7 Å²	54.7	73%	0.727	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-27.9	177.7	-26.8	33.6	0	0	0	114.7
1094	K	76	Confident	87.7	Confident	178 Å²	178	54.6 Å²	54.6	77%	0.774	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-28.8	176	-71.7	-172.8	176	-175.6	0	113.2	R1092 R1096	R1092-K1094 PolarHBondContact O-N 3.15Å; K1094-R1096 VanDerWaalsContact C-N 3.33Å
1095	D	76.4	Confident	87.8	Confident	47 Å²	47	55.3 Å²	55.3	25%	0.251	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-18	-178.6	-55.7	-20.7	0	0	0	111.1	L1090 R1092 I1237	L1090-D1095 HydrophobicContact CB-CB 4.18Å; L1090-D1095 HydrophobicContact CD2-CB 4.44Å; R1092-D1095 HydrophobicContact CB-CB 4.45Å; R1092-D1095 WeakPolarHBondContact CB-OD2 3.3Å; R1092-D1095 WeakPolarHBondContact CD-OD2 3.47Å; R1092-D1095 PolarHBondContact O-N 2.92Å; D1095-I1237 HydrophobicContact CB-CD1 4.37Å
1096	R	78.6	Confident	87.9	Confident	71 Å²	71	55.2 Å²	55.2	27%	0.268	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	7.2	178.9	-74.6	-170.6	-176.3	-151.8	1.8	114.8	L1090 D1091 R1092 K1094 G1098 E1123 D1207	L1090-R1096 VanDerWaalsContact O-CG 3.31Å; L1090-R1096 WeakPolarHBondContact O-CG 3.26Å; L1090-R1096 PolarHBondContact O-NE 2.88Å; D1091-R1096 IonicContact OD1-NH2 3.13Å; R1092-R1096 PolarHBondContact O-N 3.41Å; K1094-R1096 VanDerWaalsContact C-N 3.33Å; R1096-G1098 PolarHBondContact O-N 3.28Å; R1096-E1123 IonicContact NH1-OE1 2.72Å; R1096-D1207 VanDerWaalsContact CB-OD1 3.27Å; R1096-D1207 WeakPolarHBondContact CB-OD1 2.99Å; R1096-D1207 WeakPolarHBondContact CD-OD1 3.28Å; R1096-D1207 WeakPolarHBondContact CG-OD1 2.98Å
1097	L	80.3	Confident	87.9	Confident	117 Å²	117	55.2 Å²	55.2	61%	0.613	27%	0.273	S	S	*	.			trans	-69	126.3	177.9	-68.4	172	0	0	0	109.3	T1099	L1097-T1099 PolarHBondContact O-N 3.45Å
1098	G	83.4	Confident	88	Confident	33 Å²	33	54 Å²	54	34%	0.34	27%	0.268	S	S	.	.			trans	-66.2	132.9	179.2	0	0	0	0	0	111.9	R1096 L1205	R1096-G1098 PolarHBondContact O-N 3.28Å; G1098-L1205 CarbonylContact C-O 3.54Å; G1098-L1205 WeakPolarHBondContact CA-O 3.48Å
1099	T	88.4	Confident	88	Confident	25 Å²	25	56.4 Å²	56.4	15%	0.153	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-108.6	136.2	-171.9	55.5	0	0	0	0	111.9	L1097 E1102 R1172 R1204 L1205	L1097-T1099 PolarHBondContact O-N 3.45Å; T1099-E1102 WeakPolarHBondContact CB-OE1 3.5Å; T1099-E1102 PolarHBondContact OG1-OE1 2.85Å; T1099-R1172 PolarHBondContact O-NH2 2.89Å; T1099-R1204 CarbonylContact O-C 3.58Å; T1099-R1204 WeakPolarHBondContact O-CA 3.39Å; T1099-R1204 WeakPolarHBondContact O-CG 3.34Å; T1099-L1205 PolarHBondContact N-O 2.97Å; T1099-L1205 VanDerWaalsContact N-O 3.15Å; T1099-L1205 PolarHBondContact O-N 2.76Å
1100	V	88.9	Confident	88.1	Confident	46 Å²	46	54 Å²	54	28%	0.279	27%	0.268	S	S	.	.	S	Bend	trans	-103.3	-9.1	170.9	-66.9	0	0	0	0	112.2	R1172 L1175 G1176 V1203 R1204	V1100-R1172 PolarHBondContact O-NE 3.08Å; V1100-R1172 VanDerWaalsContact O-NE 3.13Å; V1100-R1172 PolarHBondContact O-NH2 2.79Å; V1100-R1172 VanDerWaalsContact O-NH2 3.11Å; V1100-L1175 CarbonylContact O-C 3.58Å; V1100-G1176 WeakPolarHBondContact O-CA 3.28Å; V1100-G1176 PolarHBondContact O-N 3.41Å; V1100-G1176 VanDerWaalsContact O-N 3.08Å; V1100-V1203 HydrophobicContact CG1-CG2 4.43Å; V1100-R1204 HydrophobicContact CG1-CB 4.08Å; V1100-R1204 HydrophobicContact CG1-CG 4.19Å
1101	E	90.9	Very high	88.2	Confident	107 Å²	107	61.1 Å²	61.1	50%	0.5	30%	0.299	S	S	.	.	S	Bend	trans	-138.2	140.8	177.2	-67.2	-178.9	170.2	0	0	107.9
1102	E	91	Very high	88.8	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.028	28%	0.28	C	S	.	.			trans	-134.9	148.8	179.8	-65.8	74	-154	0	0	109.7	T1099 I1104 I1129 W1171 R1172 N1235	T1099-E1102 WeakPolarHBondContact CB-OE1 3.5Å; T1099-E1102 PolarHBondContact OG1-OE1 2.85Å; E1102-I1104 HydrophobicContact CB-CD1 4.46Å; E1102-I1104 HydrophobicContact CB-CG1 4.43Å; E1102-I1129 HydrophobicContact CG-CD1 4.1Å; E1102-W1171 CarbonylContact O-C 3.56Å; E1102-W1171 WeakPolarHBondContact O-CA 3.46Å; E1102-W1171 WeakPolarHBondContact O-CB 3.49Å; E1102-R1172 PolarHBondContact O-N 2.96Å; E1102-R1172 IonicContact OE1-CZ 2.72Å; E1102-R1172 IonicContact OE1-NE 2.72Å; E1102-R1172 IonicContact OE1-NH2 3.56Å; E1102-R1172 PolarHBondContact OE1-NH2 3.16Å; E1102-R1172 WeakPolarHBondContact OE2-CB 3.46Å; E1102-R1172 WeakPolarHBondContact OE2-CD 3.3Å; E1102-R1172 IonicContact OE2-CZ 2.79Å; E1102-R1172 IonicContact OE2-NE 2.65Å; E1102-R1172 PolarHBondContact OE2-NE 3.33Å; E1102-R1172 IonicContact OE2-NH2 3.84Å; E1102-R1172 PolarHBondContact OE2-NH2 3.18Å; E1102-N1235 WeakPolarHBondContact CA-OD1 3.49Å
1103	Y	94.9	Very high	89.4	Confident	64 Å²	64	53.8 Å²	53.8	25%	0.251	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	116.5	163.7	-178.5	-96.1	0	0	0	108.6	Q1105 Y1169 W1171 W1234 N1235	Y1103-Q1105 HydrophobicContact CE1-CB 4.14Å; Y1103-Y1169 WeakPolarHBondContact OH-CD1 3.39Å; Y1103-W1171 HydrophobicContact CD2-CB 4.04Å; Y1103-W1234 CarbonylContact O-C 3.55Å; Y1103-W1234 WeakPolarHBondContact O-CA 3.5Å; Y1103-N1235 PolarHBondContact N-OD1 2.82Å; Y1103-N1235 PolarHBondContact O-N 2.91Å
1104	I	96.5	Very high	90.1	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.8	-178.6	-55.6	153.8	0	0	0	107.6	E1102 M1118 M1120 I1129 V1131 A1170 W1179 Q1233	E1102-I1104 HydrophobicContact CB-CD1 4.46Å; E1102-I1104 HydrophobicContact CB-CG1 4.43Å; I1104-M1118 HydrophobicContact CG2-CE 3.65Å; I1104-M1118 HydrophobicContact CG2-SD 4.04Å; I1104-M1120 HydrophobicContact CD1-CE 3.32Å; I1104-M1120 HydrophobicContact CG1-CE 3.7Å; I1104-I1129 HydrophobicContact CD1-CG2 4.05Å; I1104-V1131 HydrophobicContact CD1-CG2 4.25Å; I1104-V1131 HydrophobicContact CG2-CG2 4.12Å; I1104-A1170 WeakPolarHBondContact CA-O 3.44Å; I1104-A1170 HydrophobicContact CB-CB 4.24Å; I1104-A1170 HydrophobicContact CD1-CB 4.47Å; I1104-A1170 PolarHBondContact N-O 3.12Å; I1104-A1170 PolarHBondContact O-N 3.09Å; I1104-W1179 HydrophobicContact CD1-CH2 4.23Å; I1104-W1179 HydrophobicContact CD1-CZ3 4.32Å; I1104-Q1233 WeakPolarHBondContact CA-O 3.24Å
1105	Q	95.8	Very high	90.9	Very high	15 Å²	15	46 Å²	46	7%	0.07	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132.3	171.7	-176.4	-169.9	-77.2	0	0	108.4	Y1103 M1118 M1167 V1168 Y1169 A1231 A1232 Q1233	Y1103-Q1105 HydrophobicContact CE1-CB 4.14Å; Q1105-M1118 WeakPolarHBondContact O-CE 3.16Å; Q1105-M1167 HydrophobicContact CG-CG 4.45Å; Q1105-M1167 HydrophobicContact CG-SD 3.54Å; Q1105-M1167 VanDerWaalsContact CG-SD 3.54Å; Q1105-V1168 WeakPolarHBondContact CA-O 3.33Å; Q1105-Y1169 HydrophobicContact CB-CD1 4.39Å; Q1105-Y1169 HydrophobicContact CG-CD1 3.96Å; Q1105-Y1169 HydrophobicContact CG-CE1 3.8Å; Q1105-A1231 PolarHBondContact NE2-O 2Å; Q1105-A1231 VanDerWaalsContact NE2-O 3.12Å; Q1105-A1232 CarbonylContact O-C 3.59Å; Q1105-A1232 VanDerWaalsContact O-CA 3.32Å; Q1105-A1232 WeakPolarHBondContact O-CA 3.3Å; Q1105-Q1233 HydrophobicContact CB-CB 4.24Å; Q1105-Q1233 PolarHBondContact N-O 2.98Å; Q1105-Q1233 PolarHBondContact O-N 2.95Å
1106	V	96.9	Very high	91.9	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	123.7	172.9	60	0	0	0	0	110.7	L1117 M1118 V1131 V1168 I1229 A1232	V1106-L1117 HydrophobicContact CG1-CB 3.83Å; V1106-L1117 HydrophobicContact CG1-CD1 3.97Å; V1106-L1117 HydrophobicContact CG2-CB 4.01Å; V1106-M1118 HydrophobicContact CB-CE 3.75Å; V1106-M1118 HydrophobicContact CG1-CE 4.32Å; V1106-M1118 HydrophobicContact CG2-CE 4.32Å; V1106-V1131 HydrophobicContact CG1-CG1 4.25Å; V1106-V1168 HydrophobicContact CG1-CB 4.02Å; V1106-V1168 PolarHBondContact N-O 3.48Å; V1106-V1168 WeakPolarHBondContact O-CB 3.49Å; V1106-V1168 PolarHBondContact O-N 3.4Å; V1106-I1229 HydrophobicContact CG2-CG2 3.45Å; V1106-I1229 VanDerWaalsContact CG2-CG2 3.45Å; V1106-A1232 HydrophobicContact CG2-CB 4.31Å
1107	G	95.9	Very high	92.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	147.2	172.4	0	0	0	0	0	111.3	H1166 I1229 Y1230	G1107-H1166 CarbonylContact C-O 3.57Å; G1107-H1166 WeakPolarHBondContact CA-O 3.36Å; G1107-I1229 WeakPolarHBondContact O-CA 3.28Å; G1107-Y1230 WeakPolarHBondContact CA-O 3.27Å; G1107-Y1230 PolarHBondContact N-O 3.16Å; G1107-Y1230 PolarHBondContact O-N 2.54Å
1108	F	96.3	Very high	93.5	Very high	1 Å²	1	35 Å²	35	0%	0.004	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	156.5	178	76.5	-80.6	0	0	0	112.7	T1110 L1117 V1133 I1139 L1160 H1166 V1168 F1225 C1228	F1108-T1110 HydrophobicContact CD2-CG2 3.68Å; F1108-T1110 HydrophobicContact CE2-CG2 3.79Å; F1108-L1117 HydrophobicContact CB-CD1 4.44Å; F1108-L1117 HydrophobicContact CB-CD2 3.64Å; F1108-L1117 HydrophobicContact CD1-CD1 3.65Å; F1108-L1117 HydrophobicContact CD1-CD2 4.31Å; F1108-L1117 HydrophobicContact CD2-CD2 4.46Å; F1108-L1117 HydrophobicContact CE1-CD1 4.14Å; F1108-L1117 HydrophobicContact CG-CD1 4.09Å; F1108-L1117 HydrophobicContact CG-CD2 3.89Å; F1108-V1133 HydrophobicContact CD2-CG2 4.46Å; F1108-V1133 HydrophobicContact CE2-CG2 4.26Å; F1108-I1139 HydrophobicContact CE1-CD1 3.64Å; F1108-I1139 HydrophobicContact CE1-CG1 4.21Å; F1108-I1139 HydrophobicContact CZ-CD1 3.72Å; F1108-I1139 HydrophobicContact CZ-CG1 4.4Å; F1108-L1160 WeakPolarHBondContact CE2-O 3.49Å; F1108-L1160 HydrophobicContact CZ-CB 4.02Å; F1108-H1166 HydrophobicContact CD1-CB 4.1Å; F1108-H1166 HydrophobicContact CE1-CB 3.55Å; F1108-H1166 HydrophobicContact CE2-CB 4.48Å; F1108-H1166 HydrophobicContact CZ-CB 3.77Å; F1108-H1166 PolarHBondContact N-O 3.49Å; F1108-H1166 PolarHBondContact O-N 2.86Å; F1108-V1168 HydrophobicContact CD1-CG2 4.01Å; F1108-V1168 HydrophobicContact CE1-CG2 3.76Å; F1108-F1225 HydrophobicContact CB-CE2 4.24Å; F1108-F1225 HydrophobicContact CB-CZ 3.86Å; F1108-F1225 HydrophobicContact CD2-CE2 4.11Å; F1108-F1225 HydrophobicContact CD2-CZ 4.26Å; F1108-C1228 CarbonylContact C-O 3.51Å; F1108-C1228 VanDerWaalsContact CA-O 3.25Å; F1108-C1228 WeakPolarHBondContact CA-O 3.5Å
1109	K	95.1	Very high	94.1	Very high	52 Å²	52	33.5 Å²	33.5	23%	0.226	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	118.3	172.2	178	-179.5	-179	177.5	0	108.7	D1163 Q1164 G1227 C1228	K1109-D1163 WeakPolarHBondContact CE-O 3.25Å; K1109-D1163 WeakPolarHBondContact CE-OD1 3.5Å; K1109-Q1164 WeakPolarHBondContact CA-O 3.35Å; K1109-G1227 WeakPolarHBondContact O-CA 3.38Å; K1109-C1228 HydrophobicContact CB-CB 4.49Å; K1109-C1228 PolarHBondContact N-O 3.08Å; K1109-C1228 PolarHBondContact O-N 2.77Å
1110	T	94.8	Very high	94.4	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.012	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	158.3	-174.8	-172	0	0	0	0	112.4	F1108 S1112 T1161 D1163 F1225 D1226	F1108-T1110 HydrophobicContact CD2-CG2 3.68Å; F1108-T1110 HydrophobicContact CE2-CG2 3.79Å; T1110-S1112 VanDerWaalsContact OG1-CB 3.3Å; T1110-S1112 WeakPolarHBondContact OG1-CB 3.19Å; T1110-S1112 PolarHBondContact OG1-N 2.68Å; T1110-T1161 HydrophobicContact CG2-CG2 3.99Å; T1110-T1161 CarbonylContact O-C 3.59Å; T1110-T1161 WeakPolarHBondContact O-CA 3.04Å; T1110-D1163 PolarHBondContact O-N 2.75Å; T1110-F1225 HydrophobicContact CG2-CE2 3.85Å; T1110-F1225 HydrophobicContact CG2-CZ 4.22Å; T1110-D1226 PolarHBondContact OG1-O 3.16Å
1111	K	93.5	Very high	94.6	Very high	153 Å²	153	31 Å²	31	67%	0.665	14%	0.135	S	C	*	.	S	Bend	trans	-103.4	-1	163.6	-67.7	-179.7	-176.2	162.4	0	112.8	T1161 D1163	K1111-T1161 WeakPolarHBondContact CA-O 3.21Å; K1111-D1163 HydrophobicContact CD-CB 4.3Å; K1111-D1163 WeakPolarHBondContact CE-OD2 3.48Å; K1111-D1163 HydrophobicContact CG-CB 3.78Å; K1111-D1163 IonicContact NZ-OD2 3.12Å; K1111-D1163 PolarHBondContact NZ-OD2 2.63Å
1112	S	92.9	Very high	94.5	Very high	14 Å²	14	26 Å²	26	10%	0.098	11%	0.112	C	C	.	.			trans	-98.8	125	-170.7	-173.7	0	0	0	0	110.3	T1110 R1114 T1161	T1110-S1112 VanDerWaalsContact OG1-CB 3.3Å; T1110-S1112 WeakPolarHBondContact OG1-CB 3.19Å; T1110-S1112 PolarHBondContact OG1-N 2.68Å; S1112-R1114 PolarHBondContact O-N 3.35Å; S1112-R1114 VanDerWaalsContact O-N 3.11Å; S1112-R1114 WeakPolarHBondContact OG-CG 3.33Å; S1112-T1161 WeakPolarHBondContact O-CG2 3.32Å
1113	K	94.3	Very high	94.1	Very high	84 Å²	84	31.5 Å²	31.5	37%	0.365	14%	0.137	S	C	.	.	S	Bend	trans	-83.2	35.6	176.7	-62.2	-167.7	178.1	-154.4	0	113.7	N1134 N1135 N1136 D1159 T1161	K1113-N1134 CarbonylContact O-C 3.5Å; K1113-N1135 VanDerWaalsContact CD-O 3.28Å; K1113-N1135 WeakPolarHBondContact CD-O 3.48Å; K1113-N1136 PolarHBondContact NZ-O 3.41Å; K1113-D1159 WeakPolarHBondContact CE-OD2 3.46Å; K1113-D1159 IonicContact NZ-OD1 3.19Å; K1113-D1159 IonicContact NZ-OD2 3.33Å; K1113-D1159 PolarHBondContact NZ-OD2 3.01Å; K1113-T1161 WeakPolarHBondContact CE-OG1 3.33Å; K1113-T1161 HydrophobicContact CG-CG2 4.09Å; K1113-T1161 VanDerWaalsContact CG-OG1 3.29Å; K1113-T1161 WeakPolarHBondContact CG-OG1 3.34Å
1114	R	91.6	Very high	93.4	Very high	122 Å²	122	31.5 Å²	31.5	46%	0.46	16%	0.157	S	C	.	.			trans	-159.7	154.3	-174.8	55.5	-176.3	176.9	-177.3	2.7	110.9	S1112 A1222	S1112-R1114 PolarHBondContact O-N 3.35Å; S1112-R1114 VanDerWaalsContact O-N 3.11Å; S1112-R1114 WeakPolarHBondContact OG-CG 3.33Å; R1114-A1222 PolarHBondContact NE-O 3.3Å; R1114-A1222 VanDerWaalsContact NE-O 3.16Å; R1114-A1222 PolarHBondContact NH1-O 3.14Å; R1114-A1222 PolarHBondContact NH2-O 3.2Å
1115	G	93.5	Very high	92.2	Very high	5 Å²	5	37.1 Å²	37.1	5%	0.052	18%	0.184	C	C	.	.			trans	122.6	154.8	177.1	0	0	0	0	0	113.6	K1132 V1133 F1225	G1115-K1132 WeakPolarHBondContact O-CB 3.48Å; G1115-V1133 PolarHBondContact O-N 3.24Å; G1115-V1133 VanDerWaalsContact O-N 3.11Å; G1115-F1225 VanDerWaalsContact CA-N 3.33Å
1116	I	96.4	Very high	91.4	Very high	5 Å²	5	39.8 Å²	39.8	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.2	175.2	-66	179.2	0	0	0	108.1	E1119 I1130 G1214 N1216 M1219	I1116-E1119 WeakPolarHBondContact CD1-OE2 3.38Å; I1116-E1119 HydrophobicContact CG2-CB 3.85Å; I1116-I1130 HydrophobicContact CD1-CG2 4.29Å; I1116-I1130 HydrophobicContact CG1-CG2 4.13Å; I1116-I1130 HydrophobicContact CG2-CG2 4.29Å; I1116-G1214 PolarHBondContact N-O 3.06Å; I1116-G1214 CarbonylContact O-C 3.39Å; I1116-G1214 VanDerWaalsContact O-CA 3.22Å; I1116-G1214 WeakPolarHBondContact O-CA 3.5Å; I1116-G1214 PolarHBondContact O-N 2.68Å; I1116-N1216 HydrophobicContact CD1-CB 4.11Å; I1116-M1219 HydrophobicContact CD1-SD 3.44Å; I1116-M1219 WeakPolarHBondContact CD1-SD 3.34Å; I1116-M1219 HydrophobicContact CG1-CE 4.41Å; I1116-M1219 HydrophobicContact CG1-SD 3.74Å
1117	L	96.7	Very high	91	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	-46.3	171.2	-62.1	-178.1	0	0	0	109.9	V1106 F1108 V1131 V1133 I1139 V1168 F1225 I1229	V1106-L1117 HydrophobicContact CG1-CB 3.83Å; V1106-L1117 HydrophobicContact CG1-CD1 3.97Å; V1106-L1117 HydrophobicContact CG2-CB 4.01Å; F1108-L1117 HydrophobicContact CB-CD1 4.44Å; F1108-L1117 HydrophobicContact CB-CD2 3.64Å; F1108-L1117 HydrophobicContact CD1-CD1 3.65Å; F1108-L1117 HydrophobicContact CD1-CD2 4.31Å; F1108-L1117 HydrophobicContact CD2-CD2 4.46Å; F1108-L1117 HydrophobicContact CE1-CD1 4.14Å; F1108-L1117 HydrophobicContact CG-CD1 4.09Å; F1108-L1117 HydrophobicContact CG-CD2 3.89Å; L1117-V1131 HydrophobicContact CB-CG1 4.48Å; L1117-V1131 WeakPolarHBondContact CB-O 3.46Å; L1117-V1131 HydrophobicContact CD1-CG1 4.34Å; L1117-V1131 PolarHBondContact N-O 3Å; L1117-V1133 HydrophobicContact CD1-CG2 4.41Å; L1117-V1133 HydrophobicContact CD2-CG2 4.16Å; L1117-V1133 HydrophobicContact CG-CG2 4.24Å; L1117-I1139 HydrophobicContact CD1-CD1 3.93Å; L1117-V1168 HydrophobicContact CD1-CG2 4.09Å; L1117-F1225 HydrophobicContact CD2-CD2 3.76Å; L1117-F1225 HydrophobicContact CD2-CE2 3.48Å; L1117-F1225 VanDerWaalsContact CD2-CE2 3.48Å; L1117-F1225 HydrophobicContact CD2-CG 4.49Å; L1117-F1225 HydrophobicContact CD2-CZ 4.03Å; L1117-I1229 HydrophobicContact CD2-CD1 4.39Å; L1117-I1229 HydrophobicContact CD2-CG1 4.39Å
1118	M	96.6	Very high	90.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	139.1	176.7	-157	177.8	-34.5	0	0	110.4	I1104 Q1105 V1106 M1120 V1131 L1211 Y1212 A1232 W1234 P1239	I1104-M1118 HydrophobicContact CG2-CE 3.65Å; I1104-M1118 HydrophobicContact CG2-SD 4.04Å; Q1105-M1118 WeakPolarHBondContact O-CE 3.16Å; V1106-M1118 HydrophobicContact CB-CE 3.75Å; V1106-M1118 HydrophobicContact CG1-CE 4.32Å; V1106-M1118 HydrophobicContact CG2-CE 4.32Å; M1118-M1120 HydrophobicContact CG-SD 3.99Å; M1118-M1120 HydrophobicContact SD-SD 4.08Å; M1118-V1131 PolarHBondContact N-O 3.48Å; M1118-V1131 PolarHBondContact O-N 3.16Å; M1118-L1211 HydrophobicContact CG-CD1 3.72Å; M1118-L1211 HydrophobicContact CG-CG 4.34Å; M1118-L1211 HydrophobicContact SD-CD1 4.04Å; M1118-Y1212 CarbonylContact C-O 3.54Å; M1118-Y1212 WeakPolarHBondContact CA-O 3.2Å; M1118-A1232 HydrophobicContact CE-CB 4.05Å; M1118-W1234 HydrophobicContact SD-CB 3.81Å; M1118-P1239 HydrophobicContact SD-CG 4.5Å
1119	E	96.1	Very high	90.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	130.1	172.6	165.9	-179.6	171.5	0	0	109.8	I1116 R1121 I1129 I1130 L1211 Y1212 N1216	I1116-E1119 WeakPolarHBondContact CD1-OE2 3.38Å; I1116-E1119 HydrophobicContact CG2-CB 3.85Å; E1119-R1121 IonicContact OE1-CZ 3.26Å; E1119-R1121 IonicContact OE1-NE 2.72Å; E1119-R1121 PolarHBondContact OE1-NE 3.36Å; E1119-R1121 IonicContact OE1-NH2 2.97Å; E1119-R1121 PolarHBondContact OE1-NH2 3.06Å; E1119-R1121 IonicContact OE2-NH2 3.77Å; E1119-I1129 CarbonylContact C-O 3.53Å; E1119-I1129 VanDerWaalsContact CA-O 3.28Å; E1119-I1129 WeakPolarHBondContact CA-O 2.95Å; E1119-I1130 HydrophobicContact CB-CG1 3.91Å; E1119-I1130 HydrophobicContact CG-CD1 4.45Å; E1119-I1130 HydrophobicContact CG-CG1 3.6Å; E1119-L1211 CarbonylContact O-C 3.45Å; E1119-L1211 WeakPolarHBondContact O-CA 3.36Å; E1119-L1211 WeakPolarHBondContact O-CD1 3.2Å; E1119-Y1212 HydrophobicContact CB-CD2 4.47Å; E1119-Y1212 HydrophobicContact CG-CD2 4.08Å; E1119-Y1212 PolarHBondContact N-O 2.88Å; E1119-Y1212 PolarHBondContact O-N 3.06Å; E1119-N1216 VanDerWaalsContact OE2-CB 3.3Å; E1119-N1216 WeakPolarHBondContact OE2-CB 3.34Å; E1119-N1216 PolarHBondContact OE2-ND2 3.35Å
1120	M	94	Very high	90.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.4	169.6	-63.4	70.4	76.7	0	0	108.1	I1104 M1118 Y1128 I1129 L1205 L1211 W1234	I1104-M1120 HydrophobicContact CD1-CE 3.32Å; I1104-M1120 HydrophobicContact CG1-CE 3.7Å; M1118-M1120 HydrophobicContact CG-SD 3.99Å; M1118-M1120 HydrophobicContact SD-SD 4.08Å; M1120-Y1128 CarbonylContact O-C 3.53Å; M1120-Y1128 VanDerWaalsContact O-CA 3.23Å; M1120-Y1128 WeakPolarHBondContact O-CA 3.19Å; M1120-I1129 HydrophobicContact CE-CB 3.9Å; M1120-I1129 HydrophobicContact CE-CG2 3.78Å; M1120-I1129 PolarHBondContact N-O 2.88Å; M1120-I1129 PolarHBondContact O-N 2.99Å; M1120-L1205 HydrophobicContact CB-CD2 3.85Å; M1120-L1211 HydrophobicContact CG-CD1 3.55Å; M1120-L1211 HydrophobicContact SD-CD1 3.62Å; M1120-W1234 HydrophobicContact CB-CH2 4.37Å; M1120-W1234 HydrophobicContact CB-CZ2 4.29Å; M1120-W1234 HydrophobicContact CE-CD2 4.39Å; M1120-W1234 HydrophobicContact CE-CG 4.14Å; M1120-W1234 HydrophobicContact CG-CD2 3.39Å; M1120-W1234 HydrophobicContact CG-CE3 3.55Å; M1120-W1234 HydrophobicContact CG-CG 3.99Å; M1120-W1234 HydrophobicContact CG-CH2 3.93Å; M1120-W1234 HydrophobicContact CG-CZ2 3.78Å; M1120-W1234 HydrophobicContact CG-CZ3 3.82Å; M1120-W1234 HydrophobicContact SD-CB 4.45Å; M1120-W1234 HydrophobicContact SD-CD2 4.06Å; M1120-W1234 HydrophobicContact SD-CG 4Å
1121	R	92.3	Very high	90.9	Very high	20 Å²	20	40.5 Å²	40.5	8%	0.075	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.8	-177.4	-171.9	-176.2	-67.3	-152.3	-3.5	111.2	E1119 Y1209 V1210 N1216	E1119-R1121 IonicContact OE1-CZ 3.26Å; E1119-R1121 IonicContact OE1-NE 2.72Å; E1119-R1121 PolarHBondContact OE1-NE 3.36Å; E1119-R1121 IonicContact OE1-NH2 2.97Å; E1119-R1121 PolarHBondContact OE1-NH2 3.06Å; E1119-R1121 IonicContact OE2-NH2 3.77Å; R1121-Y1209 HydrophobicContact CG-CE1 4.25Å; R1121-Y1209 VanDerWaalsContact O-CD1 3.27Å; R1121-Y1209 WeakPolarHBondContact O-CD1 3.19Å; R1121-Y1209 PolarHBondContact O-N 2.95Å; R1121-V1210 HydrophobicContact CB-CG1 3.8Å; R1121-V1210 HydrophobicContact CG-CG1 4.5Å; R1121-V1210 PolarHBondContact N-O 2.98Å; R1121-V1210 PolarHBondContact O-N 3Å; R1121-N1216 PolarHBondContact NH2-ND2 3.14Å
1122	G	89.3	Confident	91.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	156.8	175.4	0	0	0	0	0	113.6	G1124 E1125 N1127 D1206 D1207 Y1209	G1122-G1124 PolarHBondContact O-N 3.25Å; G1122-E1125 PolarHBondContact O-N 2.93Å; G1122-N1127 PolarHBondContact N-O 3.15Å; G1122-D1206 WeakPolarHBondContact CA-O 3.25Å; G1122-D1207 CarbonylContact C-O 3.59Å; G1122-D1207 WeakPolarHBondContact CA-O 3.46Å; G1122-Y1209 VanDerWaalsContact C-CD1 3.43Å; G1122-Y1209 WeakPolarHBondContact O-CD1 3.46Å; G1122-Y1209 VanDerWaalsContact O-CE1 3.27Å; G1122-Y1209 WeakPolarHBondContact O-CE1 3.45Å
1123	E	83.3	Confident	91.2	Very high	122 Å²	122	35.3 Å²	35.3	57%	0.57	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	129.3	177.2	-166.3	174.8	-124.2	0	0	110.3	R1096 D1207 Y1209	R1096-E1123 IonicContact NH1-OE1 2.72Å; E1123-D1207 HydrophobicContact CB-CB 4.11Å; E1123-D1207 PolarHBondContact N-O 2.82Å; E1123-Y1209 HydrophobicContact CB-CD1 4.38Å
1124	G	80.6	Confident	91.1	Very high	65 Å²	65	32.2 Å²	32.2	67%	0.67	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.4	2.3	-176	0	0	0	0	0	115.9	G1122 S1126	G1122-G1124 PolarHBondContact O-N 3.25Å; G1124-S1126 PolarHBondContact O-N 2.84Å
1125	E	71.2	Confident	91.1	Very high	120 Å²	120	32.4 Å²	32.4	56%	0.561	18%	0.181	S	C	*	.	S	Bend	trans	62.2	7.4	172.8	-52.3	-170.3	160.4	0	0	116.4	G1122	G1122-E1125 PolarHBondContact O-N 2.93Å
1126	S	77.4	Confident	91	Very high	71 Å²	71	38 Å²	38	50%	0.497	21%	0.21	S	C	.	.	S	Bend	trans	-86.5	-31.4	178.8	62.5	0	0	0	0	113.6	G1124	G1124-S1126 PolarHBondContact O-N 2.84Å
1127	N	88.5	Confident	90.8	Very high	17 Å²	17	37.9 Å²	37.9	9%	0.091	21%	0.209	C	C	.	.			trans	-112.7	128.5	-173.4	-58.9	10.5	0	0	0	110	G1122 D1144 L1205 D1206	G1122-N1127 PolarHBondContact N-O 3.15Å; N1127-D1144 CarbonylContact C-O 3.57Å; N1127-D1144 WeakPolarHBondContact CA-O 3.19Å; N1127-L1205 HydrophobicContact CB-CD1 4.46Å; N1127-D1206 PolarHBondContact ND2-OD2 3.14Å
1128	Y	93.3	Very high	90.7	Very high	39 Å²	39	38.2 Å²	38.2	15%	0.153	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	158.6	-176.1	63.9	-94.2	0	0	0	113.2	M1120 I1130 E1142 F1143 D1144	M1120-Y1128 CarbonylContact O-C 3.53Å; M1120-Y1128 VanDerWaalsContact O-CA 3.23Å; M1120-Y1128 WeakPolarHBondContact O-CA 3.19Å; Y1128-I1130 HydrophobicContact CD2-CD1 3.47Å; Y1128-I1130 VanDerWaalsContact CD2-CD1 3.47Å; Y1128-I1130 HydrophobicContact CD2-CG1 3.7Å; Y1128-I1130 HydrophobicContact CE2-CD1 3.53Å; Y1128-I1130 HydrophobicContact CE2-CG1 4.17Å; Y1128-I1130 HydrophobicContact CG-CD1 4.42Å; Y1128-E1142 HydrophobicContact CE2-CG 3.95Å; Y1128-E1142 WeakPolarHBondContact CE2-OE1 3.02Å; Y1128-E1142 PolarHBondContact OH-OE1 2.87Å; Y1128-F1143 CarbonylContact O-C 3.5Å; Y1128-F1143 VanDerWaalsContact O-CA 3.23Å; Y1128-F1143 WeakPolarHBondContact O-CA 2.95Å; Y1128-D1144 HydrophobicContact CD1-CB 4.25Å; Y1128-D1144 HydrophobicContact CE1-CB 3.86Å; Y1128-D1144 PolarHBondContact N-O 3.02Å; Y1128-D1144 PolarHBondContact O-N 3.21Å
1129	I	95	Very high	90.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	123.2	169.4	-59.7	172.7	0	0	0	107.3	E1102 I1104 E1119 M1120 I1141 E1142 F1143 V1145 W1179 L1205	E1102-I1129 HydrophobicContact CG-CD1 4.1Å; I1104-I1129 HydrophobicContact CD1-CG2 4.05Å; E1119-I1129 CarbonylContact C-O 3.53Å; E1119-I1129 VanDerWaalsContact CA-O 3.28Å; E1119-I1129 WeakPolarHBondContact CA-O 2.95Å; M1120-I1129 HydrophobicContact CE-CB 3.9Å; M1120-I1129 HydrophobicContact CE-CG2 3.78Å; M1120-I1129 PolarHBondContact N-O 2.88Å; M1120-I1129 PolarHBondContact O-N 2.99Å; I1129-I1141 HydrophobicContact CG2-CG2 4.28Å; I1129-E1142 CarbonylContact C-O 3.36Å; I1129-F1143 HydrophobicContact CB-CB 4.42Å; I1129-F1143 HydrophobicContact CG1-CB 4Å; I1129-V1145 HydrophobicContact CD1-CG1 4.44Å; I1129-V1145 HydrophobicContact CG1-CG1 4.19Å; I1129-W1179 HydrophobicContact CD1-CH2 4.04Å; I1129-W1179 HydrophobicContact CD1-CZ2 3.95Å; I1129-W1179 HydrophobicContact CG1-CZ2 4.33Å; I1129-W1179 HydrophobicContact CG2-CH2 3.81Å; I1129-W1179 HydrophobicContact CG2-CZ2 4.11Å; I1129-L1205 HydrophobicContact CD1-CB 4.34Å; I1129-L1205 HydrophobicContact CD1-CD2 4.03Å; I1129-L1205 HydrophobicContact CG1-CD1 4.48Å
1130	I	95.7	Very high	90.8	Very high	13 Å²	13	38.4 Å²	38.4	7%	0.067	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122.3	-177.3	-61.7	163.8	0	0	0	109.1	I1116 E1119 Y1128 K1132 I1141 E1142	I1116-I1130 HydrophobicContact CD1-CG2 4.29Å; I1116-I1130 HydrophobicContact CG1-CG2 4.13Å; I1116-I1130 HydrophobicContact CG2-CG2 4.29Å; E1119-I1130 HydrophobicContact CB-CG1 3.91Å; E1119-I1130 HydrophobicContact CG-CD1 4.45Å; E1119-I1130 HydrophobicContact CG-CG1 3.6Å; Y1128-I1130 HydrophobicContact CD2-CD1 3.47Å; Y1128-I1130 VanDerWaalsContact CD2-CD1 3.47Å; Y1128-I1130 HydrophobicContact CD2-CG1 3.7Å; Y1128-I1130 HydrophobicContact CE2-CD1 3.53Å; Y1128-I1130 HydrophobicContact CE2-CG1 4.17Å; Y1128-I1130 HydrophobicContact CG-CD1 4.42Å; I1130-K1132 HydrophobicContact CG2-CB 3.96Å; I1130-K1132 HydrophobicContact CG2-CD 4.12Å; I1130-K1132 HydrophobicContact CG2-CG 4.18Å; I1130-I1141 CarbonylContact O-C 3.58Å; I1130-I1141 VanDerWaalsContact O-CA 3.3Å; I1130-I1141 WeakPolarHBondContact O-CA 2.98Å; I1130-E1142 HydrophobicContact CB-CB 4.34Å; I1130-E1142 PolarHBondContact N-O 2.87Å; I1130-E1142 PolarHBondContact O-N 3Å
1131	V	97.3	Very high	90.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	115.3	165.8	-174.3	0	0	0	0	108	I1104 V1106 L1117 M1118 I1139 V1168	I1104-V1131 HydrophobicContact CD1-CG2 4.25Å; I1104-V1131 HydrophobicContact CG2-CG2 4.12Å; V1106-V1131 HydrophobicContact CG1-CG1 4.25Å; L1117-V1131 HydrophobicContact CB-CG1 4.48Å; L1117-V1131 WeakPolarHBondContact CB-O 3.46Å; L1117-V1131 HydrophobicContact CD1-CG1 4.34Å; L1117-V1131 PolarHBondContact N-O 3Å; M1118-V1131 PolarHBondContact N-O 3.48Å; M1118-V1131 PolarHBondContact O-N 3.16Å; V1131-I1139 HydrophobicContact CG1-CG2 4.05Å; V1131-V1168 HydrophobicContact CG1-CG1 4.06Å
1132	K	96.5	Very high	91.1	Very high	51 Å²	51	38 Å²	38	22%	0.222	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	156.6	-174.2	64.1	-178.6	-174.9	-176.3	0	113.1	G1115 I1130 T1140 E1142	G1115-K1132 WeakPolarHBondContact O-CB 3.48Å; I1130-K1132 HydrophobicContact CG2-CB 3.96Å; I1130-K1132 HydrophobicContact CG2-CD 4.12Å; I1130-K1132 HydrophobicContact CG2-CG 4.18Å; K1132-T1140 PolarHBondContact N-O 3.12Å; K1132-T1140 PolarHBondContact O-N 3.08Å; K1132-E1142 IonicContact NZ-OE2 3.04Å; K1132-E1142 PolarHBondContact NZ-OE2 3.33Å
1133	V	95.7	Very high	91.3	Very high	7 Å²	7	38.1 Å²	38.1	4%	0.042	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	126.7	169.2	-176.4	0	0	0	0	108.6	F1108 G1115 L1117 I1139 T1161 F1225	F1108-V1133 HydrophobicContact CD2-CG2 4.46Å; F1108-V1133 HydrophobicContact CE2-CG2 4.26Å; G1115-V1133 PolarHBondContact O-N 3.24Å; G1115-V1133 VanDerWaalsContact O-N 3.11Å; L1117-V1133 HydrophobicContact CD1-CG2 4.41Å; L1117-V1133 HydrophobicContact CD2-CG2 4.16Å; L1117-V1133 HydrophobicContact CG-CG2 4.24Å; V1133-I1139 HydrophobicContact CG2-CD1 4.09Å; V1133-T1161 HydrophobicContact CG1-CG2 3.49Å; V1133-T1161 VanDerWaalsContact CG1-CG2 3.49Å; V1133-F1225 HydrophobicContact CG2-CD2 4.35Å; V1133-F1225 HydrophobicContact CG2-CE2 4.19Å
1134	N	92.7	Very high	91.6	Very high	20 Å²	20	34 Å²	34	11%	0.107	20%	0.195	C	C	.	.			trans	-87.4	166.7	178.8	74.9	33.9	0	0	0	112.1	K1113 N1136 G1137 G1138 T1140 T1153	K1113-N1134 CarbonylContact O-C 3.5Å; N1134-N1136 PolarHBondContact O-N 2.99Å; N1134-N1136 WeakPolarHBondContact OD1-CA 3.49Å; N1134-N1136 WeakPolarHBondContact OD1-CB 3.32Å; N1134-N1136 PolarHBondContact OD1-N 2.99Å; N1134-G1137 PolarHBondContact O-N 3.06Å; N1134-G1137 PolarHBondContact OD1-N 3.03Å; N1134-G1138 VanDerWaalsContact CG-O 3.31Å; N1134-G1138 PolarHBondContact N-O 3.19Å; N1134-G1138 WeakPolarHBondContact OD1-CA 3.27Å; N1134-G1138 PolarHBondContact OD1-N 2.92Å; N1134-G1138 PolarHBondContact OD1-O 2.86Å; N1134-T1140 PolarHBondContact ND2-OG1 3.33Å; N1134-T1153 WeakPolarHBondContact ND2-CG2 3.33Å
1135	N	91.5	Very high	91.9	Very high	126 Å²	126	30.9 Å²	30.9	67%	0.674	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.2	-177.6	62.6	-15.1	0	0	0	114.7	K1113	K1113-N1135 VanDerWaalsContact CD-O 3.28Å; K1113-N1135 WeakPolarHBondContact CD-O 3.48Å
1136	N	91.4	Very high	92.2	Very high	123 Å²	123	27.1 Å²	27.1	66%	0.658	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-12.5	174	-67.5	-15.2	0	0	0	111.9	K1113 N1134	K1113-N1136 PolarHBondContact NZ-O 3.41Å; N1134-N1136 PolarHBondContact O-N 2.99Å; N1134-N1136 WeakPolarHBondContact OD1-CA 3.49Å; N1134-N1136 WeakPolarHBondContact OD1-CB 3.32Å; N1134-N1136 PolarHBondContact OD1-N 2.99Å
1137	G	92.6	Very high	92	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.01	15%	0.147	C	C	.	.	S	Bend	trans	92.5	13.2	-175	0	0	0	0	0	113.9	N1134 D1159 L1160	N1134-G1137 PolarHBondContact O-N 3.06Å; N1134-G1137 PolarHBondContact OD1-N 3.03Å; G1137-D1159 WeakPolarHBondContact CA-OD1 3.23Å; G1137-L1160 WeakPolarHBondContact O-CA 3.41Å; G1137-L1160 VanDerWaalsContact O-CB 3.24Å; G1137-L1160 WeakPolarHBondContact O-CB 3.34Å; G1137-L1160 PolarHBondContact O-N 2.9Å
1138	G	94.9	Very high	91.7	Very high	7 Å²	7	32.2 Å²	32.2	7%	0.072	17%	0.17	C	C	.	.			trans	-95.1	-175.1	170.2	0	0	0	0	0	112.7	N1134 T1154	N1134-G1138 VanDerWaalsContact CG-O 3.31Å; N1134-G1138 PolarHBondContact N-O 3.19Å; N1134-G1138 WeakPolarHBondContact OD1-CA 3.27Å; N1134-G1138 PolarHBondContact OD1-N 2.92Å; N1134-G1138 PolarHBondContact OD1-O 2.86Å; G1138-T1154 WeakPolarHBondContact CA-OG1 3.44Å
1139	I	97.1	Very high	91.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	143.3	176.1	-61.2	-58.9	0	0	0	110.5	F1108 L1117 V1131 V1133 T1153 T1154 L1160 V1168 L1181 V1183	F1108-I1139 HydrophobicContact CE1-CD1 3.64Å; F1108-I1139 HydrophobicContact CE1-CG1 4.21Å; F1108-I1139 HydrophobicContact CZ-CD1 3.72Å; F1108-I1139 HydrophobicContact CZ-CG1 4.4Å; L1117-I1139 HydrophobicContact CD1-CD1 3.93Å; V1131-I1139 HydrophobicContact CG1-CG2 4.05Å; V1133-I1139 HydrophobicContact CG2-CD1 4.09Å; I1139-T1153 WeakPolarHBondContact O-CA 3.46Å; I1139-T1154 HydrophobicContact CB-CG2 3.93Å; I1139-T1154 PolarHBondContact N-OG1 2.81Å; I1139-T1154 PolarHBondContact O-N 3.43Å; I1139-T1154 PolarHBondContact O-OG1 3.06Å; I1139-L1160 HydrophobicContact CG1-CD1 3.88Å; I1139-V1168 HydrophobicContact CD1-CG2 4.1Å; I1139-V1168 HydrophobicContact CG1-CG2 3.84Å; I1139-V1168 HydrophobicContact CG2-CG1 3.94Å; I1139-V1168 HydrophobicContact CG2-CG2 4.28Å; I1139-L1181 HydrophobicContact CG2-CD1 4.07Å; I1139-L1181 HydrophobicContact CG2-CD2 4.41Å; I1139-V1183 HydrophobicContact CB-CG2 4.22Å; I1139-V1183 HydrophobicContact CG1-CG2 3.95Å
1140	T	96.9	Very high	91.3	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	128.4	175	-61.4	0	0	0	0	110.4	K1132 N1134 E1151 V1152 T1153	K1132-T1140 PolarHBondContact N-O 3.12Å; K1132-T1140 PolarHBondContact O-N 3.08Å; N1134-T1140 PolarHBondContact ND2-OG1 3.33Å; T1140-E1151 HydrophobicContact CG2-CB 4.08Å; T1140-E1151 HydrophobicContact CG2-CG 4.22Å; T1140-V1152 CarbonylContact C-O 3.59Å; T1140-V1152 WeakPolarHBondContact CA-O 3.37Å; T1140-T1153 WeakPolarHBondContact CG2-OG1 3.36Å; T1140-T1153 VanDerWaalsContact OG1-CG2 3.31Å; T1140-T1153 WeakPolarHBondContact OG1-CG2 3.08Å; T1140-T1153 PolarHBondContact OG1-OG1 2.99Å
1141	I	96.8	Very high	91.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	114.7	163.5	-52.9	171.2	0	0	0	106.1	I1129 I1130 F1143 E1151 V1152 A1170 W1179 L1181	I1129-I1141 HydrophobicContact CG2-CG2 4.28Å; I1130-I1141 CarbonylContact O-C 3.58Å; I1130-I1141 VanDerWaalsContact O-CA 3.3Å; I1130-I1141 WeakPolarHBondContact O-CA 2.98Å; I1141-F1143 HydrophobicContact CG2-CD1 4.21Å; I1141-E1151 CarbonylContact O-C 3.55Å; I1141-E1151 VanDerWaalsContact O-CA 3.23Å; I1141-E1151 WeakPolarHBondContact O-CA 3.29Å; I1141-V1152 HydrophobicContact CB-CB 4.29Å; I1141-V1152 HydrophobicContact CD1-CB 4.46Å; I1141-V1152 PolarHBondContact N-O 2.74Å; I1141-V1152 PolarHBondContact O-N 2.97Å; I1141-A1170 HydrophobicContact CD1-CB 3.52Å; I1141-A1170 HydrophobicContact CG1-CB 4.18Å; I1141-W1179 HydrophobicContact CD1-CE3 3.83Å; I1141-W1179 HydrophobicContact CD1-CZ3 4.18Å; I1141-W1179 HydrophobicContact CG2-CD2 4.46Å; I1141-W1179 HydrophobicContact CG2-CE3 4.34Å; I1141-W1179 HydrophobicContact CG2-CH2 4.24Å; I1141-W1179 HydrophobicContact CG2-CZ2 4.32Å; I1141-W1179 HydrophobicContact CG2-CZ3 4.24Å; I1141-L1181 HydrophobicContact CD1-CB 3.82Å; I1141-L1181 HydrophobicContact CD1-CD1 3.96Å; I1141-L1181 HydrophobicContact CD1-CD2 4.25Å; I1141-L1181 HydrophobicContact CD1-CG 4.21Å; I1141-L1181 HydrophobicContact CG1-CD1 4.11Å; I1141-L1181 HydrophobicContact CG1-CD2 4.17Å
1142	E	94.9	Very high	91.1	Very high	12 Å²	12	41.9 Å²	41.9	6%	0.056	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126	170.6	-178.7	-168.8	148.1	0	0	108.2	Y1128 I1129 I1130 K1132 R1149 Y1150 E1151	Y1128-E1142 HydrophobicContact CE2-CG 3.95Å; Y1128-E1142 WeakPolarHBondContact CE2-OE1 3.02Å; Y1128-E1142 PolarHBondContact OH-OE1 2.87Å; I1129-E1142 CarbonylContact C-O 3.36Å; I1130-E1142 HydrophobicContact CB-CB 4.34Å; I1130-E1142 PolarHBondContact N-O 2.87Å; I1130-E1142 PolarHBondContact O-N 3Å; K1132-E1142 IonicContact NZ-OE2 3.04Å; K1132-E1142 PolarHBondContact NZ-OE2 3.33Å; E1142-R1149 VanDerWaalsContact CD-NE 3.32Å; E1142-R1149 HydrophobicContact CG-CG 4.03Å; E1142-R1149 IonicContact OE1-CZ 2.66Å; E1142-R1149 IonicContact OE1-NE 3.15Å; E1142-R1149 PolarHBondContact OE1-NE 2.84Å; E1142-R1149 IonicContact OE1-NH1 3.96Å; E1142-R1149 PolarHBondContact OE1-NH1 2.72Å; E1142-R1149 VanDerWaalsContact OE1-NH1 3.12Å; E1142-R1149 IonicContact OE1-NH2 2.98Å; E1142-R1149 PolarHBondContact OE1-NH2 2.74Å; E1142-R1149 IonicContact OE2-CZ 3.99Å; E1142-R1149 VanDerWaalsContact OE2-CZ 3.26Å; E1142-R1149 IonicContact OE2-NE 3.99Å; E1142-R1149 IonicContact OE2-NH1 2.66Å; E1142-R1149 IonicContact OE2-NH2 3.22Å; E1142-R1149 PolarHBondContact OE2-NH2 3.08Å; E1142-Y1150 WeakPolarHBondContact CA-O 3.37Å; E1142-E1151 HydrophobicContact CB-CG 4.22Å; E1142-E1151 HydrophobicContact CG-CG 4.11Å
1143	F	93.3	Very high	91.1	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.009	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	146.5	-179.6	66.4	-82.1	0	0	0	112.3	Y1128 I1129 I1141 V1145 F1147 R1149 Y1150 V1152 W1179 F1193	Y1128-F1143 CarbonylContact O-C 3.5Å; Y1128-F1143 VanDerWaalsContact O-CA 3.23Å; Y1128-F1143 WeakPolarHBondContact O-CA 2.95Å; I1129-F1143 HydrophobicContact CB-CB 4.42Å; I1129-F1143 HydrophobicContact CG1-CB 4Å; I1141-F1143 HydrophobicContact CG2-CD1 4.21Å; F1143-V1145 HydrophobicContact CD2-CG2 4.35Å; F1143-F1147 HydrophobicContact CE2-CZ 4.38Å; F1143-R1149 WeakPolarHBondContact O-CA 3.4Å; F1143-Y1150 HydrophobicContact CZ-CG 4.33Å; F1143-Y1150 PolarHBondContact N-O 2.85Å; F1143-Y1150 PolarHBondContact O-N 3.1Å; F1143-V1152 HydrophobicContact CE1-CG2 4.22Å; F1143-W1179 AromaticContact CD1-CE2 3.99Å; F1143-W1179 HydrophobicContact CD1-CZ2 4.44Å; F1143-W1179 AromaticContact CD1-NE1 3.51Å; F1143-W1179 AromaticContact CD2-NE1 3.69Å; F1143-W1179 AromaticContact CE1-CD1 3.39Å; F1143-W1179 HydrophobicContact CE1-CG 4.21Å; F1143-W1179 AromaticContact CE1-NE1 3.29Å; F1143-W1179 VanDerWaalsContact CE1-NE1 3.29Å; F1143-W1179 AromaticContact CE2-CD1 3.98Å; F1143-W1179 AromaticContact CE2-NE1 3.48Å; F1143-W1179 HydrophobicContact CG-CZ2 4.33Å; F1143-W1179 AromaticContact CG-NE1 3.71Å; F1143-W1179 AromaticContact CZ-CD1 3.35Å; F1143-W1179 HydrophobicContact CZ-CG 4.49Å; F1143-W1179 AromaticContact CZ-NE1 3.27Å; F1143-W1179 VanDerWaalsContact CZ-NE1 3.27Å; F1143-F1193 AromaticContact CE1-CE2 4Å; F1143-F1193 HydrophobicContact CE1-CE2 4Å; F1143-F1193 HydrophobicContact CE1-CZ 4.07Å; F1143-F1193 AromaticContact CZ-CD2 3.97Å; F1143-F1193 HydrophobicContact CZ-CD2 3.97Å; F1143-F1193 HydrophobicContact CZ-CE1 4.39Å; F1143-F1193 AromaticContact CZ-CE2 3.63Å; F1143-F1193 HydrophobicContact CZ-CE2 3.63Å; F1143-F1193 HydrophobicContact CZ-CG 4.48Å; F1143-F1193 AromaticContact CZ-CZ 3.86Å; F1143-F1193 HydrophobicContact CZ-CZ 3.86Å
1144	D	91.2	Very high	91.1	Very high	34 Å²	34	42.4 Å²	42.4	18%	0.182	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	114.3	164.7	-165.3	-19.6	0	0	0	106.9	N1127 Y1128 G1146 F1147 K1148 R1149	N1127-D1144 CarbonylContact C-O 3.57Å; N1127-D1144 WeakPolarHBondContact CA-O 3.19Å; Y1128-D1144 HydrophobicContact CD1-CB 4.25Å; Y1128-D1144 HydrophobicContact CE1-CB 3.86Å; Y1128-D1144 PolarHBondContact N-O 3.02Å; Y1128-D1144 PolarHBondContact O-N 3.21Å; D1144-G1146 PolarHBondContact OD1-N 3.34Å; D1144-F1147 PolarHBondContact OD1-N 3.31Å; D1144-K1148 VanDerWaalsContact CG-C 3.47Å; D1144-K1148 PolarHBondContact OD1-N 3.26Å; D1144-R1149 PolarHBondContact OD2-N 3.17Å
1145	V	85.9	Confident	90.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	-118.8	28.2	-177.7	-66.4	0	0	0	0	111.5	I1129 F1143 F1147 L1205	I1129-V1145 HydrophobicContact CD1-CG1 4.44Å; I1129-V1145 HydrophobicContact CG1-CG1 4.19Å; F1143-V1145 HydrophobicContact CD2-CG2 4.35Å; V1145-F1147 HydrophobicContact CG2-CD1 4.48Å; V1145-F1147 HydrophobicContact CG2-CE1 3.57Å; V1145-F1147 HydrophobicContact CG2-CZ 3.94Å; V1145-L1205 HydrophobicContact CG1-CB 4.34Å
1146	G	77.5	Confident	90.8	Very high	42 Å²	42	43.6 Å²	43.6	43%	0.433	22%	0.221	S	C	.	.	S	Bend	trans	121.1	8.3	170.1	0	0	0	0	0	116.4	D1144	D1144-G1146 PolarHBondContact OD1-N 3.34Å
1147	F	72.6	Confident	90.6	Very high	63 Å²	63	45.9 Å²	45.9	28%	0.276	23%	0.233	S	C	.	.	S	Bend	trans	-137.3	-40.6	-179.7	49.7	-93.3	0	0	0	115.2	F1143 D1144 V1145 Y1150 L1197 A1201 D1202 V1203	F1143-F1147 HydrophobicContact CE2-CZ 4.38Å; D1144-F1147 PolarHBondContact OD1-N 3.31Å; V1145-F1147 HydrophobicContact CG2-CD1 4.48Å; V1145-F1147 HydrophobicContact CG2-CE1 3.57Å; V1145-F1147 HydrophobicContact CG2-CZ 3.94Å; F1147-Y1150 HydrophobicContact CD2-CD2 4.14Å; F1147-Y1150 AromaticContact CD2-CE2 3.54Å; F1147-Y1150 HydrophobicContact CD2-CE2 3.54Å; F1147-Y1150 AromaticContact CE2-CD2 3.5Å; F1147-Y1150 HydrophobicContact CE2-CD2 3.5Å; F1147-Y1150 VanDerWaalsContact CE2-CD2 3.5Å; F1147-Y1150 AromaticContact CE2-CE2 3.26Å; F1147-Y1150 HydrophobicContact CE2-CE2 3.26Å; F1147-L1197 HydrophobicContact CD1-CD2 4.02Å; F1147-L1197 HydrophobicContact CD2-CD2 3.39Å; F1147-L1197 HydrophobicContact CE1-CD2 3.76Å; F1147-L1197 HydrophobicContact CE2-CD2 3.13Å; F1147-L1197 HydrophobicContact CE2-CG 4.45Å; F1147-L1197 HydrophobicContact CG-CD2 3.86Å; F1147-L1197 HydrophobicContact CZ-CD1 4.17Å; F1147-L1197 HydrophobicContact CZ-CD2 3.33Å; F1147-L1197 HydrophobicContact CZ-CG 4.39Å; F1147-A1201 HydrophobicContact CD1-CB 4.33Å; F1147-D1202 WeakPolarHBondContact CD1-O 3.23Å; F1147-D1202 WeakPolarHBondContact CE1-O 3.48Å; F1147-V1203 HydrophobicContact CE1-CG1 4.11Å
1148	K	82.9	Confident	90.5	Very high	132 Å²	132	48.7 Å²	48.7	57%	0.574	25%	0.25	S	C	*	.			trans	-176.7	152.9	175.6	-166.4	177.3	177.3	-176.5	0	109.5	D1144 Y1150	D1144-K1148 VanDerWaalsContact CG-C 3.47Å; D1144-K1148 PolarHBondContact OD1-N 3.26Å; K1148-Y1150 HydrophobicContact CB-CD2 4.39Å; K1148-Y1150 HydrophobicContact CB-CE2 3.75Å; K1148-Y1150 HydrophobicContact CG-CE2 4.47Å; K1148-Y1150 WeakPolarHBondContact O-CD2 3.4Å; K1148-Y1150 PolarHBondContact O-N 2.8Å
1149	R	88.4	Confident	90.5	Very high	116 Å²	116	51.2 Å²	51.2	44%	0.438	26%	0.262	S	S	.	.			trans	-60.7	126.9	165.3	178.4	179.6	168.6	158.5	4.5	112.7	E1142 F1143 D1144 E1151	E1142-R1149 VanDerWaalsContact CD-NE 3.32Å; E1142-R1149 HydrophobicContact CG-CG 4.03Å; E1142-R1149 IonicContact OE1-CZ 2.66Å; E1142-R1149 IonicContact OE1-NE 3.15Å; E1142-R1149 PolarHBondContact OE1-NE 2.84Å; E1142-R1149 IonicContact OE1-NH1 3.96Å; E1142-R1149 PolarHBondContact OE1-NH1 2.72Å; E1142-R1149 VanDerWaalsContact OE1-NH1 3.12Å; E1142-R1149 IonicContact OE1-NH2 2.98Å; E1142-R1149 PolarHBondContact OE1-NH2 2.74Å; E1142-R1149 IonicContact OE2-CZ 3.99Å; E1142-R1149 VanDerWaalsContact OE2-CZ 3.26Å; E1142-R1149 IonicContact OE2-NE 3.99Å; E1142-R1149 IonicContact OE2-NH1 2.66Å; E1142-R1149 IonicContact OE2-NH2 3.22Å; E1142-R1149 PolarHBondContact OE2-NH2 3.08Å; F1143-R1149 WeakPolarHBondContact O-CA 3.4Å; D1144-R1149 PolarHBondContact OD2-N 3.17Å; R1149-E1151 IonicContact CZ-OE1 3.84Å; R1149-E1151 VanDerWaalsContact CZ-OE1 3.28Å; R1149-E1151 IonicContact NE-OE1 2.62Å; R1149-E1151 PolarHBondContact NE-OE1 3.42Å; R1149-E1151 VanDerWaalsContact NE-OE1 3.12Å; R1149-E1151 IonicContact NH2-OE1 3.12Å; R1149-E1151 PolarHBondContact NH2-OE1 2.87Å
1150	Y	92.3	Very high	90.4	Very high	48 Å²	48	51.3 Å²	51.3	19%	0.188	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	160.8	167.4	-71	-87.9	0	0	0	111.1	E1142 F1143 F1147 K1148 F1193 L1196	E1142-Y1150 WeakPolarHBondContact CA-O 3.37Å; F1143-Y1150 HydrophobicContact CZ-CG 4.33Å; F1143-Y1150 PolarHBondContact N-O 2.85Å; F1143-Y1150 PolarHBondContact O-N 3.1Å; F1147-Y1150 HydrophobicContact CD2-CD2 4.14Å; F1147-Y1150 AromaticContact CD2-CE2 3.54Å; F1147-Y1150 HydrophobicContact CD2-CE2 3.54Å; F1147-Y1150 AromaticContact CE2-CD2 3.5Å; F1147-Y1150 HydrophobicContact CE2-CD2 3.5Å; F1147-Y1150 VanDerWaalsContact CE2-CD2 3.5Å; F1147-Y1150 AromaticContact CE2-CE2 3.26Å; F1147-Y1150 HydrophobicContact CE2-CE2 3.26Å; K1148-Y1150 HydrophobicContact CB-CD2 4.39Å; K1148-Y1150 HydrophobicContact CB-CE2 3.75Å; K1148-Y1150 HydrophobicContact CG-CE2 4.47Å; K1148-Y1150 WeakPolarHBondContact O-CD2 3.4Å; K1148-Y1150 PolarHBondContact O-N 2.8Å; Y1150-F1193 AromaticContact CD1-CD1 3.67Å; Y1150-F1193 HydrophobicContact CD1-CD1 3.67Å; Y1150-F1193 AromaticContact CD1-CE1 3.44Å; Y1150-F1193 HydrophobicContact CD1-CE1 3.44Å; Y1150-F1193 VanDerWaalsContact CD1-CE1 3.44Å; Y1150-F1193 HydrophobicContact CE1-CD1 4.02Å; Y1150-F1193 HydrophobicContact CE1-CE1 4.2Å; Y1150-F1193 AromaticContact CG-CD1 3.99Å; Y1150-F1193 HydrophobicContact CG-CD1 3.99Å; Y1150-F1193 AromaticContact CG-CE1 3.77Å; Y1150-F1193 HydrophobicContact CG-CE1 3.77Å; Y1150-L1196 HydrophobicContact CE1-CD1 4.06Å
1151	E	94	Very high	90.3	Very high	89 Å²	89	51.5 Å²	51.5	42%	0.416	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	137.6	179.5	-66.8	-178.2	177.6	0	0	110.4	T1140 I1141 E1142 R1149	T1140-E1151 HydrophobicContact CG2-CB 4.08Å; T1140-E1151 HydrophobicContact CG2-CG 4.22Å; I1141-E1151 CarbonylContact O-C 3.55Å; I1141-E1151 VanDerWaalsContact O-CA 3.23Å; I1141-E1151 WeakPolarHBondContact O-CA 3.29Å; E1142-E1151 HydrophobicContact CB-CG 4.22Å; E1142-E1151 HydrophobicContact CG-CG 4.11Å; R1149-E1151 IonicContact CZ-OE1 3.84Å; R1149-E1151 VanDerWaalsContact CZ-OE1 3.28Å; R1149-E1151 IonicContact NE-OE1 2.62Å; R1149-E1151 PolarHBondContact NE-OE1 3.42Å; R1149-E1151 VanDerWaalsContact NE-OE1 3.12Å; R1149-E1151 IonicContact NH2-OE1 3.12Å; R1149-E1151 PolarHBondContact NH2-OE1 2.87Å
1152	V	95	Very high	90.1	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	115.8	168	-178.1	0	0	0	0	107.1	T1140 I1141 F1143 W1179 L1181 V1189 E1191 F1193	T1140-V1152 CarbonylContact C-O 3.59Å; T1140-V1152 WeakPolarHBondContact CA-O 3.37Å; I1141-V1152 HydrophobicContact CB-CB 4.29Å; I1141-V1152 HydrophobicContact CD1-CB 4.46Å; I1141-V1152 PolarHBondContact N-O 2.74Å; I1141-V1152 PolarHBondContact O-N 2.97Å; F1143-V1152 HydrophobicContact CE1-CG2 4.22Å; V1152-W1179 HydrophobicContact CG2-CB 3.85Å; V1152-W1179 HydrophobicContact CG2-CG 4.31Å; V1152-L1181 HydrophobicContact CG1-CB 4.07Å; V1152-L1181 HydrophobicContact CG1-CD2 4.21Å; V1152-V1189 HydrophobicContact CG1-CG1 3.93Å; V1152-E1191 HydrophobicContact CB-CG 4.39Å; V1152-E1191 HydrophobicContact CG1-CB 4.32Å; V1152-E1191 HydrophobicContact CG1-CG 3.83Å; V1152-E1191 HydrophobicContact CG2-CB 3.8Å; V1152-E1191 HydrophobicContact CG2-CG 3.96Å; V1152-F1193 HydrophobicContact CG2-CE2 3.9Å; V1152-F1193 HydrophobicContact CG2-CZ 3.81Å
1153	T	95.6	Very high	90	Very high	56 Å²	56	56.9 Å²	56.9	34%	0.344	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	136.6	-173	-59.3	0	0	0	0	110.6	N1134 I1139 T1140 N1155	N1134-T1153 WeakPolarHBondContact ND2-CG2 3.33Å; I1139-T1153 WeakPolarHBondContact O-CA 3.46Å; T1140-T1153 WeakPolarHBondContact CG2-OG1 3.36Å; T1140-T1153 VanDerWaalsContact OG1-CG2 3.31Å; T1140-T1153 WeakPolarHBondContact OG1-CG2 3.08Å; T1140-T1153 PolarHBondContact OG1-OG1 2.99Å; T1153-N1155 PolarHBondContact O-N 2.87Å
1154	T	94.7	Very high	90	Very high	14 Å²	14	62.5 Å²	62.5	9%	0.086	32%	0.319	C	S	.	.			trans	-59.3	133.8	172.1	55.8	0	0	0	0	111	G1138 I1139 Y1156 L1181 V1183	G1138-T1154 WeakPolarHBondContact CA-OG1 3.44Å; I1139-T1154 HydrophobicContact CB-CG2 3.93Å; I1139-T1154 PolarHBondContact N-OG1 2.81Å; I1139-T1154 PolarHBondContact O-N 3.43Å; I1139-T1154 PolarHBondContact O-OG1 3.06Å; T1154-Y1156 HydrophobicContact CG2-CD2 4.01Å; T1154-Y1156 HydrophobicContact CG2-CE2 3.5Å; T1154-L1181 HydrophobicContact CG2-CD2 3.76Å; T1154-L1181 HydrophobicContact CG2-CG 4.16Å; T1154-V1183 HydrophobicContact CG2-CG2 3.83Å
1155	N	89.9	Confident	90.1	Very high	132 Å²	132	63.9 Å²	63.9	71%	0.706	32%	0.324	S	S	*	.			trans	-106.6	26.8	178.4	64	-6.9	0	0	0	112.9	T1153	T1153-N1155 PolarHBondContact O-N 2.87Å
1156	Y	89.3	Confident	90.6	Very high	38 Å²	38	64.1 Å²	64.1	15%	0.149	33%	0.325	C	S	.	.			trans	-73.8	143.6	-179	-48.2	-35.8	0	0	0	111.6	T1154 V1158 L1160 V1183 Y1186 N1187 V1189	T1154-Y1156 HydrophobicContact CG2-CD2 4.01Å; T1154-Y1156 HydrophobicContact CG2-CE2 3.5Å; Y1156-V1158 PolarHBondContact O-N 2.92Å; Y1156-V1158 VanDerWaalsContact O-N 3.08Å; Y1156-L1160 HydrophobicContact CD2-CD1 4.46Å; Y1156-V1183 HydrophobicContact CE2-CB 3.96Å; Y1156-V1183 HydrophobicContact CE2-CG2 4.08Å; Y1156-Y1186 HydrophobicContact CD1-CG 4.47Å; Y1156-Y1186 HydrophobicContact CD2-CD2 4.25Å; Y1156-Y1186 HydrophobicContact CD2-CG 4.05Å; Y1156-Y1186 HydrophobicContact CE2-CD2 4.28Å; Y1156-Y1186 HydrophobicContact CE2-CG 4.09Å; Y1156-Y1186 HydrophobicContact CG-CD1 4.41Å; Y1156-Y1186 HydrophobicContact CG-CG 4.26Å; Y1156-Y1186 VanDerWaalsContact CZ-CB 3.41Å; Y1156-N1187 WeakPolarHBondContact CE1-O 3.48Å; Y1156-N1187 VanDerWaalsContact CZ-O 3.3Å; Y1156-N1187 PolarHBondContact OH-O 2.68Å; Y1156-V1189 HydrophobicContact CE1-CG2 4.3Å
1157	D	87.5	Confident	91.5	Very high	172 Å²	172	63.1 Å²	63.1	92%	0.92	31%	0.309	S	S	*	.	S	Bend	trans	-84.8	44.9	172.8	-161.5	19.3	0	0	0	111.3
1158	V	90.6	Very high	92.7	Very high	60 Å²	60	60.2 Å²	60.2	36%	0.364	30%	0.297	S	S	.	.	S	Bend	trans	-143.1	134.7	-178	-179	0	0	0	0	109.5	Y1156 L1160 Y1186	Y1156-V1158 PolarHBondContact O-N 2.92Å; Y1156-V1158 VanDerWaalsContact O-N 3.08Å; V1158-L1160 PolarHBondContact O-N 3.2Å; V1158-Y1186 HydrophobicContact CG2-CE1 4.07Å
1159	D	93.5	Very high	93.4	Very high	60 Å²	60	57.2 Å²	57.2	32%	0.321	28%	0.282	S	S	.	.			trans	-82.1	110.9	170.4	-171	-12.9	0	0	0	109.6	K1113 G1137 T1161 N1162	K1113-D1159 WeakPolarHBondContact CE-OD2 3.46Å; K1113-D1159 IonicContact NZ-OD1 3.19Å; K1113-D1159 IonicContact NZ-OD2 3.33Å; K1113-D1159 PolarHBondContact NZ-OD2 3.01Å; G1137-D1159 WeakPolarHBondContact CA-OD1 3.23Å; D1159-T1161 PolarHBondContact O-N 3.36Å; D1159-T1161 WeakPolarHBondContact OD1-CB 3.38Å; D1159-T1161 PolarHBondContact OD1-N 3.42Å; D1159-T1161 PolarHBondContact OD1-OG1 2.82Å; D1159-N1162 WeakPolarHBondContact O-CB 3.42Å; D1159-N1162 PolarHBondContact O-ND2 3.3Å
1160	L	95.4	Very high	93.8	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.261	C	S	.	.	S	Bend	trans	-79.7	2.6	179.2	-53	169.8	0	0	0	112.2	F1108 G1137 I1139 Y1156 V1158 N1162 H1166 V1183 Y1186	F1108-L1160 WeakPolarHBondContact CE2-O 3.49Å; F1108-L1160 HydrophobicContact CZ-CB 4.02Å; G1137-L1160 WeakPolarHBondContact O-CA 3.41Å; G1137-L1160 VanDerWaalsContact O-CB 3.24Å; G1137-L1160 WeakPolarHBondContact O-CB 3.34Å; G1137-L1160 PolarHBondContact O-N 2.9Å; I1139-L1160 HydrophobicContact CG1-CD1 3.88Å; Y1156-L1160 HydrophobicContact CD2-CD1 4.46Å; V1158-L1160 PolarHBondContact O-N 3.2Å; L1160-N1162 VanDerWaalsContact C-N 3.32Å; L1160-H1166 PolarHBondContact O-CD2 3.23Å; L1160-H1166 PolarHBondContact O-NE2 3.26Å; L1160-V1183 HydrophobicContact CD1-CB 4.32Å; L1160-V1183 HydrophobicContact CD1-CG1 4.02Å; L1160-V1183 HydrophobicContact CD1-CG2 4.18Å; L1160-V1183 HydrophobicContact CD2-CG1 4.37Å; L1160-Y1186 HydrophobicContact CD2-CE2 4.09Å
1161	T	94.6	Very high	94	Very high	9 Å²	9	52.4 Å²	52.4	6%	0.055	26%	0.264	C	S	.	.			trans	-100.9	39.1	175.6	67	0	0	0	0	112	T1110 K1111 S1112 K1113 V1133 D1159	T1110-T1161 HydrophobicContact CG2-CG2 3.99Å; T1110-T1161 CarbonylContact O-C 3.59Å; T1110-T1161 WeakPolarHBondContact O-CA 3.04Å; K1111-T1161 WeakPolarHBondContact CA-O 3.21Å; S1112-T1161 WeakPolarHBondContact O-CG2 3.32Å; K1113-T1161 WeakPolarHBondContact CE-OG1 3.33Å; K1113-T1161 HydrophobicContact CG-CG2 4.09Å; K1113-T1161 VanDerWaalsContact CG-OG1 3.29Å; K1113-T1161 WeakPolarHBondContact CG-OG1 3.34Å; V1133-T1161 HydrophobicContact CG1-CG2 3.49Å; V1133-T1161 VanDerWaalsContact CG1-CG2 3.49Å; D1159-T1161 PolarHBondContact O-N 3.36Å; D1159-T1161 WeakPolarHBondContact OD1-CB 3.38Å; D1159-T1161 PolarHBondContact OD1-N 3.42Å; D1159-T1161 PolarHBondContact OD1-OG1 2.82Å
1162	N	93.8	Very high	93.9	Very high	59 Å²	59	48.4 Å²	48.4	32%	0.316	25%	0.245	S	C	.	.	S	Bend	trans	-94.6	14.8	-171.8	59.8	21.6	0	0	0	113.4	D1159 L1160 Q1164 H1166	D1159-N1162 WeakPolarHBondContact O-CB 3.42Å; D1159-N1162 PolarHBondContact O-ND2 3.3Å; L1160-N1162 VanDerWaalsContact C-N 3.32Å; N1162-Q1164 PolarHBondContact O-N 2.83Å; N1162-Q1164 WeakPolarHBondContact OD1-CA 3.21Å; N1162-Q1164 WeakPolarHBondContact OD1-CB 3.41Å; N1162-Q1164 VanDerWaalsContact OD1-CG 3.28Å; N1162-Q1164 WeakPolarHBondContact OD1-CG 3.46Å; N1162-Q1164 PolarHBondContact OD1-N 3.04Å; N1162-H1166 PolarHBondContact ND2-NE2 2.99Å; N1162-H1166 VanDerWaalsContact ND2-NE2 3.18Å; N1162-H1166 PolarHBondContact OD1-NE2 2.97Å
1163	D	91.9	Very high	93.8	Very high	66 Å²	66	50.1 Å²	50.1	35%	0.353	26%	0.256	S	S	.	.	S	Bend	trans	61.8	20.2	-173.2	-156.5	28.2	0	0	0	114.7	K1109 T1110 K1111	K1109-D1163 WeakPolarHBondContact CE-O 3.25Å; K1109-D1163 WeakPolarHBondContact CE-OD1 3.5Å; T1110-D1163 PolarHBondContact O-N 2.75Å; K1111-D1163 HydrophobicContact CD-CB 4.3Å; K1111-D1163 WeakPolarHBondContact CE-OD2 3.48Å; K1111-D1163 HydrophobicContact CG-CB 3.78Å; K1111-D1163 IonicContact NZ-OD2 3.12Å; K1111-D1163 PolarHBondContact NZ-OD2 2.63Å
1164	Q	93.2	Very high	93.6	Very high	121 Å²	121	51.7 Å²	51.7	57%	0.565	26%	0.262	S	S	*	.	S	Bend	trans	-98.4	171.4	169.3	-56	-176.2	-20.6	0	0	110.9	K1109 N1162	K1109-Q1164 WeakPolarHBondContact CA-O 3.35Å; N1162-Q1164 PolarHBondContact O-N 2.83Å; N1162-Q1164 WeakPolarHBondContact OD1-CA 3.21Å; N1162-Q1164 WeakPolarHBondContact OD1-CB 3.41Å; N1162-Q1164 VanDerWaalsContact OD1-CG 3.28Å; N1162-Q1164 WeakPolarHBondContact OD1-CG 3.46Å; N1162-Q1164 PolarHBondContact OD1-N 3.04Å
1165	H	94.1	Very high	93.2	Very high	62 Å²	62	56.8 Å²	56.8	29%	0.287	29%	0.288	S	S	.	.			trans	-83.4	122.7	177.5	-72.9	-86.2	0	0	0	109.8	Y1230 C1265 F1267	H1165-Y1230 WeakPolarHBondContact CA-OH 3.28Å; H1165-Y1230 VanDerWaalsContact CB-OH 3.3Å; H1165-Y1230 WeakPolarHBondContact CB-OH 3.45Å; H1165-Y1230 AromaticContact ND1-CE1 3.58Å; H1165-Y1230 AromaticContact ND1-CZ 3.63Å; H1165-Y1230 PolarHBondContact ND1-OH 3.44Å; H1165-C1265 PolarHBondContact CE1-O 2.87Å; H1165-C1265 PolarHBondContact NE2-O 2.79Å; H1165-F1267 HydrophobicContact CB-CZ 4.16Å; H1165-F1267 AromaticContact CE1-CD2 3.73Å; H1165-F1267 AromaticContact CE1-CE2 3.27Å; H1165-F1267 WeakPolarHBondContact CE1-CE2 3.48Å; H1165-F1267 AromaticContact CE1-CZ 3.58Å; H1165-F1267 AromaticContact CG-CZ 3.7Å; H1165-F1267 AromaticContact ND1-CE2 3.1Å; H1165-F1267 WeakPolarHBondContact ND1-CE2 3.37Å; H1165-F1267 AromaticContact ND1-CZ 3.13Å; H1165-F1267 WeakPolarHBondContact ND1-CZ 3.46Å
1166	H	96.2	Very high	93.1	Very high	5 Å²	5	50.7 Å²	50.7	2%	0.023	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.6	176.2	-67.2	-64.3	0	0	0	109.9	G1107 F1108 L1160 N1162 V1183 D1184 Y1230	G1107-H1166 CarbonylContact C-O 3.57Å; G1107-H1166 WeakPolarHBondContact CA-O 3.36Å; F1108-H1166 HydrophobicContact CD1-CB 4.1Å; F1108-H1166 HydrophobicContact CE1-CB 3.55Å; F1108-H1166 HydrophobicContact CE2-CB 4.48Å; F1108-H1166 HydrophobicContact CZ-CB 3.77Å; F1108-H1166 PolarHBondContact N-O 3.49Å; F1108-H1166 PolarHBondContact O-N 2.86Å; L1160-H1166 PolarHBondContact O-CD2 3.23Å; L1160-H1166 PolarHBondContact O-NE2 3.26Å; N1162-H1166 PolarHBondContact ND2-NE2 2.99Å; N1162-H1166 VanDerWaalsContact ND2-NE2 3.18Å; N1162-H1166 PolarHBondContact OD1-NE2 2.97Å; H1166-V1183 HydrophobicContact CB-CG1 4.17Å; H1166-D1184 WeakPolarHBondContact CA-OD1 3.15Å; H1166-D1184 IonicContact CE1-OD2 3.91Å; H1166-D1184 IonicContact CG-OD2 3.22Å; H1166-D1184 IonicContact ND1-OD2 2.93Å; H1166-D1184 PolarHBondContact ND1-OD2 2.86Å; H1166-Y1230 PolarHBondContact N-OH 3.39Å; H1166-Y1230 PolarHBondContact O-OH 2.71Å
1167	M	96	Very high	93.1	Very high	21 Å²	21	49.9 Å²	49.9	10%	0.103	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.8	177.2	-176	62.2	65.7	0	0	110.4	Q1105 Y1169 V1183 D1184 Y1230 A1231	Q1105-M1167 HydrophobicContact CG-CG 4.45Å; Q1105-M1167 HydrophobicContact CG-SD 3.54Å; Q1105-M1167 VanDerWaalsContact CG-SD 3.54Å; M1167-Y1169 HydrophobicContact CB-CE2 4.12Å; M1167-Y1169 HydrophobicContact CG-CD2 4.11Å; M1167-Y1169 HydrophobicContact CG-CE1 4.07Å; M1167-Y1169 HydrophobicContact CG-CE2 3.4Å; M1167-Y1169 WeakPolarHBondContact CG-OH 3.36Å; M1167-V1183 CarbonylContact O-C 3.08Å; M1167-V1183 VanDerWaalsContact O-CA 3.26Å; M1167-V1183 WeakPolarHBondContact O-CA 3.33Å; M1167-V1183 WeakPolarHBondContact O-CG1 3.38Å; M1167-D1184 PolarHBondContact N-OD1 2.95Å; M1167-D1184 PolarHBondContact O-N 2.83Å; M1167-Y1230 HydrophobicContact CE-CD2 4.22Å; M1167-Y1230 HydrophobicContact CE-CE2 3.72Å; M1167-A1231 HydrophobicContact CE-CB 3.99Å
1168	V	97.6	Very high	93.4	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.012	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	126.5	176.7	-174.6	0	0	0	0	109.5	Q1105 V1106 F1108 L1117 V1131 I1139 L1181 V1183	Q1105-V1168 WeakPolarHBondContact CA-O 3.33Å; V1106-V1168 HydrophobicContact CG1-CB 4.02Å; V1106-V1168 PolarHBondContact N-O 3.48Å; V1106-V1168 WeakPolarHBondContact O-CB 3.49Å; V1106-V1168 PolarHBondContact O-N 3.4Å; F1108-V1168 HydrophobicContact CD1-CG2 4.01Å; F1108-V1168 HydrophobicContact CE1-CG2 3.76Å; L1117-V1168 HydrophobicContact CD1-CG2 4.09Å; V1131-V1168 HydrophobicContact CG1-CG1 4.06Å; I1139-V1168 HydrophobicContact CD1-CG2 4.1Å; I1139-V1168 HydrophobicContact CG1-CG2 3.84Å; I1139-V1168 HydrophobicContact CG2-CG1 3.94Å; I1139-V1168 HydrophobicContact CG2-CG2 4.28Å; V1168-L1181 HydrophobicContact CG1-CD1 3.73Å; V1168-V1183 HydrophobicContact CG2-CG1 4.4Å; V1168-V1183 HydrophobicContact CG2-CG2 4.21Å
1169	Y	96.9	Very high	93.6	Very high	69 Å²	69	41.5 Å²	41.5	27%	0.271	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123.4	167.1	-57.8	-82.9	0	0	0	108.5	Y1103 Q1105 M1167 K1182	Y1103-Y1169 WeakPolarHBondContact OH-CD1 3.39Å; Q1105-Y1169 HydrophobicContact CB-CD1 4.39Å; Q1105-Y1169 HydrophobicContact CG-CD1 3.96Å; Q1105-Y1169 HydrophobicContact CG-CE1 3.8Å; M1167-Y1169 HydrophobicContact CB-CE2 4.12Å; M1167-Y1169 HydrophobicContact CG-CD2 4.11Å; M1167-Y1169 HydrophobicContact CG-CE1 4.07Å; M1167-Y1169 HydrophobicContact CG-CE2 3.4Å; M1167-Y1169 WeakPolarHBondContact CG-OH 3.36Å; Y1169-K1182 PolarHBondContact N-O 2.85Å; Y1169-K1182 PolarHBondContact O-N 3.44Å
1170	A	97	Very high	93.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	125.7	175.7	0	0	0	0	0	109.2	I1104 I1141 W1179 H1180 L1181	I1104-A1170 WeakPolarHBondContact CA-O 3.44Å; I1104-A1170 HydrophobicContact CB-CB 4.24Å; I1104-A1170 HydrophobicContact CD1-CB 4.47Å; I1104-A1170 PolarHBondContact N-O 3.12Å; I1104-A1170 PolarHBondContact O-N 3.09Å; I1141-A1170 HydrophobicContact CD1-CB 3.52Å; I1141-A1170 HydrophobicContact CG1-CB 4.18Å; A1170-W1179 HydrophobicContact CB-CZ3 4.43Å; A1170-H1180 CarbonylContact C-O 3.55Å; A1170-H1180 VanDerWaalsContact CA-O 3.27Å; A1170-H1180 WeakPolarHBondContact CA-O 3.35Å; A1170-L1181 HydrophobicContact CB-CD1 4.33Å
1171	W	96.6	Very high	93.9	Very high	64 Å²	64	39.5 Å²	39.5	24%	0.242	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	157.6	177.4	69.3	96	0	0	0	112.4	E1102 Y1103 H1180 K1182 E1188	E1102-W1171 CarbonylContact O-C 3.56Å; E1102-W1171 WeakPolarHBondContact O-CA 3.46Å; E1102-W1171 WeakPolarHBondContact O-CB 3.49Å; Y1103-W1171 HydrophobicContact CD2-CB 4.04Å; W1171-H1180 AromaticContact CD1-CD2 3.84Å; W1171-H1180 HydrophobicContact CD2-CB 3.53Å; W1171-H1180 AromaticContact CE2-CG 3.54Å; W1171-H1180 AromaticContact CE2-ND1 3.99Å; W1171-H1180 HydrophobicContact CE3-CB 3.98Å; W1171-H1180 HydrophobicContact CG-CB 4.04Å; W1171-H1180 HydrophobicContact CH2-CB 3.83Å; W1171-H1180 HydrophobicContact CZ2-CB 3.37Å; W1171-H1180 AromaticContact CZ2-CG 3.79Å; W1171-H1180 AromaticContact CZ2-ND1 3.88Å; W1171-H1180 HydrophobicContact CZ3-CB 4.11Å; W1171-H1180 PolarHBondContact N-O 2.77Å; W1171-H1180 AromaticContact NE1-CD2 3.51Å; W1171-H1180 AromaticContact NE1-CG 3.35Å; W1171-H1180 VanDerWaalsContact NE1-CG 3.35Å; W1171-H1180 AromaticContact NE1-ND1 3.81Å; W1171-H1180 PolarHBondContact O-N 3.43Å; W1171-K1182 HydrophobicContact CH2-CB 4.41Å; W1171-K1182 HydrophobicContact CZ3-CB 4.19Å; W1171-E1188 HydrophobicContact CH2-CG 4.13Å; W1171-E1188 VanDerWaalsContact CZ2-OE1 3.28Å; W1171-E1188 WeakPolarHBondContact CZ2-OE1 3.27Å
1172	R	93.2	Very high	94	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.015	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134.8	-175	-147.3	178.1	53.7	152.2	-21	110.9	T1099 V1100 E1102 G1176 K1178 W1179 V1203	T1099-R1172 PolarHBondContact O-NH2 2.89Å; V1100-R1172 PolarHBondContact O-NE 3.08Å; V1100-R1172 VanDerWaalsContact O-NE 3.13Å; V1100-R1172 PolarHBondContact O-NH2 2.79Å; V1100-R1172 VanDerWaalsContact O-NH2 3.11Å; E1102-R1172 PolarHBondContact O-N 2.96Å; E1102-R1172 IonicContact OE1-CZ 2.72Å; E1102-R1172 IonicContact OE1-NE 2.72Å; E1102-R1172 IonicContact OE1-NH2 3.56Å; E1102-R1172 PolarHBondContact OE1-NH2 3.16Å; E1102-R1172 WeakPolarHBondContact OE2-CB 3.46Å; E1102-R1172 WeakPolarHBondContact OE2-CD 3.3Å; E1102-R1172 IonicContact OE2-CZ 2.79Å; E1102-R1172 IonicContact OE2-NE 2.65Å; E1102-R1172 PolarHBondContact OE2-NE 3.33Å; E1102-R1172 IonicContact OE2-NH2 3.84Å; E1102-R1172 PolarHBondContact OE2-NH2 3.18Å; R1172-G1176 VanDerWaalsContact CD-O 3.29Å; R1172-G1176 WeakPolarHBondContact CD-O 3.41Å; R1172-G1176 VanDerWaalsContact CZ-CA 3.42Å; R1172-G1176 VanDerWaalsContact NE-CA 3.3Å; R1172-G1176 PolarHBondContact NH1-O 3.33Å; R1172-K1178 WeakPolarHBondContact CA-O 3.45Å; R1172-K1178 VanDerWaalsContact CG-O 3.23Å; R1172-K1178 WeakPolarHBondContact CG-O 3.42Å; R1172-W1179 HydrophobicContact CB-CD2 4.24Å; R1172-W1179 HydrophobicContact CB-CE3 4.16Å; R1172-W1179 HydrophobicContact CB-CH2 4.28Å; R1172-W1179 HydrophobicContact CB-CZ2 4.39Å; R1172-W1179 HydrophobicContact CB-CZ3 4.17Å; R1172-W1179 HydrophobicContact CG-CD2 3.78Å; R1172-W1179 HydrophobicContact CG-CE3 4.22Å; R1172-W1179 HydrophobicContact CG-CG 4.1Å; R1172-W1179 HydrophobicContact CG-CH2 4.5Å; R1172-W1179 HydrophobicContact CG-CZ2 4.12Å; R1172-V1203 VanDerWaalsContact CZ-O 3.24Å; R1172-V1203 PolarHBondContact NH1-O 2.81Å; R1172-V1203 PolarHBondContact NH2-O 2.88Å
1173	T	92.8	Very high	94.1	Very high	38 Å²	38	39.3 Å²	39.3	23%	0.233	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	-177.1	-177.7	65.4	0	0	0	0	110.5	L1175 G1176 T1177 K1178 H1180	T1173-L1175 PolarHBondContact O-N 3.31Å; T1173-G1176 WeakPolarHBondContact O-CA 3.23Å; T1173-G1176 PolarHBondContact O-N 3.12Å; T1173-T1177 PolarHBondContact O-N 2.93Å; T1173-K1178 PolarHBondContact N-O 2.92Å; T1173-K1178 PolarHBondContact O-N 2.82Å; T1173-H1180 PolarHBondContact OG1-NE2 2.84Å
1174	D	91.1	Very high	94.2	Very high	88 Å²	88	38.1 Å²	38.1	47%	0.471	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	56.1	48.5	177.2	-64.5	-38.7	0	0	0	112.6	G1176 T1177 K1178	D1174-G1176 PolarHBondContact O-N 2.85Å; D1174-T1177 PolarHBondContact O-N 2.86Å; D1174-T1177 PolarHBondContact O-OG1 3.03Å; D1174-K1178 HydrophobicContact CB-CB 4.14Å; D1174-K1178 WeakPolarHBondContact OD2-CD 3.25Å; D1174-K1178 IonicContact OD2-NZ 3.22Å
1175	L	86.9	Confident	94.1	Very high	122 Å²	122	39.5 Å²	39.5	64%	0.639	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	58.4	24	-174.3	-57.5	171.5	0	0	0	113.5	V1100 T1173 V1203	V1100-L1175 CarbonylContact O-C 3.58Å; T1173-L1175 PolarHBondContact O-N 3.31Å; L1175-V1203 WeakPolarHBondContact O-CG2 3.4Å
1176	G	87.6	Confident	94.1	Very high	3 Å²	3	40.3 Å²	40.3	3%	0.031	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	94.8	4.4	174.8	0	0	0	0	0	115	V1100 R1172 T1173 D1174	V1100-G1176 WeakPolarHBondContact O-CA 3.28Å; V1100-G1176 PolarHBondContact O-N 3.41Å; V1100-G1176 VanDerWaalsContact O-N 3.08Å; R1172-G1176 VanDerWaalsContact CD-O 3.29Å; R1172-G1176 WeakPolarHBondContact CD-O 3.41Å; R1172-G1176 VanDerWaalsContact CZ-CA 3.42Å; R1172-G1176 VanDerWaalsContact NE-CA 3.3Å; R1172-G1176 PolarHBondContact NH1-O 3.33Å; T1173-G1176 WeakPolarHBondContact O-CA 3.23Å; T1173-G1176 PolarHBondContact O-N 3.12Å; D1174-G1176 PolarHBondContact O-N 2.85Å
1177	T	89.1	Confident	93.9	Very high	22 Å²	22	46.7 Å²	46.7	14%	0.135	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-15.6	178.5	64.4	0	0	0	0	113.1	T1173 D1174 F1193 S1194 L1197 V1203	T1173-T1177 PolarHBondContact O-N 2.93Å; D1174-T1177 PolarHBondContact O-N 2.86Å; D1174-T1177 PolarHBondContact O-OG1 3.03Å; T1177-F1193 WeakPolarHBondContact O-CA 3.35Å; T1177-F1193 WeakPolarHBondContact O-CB 2.94Å; T1177-F1193 WeakPolarHBondContact O-CD2 3.47Å; T1177-F1193 PolarHBondContact O-N 2.95Å; T1177-S1194 WeakPolarHBondContact CB-OG 3.45Å; T1177-S1194 PolarHBondContact OG1-OG 2.81Å; T1177-L1197 HydrophobicContact CG2-CD1 3.83Å; T1177-V1203 HydrophobicContact CG2-CG1 4.3Å
1178	K	93.2	Very high	93.9	Very high	55 Å²	55	49.8 Å²	49.8	24%	0.239	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.8	-175.7	-169.8	175.8	-179.4	177.8	0	111.6	R1172 T1173 D1174 V1190 E1191 D1192	R1172-K1178 WeakPolarHBondContact CA-O 3.45Å; R1172-K1178 VanDerWaalsContact CG-O 3.23Å; R1172-K1178 WeakPolarHBondContact CG-O 3.42Å; T1173-K1178 PolarHBondContact N-O 2.92Å; T1173-K1178 PolarHBondContact O-N 2.82Å; D1174-K1178 HydrophobicContact CB-CB 4.14Å; D1174-K1178 WeakPolarHBondContact OD2-CD 3.25Å; D1174-K1178 IonicContact OD2-NZ 3.22Å; K1178-V1190 HydrophobicContact CD-CG1 4.19Å; K1178-V1190 HydrophobicContact CG-CG1 3.99Å; K1178-E1191 WeakPolarHBondContact CA-O 3.43Å; K1178-D1192 HydrophobicContact CG-CB 4.28Å
1179	W	95.2	Very high	93.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	139.4	178.6	-86.5	101.6	0	0	0	111.3	I1104 I1129 I1141 F1143 V1152 A1170 R1172 V1190 E1191 F1193	I1104-W1179 HydrophobicContact CD1-CH2 4.23Å; I1104-W1179 HydrophobicContact CD1-CZ3 4.32Å; I1129-W1179 HydrophobicContact CD1-CH2 4.04Å; I1129-W1179 HydrophobicContact CD1-CZ2 3.95Å; I1129-W1179 HydrophobicContact CG1-CZ2 4.33Å; I1129-W1179 HydrophobicContact CG2-CH2 3.81Å; I1129-W1179 HydrophobicContact CG2-CZ2 4.11Å; I1141-W1179 HydrophobicContact CD1-CE3 3.83Å; I1141-W1179 HydrophobicContact CD1-CZ3 4.18Å; I1141-W1179 HydrophobicContact CG2-CD2 4.46Å; I1141-W1179 HydrophobicContact CG2-CE3 4.34Å; I1141-W1179 HydrophobicContact CG2-CH2 4.24Å; I1141-W1179 HydrophobicContact CG2-CZ2 4.32Å; I1141-W1179 HydrophobicContact CG2-CZ3 4.24Å; F1143-W1179 AromaticContact CD1-CE2 3.99Å; F1143-W1179 HydrophobicContact CD1-CZ2 4.44Å; F1143-W1179 AromaticContact CD1-NE1 3.51Å; F1143-W1179 AromaticContact CD2-NE1 3.69Å; F1143-W1179 AromaticContact CE1-CD1 3.39Å; F1143-W1179 HydrophobicContact CE1-CG 4.21Å; F1143-W1179 AromaticContact CE1-NE1 3.29Å; F1143-W1179 VanDerWaalsContact CE1-NE1 3.29Å; F1143-W1179 AromaticContact CE2-CD1 3.98Å; F1143-W1179 AromaticContact CE2-NE1 3.48Å; F1143-W1179 HydrophobicContact CG-CZ2 4.33Å; F1143-W1179 AromaticContact CG-NE1 3.71Å; F1143-W1179 AromaticContact CZ-CD1 3.35Å; F1143-W1179 HydrophobicContact CZ-CG 4.49Å; F1143-W1179 AromaticContact CZ-NE1 3.27Å; F1143-W1179 VanDerWaalsContact CZ-NE1 3.27Å; V1152-W1179 HydrophobicContact CG2-CB 3.85Å; V1152-W1179 HydrophobicContact CG2-CG 4.31Å; A1170-W1179 HydrophobicContact CB-CZ3 4.43Å; R1172-W1179 HydrophobicContact CB-CD2 4.24Å; R1172-W1179 HydrophobicContact CB-CE3 4.16Å; R1172-W1179 HydrophobicContact CB-CH2 4.28Å; R1172-W1179 HydrophobicContact CB-CZ2 4.39Å; R1172-W1179 HydrophobicContact CB-CZ3 4.17Å; R1172-W1179 HydrophobicContact CG-CD2 3.78Å; R1172-W1179 HydrophobicContact CG-CE3 4.22Å; R1172-W1179 HydrophobicContact CG-CG 4.1Å; R1172-W1179 HydrophobicContact CG-CH2 4.5Å; R1172-W1179 HydrophobicContact CG-CZ2 4.12Å; W1179-V1190 WeakPolarHBondContact O-CA 3.5Å; W1179-E1191 PolarHBondContact N-O 2.76Å; W1179-E1191 PolarHBondContact O-N 2.71Å; W1179-F1193 HydrophobicContact CB-CE2 4.31Å; W1179-F1193 AromaticContact CD1-CE2 3.85Å; W1179-F1193 HydrophobicContact CG-CE2 4.47Å
1180	H	97.1	Very high	93.7	Very high	19 Å²	19	49.8 Å²	49.8	9%	0.088	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.5	176.8	-58.8	-105.1	0	0	0	108.3	A1170 W1171 T1173 E1188	A1170-H1180 CarbonylContact C-O 3.55Å; A1170-H1180 VanDerWaalsContact CA-O 3.27Å; A1170-H1180 WeakPolarHBondContact CA-O 3.35Å; W1171-H1180 AromaticContact CD1-CD2 3.84Å; W1171-H1180 HydrophobicContact CD2-CB 3.53Å; W1171-H1180 AromaticContact CE2-CG 3.54Å; W1171-H1180 AromaticContact CE2-ND1 3.99Å; W1171-H1180 HydrophobicContact CE3-CB 3.98Å; W1171-H1180 HydrophobicContact CG-CB 4.04Å; W1171-H1180 HydrophobicContact CH2-CB 3.83Å; W1171-H1180 HydrophobicContact CZ2-CB 3.37Å; W1171-H1180 AromaticContact CZ2-CG 3.79Å; W1171-H1180 AromaticContact CZ2-ND1 3.88Å; W1171-H1180 HydrophobicContact CZ3-CB 4.11Å; W1171-H1180 PolarHBondContact N-O 2.77Å; W1171-H1180 AromaticContact NE1-CD2 3.51Å; W1171-H1180 AromaticContact NE1-CG 3.35Å; W1171-H1180 VanDerWaalsContact NE1-CG 3.35Å; W1171-H1180 AromaticContact NE1-ND1 3.81Å; W1171-H1180 PolarHBondContact O-N 3.43Å; T1173-H1180 PolarHBondContact OG1-NE2 2.84Å; H1180-E1188 IonicContact CE1-OE1 3.56Å; H1180-E1188 IonicContact CG-OE1 2.66Å; H1180-E1188 IonicContact ND1-OE1 3.78Å; H1180-E1188 PolarHBondContact ND1-OE1 2.93Å
1181	L	97.3	Very high	93.5	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	122.2	178.5	174.3	60.1	0	0	0	109.3	I1139 I1141 V1152 T1154 V1168 A1170 V1189	I1139-L1181 HydrophobicContact CG2-CD1 4.07Å; I1139-L1181 HydrophobicContact CG2-CD2 4.41Å; I1141-L1181 HydrophobicContact CD1-CB 3.82Å; I1141-L1181 HydrophobicContact CD1-CD1 3.96Å; I1141-L1181 HydrophobicContact CD1-CD2 4.25Å; I1141-L1181 HydrophobicContact CD1-CG 4.21Å; I1141-L1181 HydrophobicContact CG1-CD1 4.11Å; I1141-L1181 HydrophobicContact CG1-CD2 4.17Å; V1152-L1181 HydrophobicContact CG1-CB 4.07Å; V1152-L1181 HydrophobicContact CG1-CD2 4.21Å; T1154-L1181 HydrophobicContact CG2-CD2 3.76Å; T1154-L1181 HydrophobicContact CG2-CG 4.16Å; V1168-L1181 HydrophobicContact CG1-CD1 3.73Å; A1170-L1181 HydrophobicContact CB-CD1 4.33Å; L1181-V1189 HydrophobicContact CB-CB 4.4Å; L1181-V1189 PolarHBondContact N-O 2.6Å; L1181-V1189 PolarHBondContact O-N 3.41Å
1182	K	96.8	Very high	93.4	Very high	65 Å²	65	54.5 Å²	54.5	28%	0.283	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	133.1	176.8	-171.3	-178.5	179.8	-166	0	109.5	Y1169 W1171 D1184 Y1186	Y1169-K1182 PolarHBondContact N-O 2.85Å; Y1169-K1182 PolarHBondContact O-N 3.44Å; W1171-K1182 HydrophobicContact CH2-CB 4.41Å; W1171-K1182 HydrophobicContact CZ3-CB 4.19Å; K1182-D1184 VanDerWaalsContact CE-O 3.23Å; K1182-D1184 WeakPolarHBondContact CE-O 3.21Å; K1182-Y1186 WeakPolarHBondContact CE-O 3.23Å
1183	V	96.3	Very high	93.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	130.2	169.9	-169.9	0	0	0	0	108.4	I1139 T1154 Y1156 L1160 H1166 M1167 V1168 D1185 Y1186	I1139-V1183 HydrophobicContact CB-CG2 4.22Å; I1139-V1183 HydrophobicContact CG1-CG2 3.95Å; T1154-V1183 HydrophobicContact CG2-CG2 3.83Å; Y1156-V1183 HydrophobicContact CE2-CB 3.96Å; Y1156-V1183 HydrophobicContact CE2-CG2 4.08Å; L1160-V1183 HydrophobicContact CD1-CB 4.32Å; L1160-V1183 HydrophobicContact CD1-CG1 4.02Å; L1160-V1183 HydrophobicContact CD1-CG2 4.18Å; L1160-V1183 HydrophobicContact CD2-CG1 4.37Å; H1166-V1183 HydrophobicContact CB-CG1 4.17Å; M1167-V1183 CarbonylContact O-C 3.08Å; M1167-V1183 VanDerWaalsContact O-CA 3.26Å; M1167-V1183 WeakPolarHBondContact O-CA 3.33Å; M1167-V1183 WeakPolarHBondContact O-CG1 3.38Å; V1168-V1183 HydrophobicContact CG2-CG1 4.4Å; V1168-V1183 HydrophobicContact CG2-CG2 4.21Å; V1183-D1185 PolarHBondContact O-N 2.65Å; V1183-Y1186 WeakPolarHBondContact O-CB 3.25Å; V1183-Y1186 VanDerWaalsContact O-CD2 3.3Å; V1183-Y1186 WeakPolarHBondContact O-CD2 3.12Å; V1183-Y1186 PolarHBondContact O-N 3.35Å
1184	D	94.3	Very high	92.9	Very high	41 Å²	41	55.4 Å²	55.4	22%	0.219	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	49	-128.9	-177.3	-53.7	-37	0	0	0	112.4	H1166 M1167 K1182 Y1186	H1166-D1184 WeakPolarHBondContact CA-OD1 3.15Å; H1166-D1184 IonicContact CE1-OD2 3.91Å; H1166-D1184 IonicContact CG-OD2 3.22Å; H1166-D1184 IonicContact ND1-OD2 2.93Å; H1166-D1184 PolarHBondContact ND1-OD2 2.86Å; M1167-D1184 PolarHBondContact N-OD1 2.95Å; M1167-D1184 PolarHBondContact O-N 2.83Å; K1182-D1184 VanDerWaalsContact CE-O 3.23Å; K1182-D1184 WeakPolarHBondContact CE-O 3.21Å; D1184-Y1186 HydrophobicContact CB-CD2 4.15Å; D1184-Y1186 HydrophobicContact CB-CE2 4.39Å
1185	D	90.6	Very high	92.7	Very high	149 Å²	149	58.6 Å²	58.6	80%	0.797	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	9.7	174.4	-68.4	-36.5	0	0	0	113.1	V1183	V1183-D1185 PolarHBondContact O-N 2.65Å
1186	Y	93.8	Very high	92.6	Very high	80 Å²	80	58.1 Å²	58.1	31%	0.314	30%	0.3	S	S	.	.	S	Bend	trans	-66.3	160.6	175.1	-64.7	-76.5	0	0	0	111.2	Y1156 V1158 L1160 K1182 V1183 D1184 E1188	Y1156-Y1186 HydrophobicContact CD1-CG 4.47Å; Y1156-Y1186 HydrophobicContact CD2-CD2 4.25Å; Y1156-Y1186 HydrophobicContact CD2-CG 4.05Å; Y1156-Y1186 HydrophobicContact CE2-CD2 4.28Å; Y1156-Y1186 HydrophobicContact CE2-CG 4.09Å; Y1156-Y1186 HydrophobicContact CG-CD1 4.41Å; Y1156-Y1186 HydrophobicContact CG-CG 4.26Å; Y1156-Y1186 VanDerWaalsContact CZ-CB 3.41Å; V1158-Y1186 HydrophobicContact CG2-CE1 4.07Å; L1160-Y1186 HydrophobicContact CD2-CE2 4.09Å; K1182-Y1186 WeakPolarHBondContact CE-O 3.23Å; V1183-Y1186 WeakPolarHBondContact O-CB 3.25Å; V1183-Y1186 VanDerWaalsContact O-CD2 3.3Å; V1183-Y1186 WeakPolarHBondContact O-CD2 3.12Å; V1183-Y1186 PolarHBondContact O-N 3.35Å; D1184-Y1186 HydrophobicContact CB-CD2 4.15Å; D1184-Y1186 HydrophobicContact CB-CE2 4.39Å; Y1186-E1188 PolarHBondContact O-N 2.99Å
1187	N	92.4	Very high	92.3	Very high	138 Å²	138	59.1 Å²	59.1	74%	0.738	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-57.8	136	-180	-70.6	-22.3	0	0	0	110.9	Y1156 V1189	Y1156-N1187 WeakPolarHBondContact CE1-O 3.48Å; Y1156-N1187 VanDerWaalsContact CZ-O 3.3Å; Y1156-N1187 PolarHBondContact OH-O 2.68Å; N1187-V1189 PolarHBondContact O-N 2.92Å
1188	E	95.3	Very high	91.9	Very high	86 Å²	86	61.3 Å²	61.3	40%	0.402	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-64.1	130.8	174.8	-173.4	-173.6	164.8	0	0	110.7	W1171 H1180 Y1186 V1190	W1171-E1188 HydrophobicContact CH2-CG 4.13Å; W1171-E1188 VanDerWaalsContact CZ2-OE1 3.28Å; W1171-E1188 WeakPolarHBondContact CZ2-OE1 3.27Å; H1180-E1188 IonicContact CE1-OE1 3.56Å; H1180-E1188 IonicContact CG-OE1 2.66Å; H1180-E1188 IonicContact ND1-OE1 3.78Å; H1180-E1188 PolarHBondContact ND1-OE1 2.93Å; Y1186-E1188 PolarHBondContact O-N 2.99Å; E1188-V1190 HydrophobicContact CG-CG2 3.71Å; E1188-V1190 VanDerWaalsContact OE1-CG2 3.25Å; E1188-V1190 WeakPolarHBondContact OE1-CG2 3.39Å
1189	V	95.1	Very high	91	Very high	12 Å²	12	65.4 Å²	65.4	7%	0.073	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.5	169.8	179.8	0	0	0	0	107.4	V1152 Y1156 L1181 N1187 E1191	V1152-V1189 HydrophobicContact CG1-CG1 3.93Å; Y1156-V1189 HydrophobicContact CE1-CG2 4.3Å; L1181-V1189 HydrophobicContact CB-CB 4.4Å; L1181-V1189 PolarHBondContact N-O 2.6Å; L1181-V1189 PolarHBondContact O-N 3.41Å; N1187-V1189 PolarHBondContact O-N 2.92Å; V1189-E1191 HydrophobicContact CG1-CG 4.38Å
1190	V	95.4	Very high	90.2	Very high	60 Å²	60	71.4 Å²	71.4	36%	0.364	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	120.3	179	-175.3	0	0	0	0	108.6	K1178 W1179 E1188	K1178-V1190 HydrophobicContact CD-CG1 4.19Å; K1178-V1190 HydrophobicContact CG-CG1 3.99Å; W1179-V1190 WeakPolarHBondContact O-CA 3.5Å; E1188-V1190 HydrophobicContact CG-CG2 3.71Å; E1188-V1190 VanDerWaalsContact OE1-CG2 3.25Å; E1188-V1190 WeakPolarHBondContact OE1-CG2 3.39Å
1191	E	94.3	Very high	89.3	Confident	90 Å²	90	71.8 Å²	71.8	42%	0.421	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	121.1	176.5	-70.5	-65.3	164.1	0	0	109.2	V1152 K1178 W1179 V1189 F1193	V1152-E1191 HydrophobicContact CB-CG 4.39Å; V1152-E1191 HydrophobicContact CG1-CB 4.32Å; V1152-E1191 HydrophobicContact CG1-CG 3.83Å; V1152-E1191 HydrophobicContact CG2-CB 3.8Å; V1152-E1191 HydrophobicContact CG2-CG 3.96Å; K1178-E1191 WeakPolarHBondContact CA-O 3.43Å; W1179-E1191 PolarHBondContact N-O 2.76Å; W1179-E1191 PolarHBondContact O-N 2.71Å; V1189-E1191 HydrophobicContact CG1-CG 4.38Å; E1191-F1193 HydrophobicContact CB-CE2 3.71Å; E1191-F1193 HydrophobicContact CB-CZ 3.85Å
1192	D	92.8	Very high	88.7	Confident	73 Å²	73	75 Å²	75	39%	0.39	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	111.3	-179.5	-177.2	0.1	0	0	0	110	K1178 S1194	K1178-D1192 HydrophobicContact CG-CB 4.28Å; D1192-S1194 WeakPolarHBondContact OD1-CB 3.42Å; D1192-S1194 PolarHBondContact OD1-N 3.05Å; D1192-S1194 PolarHBondContact OD1-OG 3.4Å
1193	F	90.1	Very high	88.2	Confident	12 Å²	12	73 Å²	73	5%	0.053	41%	0.406	C	S	.	.			trans	-91.3	0.5	-179.8	-58.5	-86.1	0	0	0	112.6	F1143 Y1150 V1152 T1177 W1179 E1191 N1195 L1196 L1197	F1143-F1193 AromaticContact CE1-CE2 4Å; F1143-F1193 HydrophobicContact CE1-CE2 4Å; F1143-F1193 HydrophobicContact CE1-CZ 4.07Å; F1143-F1193 AromaticContact CZ-CD2 3.97Å; F1143-F1193 HydrophobicContact CZ-CD2 3.97Å; F1143-F1193 HydrophobicContact CZ-CE1 4.39Å; F1143-F1193 AromaticContact CZ-CE2 3.63Å; F1143-F1193 HydrophobicContact CZ-CE2 3.63Å; F1143-F1193 HydrophobicContact CZ-CG 4.48Å; F1143-F1193 AromaticContact CZ-CZ 3.86Å; F1143-F1193 HydrophobicContact CZ-CZ 3.86Å; Y1150-F1193 AromaticContact CD1-CD1 3.67Å; Y1150-F1193 HydrophobicContact CD1-CD1 3.67Å; Y1150-F1193 AromaticContact CD1-CE1 3.44Å; Y1150-F1193 HydrophobicContact CD1-CE1 3.44Å; Y1150-F1193 VanDerWaalsContact CD1-CE1 3.44Å; Y1150-F1193 HydrophobicContact CE1-CD1 4.02Å; Y1150-F1193 HydrophobicContact CE1-CE1 4.2Å; Y1150-F1193 AromaticContact CG-CD1 3.99Å; Y1150-F1193 HydrophobicContact CG-CD1 3.99Å; Y1150-F1193 AromaticContact CG-CE1 3.77Å; Y1150-F1193 HydrophobicContact CG-CE1 3.77Å; V1152-F1193 HydrophobicContact CG2-CE2 3.9Å; V1152-F1193 HydrophobicContact CG2-CZ 3.81Å; T1177-F1193 WeakPolarHBondContact O-CA 3.35Å; T1177-F1193 WeakPolarHBondContact O-CB 2.94Å; T1177-F1193 WeakPolarHBondContact O-CD2 3.47Å; T1177-F1193 PolarHBondContact O-N 2.95Å; W1179-F1193 HydrophobicContact CB-CE2 4.31Å; W1179-F1193 AromaticContact CD1-CE2 3.85Å; W1179-F1193 HydrophobicContact CG-CE2 4.47Å; E1191-F1193 HydrophobicContact CB-CE2 3.71Å; E1191-F1193 HydrophobicContact CB-CZ 3.85Å; F1193-N1195 PolarHBondContact O-N 3.33Å; F1193-L1196 HydrophobicContact CD1-CD1 3.95Å; F1193-L1196 WeakPolarHBondContact O-CA 3.47Å; F1193-L1196 PolarHBondContact O-N 3.39Å; F1193-L1197 HydrophobicContact CB-CD1 3.94Å; F1193-L1197 HydrophobicContact CB-CG 4.19Å; F1193-L1197 VanDerWaalsContact O-CG 3.3Å; F1193-L1197 WeakPolarHBondContact O-CG 3.43Å; F1193-L1197 PolarHBondContact O-N 2.82Å
1194	S	86.9	Confident	87.8	Confident	49 Å²	49	78.5 Å²	78.5	34%	0.343	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-33.4	-176	-55.4	0	0	0	0	113.3	T1177 D1192	T1177-S1194 WeakPolarHBondContact CB-OG 3.45Å; T1177-S1194 PolarHBondContact OG1-OG 2.81Å; D1192-S1194 WeakPolarHBondContact OD1-CB 3.42Å; D1192-S1194 PolarHBondContact OD1-N 3.05Å; D1192-S1194 PolarHBondContact OD1-OG 3.4Å
1195	N	85.9	Confident	87.5	Confident	154 Å²	154	76.6 Å²	76.6	82%	0.824	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-14.8	178.4	-66.1	-38.7	0	0	0	114.4	F1193	F1193-N1195 PolarHBondContact O-N 3.33Å
1196	L	84.7	Confident	87.4	Confident	113 Å²	113	71.9 Å²	71.9	59%	0.592	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-16.6	-179.3	-63.6	171.2	0	0	0	112.1	Y1150 F1193	Y1150-L1196 HydrophobicContact CE1-CD1 4.06Å; F1193-L1196 HydrophobicContact CD1-CD1 3.95Å; F1193-L1196 WeakPolarHBondContact O-CA 3.47Å; F1193-L1196 PolarHBondContact O-N 3.39Å
1197	L	82.6	Confident	87.1	Confident	24 Å²	24	70.4 Å²	70.4	13%	0.126	39%	0.389	C	S	.	.	S	Bend	trans	-97.9	142.1	-174.6	-60.3	173.8	0	0	0	111.8	F1147 T1177 F1193 A1201 V1203	F1147-L1197 HydrophobicContact CD1-CD2 4.02Å; F1147-L1197 HydrophobicContact CD2-CD2 3.39Å; F1147-L1197 HydrophobicContact CE1-CD2 3.76Å; F1147-L1197 HydrophobicContact CE2-CD2 3.13Å; F1147-L1197 HydrophobicContact CE2-CG 4.45Å; F1147-L1197 HydrophobicContact CG-CD2 3.86Å; F1147-L1197 HydrophobicContact CZ-CD1 4.17Å; F1147-L1197 HydrophobicContact CZ-CD2 3.33Å; F1147-L1197 HydrophobicContact CZ-CG 4.39Å; T1177-L1197 HydrophobicContact CG2-CD1 3.83Å; F1193-L1197 HydrophobicContact CB-CD1 3.94Å; F1193-L1197 HydrophobicContact CB-CG 4.19Å; F1193-L1197 VanDerWaalsContact O-CG 3.3Å; F1193-L1197 WeakPolarHBondContact O-CG 3.43Å; F1193-L1197 PolarHBondContact O-N 2.82Å; L1197-A1201 HydrophobicContact CB-CB 4.09Å; L1197-A1201 HydrophobicContact CD2-CB 4.37Å; L1197-V1203 HydrophobicContact CD1-CG1 3.95Å
1198	S	79.9	Confident	86.9	Confident	67 Å²	67	63.9 Å²	63.9	47%	0.469	35%	0.354	S	S	.	.			trans	-64.9	147.4	166.9	178	0	0	0	0	109.4	T1200 A1201	S1198-T1200 PolarHBondContact O-N 3.27Å; S1198-T1200 PolarHBondContact OG-N 2.93Å; S1198-T1200 PolarHBondContact OG-OG1 2.76Å; S1198-T1200 VanDerWaalsContact OG-OG1 3.1Å; S1198-A1201 WeakPolarHBondContact O-CB 3.33Å; S1198-A1201 PolarHBondContact O-N 2.89Å
1199	P	75.3	Confident	86.7	Confident	142 Å²	142	61.7 Å²	61.7	92%	0.922	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-17.7	170.4	-23.8	32.8	0	0	0	114.3
1200	T	77	Confident	86.6	Confident	126 Å²	126	61.1 Å²	61.1	77%	0.773	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	10.7	176.7	66	0	0	0	0	112.9	S1198 D1202	S1198-T1200 PolarHBondContact O-N 3.27Å; S1198-T1200 PolarHBondContact OG-N 2.93Å; S1198-T1200 PolarHBondContact OG-OG1 2.76Å; S1198-T1200 VanDerWaalsContact OG-OG1 3.1Å; T1200-D1202 PolarHBondContact O-N 3.01Å
1201	A	79.5	Confident	86.6	Confident	26 Å²	26	58.2 Å²	58.2	22%	0.215	32%	0.322	C	S	.	.			trans	-64.8	135.2	178	0	0	0	0	0	109.2	F1147 L1197 S1198 V1203	F1147-A1201 HydrophobicContact CD1-CB 4.33Å; L1197-A1201 HydrophobicContact CB-CB 4.09Å; L1197-A1201 HydrophobicContact CD2-CB 4.37Å; S1198-A1201 WeakPolarHBondContact O-CB 3.33Å; S1198-A1201 PolarHBondContact O-N 2.89Å; A1201-V1203 PolarHBondContact O-N 3Å
1202	D	83.1	Confident	86.7	Confident	69 Å²	69	54 Å²	54	37%	0.369	30%	0.302	S	S	.	.			trans	-73.5	120.1	171.4	-160.1	-14.6	0	0	0	108.8	F1147 T1200 R1204	F1147-D1202 WeakPolarHBondContact CD1-O 3.23Å; F1147-D1202 WeakPolarHBondContact CE1-O 3.48Å; T1200-D1202 PolarHBondContact O-N 3.01Å; D1202-R1204 VanDerWaalsContact OD1-CB 3.29Å; D1202-R1204 WeakPolarHBondContact OD1-CB 3.33Å; D1202-R1204 PolarHBondContact OD1-N 2.91Å
1203	V	86.4	Confident	86.9	Confident	22 Å²	22	50.6 Å²	50.6	13%	0.133	28%	0.284	C	S	.	.			trans	-110.2	8.7	-179.6	-72.8	0	0	0	0	110.2	V1100 F1147 R1172 L1175 T1177 L1197 A1201	V1100-V1203 HydrophobicContact CG1-CG2 4.43Å; F1147-V1203 HydrophobicContact CE1-CG1 4.11Å; R1172-V1203 VanDerWaalsContact CZ-O 3.24Å; R1172-V1203 PolarHBondContact NH1-O 2.81Å; R1172-V1203 PolarHBondContact NH2-O 2.88Å; L1175-V1203 WeakPolarHBondContact O-CG2 3.4Å; T1177-V1203 HydrophobicContact CG2-CG1 4.3Å; L1197-V1203 HydrophobicContact CD1-CG1 3.95Å; A1201-V1203 PolarHBondContact O-N 3Å
1204	R	88.5	Confident	87.2	Confident	116 Å²	116	50 Å²	50	44%	0.438	28%	0.281	S	S	.	.			trans	-90.2	135.1	-175.6	-166.7	175.6	-66.3	154.2	1.2	111.1	T1099 V1100 D1202 D1206	T1099-R1204 CarbonylContact O-C 3.58Å; T1099-R1204 WeakPolarHBondContact O-CA 3.39Å; T1099-R1204 WeakPolarHBondContact O-CG 3.34Å; V1100-R1204 HydrophobicContact CG1-CB 4.08Å; V1100-R1204 HydrophobicContact CG1-CG 4.19Å; D1202-R1204 VanDerWaalsContact OD1-CB 3.29Å; D1202-R1204 WeakPolarHBondContact OD1-CB 3.33Å; D1202-R1204 PolarHBondContact OD1-N 2.91Å; R1204-D1206 VanDerWaalsContact C-N 3.32Å; R1204-D1206 VanDerWaalsContact CD-OD1 3.29Å; R1204-D1206 WeakPolarHBondContact CD-OD1 3.28Å; R1204-D1206 PolarHBondContact O-N 3.22Å
1205	L	88.7	Confident	87.5	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-73.5	94.4	159.1	178	66.5	0	0	0	107.3	G1098 T1099 M1120 N1127 I1129 V1145 P1208 W1234	G1098-L1205 CarbonylContact C-O 3.54Å; G1098-L1205 WeakPolarHBondContact CA-O 3.48Å; T1099-L1205 PolarHBondContact N-O 2.97Å; T1099-L1205 VanDerWaalsContact N-O 3.15Å; T1099-L1205 PolarHBondContact O-N 2.76Å; M1120-L1205 HydrophobicContact CB-CD2 3.85Å; N1127-L1205 HydrophobicContact CB-CD1 4.46Å; I1129-L1205 HydrophobicContact CD1-CB 4.34Å; I1129-L1205 HydrophobicContact CD1-CD2 4.03Å; I1129-L1205 HydrophobicContact CG1-CD1 4.48Å; V1145-L1205 HydrophobicContact CG1-CB 4.34Å; L1205-P1208 HydrophobicContact CD2-CB 4.14Å; L1205-P1208 HydrophobicContact CG-CB 4.38Å; L1205-W1234 HydrophobicContact CD2-CH2 4.46Å; L1205-W1234 HydrophobicContact CD2-CZ2 3.9Å
1206	D	87.3	Confident	87.9	Confident	50 Å²	50	42.1 Å²	42.1	27%	0.267	23%	0.233	S	C	.	.			trans	-73.7	138.3	-178.1	-66.7	-50.7	0	0	0	112.7	G1122 N1127 R1204	G1122-D1206 WeakPolarHBondContact CA-O 3.25Å; N1127-D1206 PolarHBondContact ND2-OD2 3.14Å; R1204-D1206 VanDerWaalsContact C-N 3.32Å; R1204-D1206 VanDerWaalsContact CD-OD1 3.29Å; R1204-D1206 WeakPolarHBondContact CD-OD1 3.28Å; R1204-D1206 PolarHBondContact O-N 3.22Å
1207	D	87.5	Confident	88.2	Confident	50 Å²	50	40.4 Å²	40.4	27%	0.267	22%	0.224	S	C	.	.	S	Bend	trans	37.1	58.8	171.9	-159.6	9.4	0	0	0	114.2	R1096 G1122 E1123 Y1209	R1096-D1207 VanDerWaalsContact CB-OD1 3.27Å; R1096-D1207 WeakPolarHBondContact CB-OD1 2.99Å; R1096-D1207 WeakPolarHBondContact CD-OD1 3.28Å; R1096-D1207 WeakPolarHBondContact CG-OD1 2.98Å; G1122-D1207 CarbonylContact C-O 3.59Å; G1122-D1207 WeakPolarHBondContact CA-O 3.46Å; E1123-D1207 HydrophobicContact CB-CB 4.11Å; E1123-D1207 PolarHBondContact N-O 2.82Å; D1207-Y1209 PolarHBondContact O-N 2.68Å
1208	P	89.9	Confident	88.6	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	114.9	177.9	25.2	-33.6	0	0	0	109.3	L1090 L1205 W1234	L1090-P1208 HydrophobicContact CD1-CB 4.02Å; L1090-P1208 WeakPolarHBondContact CD1-O 2.9Å; L1205-P1208 HydrophobicContact CD2-CB 4.14Å; L1205-P1208 HydrophobicContact CG-CB 4.38Å; P1208-W1234 HydrophobicContact CB-CH2 3.61Å; P1208-W1234 HydrophobicContact CB-CZ2 4.39Å; P1208-W1234 HydrophobicContact CB-CZ3 4.46Å; P1208-W1234 HydrophobicContact CG-CH2 3.75Å; P1208-W1234 HydrophobicContact CG-CZ2 4.42Å
1209	Y	90.3	Very high	89.2	Confident	40 Å²	40	43 Å²	43	16%	0.157	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-19.7	-174.5	86.7	-78.7	0	0	0	112.8	L1090 R1121 G1122 E1123 D1207	L1090-Y1209 PolarHBondContact N-O 3.39Å; R1121-Y1209 HydrophobicContact CG-CE1 4.25Å; R1121-Y1209 VanDerWaalsContact O-CD1 3.27Å; R1121-Y1209 WeakPolarHBondContact O-CD1 3.19Å; R1121-Y1209 PolarHBondContact O-N 2.95Å; G1122-Y1209 VanDerWaalsContact C-CD1 3.43Å; G1122-Y1209 WeakPolarHBondContact O-CD1 3.46Å; G1122-Y1209 VanDerWaalsContact O-CE1 3.27Å; G1122-Y1209 WeakPolarHBondContact O-CE1 3.45Å; E1123-Y1209 HydrophobicContact CB-CD1 4.38Å; D1207-Y1209 PolarHBondContact O-N 2.68Å
1210	V	93.7	Very high	90	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	142.9	-178	70.1	0	0	0	0	112.3	K1087 I1088 R1121 Y1212	K1087-V1210 HydrophobicContact CD-CG2 4.26Å; K1087-V1210 HydrophobicContact CG-CG2 3.49Å; K1087-V1210 VanDerWaalsContact CG-CG2 3.49Å; I1088-V1210 CarbonylContact O-C 3.54Å; I1088-V1210 WeakPolarHBondContact O-CA 3.44Å; R1121-V1210 HydrophobicContact CB-CG1 3.8Å; R1121-V1210 HydrophobicContact CG-CG1 4.5Å; R1121-V1210 PolarHBondContact N-O 2.98Å; R1121-V1210 PolarHBondContact O-N 3Å; V1210-Y1212 HydrophobicContact CB-CE2 4.33Å; V1210-Y1212 HydrophobicContact CG1-CD2 4.24Å; V1210-Y1212 HydrophobicContact CG1-CE2 3.42Å; V1210-Y1212 VanDerWaalsContact CG1-CE2 3.42Å; V1210-Y1212 HydrophobicContact CG2-CD2 4.44Å; V1210-Y1212 HydrophobicContact CG2-CE1 4.3Å; V1210-Y1212 HydrophobicContact CG2-CE2 3.93Å
1211	L	94.9	Very high	90.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.4	171.6	-177	96.8	0	0	0	110.3	K1087 I1088 M1118 E1119 M1120 W1234 P1239	K1087-L1211 CarbonylContact C-O 3.59Å; K1087-L1211 WeakPolarHBondContact CA-O 3.48Å; I1088-L1211 HydrophobicContact CB-CB 4.27Å; I1088-L1211 HydrophobicContact CD1-CD2 4.08Å; I1088-L1211 PolarHBondContact N-O 3.19Å; I1088-L1211 PolarHBondContact O-N 2.84Å; M1118-L1211 HydrophobicContact CG-CD1 3.72Å; M1118-L1211 HydrophobicContact CG-CG 4.34Å; M1118-L1211 HydrophobicContact SD-CD1 4.04Å; E1119-L1211 CarbonylContact O-C 3.45Å; E1119-L1211 WeakPolarHBondContact O-CA 3.36Å; E1119-L1211 WeakPolarHBondContact O-CD1 3.2Å; M1120-L1211 HydrophobicContact CG-CD1 3.55Å; M1120-L1211 HydrophobicContact SD-CD1 3.62Å; L1211-W1234 HydrophobicContact CD1-CE3 4.09Å; L1211-P1239 HydrophobicContact CD2-CB 3.48Å; L1211-P1239 VanDerWaalsContact CD2-CB 3.48Å; L1211-P1239 HydrophobicContact CD2-CG 3.21Å
1212	Y	96.4	Very high	90.9	Very high	1 Å²	1	41 Å²	41	0%	0.004	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	146.4	173.5	-58.2	-89.2	0	0	0	112.4	M1085 V1086 K1087 M1118 E1119 V1210 N1216 D1217	M1085-Y1212 HydrophobicContact CG-CD1 4.19Å; M1085-Y1212 HydrophobicContact SD-CD1 3.97Å; M1085-Y1212 HydrophobicContact SD-CE1 4.03Å; V1086-Y1212 CarbonylContact O-C 3.54Å; V1086-Y1212 VanDerWaalsContact O-CA 3.27Å; V1086-Y1212 WeakPolarHBondContact O-CA 3.33Å; K1087-Y1212 HydrophobicContact CB-CD1 4.11Å; K1087-Y1212 HydrophobicContact CB-CE1 4.06Å; K1087-Y1212 HydrophobicContact CD-CE1 3.72Å; K1087-Y1212 VanDerWaalsContact CE-OH 3.26Å; K1087-Y1212 WeakPolarHBondContact CE-OH 3.47Å; K1087-Y1212 HydrophobicContact CG-CD1 4.09Å; K1087-Y1212 HydrophobicContact CG-CE1 3.63Å; K1087-Y1212 PolarHBondContact NZ-OH 3.3Å; M1118-Y1212 CarbonylContact C-O 3.54Å; M1118-Y1212 WeakPolarHBondContact CA-O 3.2Å; E1119-Y1212 HydrophobicContact CB-CD2 4.47Å; E1119-Y1212 HydrophobicContact CG-CD2 4.08Å; E1119-Y1212 PolarHBondContact N-O 2.88Å; E1119-Y1212 PolarHBondContact O-N 3.06Å; V1210-Y1212 HydrophobicContact CB-CE2 4.33Å; V1210-Y1212 HydrophobicContact CG1-CD2 4.24Å; V1210-Y1212 HydrophobicContact CG1-CE2 3.42Å; V1210-Y1212 VanDerWaalsContact CG1-CE2 3.42Å; V1210-Y1212 HydrophobicContact CG2-CD2 4.44Å; V1210-Y1212 HydrophobicContact CG2-CE1 4.3Å; V1210-Y1212 HydrophobicContact CG2-CE2 3.93Å; Y1212-N1216 HydrophobicContact CD1-CB 4.12Å; Y1212-N1216 HydrophobicContact CD2-CB 4.14Å; Y1212-N1216 HydrophobicContact CE1-CB 4.46Å; Y1212-N1216 HydrophobicContact CE2-CB 4.48Å; Y1212-N1216 HydrophobicContact CG-CB 3.96Å; Y1212-D1217 PolarHBondContact OH-OD2 3.38Å; Y1212-D1217 VanDerWaalsContact OH-OD2 3.09Å
1213	M	96.3	Very high	91.3	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	145.9	166	-57	177.9	71.7	0	0	110.2	F1080 V1086 R1215 I1229 A1232 P1239 L1240	F1080-M1213 HydrophobicContact CE1-CB 3.95Å; F1080-M1213 HydrophobicContact CZ-CB 3.92Å; F1080-M1213 HydrophobicContact CZ-CE 4.47Å; V1086-M1213 HydrophobicContact CB-CB 4.2Å; V1086-M1213 PolarHBondContact N-O 2.89Å; V1086-M1213 PolarHBondContact O-N 3.33Å; M1213-R1215 VanDerWaalsContact C-N 3.3Å; M1213-R1215 PolarHBondContact O-N 2.87Å; M1213-R1215 VanDerWaalsContact O-N 3.15Å; M1213-I1229 HydrophobicContact CE-CB 4.24Å; M1213-I1229 HydrophobicContact CE-CD1 4.31Å; M1213-I1229 HydrophobicContact CE-CG2 3.44Å; M1213-I1229 VanDerWaalsContact CE-CG2 3.44Å; M1213-A1232 HydrophobicContact CE-CB 3.55Å; M1213-A1232 HydrophobicContact SD-CB 4.36Å; M1213-P1239 HydrophobicContact SD-CB 3.55Å; M1213-P1239 VanDerWaalsContact SD-CB 3.55Å; M1213-P1239 HydrophobicContact SD-CG 4.39Å; M1213-L1240 HydrophobicContact CE-CD2 3.88Å; M1213-L1240 HydrophobicContact CE-CG 4.26Å; M1213-L1240 HydrophobicContact SD-CD2 4.19Å
1214	G	95.9	Very high	91.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	86.4	-63.4	-177.7	0	0	0	0	0	112.7	I1116 F1225	I1116-G1214 PolarHBondContact N-O 3.06Å; I1116-G1214 CarbonylContact O-C 3.39Å; I1116-G1214 VanDerWaalsContact O-CA 3.22Å; I1116-G1214 WeakPolarHBondContact O-CA 3.5Å; I1116-G1214 PolarHBondContact O-N 2.68Å; G1214-F1225 WeakPolarHBondContact O-CB 3.22Å; G1214-F1225 PolarHBondContact O-N 3.02Å
1215	R	94.8	Very high	91.9	Very high	28 Å²	28	34.8 Å²	34.8	11%	0.106	19%	0.193	C	C	.	.			trans	-154.5	169	172.9	71.1	179.8	175.1	76.3	13.5	110.3	G1083 M1085 M1213 M1219	G1083-R1215 VanDerWaalsContact O-CD 3.26Å; G1083-R1215 WeakPolarHBondContact O-CD 3.26Å; G1083-R1215 PolarHBondContact O-NE 2.64Å; M1085-R1215 HydrophobicContact CB-CG 3.69Å; M1085-R1215 HydrophobicContact CG-CG 4.35Å; M1085-R1215 VanDerWaalsContact CG-O 3.24Å; M1085-R1215 WeakPolarHBondContact CG-O 3.34Å; M1213-R1215 VanDerWaalsContact C-N 3.3Å; M1213-R1215 PolarHBondContact O-N 2.87Å; M1213-R1215 VanDerWaalsContact O-N 3.15Å; R1215-M1219 HydrophobicContact CB-CB 3.95Å; R1215-M1219 HydrophobicContact CB-CE 4.29Å; R1215-M1219 HydrophobicContact CB-SD 4.05Å; R1215-M1219 PolarHBondContact NH1-O 2.98Å; R1215-M1219 VanDerWaalsContact NH1-O 3.15Å
1216	N	93.5	Very high	92.1	Very high	9 Å²	9	38.2 Å²	38.2	5%	0.048	21%	0.211	C	C	.	.			trans	-107.9	178.3	171	66.8	29.6	0	0	0	111.6	I1116 E1119 R1121 Y1212 T1218 M1219	I1116-N1216 HydrophobicContact CD1-CB 4.11Å; E1119-N1216 VanDerWaalsContact OE2-CB 3.3Å; E1119-N1216 WeakPolarHBondContact OE2-CB 3.34Å; E1119-N1216 PolarHBondContact OE2-ND2 3.35Å; R1121-N1216 PolarHBondContact NH2-ND2 3.14Å; Y1212-N1216 HydrophobicContact CD1-CB 4.12Å; Y1212-N1216 HydrophobicContact CD2-CB 4.14Å; Y1212-N1216 HydrophobicContact CE1-CB 4.46Å; Y1212-N1216 HydrophobicContact CE2-CB 4.48Å; Y1212-N1216 HydrophobicContact CG-CB 3.96Å; N1216-T1218 PolarHBondContact O-N 2.75Å; N1216-T1218 VanDerWaalsContact O-N 3.14Å; N1216-T1218 PolarHBondContact OD1-N 3.03Å; N1216-T1218 PolarHBondContact OD1-OG1 2.84Å; N1216-M1219 PolarHBondContact O-N 3.12Å; N1216-M1219 VanDerWaalsContact O-N 3.16Å; N1216-M1219 WeakPolarHBondContact OD1-CG 3.43Å; N1216-M1219 PolarHBondContact OD1-N 2.91Å
1217	D	91.7	Very high	92.4	Very high	77 Å²	77	36.6 Å²	36.6	41%	0.412	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.4	-177.7	-74.7	-38.4	0	0	0	113.7	M1085 K1087 Y1212	M1085-D1217 WeakPolarHBondContact CE-OD1 3.39Å; M1085-D1217 VanDerWaalsContact SD-OD1 3.33Å; K1087-D1217 IonicContact NZ-OD2 2.76Å; K1087-D1217 PolarHBondContact NZ-OD2 3.19Å; Y1212-D1217 PolarHBondContact OH-OD2 3.38Å; Y1212-D1217 VanDerWaalsContact OH-OD2 3.09Å
1218	T	90.4	Very high	92.8	Very high	105 Å²	105	34.6 Å²	34.6	64%	0.644	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-15.1	-178.5	68.7	0	0	0	0	113.8	N1216	N1216-T1218 PolarHBondContact O-N 2.75Å; N1216-T1218 VanDerWaalsContact O-N 3.14Å; N1216-T1218 PolarHBondContact OD1-N 3.03Å; N1216-T1218 PolarHBondContact OD1-OG1 2.84Å
1219	M	92.5	Very high	93.1	Very high	40 Å²	40	34.6 Å²	34.6	20%	0.197	20%	0.196	C	C	.	.	S	Bend	trans	-93.4	136.4	-177	-70.3	174.5	73.3	0	0	111.6	I1116 R1215 N1216 D1223	I1116-M1219 HydrophobicContact CD1-SD 3.44Å; I1116-M1219 WeakPolarHBondContact CD1-SD 3.34Å; I1116-M1219 HydrophobicContact CG1-CE 4.41Å; I1116-M1219 HydrophobicContact CG1-SD 3.74Å; R1215-M1219 HydrophobicContact CB-CB 3.95Å; R1215-M1219 HydrophobicContact CB-CE 4.29Å; R1215-M1219 HydrophobicContact CB-SD 4.05Å; R1215-M1219 PolarHBondContact NH1-O 2.98Å; R1215-M1219 VanDerWaalsContact NH1-O 3.15Å; N1216-M1219 PolarHBondContact O-N 3.12Å; N1216-M1219 VanDerWaalsContact O-N 3.16Å; N1216-M1219 WeakPolarHBondContact OD1-CG 3.43Å; N1216-M1219 PolarHBondContact OD1-N 2.91Å; M1219-D1223 HydrophobicContact CE-CB 3.98Å; M1219-D1223 WeakPolarHBondContact CE-O 3.14Å
1220	Q	91.1	Very high	93.4	Very high	127 Å²	127	33 Å²	33	59%	0.593	19%	0.19	S	C	*	.			trans	-68.6	151.6	170.6	-64.1	-59.3	-45.4	0	0	110.2	A1222 D1223 G1224	Q1220-A1222 PolarHBondContact O-N 2.89Å; Q1220-A1222 VanDerWaalsContact O-N 3.12Å; Q1220-D1223 PolarHBondContact O-N 3.1Å; Q1220-G1224 PolarHBondContact O-N 3.02Å
1221	P	87.5	Confident	93.4	Very high	62 Å²	62	33 Å²	33	40%	0.403	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-53.8	-34.4	177	-27.3	34.9	0	0	0	113.4	G1083 D1223 G1224	G1083-P1221 WeakPolarHBondContact CA-O 3.48Å; P1221-D1223 PolarHBondContact O-N 3.42Å; P1221-G1224 PolarHBondContact O-N 3.39Å
1222	A	88.4	Confident	93.4	Very high	64 Å²	64	33 Å²	33	53%	0.529	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-62	-23.4	175.7	0	0	0	0	0	113.6	R1114 Q1220	R1114-A1222 PolarHBondContact NE-O 3.3Å; R1114-A1222 VanDerWaalsContact NE-O 3.16Å; R1114-A1222 PolarHBondContact NH1-O 3.14Å; R1114-A1222 PolarHBondContact NH2-O 3.2Å; Q1220-A1222 PolarHBondContact O-N 2.89Å; Q1220-A1222 VanDerWaalsContact O-N 3.12Å
1223	D	91.4	Very high	93.3	Very high	74 Å²	74	34.1 Å²	34.1	40%	0.396	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-95.2	-8.2	-179.4	-59.6	-43.5	0	0	0	113.2	M1219 Q1220 P1221	M1219-D1223 HydrophobicContact CE-CB 3.98Å; M1219-D1223 WeakPolarHBondContact CE-O 3.14Å; Q1220-D1223 PolarHBondContact O-N 3.1Å; P1221-D1223 PolarHBondContact O-N 3.42Å
1224	G	92.3	Very high	93.2	Very high	2 Å²	2	34.2 Å²	34.2	2%	0.021	20%	0.196	C	C	.	.	S	Bend	trans	-69.2	164.9	179.8	0	0	0	0	0	113.6	Q1220 P1221 D1226	Q1220-G1224 PolarHBondContact O-N 3.02Å; P1221-G1224 PolarHBondContact O-N 3.39Å; G1224-D1226 PolarHBondContact O-N 3.26Å
1225	F	95	Very high	93	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.207	C	C	.	.			trans	-62.6	132.8	174.5	-173.7	-100.1	0	0	0	110.2	F1080 G1083 F1108 T1110 G1115 L1117 V1133 G1214 G1227 I1229	F1080-F1225 HydrophobicContact CB-CD1 3.9Å; F1080-F1225 HydrophobicContact CG-CD1 4.32Å; G1083-F1225 WeakPolarHBondContact CA-O 3Å; F1108-F1225 HydrophobicContact CB-CE2 4.24Å; F1108-F1225 HydrophobicContact CB-CZ 3.86Å; F1108-F1225 HydrophobicContact CD2-CE2 4.11Å; F1108-F1225 HydrophobicContact CD2-CZ 4.26Å; T1110-F1225 HydrophobicContact CG2-CE2 3.85Å; T1110-F1225 HydrophobicContact CG2-CZ 4.22Å; G1115-F1225 VanDerWaalsContact CA-N 3.33Å; L1117-F1225 HydrophobicContact CD2-CD2 3.76Å; L1117-F1225 HydrophobicContact CD2-CE2 3.48Å; L1117-F1225 VanDerWaalsContact CD2-CE2 3.48Å; L1117-F1225 HydrophobicContact CD2-CG 4.49Å; L1117-F1225 HydrophobicContact CD2-CZ 4.03Å; V1133-F1225 HydrophobicContact CG2-CD2 4.35Å; V1133-F1225 HydrophobicContact CG2-CE2 4.19Å; G1214-F1225 WeakPolarHBondContact O-CB 3.22Å; G1214-F1225 PolarHBondContact O-N 3.02Å; F1225-G1227 VanDerWaalsContact CE1-C 3.45Å; F1225-I1229 HydrophobicContact CD1-CD1 3.65Å; F1225-I1229 HydrophobicContact CD1-CG1 3.51Å; F1225-I1229 HydrophobicContact CE1-CD1 3.98Å; F1225-I1229 HydrophobicContact CE1-CG1 3.29Å; F1225-I1229 HydrophobicContact CG-CD1 4.13Å; F1225-I1229 HydrophobicContact CG-CG1 4.33Å; F1225-I1229 HydrophobicContact CZ-CG1 3.97Å
1226	D	93.9	Very high	92.7	Very high	72 Å²	72	41.3 Å²	41.3	39%	0.385	24%	0.236	S	C	.	.			trans	-125.7	100.4	179	-170.4	38.6	0	0	0	108.7	F1080 S1082 T1110 G1224	F1080-D1226 VanDerWaalsContact O-CA 3.32Å; F1080-D1226 WeakPolarHBondContact O-CA 3.33Å; S1082-D1226 PolarHBondContact N-OD1 2.82Å; T1110-D1226 PolarHBondContact OG1-O 3.16Å; G1224-D1226 PolarHBondContact O-N 3.26Å
1227	G	94	Very high	92.6	Very high	16 Å²	16	42 Å²	42	17%	0.165	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159	-160.7	-170.8	0	0	0	0	0	112.5	F1080 K1109 F1225	F1080-G1227 WeakPolarHBondContact CA-O 3.28Å; F1080-G1227 PolarHBondContact N-O 2.66Å; F1080-G1227 PolarHBondContact O-N 3.01Å; F1080-G1227 VanDerWaalsContact O-N 3.13Å; K1109-G1227 WeakPolarHBondContact O-CA 3.38Å; F1225-G1227 VanDerWaalsContact CE1-C 3.45Å
1228	C	95.2	Very high	92.6	Very high	9 Å²	9	39 Å²	39	6%	0.061	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	131.2	177.1	-144.6	0	0	0	0	110.6	G1078 T1079 F1108 K1109 C1265	G1078-C1228 WeakPolarHBondContact O-CA 3.47Å; G1078-C1228 PolarHBondContact O-SG 2.89Å; T1079-C1228 PolarHBondContact OG1-SG 2.98Å; F1108-C1228 CarbonylContact C-O 3.51Å; F1108-C1228 VanDerWaalsContact CA-O 3.25Å; F1108-C1228 WeakPolarHBondContact CA-O 3.5Å; K1109-C1228 HydrophobicContact CB-CB 4.49Å; K1109-C1228 PolarHBondContact N-O 3.08Å; K1109-C1228 PolarHBondContact O-N 2.77Å; C1228-C1265 HydrophobicContact CB-CB 3.63Å; C1228-C1265 WeakPolarHBondContact CB-SG 3.34Å; C1228-C1265 WeakPolarHBondContact SG-CA 3.32Å; C1228-C1265 WeakPolarHBondContact SG-CB 3.39Å; C1228-C1265 CovalentContact SG-SG 2.02Å; C1228-C1265 PolarHBondContact SG-SG 2.57Å
1229	I	96.3	Very high	92.8	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132.5	170.4	-55.5	179.3	0	0	0	107.6	G1077 G1078 F1080 V1106 G1107 L1117 M1213 F1225	G1077-I1229 CarbonylContact C-O 3.55Å; G1077-I1229 WeakPolarHBondContact CA-O 3.45Å; G1078-I1229 PolarHBondContact N-O 3.18Å; G1078-I1229 PolarHBondContact O-N 2.81Å; F1080-I1229 HydrophobicContact CD1-CD1 4.29Å; F1080-I1229 HydrophobicContact CD2-CB 4.06Å; F1080-I1229 HydrophobicContact CD2-CD1 3.92Å; F1080-I1229 HydrophobicContact CD2-CG1 3.84Å; F1080-I1229 HydrophobicContact CE1-CD1 4.2Å; F1080-I1229 HydrophobicContact CE2-CB 3.81Å; F1080-I1229 HydrophobicContact CE2-CD1 3.84Å; F1080-I1229 HydrophobicContact CE2-CG1 3.95Å; F1080-I1229 HydrophobicContact CG-CD1 4.18Å; F1080-I1229 HydrophobicContact CG-CG1 4.42Å; F1080-I1229 HydrophobicContact CZ-CD1 3.99Å; V1106-I1229 HydrophobicContact CG2-CG2 3.45Å; V1106-I1229 VanDerWaalsContact CG2-CG2 3.45Å; G1107-I1229 WeakPolarHBondContact O-CA 3.28Å; L1117-I1229 HydrophobicContact CD2-CD1 4.39Å; L1117-I1229 HydrophobicContact CD2-CG1 4.39Å; M1213-I1229 HydrophobicContact CE-CB 4.24Å; M1213-I1229 HydrophobicContact CE-CD1 4.31Å; M1213-I1229 HydrophobicContact CE-CG2 3.44Å; M1213-I1229 VanDerWaalsContact CE-CG2 3.44Å; F1225-I1229 HydrophobicContact CD1-CD1 3.65Å; F1225-I1229 HydrophobicContact CD1-CG1 3.51Å; F1225-I1229 HydrophobicContact CE1-CD1 3.98Å; F1225-I1229 HydrophobicContact CE1-CG1 3.29Å; F1225-I1229 HydrophobicContact CG-CD1 4.13Å; F1225-I1229 HydrophobicContact CG-CG1 4.33Å; F1225-I1229 HydrophobicContact CZ-CG1 3.97Å
1230	Y	95.5	Very high	92.8	Very high	6 Å²	6	32.2 Å²	32.2	2%	0.024	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	163.2	-178.5	58.7	-92.7	0	0	0	112.1	Q1075 I1076 G1107 H1165 H1166 M1167 A1232 C1265 F1267	Q1075-Y1230 HydrophobicContact CG-CD2 4.11Å; I1076-Y1230 CarbonylContact O-C 3.53Å; I1076-Y1230 VanDerWaalsContact O-CA 3.27Å; I1076-Y1230 WeakPolarHBondContact O-CA 3.29Å; I1076-Y1230 WeakPolarHBondContact O-CB 3.36Å; G1107-Y1230 WeakPolarHBondContact CA-O 3.27Å; G1107-Y1230 PolarHBondContact N-O 3.16Å; G1107-Y1230 PolarHBondContact O-N 2.54Å; H1165-Y1230 WeakPolarHBondContact CA-OH 3.28Å; H1165-Y1230 VanDerWaalsContact CB-OH 3.3Å; H1165-Y1230 WeakPolarHBondContact CB-OH 3.45Å; H1165-Y1230 AromaticContact ND1-CE1 3.58Å; H1165-Y1230 AromaticContact ND1-CZ 3.63Å; H1165-Y1230 PolarHBondContact ND1-OH 3.44Å; H1166-Y1230 PolarHBondContact N-OH 3.39Å; H1166-Y1230 PolarHBondContact O-OH 2.71Å; M1167-Y1230 HydrophobicContact CE-CD2 4.22Å; M1167-Y1230 HydrophobicContact CE-CE2 3.72Å; Y1230-A1232 PolarHBondContact O-N 3.46Å; Y1230-A1232 VanDerWaalsContact O-N 3.1Å; Y1230-C1265 HydrophobicContact CD1-CB 3.87Å; Y1230-C1265 HydrophobicContact CG-CB 4.5Å; Y1230-F1267 HydrophobicContact CD1-CE2 4.17Å; Y1230-F1267 AromaticContact CD2-CE2 3.86Å; Y1230-F1267 HydrophobicContact CD2-CE2 3.86Å; Y1230-F1267 HydrophobicContact CD2-CZ 4.46Å; Y1230-F1267 AromaticContact CE1-CE2 3.93Å; Y1230-F1267 HydrophobicContact CE1-CE2 3.93Å; Y1230-F1267 AromaticContact CE2-CE2 3.58Å; Y1230-F1267 HydrophobicContact CE2-CE2 3.58Å; Y1230-F1267 AromaticContact CE2-CZ 3.8Å; Y1230-F1267 HydrophobicContact CE2-CZ 3.8Å; Y1230-F1267 HydrophobicContact CG-CE2 4.13Å; Y1230-F1267 AromaticContact CZ-CE2 3.64Å; Y1230-F1267 AromaticContact CZ-CZ 3.85Å
1231	A	93.5	Very high	92.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50	36	177.7	0	0	0	0	0	115.4	P1066 Q1075 I1076 Q1105 M1167 Q1233	P1066-A1231 HydrophobicContact CB-CB 4.24Å; P1066-A1231 HydrophobicContact CG-CB 4.24Å; Q1075-A1231 HydrophobicContact CG-CB 3.9Å; Q1075-A1231 VanDerWaalsContact NE2-CB 3.31Å; I1076-A1231 PolarHBondContact O-N 2.82Å; Q1105-A1231 PolarHBondContact NE2-O 2Å; Q1105-A1231 VanDerWaalsContact NE2-O 3.12Å; M1167-A1231 HydrophobicContact CE-CB 3.99Å; A1231-Q1233 PolarHBondContact O-N 2.87Å
1232	A	95.4	Very high	93	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.008	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	127.7	-179.5	0	0	0	0	0	110.6	Q1105 V1106 M1118 M1213 Y1230 P1239 L1240	Q1105-A1232 CarbonylContact O-C 3.59Å; Q1105-A1232 VanDerWaalsContact O-CA 3.32Å; Q1105-A1232 WeakPolarHBondContact O-CA 3.3Å; V1106-A1232 HydrophobicContact CG2-CB 4.31Å; M1118-A1232 HydrophobicContact CE-CB 4.05Å; M1213-A1232 HydrophobicContact CE-CB 3.55Å; M1213-A1232 HydrophobicContact SD-CB 4.36Å; Y1230-A1232 PolarHBondContact O-N 3.46Å; Y1230-A1232 VanDerWaalsContact O-N 3.1Å; A1232-P1239 HydrophobicContact CB-CG 4.49Å; A1232-P1239 VanDerWaalsContact O-CD 3.29Å; A1232-P1239 WeakPolarHBondContact O-CD 3.11Å; A1232-L1240 HydrophobicContact CB-CD1 3.99Å; A1232-L1240 HydrophobicContact CB-CG 3.94Å
1233	Q	95	Very high	93.1	Very high	24 Å²	24	24 Å²	24	11%	0.112	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	138.2	177	173.2	-177.1	-6.3	0	0	109	I1104 Q1105 A1231 N1235 I1237 F1238	I1104-Q1233 WeakPolarHBondContact CA-O 3.24Å; Q1105-Q1233 HydrophobicContact CB-CB 4.24Å; Q1105-Q1233 PolarHBondContact N-O 2.98Å; Q1105-Q1233 PolarHBondContact O-N 2.95Å; A1231-Q1233 PolarHBondContact O-N 2.87Å; Q1233-N1235 WeakPolarHBondContact CG-O 3.35Å; Q1233-N1235 PolarHBondContact NE2-O 3.01Å; Q1233-I1237 WeakPolarHBondContact CA-O 2.83Å; Q1233-F1238 HydrophobicContact CB-CD1 4.04Å; Q1233-F1238 HydrophobicContact CB-CE1 4.07Å; Q1233-F1238 HydrophobicContact CG-CD1 4Å; Q1233-F1238 HydrophobicContact CG-CE1 3.61Å; Q1233-F1238 HydrophobicContact CG-CZ 4.35Å
1234	W	94.2	Very high	93	Very high	3 Å²	3	22.7 Å²	22.7	1%	0.011	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	114.2	165.2	170.4	47.6	0	0	0	108.8	L1090 Y1103 M1118 M1120 L1205 P1208 L1211 N1236 I1237	L1090-W1234 HydrophobicContact CD1-CH2 4.16Å; L1090-W1234 HydrophobicContact CD1-CZ3 3.63Å; Y1103-W1234 CarbonylContact O-C 3.55Å; Y1103-W1234 WeakPolarHBondContact O-CA 3.5Å; M1118-W1234 HydrophobicContact SD-CB 3.81Å; M1120-W1234 HydrophobicContact CB-CH2 4.37Å; M1120-W1234 HydrophobicContact CB-CZ2 4.29Å; M1120-W1234 HydrophobicContact CE-CD2 4.39Å; M1120-W1234 HydrophobicContact CE-CG 4.14Å; M1120-W1234 HydrophobicContact CG-CD2 3.39Å; M1120-W1234 HydrophobicContact CG-CE3 3.55Å; M1120-W1234 HydrophobicContact CG-CG 3.99Å; M1120-W1234 HydrophobicContact CG-CH2 3.93Å; M1120-W1234 HydrophobicContact CG-CZ2 3.78Å; M1120-W1234 HydrophobicContact CG-CZ3 3.82Å; M1120-W1234 HydrophobicContact SD-CB 4.45Å; M1120-W1234 HydrophobicContact SD-CD2 4.06Å; M1120-W1234 HydrophobicContact SD-CG 4Å; L1205-W1234 HydrophobicContact CD2-CH2 4.46Å; L1205-W1234 HydrophobicContact CD2-CZ2 3.9Å; P1208-W1234 HydrophobicContact CB-CH2 3.61Å; P1208-W1234 HydrophobicContact CB-CZ2 4.39Å; P1208-W1234 HydrophobicContact CB-CZ3 4.46Å; P1208-W1234 HydrophobicContact CG-CH2 3.75Å; P1208-W1234 HydrophobicContact CG-CZ2 4.42Å; L1211-W1234 HydrophobicContact CD1-CE3 4.09Å; W1234-N1236 PolarHBondContact O-N 3.04Å; W1234-N1236 VanDerWaalsContact O-N 3.08Å; W1234-I1237 HydrophobicContact CE3-CD1 3.76Å; W1234-I1237 HydrophobicContact CZ3-CD1 3.68Å; W1234-I1237 PolarHBondContact N-O 2.89Å; W1234-I1237 WeakPolarHBondContact O-CA 3.28Å; W1234-I1237 WeakPolarHBondContact O-CB 3.22Å; W1234-I1237 PolarHBondContact O-N 2.91Å
1235	N	91	Very high	92.8	Very high	42 Å²	42	26.4 Å²	26.4	23%	0.225	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	-114.4	-171.3	-61.5	-22.8	0	0	0	110.3	E1102 Y1103 Q1233	E1102-N1235 WeakPolarHBondContact CA-OD1 3.49Å; Y1103-N1235 PolarHBondContact N-OD1 2.82Å; Y1103-N1235 PolarHBondContact O-N 2.91Å; Q1233-N1235 WeakPolarHBondContact CG-O 3.35Å; Q1233-N1235 PolarHBondContact NE2-O 3.01Å
1236	N	88.5	Confident	92.3	Very high	134 Å²	134	35.5 Å²	35.5	72%	0.717	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.2	16.3	176.9	-64.6	-19.3	0	0	0	113.1	W1234 F1238	W1234-N1236 PolarHBondContact O-N 3.04Å; W1234-N1236 VanDerWaalsContact O-N 3.08Å; N1236-F1238 WeakPolarHBondContact O-CE2 3.44Å
1237	I	91	Very high	91.9	Very high	24 Å²	24	38 Å²	38	12%	0.123	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-102.8	131.8	176.6	-59.7	172.5	0	0	0	108.3	L1090 D1095 Q1233 W1234 P1239 L1242	L1090-I1237 HydrophobicContact CD2-CD1 3.9Å; D1095-I1237 HydrophobicContact CB-CD1 4.37Å; Q1233-I1237 WeakPolarHBondContact CA-O 2.83Å; W1234-I1237 HydrophobicContact CE3-CD1 3.76Å; W1234-I1237 HydrophobicContact CZ3-CD1 3.68Å; W1234-I1237 PolarHBondContact N-O 2.89Å; W1234-I1237 WeakPolarHBondContact O-CA 3.28Å; W1234-I1237 WeakPolarHBondContact O-CB 3.22Å; W1234-I1237 PolarHBondContact O-N 2.91Å; I1237-P1239 HydrophobicContact CG2-CG 4.42Å; I1237-P1239 WeakPolarHBondContact O-CD 2.94Å; I1237-L1242 HydrophobicContact CG2-CD1 4.17Å
1238	F	92.9	Very high	91.3	Very high	15 Å²	15	42.4 Å²	42.4	7%	0.066	21%	0.21	C	C	.	.			trans	-117.5	85.7	179.8	-55	-81.6	0	0	0	109.2	L1064 T1065 P1066 Q1233 N1236 L1240 H1241 L1242	L1064-F1238 WeakPolarHBondContact O-CZ 3.17Å; T1065-F1238 VanDerWaalsContact C-CD1 3.48Å; T1065-F1238 VanDerWaalsContact C-CE1 3.45Å; P1066-F1238 HydrophobicContact CB-CD1 3.95Å; P1066-F1238 HydrophobicContact CB-CE1 4.48Å; Q1233-F1238 HydrophobicContact CB-CD1 4.04Å; Q1233-F1238 HydrophobicContact CB-CE1 4.07Å; Q1233-F1238 HydrophobicContact CG-CD1 4Å; Q1233-F1238 HydrophobicContact CG-CE1 3.61Å; Q1233-F1238 HydrophobicContact CG-CZ 4.35Å; N1236-F1238 WeakPolarHBondContact O-CE2 3.44Å; F1238-L1240 VanDerWaalsContact C-N 3.27Å; F1238-L1240 PolarHBondContact O-N 3.47Å; F1238-L1240 VanDerWaalsContact O-N 3.16Å; F1238-H1241 HydrophobicContact CB-CB 4.16Å; F1238-H1241 WeakPolarHBondContact O-CB 3.33Å; F1238-H1241 PolarHBondContact O-N 2.88Å; F1238-L1242 PolarHBondContact O-N 2.87Å
1239	P	93.6	Very high	90.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-55.2	-40.1	-168.4	-30.2	39.1	0	0	0	113.7	I1088 M1118 L1211 M1213 A1232 I1237 H1241 L1242 I1243	I1088-P1239 HydrophobicContact CD1-CB 3.75Å; M1118-P1239 HydrophobicContact SD-CG 4.5Å; L1211-P1239 HydrophobicContact CD2-CB 3.48Å; L1211-P1239 VanDerWaalsContact CD2-CB 3.48Å; L1211-P1239 HydrophobicContact CD2-CG 3.21Å; M1213-P1239 HydrophobicContact SD-CB 3.55Å; M1213-P1239 VanDerWaalsContact SD-CB 3.55Å; M1213-P1239 HydrophobicContact SD-CG 4.39Å; A1232-P1239 HydrophobicContact CB-CG 4.49Å; A1232-P1239 VanDerWaalsContact O-CD 3.29Å; A1232-P1239 WeakPolarHBondContact O-CD 3.11Å; I1237-P1239 HydrophobicContact CG2-CG 4.42Å; I1237-P1239 WeakPolarHBondContact O-CD 2.94Å; P1239-H1241 VanDerWaalsContact C-N 3.32Å; P1239-H1241 PolarHBondContact O-N 2.94Å; P1239-L1242 WeakPolarHBondContact O-CB 3.19Å; P1239-L1242 PolarHBondContact O-N 2.95Å; P1239-I1243 WeakPolarHBondContact O-CG1 3.2Å; P1239-I1243 PolarHBondContact O-N 2.03Å
1240	L	93.3	Very high	90.6	Very high	2 Å²	2	48 Å²	48	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-69.4	-27.4	-179.8	-62	176.2	0	0	0	112.9	I1076 M1213 A1232 F1238 I1243 Y1244	I1076-L1240 HydrophobicContact CB-CB 4.39Å; I1076-L1240 HydrophobicContact CG2-CB 3.65Å; I1076-L1240 HydrophobicContact CG2-CD1 4.49Å; I1076-L1240 VanDerWaalsContact O-CD1 3.23Å; I1076-L1240 WeakPolarHBondContact O-CD1 3.47Å; M1213-L1240 HydrophobicContact CE-CD2 3.88Å; M1213-L1240 HydrophobicContact CE-CG 4.26Å; M1213-L1240 HydrophobicContact SD-CD2 4.19Å; A1232-L1240 HydrophobicContact CB-CD1 3.99Å; A1232-L1240 HydrophobicContact CB-CG 3.94Å; F1238-L1240 VanDerWaalsContact C-N 3.27Å; F1238-L1240 PolarHBondContact O-N 3.47Å; F1238-L1240 VanDerWaalsContact O-N 3.16Å; L1240-I1243 HydrophobicContact CD2-CD1 3.7Å; L1240-Y1244 HydrophobicContact CB-CE2 4.42Å; L1240-Y1244 WeakPolarHBondContact O-CD2 3.33Å
1241	H	90.8	Very high	90.4	Very high	43 Å²	43	49 Å²	49	20%	0.199	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-48.2	170.5	-79.7	-106.3	0	0	0	110.1	T1065 Y1067 I1076 F1238 P1239 I1243 Y1244 E1245	T1065-H1241 PolarHBondContact O-NE2 3.17Å; Y1067-H1241 PolarHBondContact O-CE1 2.99Å; Y1067-H1241 PolarHBondContact O-NE2 2.6Å; I1076-H1241 VanDerWaalsContact CD1-CD2 3.42Å; I1076-H1241 WeakPolarHBondContact CD1-CD2 3.27Å; I1076-H1241 WeakPolarHBondContact CD1-CE1 3.28Å; I1076-H1241 WeakPolarHBondContact CD1-NE2 3.16Å; F1238-H1241 HydrophobicContact CB-CB 4.16Å; F1238-H1241 WeakPolarHBondContact O-CB 3.33Å; F1238-H1241 PolarHBondContact O-N 2.88Å; P1239-H1241 VanDerWaalsContact C-N 3.32Å; P1239-H1241 PolarHBondContact O-N 2.94Å; H1241-I1243 VanDerWaalsContact C-N 3.25Å; H1241-I1243 PolarHBondContact O-N 2.81Å; H1241-Y1244 CarbonylContact O-C 3.45Å; H1241-Y1244 PolarHBondContact O-N 2.85Å; H1241-E1245 PolarHBondContact O-N 2.9Å; H1241-E1245 VanDerWaalsContact O-N 3.09Å
1242	L	90.8	Very high	90.3	Very high	31 Å²	31	49.3 Å²	49.3	16%	0.162	26%	0.264	C	S	.	.	H	α-helix	trans	-60	-34.2	-178.2	-59.1	174.3	0	0	0	112.7	I1088 I1237 F1238 P1239 Y1244 V1252	I1088-L1242 HydrophobicContact CD1-CB 4.31Å; I1088-L1242 HydrophobicContact CD1-CD1 4.21Å; I1088-L1242 HydrophobicContact CG2-CD1 3.83Å; I1237-L1242 HydrophobicContact CG2-CD1 4.17Å; F1238-L1242 PolarHBondContact O-N 2.87Å; P1239-L1242 WeakPolarHBondContact O-CB 3.19Å; P1239-L1242 PolarHBondContact O-N 2.95Å; L1242-Y1244 VanDerWaalsContact C-N 3.28Å; L1242-Y1244 PolarHBondContact O-N 2.67Å; L1242-V1252 HydrophobicContact CB-CG2 3.86Å
1243	I	91.4	Very high	90.2	Very high	7 Å²	7	53.6 Å²	53.6	4%	0.036	28%	0.283	C	S	.	.	H	α-helix	trans	-64.3	-34.8	176.3	-61	167.8	0	0	0	111.5	V1086 I1088 P1239 L1240 H1241 V1252 M1254	V1086-I1243 HydrophobicContact CB-CD1 4.45Å; V1086-I1243 HydrophobicContact CG1-CD1 3.7Å; V1086-I1243 HydrophobicContact CG1-CG1 3.88Å; V1086-I1243 HydrophobicContact CG2-CD1 4.11Å; I1088-I1243 HydrophobicContact CD1-CG1 4.46Å; P1239-I1243 WeakPolarHBondContact O-CG1 3.2Å; P1239-I1243 PolarHBondContact O-N 2.03Å; L1240-I1243 HydrophobicContact CD2-CD1 3.7Å; H1241-I1243 VanDerWaalsContact C-N 3.25Å; H1241-I1243 PolarHBondContact O-N 2.81Å; I1243-V1252 HydrophobicContact CG1-CG1 4.01Å; I1243-M1254 HydrophobicContact CG2-CE 4.26Å; I1243-M1254 HydrophobicContact CG2-SD 3.89Å
1244	Y	90	Very high	90.1	Very high	45 Å²	45	53.1 Å²	53.1	18%	0.176	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	11.8	-172.2	-52	-46.2	0	0	0	114.2	I1076 G1077 G1078 L1240 H1241 L1242 R1261 E1262	I1076-Y1244 HydrophobicContact CG2-CD2 3.63Å; I1076-Y1244 HydrophobicContact CG2-CE2 3.6Å; G1077-Y1244 WeakPolarHBondContact O-CE2 3.44Å; G1077-Y1244 PolarHBondContact O-OH 2.84Å; G1078-Y1244 WeakPolarHBondContact CA-OH 3.44Å; L1240-Y1244 HydrophobicContact CB-CE2 4.42Å; L1240-Y1244 WeakPolarHBondContact O-CD2 3.33Å; H1241-Y1244 CarbonylContact O-C 3.45Å; H1241-Y1244 PolarHBondContact O-N 2.85Å; L1242-Y1244 VanDerWaalsContact C-N 3.28Å; L1242-Y1244 PolarHBondContact O-N 2.67Å; Y1244-R1261 PolarHBondContact OH-O 2.99Å; Y1244-E1262 HydrophobicContact CD1-CB 4.05Å; Y1244-E1262 HydrophobicContact CD2-CB 4.18Å; Y1244-E1262 HydrophobicContact CD2-CG 3.99Å; Y1244-E1262 HydrophobicContact CE1-CB 3.73Å; Y1244-E1262 HydrophobicContact CE1-CG 4.48Å; Y1244-E1262 HydrophobicContact CE2-CB 3.86Å; Y1244-E1262 HydrophobicContact CE2-CG 3.71Å; Y1244-E1262 HydrophobicContact CG-CB 4.28Å; Y1244-E1262 HydrophobicContact CG-CG 4.49Å; Y1244-E1262 WeakPolarHBondContact OH-CA 3.39Å; Y1244-E1262 PolarHBondContact OH-N 2.64Å
1245	E	87.1	Confident	90	Very high	81 Å²	81	56.9 Å²	56.9	38%	0.379	30%	0.301	S	S	.	.			trans	-62.6	141	172.6	-78.9	-179.9	175.4	0	0	111.5	H1241 P1247 R1248 N1249	H1241-E1245 PolarHBondContact O-N 2.9Å; H1241-E1245 VanDerWaalsContact O-N 3.09Å; E1245-P1247 CarbonylContact C-O 3.58Å; E1245-P1247 CarbonylContact O-C 3.52Å; E1245-P1247 VanDerWaalsContact O-C 3.28Å; E1245-R1248 VanDerWaalsContact O-CA 3.27Å; E1245-R1248 WeakPolarHBondContact O-CA 3.19Å; E1245-R1248 PolarHBondContact O-N 2.96Å; E1245-N1249 HydrophobicContact CB-CB 4.43Å; E1245-N1249 WeakPolarHBondContact OE2-CB 3.17Å; E1245-N1249 PolarHBondContact OE2-ND2 2.79Å
1246	E	83.9	Confident	90	Very high	190 Å²	190	59 Å²	59	89%	0.888	32%	0.318	S	S	*	.	S	Bend	trans	-120.3	121	173.3	-73	-168.3	171.9	0	0	110.8
1247	P	86.9	Confident	90	Very high	125 Å²	125	56 Å²	56	81%	0.812	31%	0.311	S	S	*	.	S	Bend	cis	-67.2	155.3	-3	30.9	-35.7	0	0	0	112.3	E1245 N1249	E1245-P1247 CarbonylContact C-O 3.58Å; E1245-P1247 CarbonylContact O-C 3.52Å; E1245-P1247 VanDerWaalsContact O-C 3.28Å; P1247-N1249 PolarHBondContact O-N 3.15Å
1248	R	81.8	Confident	89.8	Confident	108 Å²	108	59.5 Å²	59.5	41%	0.408	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-51.5	128.2	-175.7	-171.9	174.2	174.8	172.1	1.1	111.9	E1245 A1250 M1254 D1258	E1245-R1248 VanDerWaalsContact O-CA 3.27Å; E1245-R1248 WeakPolarHBondContact O-CA 3.19Å; E1245-R1248 PolarHBondContact O-N 2.96Å; R1248-A1250 PolarHBondContact O-N 3.15Å; R1248-M1254 VanDerWaalsContact CZ-CE 3.5Å; R1248-D1258 IonicContact CZ-OD1 3.28Å; R1248-D1258 IonicContact NH1-OD1 3.73Å; R1248-D1258 PolarHBondContact NH1-OD1 3.44Å; R1248-D1258 IonicContact NH2-OD1 2.67Å
1249	N	86.8	Confident	89.7	Confident	25 Å²	25	60.2 Å²	60.2	13%	0.134	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-63.9	123.4	179.1	-167.4	-41.5	0	0	0	110.5	E1245 P1247 S1251 V1252	E1245-N1249 HydrophobicContact CB-CB 4.43Å; E1245-N1249 WeakPolarHBondContact OE2-CB 3.17Å; E1245-N1249 PolarHBondContact OE2-ND2 2.79Å; P1247-N1249 PolarHBondContact O-N 3.15Å; N1249-S1251 PolarHBondContact O-N 3.43Å; N1249-S1251 VanDerWaalsContact O-N 3.14Å; N1249-S1251 WeakPolarHBondContact OD1-CB 3.28Å; N1249-S1251 PolarHBondContact OD1-N 3.08Å; N1249-S1251 PolarHBondContact OD1-OG 3.28Å; N1249-V1252 HydrophobicContact CB-CG2 4.23Å; N1249-V1252 PolarHBondContact O-N 3.11Å; N1249-V1252 VanDerWaalsContact O-N 3.12Å
1250	A	88.5	Confident	89.5	Confident	102 Å²	102	60.5 Å²	60.5	84%	0.843	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.2	-177.9	0	0	0	0	0	113.4	R1248 V1252	R1248-A1250 PolarHBondContact O-N 3.15Å; A1250-V1252 VanDerWaalsContact C-N 3.27Å; A1250-V1252 PolarHBondContact O-N 2.87Å
1251	S	90.9	Very high	89.3	Confident	26 Å²	26	69.7 Å²	69.7	18%	0.182	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-6.2	179.6	-23.9	0	0	0	0	112.8	I1088 F1089 N1249	I1088-S1251 CarbonylContact C-O 3.42Å; I1088-S1251 WeakPolarHBondContact CA-O 3.42Å; F1089-S1251 WeakPolarHBondContact CD2-O 3.2Å; F1089-S1251 PolarHBondContact N-O 3.44Å; F1089-S1251 VanDerWaalsContact O-CB 3.29Å; F1089-S1251 WeakPolarHBondContact O-CB 3.4Å; N1249-S1251 PolarHBondContact O-N 3.43Å; N1249-S1251 VanDerWaalsContact O-N 3.14Å; N1249-S1251 WeakPolarHBondContact OD1-CB 3.28Å; N1249-S1251 PolarHBondContact OD1-N 3.08Å; N1249-S1251 PolarHBondContact OD1-OG 3.28Å
1252	V	93.2	Very high	89.3	Confident	8 Å²	8	70.5 Å²	70.5	5%	0.048	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	113.7	-177.9	-179.7	0	0	0	0	111.7	V1086 I1088 L1242 I1243 N1249 A1250 M1254	V1086-V1252 HydrophobicContact CG1-CG1 4.22Å; I1088-V1252 HydrophobicContact CD1-CG2 4.19Å; I1088-V1252 HydrophobicContact CG1-CG1 4.34Å; I1088-V1252 HydrophobicContact CG1-CG2 3.92Å; I1088-V1252 HydrophobicContact CG2-CG2 4.21Å; L1242-V1252 HydrophobicContact CB-CG2 3.86Å; I1243-V1252 HydrophobicContact CG1-CG1 4.01Å; N1249-V1252 HydrophobicContact CB-CG2 4.23Å; N1249-V1252 PolarHBondContact O-N 3.11Å; N1249-V1252 VanDerWaalsContact O-N 3.12Å; A1250-V1252 VanDerWaalsContact C-N 3.27Å; A1250-V1252 PolarHBondContact O-N 2.87Å; V1252-M1254 HydrophobicContact CG1-CG 4.43Å
1253	E	93.4	Very high	89.3	Confident	90 Å²	90	72.4 Å²	72.4	42%	0.421	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	135.3	170	-72.7	-176	176.6	0	0	111.2	K1087 F1089	K1087-E1253 HydrophobicContact CB-CB 4.25Å; K1087-E1253 PolarHBondContact N-O 3.14Å; K1087-E1253 PolarHBondContact O-N 3.48Å; F1089-E1253 VanDerWaalsContact CE2-CD 3.48Å; F1089-E1253 HydrophobicContact CE2-CG 3.87Å
1254	M	92.5	Very high	89.1	Confident	15 Å²	15	74.6 Å²	74.6	7%	0.074	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.3	173.8	-65.5	-167.6	-85.7	0	0	109.3	M1085 V1086 I1243 R1248 V1252 P1256 A1257 V1260	M1085-M1254 CarbonylContact O-C 3.21Å; M1085-M1254 WeakPolarHBondContact O-CA 3.36Å; V1086-M1254 HydrophobicContact CG2-CG 4.27Å; I1243-M1254 HydrophobicContact CG2-CE 4.26Å; I1243-M1254 HydrophobicContact CG2-SD 3.89Å; R1248-M1254 VanDerWaalsContact CZ-CE 3.5Å; V1252-M1254 HydrophobicContact CG1-CG 4.43Å; M1254-P1256 CarbonylContact C-O 3.26Å; M1254-P1256 VanDerWaalsContact C-O 3.26Å; M1254-P1256 CarbonylContact O-C 3.47Å; M1254-A1257 VanDerWaalsContact O-CA 3.25Å; M1254-A1257 WeakPolarHBondContact O-CA 3.37Å; M1254-A1257 PolarHBondContact O-N 3.38Å; M1254-A1257 VanDerWaalsContact O-N 3.14Å; M1254-V1260 HydrophobicContact SD-CB 3.87Å; M1254-V1260 HydrophobicContact SD-CG2 4.39Å
1255	L	91.8	Very high	89.2	Confident	81 Å²	81	72.8 Å²	72.8	42%	0.424	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	111.1	179.7	-75.5	172.4	0	0	0	111.4	M1085	M1085-L1255 HydrophobicContact CB-CB 4.41Å; M1085-L1255 HydrophobicContact CE-CB 4.2Å; M1085-L1255 HydrophobicContact CE-CD1 3.44Å; M1085-L1255 VanDerWaalsContact CE-CD1 3.44Å; M1085-L1255 HydrophobicContact CE-CG 4.24Å; M1085-L1255 PolarHBondContact N-O 2.59Å; M1085-L1255 PolarHBondContact O-N 3.39Å
1256	P	91.4	Very high	89.1	Confident	88 Å²	88	71.6 Å²	71.6	57%	0.571	40%	0.402	S	S	*	.	S	Bend	cis	-62.2	157.3	-4.1	-20.9	33.6	0	0	0	113.9	M1254 D1258 S1259	M1254-P1256 CarbonylContact C-O 3.26Å; M1254-P1256 VanDerWaalsContact C-O 3.26Å; M1254-P1256 CarbonylContact O-C 3.47Å; P1256-D1258 PolarHBondContact O-N 2.76Å; P1256-S1259 WeakPolarHBondContact O-CB 3.44Å; P1256-S1259 PolarHBondContact O-N 2.76Å; P1256-S1259 PolarHBondContact O-OG 3.32Å
1257	A	88.8	Confident	89.2	Confident	69 Å²	69	65.9 Å²	65.9	57%	0.57	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	137.2	176.4	0	0	0	0	0	110.6	M1254 S1259	M1254-A1257 VanDerWaalsContact O-CA 3.25Å; M1254-A1257 WeakPolarHBondContact O-CA 3.37Å; M1254-A1257 PolarHBondContact O-N 3.38Å; M1254-A1257 VanDerWaalsContact O-N 3.14Å; A1257-S1259 PolarHBondContact O-N 3.42Å; A1257-S1259 VanDerWaalsContact O-N 3.16Å
1258	D	86	Confident	89.2	Confident	98 Å²	98	67.3 Å²	67.3	52%	0.524	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	22.6	179.5	-48.6	-35.8	0	0	0	114.5	R1248 P1256 V1260	R1248-D1258 IonicContact CZ-OD1 3.28Å; R1248-D1258 IonicContact NH1-OD1 3.73Å; R1248-D1258 PolarHBondContact NH1-OD1 3.44Å; R1248-D1258 IonicContact NH2-OD1 2.67Å; P1256-D1258 PolarHBondContact O-N 2.76Å; D1258-V1260 VanDerWaalsContact C-N 3.35Å
1259	S	89.8	Confident	89.4	Confident	30 Å²	30	65 Å²	65	21%	0.21	37%	0.367	C	S	.	.			trans	-73.7	-25.6	177.9	62.2	0	0	0	0	113.5	P1084 P1256 A1257	P1084-S1259 WeakPolarHBondContact CB-OG 3.43Å; P1256-S1259 WeakPolarHBondContact O-CB 3.44Å; P1256-S1259 PolarHBondContact O-N 2.76Å; P1256-S1259 PolarHBondContact O-OG 3.32Å; A1257-S1259 PolarHBondContact O-N 3.42Å; A1257-S1259 VanDerWaalsContact O-N 3.16Å
1260	V	91.5	Very high	89.4	Confident	7 Å²	7	68.5 Å²	68.5	4%	0.042	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	119.5	175.5	-176.3	0	0	0	0	108.1	F1080 P1084 V1086 M1254 D1258	F1080-V1260 HydrophobicContact CD1-CG2 3.98Å; F1080-V1260 HydrophobicContact CD2-CG1 4.2Å; F1080-V1260 HydrophobicContact CD2-CG2 4.49Å; F1080-V1260 HydrophobicContact CE1-CG2 3.88Å; F1080-V1260 HydrophobicContact CE2-CG1 3.83Å; F1080-V1260 HydrophobicContact CE2-CG2 4.39Å; F1080-V1260 HydrophobicContact CG-CG2 4.26Å; F1080-V1260 HydrophobicContact CZ-CG1 4.1Å; F1080-V1260 HydrophobicContact CZ-CG2 4.09Å; P1084-V1260 HydrophobicContact CB-CG2 4.11Å; P1084-V1260 HydrophobicContact CG-CG2 3.86Å; V1086-V1260 HydrophobicContact CG2-CB 4.36Å; V1086-V1260 HydrophobicContact CG2-CG2 3.62Å; M1254-V1260 HydrophobicContact SD-CB 3.87Å; M1254-V1260 HydrophobicContact SD-CG2 4.39Å; D1258-V1260 VanDerWaalsContact C-N 3.35Å
1261	R	89.2	Confident	89.3	Confident	195 Å²	195	69.5 Å²	69.5	74%	0.736	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	144.6	176.1	-66.9	-174.5	179.7	-172.6	-1.2	109.4	G1078 T1079 Y1244 D1263	G1078-R1261 WeakPolarHBondContact CA-O 3.5Å; T1079-R1261 PolarHBondContact N-O 3.49Å; Y1244-R1261 PolarHBondContact OH-O 2.99Å; R1261-D1263 PolarHBondContact O-N 3.03Å
1262	E	89.9	Confident	88.9	Confident	60 Å²	60	70.8 Å²	70.8	28%	0.28	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	129.5	173.5	-168.7	171.2	-169.5	0	0	110.9	R1068 G1077 Y1244	R1068-E1262 IonicContact CZ-OE1 2.64Å; R1068-E1262 IonicContact CZ-OE2 3.62Å; R1068-E1262 IonicContact NE-OE1 3.83Å; R1068-E1262 PolarHBondContact NE-OE1 3.17Å; R1068-E1262 VanDerWaalsContact NE-OE1 3.11Å; R1068-E1262 IonicContact NH1-OE1 2.81Å; R1068-E1262 PolarHBondContact NH1-OE1 2.88Å; R1068-E1262 IonicContact NH1-OE2 3.52Å; R1068-E1262 PolarHBondContact NH1-OE2 3.35Å; R1068-E1262 IonicContact NH2-OE1 3.69Å; R1068-E1262 PolarHBondContact NH2-OE1 2.88Å; R1068-E1262 IonicContact NH2-OE2 2.7Å; R1068-E1262 PolarHBondContact NH2-OE2 3.45Å; G1077-E1262 WeakPolarHBondContact O-CA 3.42Å; Y1244-E1262 HydrophobicContact CD1-CB 4.05Å; Y1244-E1262 HydrophobicContact CD2-CB 4.18Å; Y1244-E1262 HydrophobicContact CD2-CG 3.99Å; Y1244-E1262 HydrophobicContact CE1-CB 3.73Å; Y1244-E1262 HydrophobicContact CE1-CG 4.48Å; Y1244-E1262 HydrophobicContact CE2-CB 3.86Å; Y1244-E1262 HydrophobicContact CE2-CG 3.71Å; Y1244-E1262 HydrophobicContact CG-CB 4.28Å; Y1244-E1262 HydrophobicContact CG-CG 4.49Å; Y1244-E1262 WeakPolarHBondContact OH-CA 3.39Å; Y1244-E1262 PolarHBondContact OH-N 2.64Å
1263	D	89.9	Confident	88.3	Confident	71 Å²	71	79.4 Å²	79.4	38%	0.38	42%	0.423	S	S	.	.			trans	-142.6	144.2	-177.9	-166.8	-20.2	0	0	0	108.3	G1077 T1079 R1261 C1265	G1077-D1263 CarbonylContact C-O 3.57Å; G1077-D1263 WeakPolarHBondContact CA-O 3.35Å; G1077-D1263 PolarHBondContact N-O 3.41Å; G1077-D1263 PolarHBondContact O-N 2.82Å; T1079-D1263 WeakPolarHBondContact OG1-CB 3.42Å; T1079-D1263 PolarHBondContact OG1-OD2 2.7Å; R1261-D1263 PolarHBondContact O-N 3.03Å; D1263-C1265 PolarHBondContact O-N 2.91Å; D1263-C1265 PolarHBondContact OD1-N 2.82Å
1264	L	89.1	Confident	87.6	Confident	52 Å²	52	84.3 Å²	84.3	27%	0.272	45%	0.446	S	S	.	.			trans	-74.3	-1.7	172.2	-67.7	173.3	0	0	0	111.9	R1074 G1266 F1267	R1074-L1264 HydrophobicContact CG-CD2 3.7Å; L1264-G1266 PolarHBondContact O-N 2.92Å; L1264-F1267 WeakPolarHBondContact CB-O 3.24Å; L1264-F1267 WeakPolarHBondContact O-CB 2.93Å; L1264-F1267 VanDerWaalsContact O-CD2 3.28Å; L1264-F1267 WeakPolarHBondContact O-CD2 3.31Å; L1264-F1267 PolarHBondContact O-N 3.43Å
1265	C	90.6	Very high	86.9	Confident	7 Å²	7	89.5 Å²	89.5	5%	0.047	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	11.8	-179	-60.6	0	0	0	0	114.7	H1165 C1228 Y1230 D1263 F1267	H1165-C1265 PolarHBondContact CE1-O 2.87Å; H1165-C1265 PolarHBondContact NE2-O 2.79Å; C1228-C1265 HydrophobicContact CB-CB 3.63Å; C1228-C1265 WeakPolarHBondContact CB-SG 3.34Å; C1228-C1265 WeakPolarHBondContact SG-CA 3.32Å; C1228-C1265 WeakPolarHBondContact SG-CB 3.39Å; C1228-C1265 CovalentContact SG-SG 2.02Å; C1228-C1265 PolarHBondContact SG-SG 2.57Å; Y1230-C1265 HydrophobicContact CD1-CB 3.87Å; Y1230-C1265 HydrophobicContact CG-CB 4.5Å; D1263-C1265 PolarHBondContact O-N 2.91Å; D1263-C1265 PolarHBondContact OD1-N 2.82Å; C1265-F1267 HydrophobicContact CB-CD2 4.4Å
1266	G	86.2	Confident	86.3	Confident	56 Å²	56	90.9 Å²	90.9	58%	0.577	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.2	-3.2	-173.2	0	0	0	0	0	115.2	L1264	L1264-G1266 PolarHBondContact O-N 2.92Å
1267	F	85.9	Confident	85.7	Confident	71 Å²	71	92.9 Å²	92.9	31%	0.311	50%	0.495	S	S	.	.			trans	-77.4	155.4	172.5	-66.2	-77.6	0	0	0	112.2	Q1075 H1165 Y1230 L1264 C1265	Q1075-F1267 VanDerWaalsContact OE1-CZ 3.28Å; H1165-F1267 HydrophobicContact CB-CZ 4.16Å; H1165-F1267 AromaticContact CE1-CD2 3.73Å; H1165-F1267 AromaticContact CE1-CE2 3.27Å; H1165-F1267 WeakPolarHBondContact CE1-CE2 3.48Å; H1165-F1267 AromaticContact CE1-CZ 3.58Å; H1165-F1267 AromaticContact CG-CZ 3.7Å; H1165-F1267 AromaticContact ND1-CE2 3.1Å; H1165-F1267 WeakPolarHBondContact ND1-CE2 3.37Å; H1165-F1267 AromaticContact ND1-CZ 3.13Å; H1165-F1267 WeakPolarHBondContact ND1-CZ 3.46Å; Y1230-F1267 HydrophobicContact CD1-CE2 4.17Å; Y1230-F1267 AromaticContact CD2-CE2 3.86Å; Y1230-F1267 HydrophobicContact CD2-CE2 3.86Å; Y1230-F1267 HydrophobicContact CD2-CZ 4.46Å; Y1230-F1267 AromaticContact CE1-CE2 3.93Å; Y1230-F1267 HydrophobicContact CE1-CE2 3.93Å; Y1230-F1267 AromaticContact CE2-CE2 3.58Å; Y1230-F1267 HydrophobicContact CE2-CE2 3.58Å; Y1230-F1267 AromaticContact CE2-CZ 3.8Å; Y1230-F1267 HydrophobicContact CE2-CZ 3.8Å; Y1230-F1267 HydrophobicContact CG-CE2 4.13Å; Y1230-F1267 AromaticContact CZ-CE2 3.64Å; Y1230-F1267 AromaticContact CZ-CZ 3.85Å; L1264-F1267 WeakPolarHBondContact CB-O 3.24Å; L1264-F1267 WeakPolarHBondContact O-CB 2.93Å; L1264-F1267 VanDerWaalsContact O-CD2 3.28Å; L1264-F1267 WeakPolarHBondContact O-CD2 3.31Å; L1264-F1267 PolarHBondContact O-N 3.43Å; C1265-F1267 HydrophobicContact CB-CD2 4.4Å
1268	I	86.3	Confident	85.3	Confident	155 Å²	155	92.5 Å²	92.5	80%	0.795	48%	0.481	S	S	*	.			trans	-106	133.8	170.6	-59.6	172.6	0	0	0	107	I1270	I1268-I1270 PolarHBondContact O-N 2.81Å
1269	E	85.5	Confident	84.9	Confident	58 Å²	58	94.5 Å²	94.5	27%	0.271	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-64.9	128.8	174.2	175.7	168.5	-167.3	0	0	110.3	R1074 L1271	R1074-E1269 HydrophobicContact CB-CB 4.29Å; R1074-E1269 HydrophobicContact CB-CG 3.83Å; R1074-E1269 WeakPolarHBondContact CD-OE2 3.5Å; R1074-E1269 HydrophobicContact CG-CB 4.46Å; R1074-E1269 HydrophobicContact CG-CG 4.44Å; E1269-L1271 HydrophobicContact CG-CD2 3.99Å; E1269-L1271 PolarHBondContact O-N 2.86Å
1270	I	86.8	Confident	84.1	Confident	99 Å²	99	98.3 Å²	98.3	51%	0.508	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-80	119.9	172.5	-56.2	172.9	0	0	0	107.6	L1046 I1071 G1073 I1268	L1046-I1270 HydrophobicContact CD1-CB 3.94Å; L1046-I1270 HydrophobicContact CD1-CD1 4Å; L1046-I1270 HydrophobicContact CD1-CG2 3.77Å; I1071-I1270 HydrophobicContact CD1-CG2 4.3Å; G1073-I1270 PolarHBondContact O-N 2.92Å; I1268-I1270 PolarHBondContact O-N 2.81Å
1271	L	86.1	Confident	83	Confident	123 Å²	123	102 Å²	102	64%	0.644	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-102	150.4	177.1	-63.5	175.8	0	0	0	110.2	E1269	E1269-L1271 HydrophobicContact CG-CD2 3.99Å; E1269-L1271 PolarHBondContact O-N 2.86Å
1272	P	83.6	Confident	81.8	Confident	53 Å²	53	97.8 Å²	97.8	34%	0.344	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-64.5	150.1	173.2	29	-35.2	0	0	0	110.7	F1070 I1071	F1070-P1272 HydrophobicContact CD1-CG 4.11Å; I1071-P1272 HydrophobicContact CD1-CB 4.46Å; I1071-P1272 HydrophobicContact CG2-CB 4.11Å; I1071-P1272 HydrophobicContact CG2-CG 4.22Å
1273	E	81.2	Confident	80.3	Confident	189 Å²	189	99.5 Å²	99.5	88%	0.883	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-62.4	138.5	170.4	-67.5	-175.5	169.5	0	0	110.4	E1275	E1273-E1275 PolarHBondContact O-N 2.78Å
1274	E	77.8	Confident	78.6	Confident	194 Å²	194	100.6 Å²	100.6	91%	0.907	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-68.4	121.5	178	-69	-175.8	175.4	0	0	110.5
1275	E	77.1	Confident	76.7	Confident	123 Å²	123	102.5 Å²	102.5	58%	0.575	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-68.7	139.2	174.8	-69	-173	175.6	0	0	110.8	K1039 E1273 V1277	K1039-E1275 IonicContact NZ-OE1 2.84Å; K1039-E1275 PolarHBondContact NZ-OE1 2.82Å; K1039-E1275 IonicContact NZ-OE2 3.16Å; K1039-E1275 PolarHBondContact NZ-OE2 3.12Å; E1273-E1275 PolarHBondContact O-N 2.78Å; E1275-V1277 PolarHBondContact O-N 2.81Å
1276	P	79.1	Confident	74.8	Confident	111 Å²	111	105.1 Å²	105.1	72%	0.721	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-61.6	134.6	177.2	25.6	-33.4	0	0	0	110.8	E1278	P1276-E1278 PolarHBondContact O-N 3.43Å
1277	V	78.9	Confident	73.2	Confident	130 Å²	130	109.4 Å²	109.4	79%	0.788	60%	0.601	S	S	*	*			trans	-67.7	103.7	179	-178.3	0	0	0	0	110	E1275 I1279	E1275-V1277 PolarHBondContact O-N 2.81Å; V1277-I1279 HydrophobicContact CG1-CG1 4.12Å
1278	E	80.2	Confident	71.3	Confident	60 Å²	60	113.4 Å²	113.4	28%	0.28	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-78.5	117.6	170.3	-70	-178	-158.6	0	0	110.8	R875 K876 Y1030 G1031 P1276	R875-E1278 IonicContact CZ-OE1 3.68Å; R875-E1278 VanDerWaalsContact CZ-OE1 3.28Å; R875-E1278 IonicContact CZ-OE2 2.72Å; R875-E1278 IonicContact NH1-OE1 2.64Å; R875-E1278 PolarHBondContact NH1-OE1 3.26Å; R875-E1278 IonicContact NH1-OE2 3.45Å; R875-E1278 IonicContact NH2-OE1 2.67Å; R875-E1278 PolarHBondContact NH2-OE1 2.75Å; R875-E1278 IonicContact NH2-OE2 3.48Å; R875-E1278 PolarHBondContact NH2-OE2 3.43Å; K876-E1278 PolarHBondContact NZ-O 3.31Å; Y1030-E1278 HydrophobicContact CE2-CB 4.49Å; G1031-E1278 PolarHBondContact N-OE2 2.94Å; G1031-E1278 VanDerWaalsContact N-OE2 3.16Å; P1276-E1278 PolarHBondContact O-N 3.43Å
1279	I	77.9	Confident	69.1	Low	141 Å²	141	109.4 Å²	109.4	72%	0.723	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-103.9	137.9	176.5	-54.8	174	0	0	0	108.8	V1277	V1277-I1279 HydrophobicContact CG1-CG1 4.12Å
1280	R	73.7	Confident	66.7	Low	110 Å²	110	112.8 Å²	112.8	42%	0.415	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-59.6	131.3	176.1	-169.4	-174.5	-105.1	-151.7	-6.7	110	D878 Y1030 S1282	D878-R1280 PolarHBondContact O-NH2 3.38Å; Y1030-R1280 HydrophobicContact CD1-CB 4.25Å; Y1030-R1280 HydrophobicContact CD1-CG 4.03Å; Y1030-R1280 VanDerWaalsContact CD2-CA 3.45Å; Y1030-R1280 HydrophobicContact CD2-CB 4.12Å; Y1030-R1280 HydrophobicContact CE1-CB 4.03Å; Y1030-R1280 HydrophobicContact CE1-CG 4.13Å; Y1030-R1280 HydrophobicContact CE2-CB 3.89Å; Y1030-R1280 HydrophobicContact CG-CB 4.27Å; Y1030-R1280 HydrophobicContact CG-CG 4.26Å; R1280-S1282 PolarHBondContact O-N 3.35Å
1281	P	68.7	Low	64.6	Low	83 Å²	83	113.5 Å²	113.5	54%	0.539	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-53.8	142.2	169.9	-21.7	30.1	0	0	0	110.1
1282	S	63.5	Low	62.5	Low	108 Å²	108	112.2 Å²	112.2	76%	0.755	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-58.3	142.9	167	-61.9	0	0	0	0	108.8	R1280 A1284	R1280-S1282 PolarHBondContact O-N 3.35Å; S1282-A1284 PolarHBondContact O-N 3.43Å
1283	P	59.1	Low	60.4	Low	95 Å²	95	115.9 Å²	115.9	62%	0.617	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-50.7	129.4	178.1	-20.2	27.5	0	0	0	110	Y995 I1285	Y995-P1283 HydrophobicContact CE1-CB 4.48Å; P1283-I1285 PolarHBondContact O-N 3.43Å; P1283-I1285 VanDerWaalsContact O-N 3.07Å
1284	A	53.6	Low	58.7	Low	95 Å²	95	114 Å²	114	79%	0.785	64%	0.636	S	S	*	*			trans	-64.3	113	171.7	0	0	0	0	0	107.5	S1282 P1286	S1282-A1284 PolarHBondContact O-N 3.43Å; A1284-P1286 WeakPolarHBondContact O-CD 3.33Å
1285	I	50.1	Low	57.2	Low	92 Å²	92	107.8 Å²	107.8	47%	0.472	61%	0.611	S	S	.	*			trans	-69.2	123	172.4	-58.2	127	0	0	0	106.4	P1283 T1287 I1289 F1291	P1283-I1285 PolarHBondContact O-N 3.43Å; P1283-I1285 VanDerWaalsContact O-N 3.07Å; I1285-T1287 PolarHBondContact O-N 2.85Å; I1285-I1289 HydrophobicContact CG2-CB 4.36Å; I1285-F1291 HydrophobicContact CB-CE1 4.29Å; I1285-F1291 HydrophobicContact CB-CE2 4.18Å; I1285-F1291 HydrophobicContact CB-CZ 3.6Å; I1285-F1291 HydrophobicContact CD1-CE1 4.37Å; I1285-F1291 HydrophobicContact CD1-CE2 4.39Å; I1285-F1291 HydrophobicContact CD1-CZ 3.53Å; I1285-F1291 HydrophobicContact CG1-CE1 3.88Å; I1285-F1291 HydrophobicContact CG1-CE2 4.34Å; I1285-F1291 HydrophobicContact CG1-CZ 3.35Å; I1285-F1291 HydrophobicContact CG2-CD1 4.37Å; I1285-F1291 HydrophobicContact CG2-CD2 4.2Å; I1285-F1291 HydrophobicContact CG2-CE1 3.51Å; I1285-F1291 HydrophobicContact CG2-CE2 3.32Å; I1285-F1291 HydrophobicContact CG2-CZ 2.97Å
1286	P	49.2	Very low	56.1	Low	62 Å²	62	105.7 Å²	105.7	40%	0.403	60%	0.604	S	S	.	*			trans	-56.8	136.9	176.2	-17.2	27.6	0	0	0	110.7	A1284 N1288 I1289	A1284-P1286 WeakPolarHBondContact O-CD 3.33Å; P1286-N1288 PolarHBondContact O-N 2.94Å; P1286-N1288 VanDerWaalsContact O-N 3.1Å; P1286-I1289 HydrophobicContact CB-CB 4.46Å; P1286-I1289 HydrophobicContact CB-CD1 4.25Å; P1286-I1289 HydrophobicContact CB-CG1 3.92Å; P1286-I1289 HydrophobicContact CG-CD1 3.56Å; P1286-I1289 HydrophobicContact CG-CG1 3.8Å; P1286-I1289 PolarHBondContact O-N 3.01Å
1287	T	53.1	Low	55	Low	146 Å²	146	104.9 Å²	104.9	90%	0.896	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-23	-178.2	47.4	0	0	0	0	114	I1285	I1285-T1287 PolarHBondContact O-N 2.85Å
1288	N	46.7	Very low	54	Low	155 Å²	155	100.1 Å²	100.1	83%	0.829	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	4.3	176.7	-89.3	0.1	0	0	0	114.2	P1286 T1290	P1286-N1288 PolarHBondContact O-N 2.94Å; P1286-N1288 VanDerWaalsContact O-N 3.1Å; N1288-T1290 PolarHBondContact O-N 3.39Å
1289	I	38.7	Very low	53.1	Low	71 Å²	71	101.2 Å²	101.2	36%	0.364	57%	0.573	S	S	.	*			trans	-75.2	94.8	156.4	-67	-171.4	0	0	0	104.4	I1285 P1286 F1291	I1285-I1289 HydrophobicContact CG2-CB 4.36Å; P1286-I1289 HydrophobicContact CB-CB 4.46Å; P1286-I1289 HydrophobicContact CB-CD1 4.25Å; P1286-I1289 HydrophobicContact CB-CG1 3.92Å; P1286-I1289 HydrophobicContact CG-CD1 3.56Å; P1286-I1289 HydrophobicContact CG-CG1 3.8Å; P1286-I1289 PolarHBondContact O-N 3.01Å; I1289-F1291 HydrophobicContact CG2-CD1 4.21Å; I1289-F1291 HydrophobicContact CG2-CG 4.27Å; I1289-F1291 PolarHBondContact O-N 3.08Å
1290	T	36.7	Very low	52.6	Low	128 Å²	128	101.7 Å²	101.7	79%	0.785	57%	0.566	S	S	*	*			trans	-52.2	102	136.6	44.7	0	0	0	0	103.4	N1288	N1288-T1290 PolarHBondContact O-N 3.39Å
1291	F	41.7	Very low	52.5	Low	115 Å²	115	102.3 Å²	102.3	50%	0.504	57%	0.573	S	S	.	*			trans	-45.6	142.1	150.4	-60.6	-83.7	0	0	0	104.3	I1285 I1289 E1293	I1285-F1291 HydrophobicContact CB-CE1 4.29Å; I1285-F1291 HydrophobicContact CB-CE2 4.18Å; I1285-F1291 HydrophobicContact CB-CZ 3.6Å; I1285-F1291 HydrophobicContact CD1-CE1 4.37Å; I1285-F1291 HydrophobicContact CD1-CE2 4.39Å; I1285-F1291 HydrophobicContact CD1-CZ 3.53Å; I1285-F1291 HydrophobicContact CG1-CE1 3.88Å; I1285-F1291 HydrophobicContact CG1-CE2 4.34Å; I1285-F1291 HydrophobicContact CG1-CZ 3.35Å; I1285-F1291 HydrophobicContact CG2-CD1 4.37Å; I1285-F1291 HydrophobicContact CG2-CD2 4.2Å; I1285-F1291 HydrophobicContact CG2-CE1 3.51Å; I1285-F1291 HydrophobicContact CG2-CE2 3.32Å; I1285-F1291 HydrophobicContact CG2-CZ 2.97Å; I1289-F1291 HydrophobicContact CG2-CD1 4.21Å; I1289-F1291 HydrophobicContact CG2-CG 4.27Å; I1289-F1291 PolarHBondContact O-N 3.08Å; F1291-E1293 PolarHBondContact O-N 3.16Å
1292	P	41.9	Very low	52.8	Low	96 Å²	96	105 Å²	105	62%	0.623	58%	0.577	S	S	*	*			trans	-48.7	108.2	148.4	24.1	-27.6	0	0	0	102.1	I1294 D1296	P1292-I1294 PolarHBondContact O-N 2.9Å; P1292-D1296 HydrophobicContact CB-CB 4.08Å
1293	E	39	Very low	53.4	Low	130 Å²	130	107.7 Å²	107.7	61%	0.607	57%	0.57	S	S	*	*			trans	-47.2	143.2	175.2	-94.5	-175.4	147.5	0	0	102.4	F1291 T1295 D1296	F1291-E1293 PolarHBondContact O-N 3.16Å; E1293-T1295 HydrophobicContact CB-CG2 3.84Å; E1293-T1295 WeakPolarHBondContact CB-OG1 3.46Å; E1293-T1295 HydrophobicContact CG-CG2 4.32Å; E1293-T1295 CarbonylContact O-C 3.46Å; E1293-T1295 PolarHBondContact O-N 3.41Å; E1293-T1295 WeakPolarHBondContact OE2-CB 3.24Å; E1293-T1295 VanDerWaalsContact OE2-CG2 3.31Å; E1293-T1295 WeakPolarHBondContact OE2-CG2 3.5Å; E1293-T1295 PolarHBondContact OE2-OG1 2.75Å; E1293-D1296 PolarHBondContact O-N 3.23Å
1294	I	45.8	Very low	54.4	Low	149 Å²	149	107.2 Å²	107.2	76%	0.764	56%	0.562	S	S	*	*	H	α-helix	trans	-60	-2.5	170.5	-63	164.7	0	0	0	109.3	P1292 D1296 A1298	P1292-I1294 PolarHBondContact O-N 2.9Å; I1294-D1296 VanDerWaalsContact C-N 3.34Å; I1294-A1298 WeakPolarHBondContact O-CA 3.44Å; I1294-A1298 WeakPolarHBondContact O-CB 3.29Å; I1294-A1298 PolarHBondContact O-N 3.27Å
1295	T	47.7	Very low	55.6	Low	64 Å²	64	107.1 Å²	107.1	39%	0.393	55%	0.547	S	S	.	.	H	α-helix	trans	-62.2	-26.7	158.7	73.7	0	0	0	0	114.6	E1293 A1298 E1299	E1293-T1295 HydrophobicContact CB-CG2 3.84Å; E1293-T1295 WeakPolarHBondContact CB-OG1 3.46Å; E1293-T1295 HydrophobicContact CG-CG2 4.32Å; E1293-T1295 CarbonylContact O-C 3.46Å; E1293-T1295 PolarHBondContact O-N 3.41Å; E1293-T1295 WeakPolarHBondContact OE2-CB 3.24Å; E1293-T1295 VanDerWaalsContact OE2-CG2 3.31Å; E1293-T1295 WeakPolarHBondContact OE2-CG2 3.5Å; E1293-T1295 PolarHBondContact OE2-OG1 2.75Å; T1295-A1298 CarbonylContact O-C 3.57Å; T1295-E1299 WeakPolarHBondContact O-CA 3.02Å; T1295-E1299 WeakPolarHBondContact O-CB 3.02Å; T1295-E1299 WeakPolarHBondContact O-CG 3.49Å; T1295-E1299 PolarHBondContact O-N 3.27Å
1296	D	52.3	Low	57	Low	79 Å²	79	105 Å²	105	42%	0.422	54%	0.543	S	S	.	.	H	α-helix	trans	-82.3	-32	176.8	-119.7	-1	0	0	0	111.4	P1292 E1293 I1294 R1300	P1292-D1296 HydrophobicContact CB-CB 4.08Å; E1293-D1296 PolarHBondContact O-N 3.23Å; I1294-D1296 VanDerWaalsContact C-N 3.34Å; D1296-R1300 VanDerWaalsContact O-CA 3.31Å; D1296-R1300 WeakPolarHBondContact O-CA 3.27Å; D1296-R1300 WeakPolarHBondContact O-CB 3.49Å; D1296-R1300 PolarHBondContact O-N 3.4Å
1297	D	56.9	Low	58.6	Low	93 Å²	93	104.1 Å²	104.1	50%	0.497	55%	0.545	S	S	.	.	H	α-helix	trans	-80	-29.8	166.4	-97.4	-23.2	0	0	0	111.7	R1300 E1301	D1297-R1300 IonicContact OD1-NH1 3.88Å; D1297-E1301 WeakPolarHBondContact O-CA 3.39Å; D1297-E1301 WeakPolarHBondContact O-CB 3.45Å; D1297-E1301 VanDerWaalsContact O-CG 3.24Å; D1297-E1301 WeakPolarHBondContact O-CG 3.47Å; D1297-E1301 PolarHBondContact O-N 2.98Å
1298	A	57.9	Low	60.1	Low	31 Å²	31	101.2 Å²	101.2	26%	0.256	53%	0.527	S	S	.	.	H	α-helix	trans	-77	-24.6	168.7	0	0	0	0	0	112	I1294 T1295 K1302	I1294-A1298 WeakPolarHBondContact O-CA 3.44Å; I1294-A1298 WeakPolarHBondContact O-CB 3.29Å; I1294-A1298 PolarHBondContact O-N 3.27Å; T1295-A1298 CarbonylContact O-C 3.57Å; A1298-K1302 WeakPolarHBondContact O-CA 3.47Å; A1298-K1302 WeakPolarHBondContact O-CB 3.39Å; A1298-K1302 VanDerWaalsContact O-CD 3.27Å; A1298-K1302 WeakPolarHBondContact O-CD 3.46Å; A1298-K1302 WeakPolarHBondContact O-CG 3.41Å; A1298-K1302 PolarHBondContact O-N 3.41Å
1299	E	60.6	Low	61.9	Low	83 Å²	83	97.2 Å²	97.2	39%	0.388	51%	0.508	S	S	.	.	H	α-helix	trans	-84.3	-36.1	172	-89.4	-158.8	174.2	0	0	109.7	T1295 K1302 R1303	T1295-E1299 WeakPolarHBondContact O-CA 3.02Å; T1295-E1299 WeakPolarHBondContact O-CB 3.02Å; T1295-E1299 WeakPolarHBondContact O-CG 3.49Å; T1295-E1299 PolarHBondContact O-N 3.27Å; E1299-K1302 CarbonylContact O-C 3.59Å; E1299-K1302 PolarHBondContact O-N 2.92Å; E1299-R1303 WeakPolarHBondContact O-CA 3.46Å; E1299-R1303 WeakPolarHBondContact O-CB 3.34Å; E1299-R1303 WeakPolarHBondContact O-CG 3.49Å; E1299-R1303 PolarHBondContact O-N 3.11Å; E1299-R1303 IonicContact OE2-CZ 2.77Å; E1299-R1303 IonicContact OE2-NE 2.63Å; E1299-R1303 IonicContact OE2-NH2 3.91Å; E1299-R1303 PolarHBondContact OE2-NH2 3.01Å
1300	R	68.1	Low	63.7	Low	150 Å²	150	97.2 Å²	97.2	57%	0.566	52%	0.515	S	S	*	.	H	α-helix	trans	-70.4	-39.4	170.2	-179.2	174.3	174.1	-105.4	-2	109.7	D1296 D1297 R1303 I1304	D1296-R1300 VanDerWaalsContact O-CA 3.31Å; D1296-R1300 WeakPolarHBondContact O-CA 3.27Å; D1296-R1300 WeakPolarHBondContact O-CB 3.49Å; D1296-R1300 PolarHBondContact O-N 3.4Å; D1297-R1300 IonicContact OD1-NH1 3.88Å; R1300-R1303 CarbonylContact O-C 3.45Å; R1300-R1303 PolarHBondContact O-N 2.93Å; R1300-I1304 HydrophobicContact CG-CD1 3.71Å; R1300-I1304 HydrophobicContact CG-CG1 4.24Å; R1300-I1304 WeakPolarHBondContact O-CA 3.36Å; R1300-I1304 WeakPolarHBondContact O-CB 3.42Å; R1300-I1304 WeakPolarHBondContact O-CD1 3.29Å; R1300-I1304 WeakPolarHBondContact O-CG1 3.35Å; R1300-I1304 PolarHBondContact O-N 3.15Å
1301	E	72	Confident	66.1	Low	123 Å²	123	92.4 Å²	92.4	58%	0.575	49%	0.49	S	S	*	.	H	α-helix	trans	-64.4	-42.9	164.9	-84	-169.1	153	0	0	109.7	D1297 R1303 I1304 I1305	D1297-E1301 WeakPolarHBondContact O-CA 3.39Å; D1297-E1301 WeakPolarHBondContact O-CB 3.45Å; D1297-E1301 VanDerWaalsContact O-CG 3.24Å; D1297-E1301 WeakPolarHBondContact O-CG 3.47Å; D1297-E1301 PolarHBondContact O-N 2.98Å; E1301-R1303 VanDerWaalsContact C-N 3.28Å; E1301-R1303 PolarHBondContact O-N 3.29Å; E1301-I1304 PolarHBondContact O-N 3.33Å; E1301-I1305 HydrophobicContact CB-CD1 4.14Å; E1301-I1305 VanDerWaalsContact O-CA 3.31Å; E1301-I1305 WeakPolarHBondContact O-CA 3.37Å; E1301-I1305 WeakPolarHBondContact O-CB 3.44Å; E1301-I1305 WeakPolarHBondContact O-CD1 3.5Å; E1301-I1305 WeakPolarHBondContact O-CG1 3.23Å; E1301-I1305 PolarHBondContact O-N 3.28Å
1302	K	74.1	Confident	68.2	Low	140 Å²	140	90.4 Å²	90.4	61%	0.609	49%	0.488	S	S	*	.	H	α-helix	trans	-66.6	-26.8	173.4	-76.8	161	-171.8	174.5	0	112.5	A1298 E1299 A1306	A1298-K1302 WeakPolarHBondContact O-CA 3.47Å; A1298-K1302 WeakPolarHBondContact O-CB 3.39Å; A1298-K1302 VanDerWaalsContact O-CD 3.27Å; A1298-K1302 WeakPolarHBondContact O-CD 3.46Å; A1298-K1302 WeakPolarHBondContact O-CG 3.41Å; A1298-K1302 PolarHBondContact O-N 3.41Å; E1299-K1302 CarbonylContact O-C 3.59Å; E1299-K1302 PolarHBondContact O-N 2.92Å; K1302-A1306 VanDerWaalsContact O-CA 3.27Å; K1302-A1306 WeakPolarHBondContact O-CA 3.49Å; K1302-A1306 WeakPolarHBondContact O-CB 3.38Å; K1302-A1306 PolarHBondContact O-N 3.3Å
1303	R	77.1	Confident	70.2	Confident	164 Å²	164	90.7 Å²	90.7	62%	0.619	48%	0.483	S	S	*	.	H	α-helix	trans	-85.1	-30.8	177.9	-76.1	169.8	-163	-174.6	12.2	110.7	E1299 R1300 E1301 G1307	E1299-R1303 WeakPolarHBondContact O-CA 3.46Å; E1299-R1303 WeakPolarHBondContact O-CB 3.34Å; E1299-R1303 WeakPolarHBondContact O-CG 3.49Å; E1299-R1303 PolarHBondContact O-N 3.11Å; E1299-R1303 IonicContact OE2-CZ 2.77Å; E1299-R1303 IonicContact OE2-NE 2.63Å; E1299-R1303 IonicContact OE2-NH2 3.91Å; E1299-R1303 PolarHBondContact OE2-NH2 3.01Å; R1300-R1303 CarbonylContact O-C 3.45Å; R1300-R1303 PolarHBondContact O-N 2.93Å; E1301-R1303 VanDerWaalsContact C-N 3.28Å; E1301-R1303 PolarHBondContact O-N 3.29Å; R1303-G1307 VanDerWaalsContact O-CA 3.29Å; R1303-G1307 WeakPolarHBondContact O-CA 3.45Å; R1303-G1307 PolarHBondContact O-N 3.47Å
1304	I	79.6	Confident	72.3	Confident	85 Å²	85	89.7 Å²	89.7	44%	0.436	48%	0.481	S	S	.	.	H	α-helix	trans	-76.9	-48.9	171.5	-71.2	167.5	0	0	0	108.2	R1300 E1301 G1307 V1308	R1300-I1304 HydrophobicContact CG-CD1 3.71Å; R1300-I1304 HydrophobicContact CG-CG1 4.24Å; R1300-I1304 WeakPolarHBondContact O-CA 3.36Å; R1300-I1304 WeakPolarHBondContact O-CB 3.42Å; R1300-I1304 WeakPolarHBondContact O-CD1 3.29Å; R1300-I1304 WeakPolarHBondContact O-CG1 3.35Å; R1300-I1304 PolarHBondContact O-N 3.15Å; E1301-I1304 PolarHBondContact O-N 3.33Å; I1304-G1307 CarbonylContact O-C 3.57Å; I1304-G1307 PolarHBondContact O-N 3.01Å; I1304-V1308 HydrophobicContact CG2-CG2 4.13Å; I1304-V1308 WeakPolarHBondContact O-CA 3.47Å; I1304-V1308 WeakPolarHBondContact O-CB 3.37Å; I1304-V1308 WeakPolarHBondContact O-CG2 3.37Å; I1304-V1308 PolarHBondContact O-N 2.88Å
1305	I	79.4	Confident	74.2	Confident	94 Å²	94	87.5 Å²	87.5	48%	0.482	47%	0.47	S	S	.	.	H	α-helix	trans	-61	-45.8	170.8	-65.2	164.2	0	0	0	109	E1301 V1308 V1309	E1301-I1305 HydrophobicContact CB-CD1 4.14Å; E1301-I1305 VanDerWaalsContact O-CA 3.31Å; E1301-I1305 WeakPolarHBondContact O-CA 3.37Å; E1301-I1305 WeakPolarHBondContact O-CB 3.44Å; E1301-I1305 WeakPolarHBondContact O-CD1 3.5Å; E1301-I1305 WeakPolarHBondContact O-CG1 3.23Å; E1301-I1305 PolarHBondContact O-N 3.28Å; I1305-V1308 PolarHBondContact O-N 2.91Å; I1305-V1309 HydrophobicContact CG2-CG2 3.91Å; I1305-V1309 WeakPolarHBondContact O-CA 3.18Å; I1305-V1309 WeakPolarHBondContact O-CB 3.47Å; I1305-V1309 WeakPolarHBondContact O-CG2 3.46Å; I1305-V1309 PolarHBondContact O-N 2.82Å
1306	A	78.8	Confident	76	Confident	47 Å²	47	88.5 Å²	88.5	39%	0.388	47%	0.472	S	S	.	.	H	α-helix	trans	-65.3	-39.8	173	0	0	0	0	0	110.6	K1302 V1309 S1310	K1302-A1306 VanDerWaalsContact O-CA 3.27Å; K1302-A1306 WeakPolarHBondContact O-CA 3.49Å; K1302-A1306 WeakPolarHBondContact O-CB 3.38Å; K1302-A1306 PolarHBondContact O-N 3.3Å; A1306-V1309 PolarHBondContact O-N 3.46Å; A1306-S1310 WeakPolarHBondContact O-CA 3.29Å; A1306-S1310 WeakPolarHBondContact O-CB 3.35Å; A1306-S1310 PolarHBondContact O-N 3.03Å; A1306-S1310 PolarHBondContact O-OG 3.01Å
1307	G	82.7	Confident	77.4	Confident	43 Å²	43	87.4 Å²	87.4	44%	0.443	47%	0.471	S	S	.	.	H	α-helix	trans	-67.4	-35.4	177.2	0	0	0	0	0	113.1	R1303 I1304 G1311	R1303-G1307 VanDerWaalsContact O-CA 3.29Å; R1303-G1307 WeakPolarHBondContact O-CA 3.45Å; R1303-G1307 PolarHBondContact O-N 3.47Å; I1304-G1307 CarbonylContact O-C 3.57Å; I1304-G1307 PolarHBondContact O-N 3.01Å; G1307-G1311 WeakPolarHBondContact O-CA 3.31Å; G1307-G1311 PolarHBondContact O-N 3.22Å
1308	V	84.8	Confident	78.7	Confident	85 Å²	85	86.4 Å²	86.4	52%	0.515	47%	0.468	S	S	.	.	H	α-helix	trans	-78.4	-39.8	176.2	169.8	0	0	0	0	109.7	I1304 I1305 G1311 V1312	I1304-V1308 HydrophobicContact CG2-CG2 4.13Å; I1304-V1308 WeakPolarHBondContact O-CA 3.47Å; I1304-V1308 WeakPolarHBondContact O-CB 3.37Å; I1304-V1308 WeakPolarHBondContact O-CG2 3.37Å; I1304-V1308 PolarHBondContact O-N 2.88Å; I1305-V1308 PolarHBondContact O-N 2.91Å; V1308-G1311 CarbonylContact O-C 3.5Å; V1308-G1311 PolarHBondContact O-N 3.22Å; V1308-V1312 HydrophobicContact CG1-CG2 4.27Å; V1308-V1312 WeakPolarHBondContact O-CA 3.29Å; V1308-V1312 WeakPolarHBondContact O-CB 3.35Å; V1308-V1312 WeakPolarHBondContact O-CG2 3.27Å; V1308-V1312 PolarHBondContact O-N 2.61Å
1309	V	83.1	Confident	79.9	Confident	72 Å²	72	88.9 Å²	88.9	44%	0.436	48%	0.476	S	S	.	.	H	α-helix	trans	-70.1	-43.7	174.4	169.2	0	0	0	0	109.7	I1305 A1306 G1311 V1312 I1313	I1305-V1309 HydrophobicContact CG2-CG2 3.91Å; I1305-V1309 WeakPolarHBondContact O-CA 3.18Å; I1305-V1309 WeakPolarHBondContact O-CB 3.47Å; I1305-V1309 WeakPolarHBondContact O-CG2 3.46Å; I1305-V1309 PolarHBondContact O-N 2.82Å; A1306-V1309 PolarHBondContact O-N 3.46Å; V1309-G1311 VanDerWaalsContact C-N 3.34Å; V1309-V1312 PolarHBondContact O-N 3.35Å; V1309-I1313 HydrophobicContact CG1-CD1 3.6Å; V1309-I1313 HydrophobicContact CG1-CG1 4.25Å; V1309-I1313 WeakPolarHBondContact O-CA 3.4Å; V1309-I1313 WeakPolarHBondContact O-CB 3.4Å; V1309-I1313 WeakPolarHBondContact O-CD1 3.48Å; V1309-I1313 WeakPolarHBondContact O-CG1 3.35Å; V1309-I1313 PolarHBondContact O-N 2.78Å
1310	S	77.9	Confident	80.9	Confident	71 Å²	71	89.7 Å²	89.7	50%	0.497	48%	0.482	S	S	.	.	H	α-helix	trans	-62.2	-42.5	170.1	-64.4	0	0	0	0	110.4	A1306 I1313 L1314	A1306-S1310 WeakPolarHBondContact O-CA 3.29Å; A1306-S1310 WeakPolarHBondContact O-CB 3.35Å; A1306-S1310 PolarHBondContact O-N 3.03Å; A1306-S1310 PolarHBondContact O-OG 3.01Å; S1310-I1313 CarbonylContact O-C 3.22Å; S1310-I1313 PolarHBondContact O-N 3.07Å; S1310-L1314 WeakPolarHBondContact O-CA 3.28Å; S1310-L1314 WeakPolarHBondContact O-CB 3.17Å; S1310-L1314 PolarHBondContact O-N 2.76Å
1311	G	85.8	Confident	81.4	Confident	27 Å²	27	87.7 Å²	87.7	28%	0.278	48%	0.482	S	S	.	.	H	α-helix	trans	-64.8	-40.9	175.5	0	0	0	0	0	112.6	G1307 V1308 V1309 L1314 I1315	G1307-G1311 WeakPolarHBondContact O-CA 3.31Å; G1307-G1311 PolarHBondContact O-N 3.22Å; V1308-G1311 CarbonylContact O-C 3.5Å; V1308-G1311 PolarHBondContact O-N 3.22Å; V1309-G1311 VanDerWaalsContact C-N 3.34Å; G1311-L1314 PolarHBondContact O-N 3.14Å; G1311-I1315 VanDerWaalsContact O-CB 3.31Å; G1311-I1315 WeakPolarHBondContact O-CB 3.44Å; G1311-I1315 WeakPolarHBondContact O-CD1 3.37Å; G1311-I1315 WeakPolarHBondContact O-CG1 3.49Å; G1311-I1315 PolarHBondContact O-N 3.46Å
1312	V	86	Confident	81.8	Confident	73 Å²	73	85.8 Å²	85.8	44%	0.442	48%	0.479	S	S	.	.	H	α-helix	trans	-72.1	-37.5	175.3	167.5	0	0	0	0	110.6	V1308 V1309 L1314 L1316	V1308-V1312 HydrophobicContact CG1-CG2 4.27Å; V1308-V1312 WeakPolarHBondContact O-CA 3.29Å; V1308-V1312 WeakPolarHBondContact O-CB 3.35Å; V1308-V1312 WeakPolarHBondContact O-CG2 3.27Å; V1308-V1312 PolarHBondContact O-N 2.61Å; V1309-V1312 PolarHBondContact O-N 3.35Å; V1312-L1314 VanDerWaalsContact C-N 3.32Å; V1312-L1316 HydrophobicContact CG1-CD1 3.81Å; V1312-L1316 HydrophobicContact CG1-CG 4.32Å; V1312-L1316 WeakPolarHBondContact O-CA 3.33Å; V1312-L1316 WeakPolarHBondContact O-CB 3.47Å; V1312-L1316 WeakPolarHBondContact O-CG 3.23Å; V1312-L1316 PolarHBondContact O-N 2.86Å
1313	I	83.9	Confident	81.9	Confident	101 Å²	101	83.6 Å²	83.6	52%	0.518	47%	0.473	S	S	.	.	H	α-helix	trans	-67.9	-34.9	171.9	-72.5	167.6	0	0	0	110.1	V1309 S1310 S1317	V1309-I1313 HydrophobicContact CG1-CD1 3.6Å; V1309-I1313 HydrophobicContact CG1-CG1 4.25Å; V1309-I1313 WeakPolarHBondContact O-CA 3.4Å; V1309-I1313 WeakPolarHBondContact O-CB 3.4Å; V1309-I1313 WeakPolarHBondContact O-CD1 3.48Å; V1309-I1313 WeakPolarHBondContact O-CG1 3.35Å; V1309-I1313 PolarHBondContact O-N 2.78Å; S1310-I1313 CarbonylContact O-C 3.22Å; S1310-I1313 PolarHBondContact O-N 3.07Å; I1313-S1317 WeakPolarHBondContact O-CA 3.44Å; I1313-S1317 WeakPolarHBondContact O-CB 3.48Å; I1313-S1317 PolarHBondContact O-N 2.86Å; I1313-S1317 PolarHBondContact O-OG 3.42Å
1314	L	84.4	Confident	81.6	Confident	109 Å²	109	81.4 Å²	81.4	57%	0.571	47%	0.468	S	S	*	.	H	α-helix	trans	-75	-39	177	-157.3	152.9	0	0	0	110.4	S1310 G1311 V1312 S1317 V1318	S1310-L1314 WeakPolarHBondContact O-CA 3.28Å; S1310-L1314 WeakPolarHBondContact O-CB 3.17Å; S1310-L1314 PolarHBondContact O-N 2.76Å; G1311-L1314 PolarHBondContact O-N 3.14Å; V1312-L1314 VanDerWaalsContact C-N 3.32Å; L1314-S1317 VanDerWaalsContact CA-OG 3.29Å; L1314-S1317 WeakPolarHBondContact CA-OG 2.93Å; L1314-S1317 PolarHBondContact O-N 3.06Å; L1314-S1317 PolarHBondContact O-OG 2.73Å; L1314-S1317 VanDerWaalsContact O-OG 3.06Å; L1314-V1318 HydrophobicContact CD2-CG2 4.04Å; L1314-V1318 VanDerWaalsContact O-CB 3.23Å; L1314-V1318 WeakPolarHBondContact O-CB 3.24Å; L1314-V1318 WeakPolarHBondContact O-CG2 3.28Å; L1314-V1318 PolarHBondContact O-N 3.47Å
1315	I	85.8	Confident	81.1	Confident	103 Å²	103	80.4 Å²	80.4	53%	0.528	47%	0.468	S	S	.	.	H	α-helix	trans	-66.8	-42.6	170.3	-71.2	164.2	0	0	0	110.3	G1311 V1318 I1319	G1311-I1315 VanDerWaalsContact O-CB 3.31Å; G1311-I1315 WeakPolarHBondContact O-CB 3.44Å; G1311-I1315 WeakPolarHBondContact O-CD1 3.37Å; G1311-I1315 WeakPolarHBondContact O-CG1 3.49Å; G1311-I1315 PolarHBondContact O-N 3.46Å; I1315-V1318 CarbonylContact O-C 3.53Å; I1315-V1318 PolarHBondContact O-N 2.82Å; I1315-I1319 HydrophobicContact CG2-CD1 3.67Å; I1315-I1319 HydrophobicContact CG2-CG1 4.3Å; I1315-I1319 VanDerWaalsContact O-CB 3.3Å; I1315-I1319 WeakPolarHBondContact O-CB 3.15Å; I1315-I1319 WeakPolarHBondContact O-CG1 3.49Å; I1315-I1319 PolarHBondContact O-N 3.44Å
1316	L	84.8	Confident	80	Confident	85 Å²	85	84.6 Å²	84.6	45%	0.445	48%	0.478	S	S	.	.	H	α-helix	trans	-68.3	-35.7	175.6	-81.9	167.4	0	0	0	111.3	V1312 I1319 I1320	V1312-L1316 HydrophobicContact CG1-CD1 3.81Å; V1312-L1316 HydrophobicContact CG1-CG 4.32Å; V1312-L1316 WeakPolarHBondContact O-CA 3.33Å; V1312-L1316 WeakPolarHBondContact O-CB 3.47Å; V1312-L1316 WeakPolarHBondContact O-CG 3.23Å; V1312-L1316 PolarHBondContact O-N 2.86Å; L1316-I1319 PolarHBondContact O-N 2.77Å; L1316-I1320 WeakPolarHBondContact O-CA 3.48Å; L1316-I1320 WeakPolarHBondContact O-CB 3.42Å; L1316-I1320 WeakPolarHBondContact O-CD1 3.49Å; L1316-I1320 WeakPolarHBondContact O-CG1 3.38Å; L1316-I1320 PolarHBondContact O-N 3.02Å
1317	S	81.2	Confident	79	Confident	56 Å²	56	88.2 Å²	88.2	39%	0.392	49%	0.486	S	S	.	.	H	α-helix	trans	-75.9	-30.5	175.8	67.4	0	0	0	0	111.1	I1313 L1314 L1321	I1313-S1317 WeakPolarHBondContact O-CA 3.44Å; I1313-S1317 WeakPolarHBondContact O-CB 3.48Å; I1313-S1317 PolarHBondContact O-N 2.86Å; I1313-S1317 PolarHBondContact O-OG 3.42Å; L1314-S1317 VanDerWaalsContact CA-OG 3.29Å; L1314-S1317 WeakPolarHBondContact CA-OG 2.93Å; L1314-S1317 PolarHBondContact O-N 3.06Å; L1314-S1317 PolarHBondContact O-OG 2.73Å; L1314-S1317 VanDerWaalsContact O-OG 3.06Å; S1317-L1321 WeakPolarHBondContact O-CA 3.5Å; S1317-L1321 WeakPolarHBondContact O-CB 3.43Å; S1317-L1321 PolarHBondContact O-N 3.03Å
1318	V	83.7	Confident	77.5	Confident	73 Å²	73	91.1 Å²	91.1	44%	0.442	49%	0.487	S	S	.	.	H	α-helix	trans	-71.3	-38.3	167.4	169.6	0	0	0	0	110.7	L1314 I1315 L1321 V1322	L1314-V1318 HydrophobicContact CD2-CG2 4.04Å; L1314-V1318 VanDerWaalsContact O-CB 3.23Å; L1314-V1318 WeakPolarHBondContact O-CB 3.24Å; L1314-V1318 WeakPolarHBondContact O-CG2 3.28Å; L1314-V1318 PolarHBondContact O-N 3.47Å; I1315-V1318 CarbonylContact O-C 3.53Å; I1315-V1318 PolarHBondContact O-N 2.82Å; V1318-L1321 CarbonylContact O-C 3.58Å; V1318-L1321 PolarHBondContact O-N 2.94Å; V1318-V1322 HydrophobicContact CG1-CG2 4.27Å; V1318-V1322 WeakPolarHBondContact O-CA 3.41Å; V1318-V1322 WeakPolarHBondContact O-CB 3.48Å; V1318-V1322 WeakPolarHBondContact O-CG2 3.37Å; V1318-V1322 PolarHBondContact O-N 3.37Å
1319	I	83.2	Confident	75.9	Confident	82 Å²	82	92.2 Å²	92.2	42%	0.421	49%	0.494	S	S	.	.	H	α-helix	trans	-68.8	-43	174	-72.8	166.2	0	0	0	109.8	I1315 L1316 L1321 V1322 L1323	I1315-I1319 HydrophobicContact CG2-CD1 3.67Å; I1315-I1319 HydrophobicContact CG2-CG1 4.3Å; I1315-I1319 VanDerWaalsContact O-CB 3.3Å; I1315-I1319 WeakPolarHBondContact O-CB 3.15Å; I1315-I1319 WeakPolarHBondContact O-CG1 3.49Å; I1315-I1319 PolarHBondContact O-N 3.44Å; L1316-I1319 PolarHBondContact O-N 2.77Å; I1319-L1321 VanDerWaalsContact C-N 3.35Å; I1319-V1322 CarbonylContact O-C 3.51Å; I1319-V1322 PolarHBondContact O-N 3.49Å; I1319-L1323 HydrophobicContact CG2-CD1 3.84Å; I1319-L1323 HydrophobicContact CG2-CG 4.21Å; I1319-L1323 WeakPolarHBondContact O-CB 3.36Å; I1319-L1323 WeakPolarHBondContact O-CG 3.36Å; I1319-L1323 PolarHBondContact O-N 3.47Å
1320	I	81.9	Confident	73.7	Confident	101 Å²	101	96.7 Å²	96.7	52%	0.518	51%	0.508	S	S	.	.	H	α-helix	trans	-64.5	-43.1	173.5	-73.1	164.1	0	0	0	108.3	L1316 V1322 L1323 F1324	L1316-I1320 WeakPolarHBondContact O-CA 3.48Å; L1316-I1320 WeakPolarHBondContact O-CB 3.42Å; L1316-I1320 WeakPolarHBondContact O-CD1 3.49Å; L1316-I1320 WeakPolarHBondContact O-CG1 3.38Å; L1316-I1320 PolarHBondContact O-N 3.02Å; I1320-V1322 VanDerWaalsContact C-N 3.34Å; I1320-V1322 PolarHBondContact O-N 3.42Å; I1320-L1323 CarbonylContact O-C 3.35Å; I1320-L1323 PolarHBondContact O-N 2.62Å; I1320-F1324 VanDerWaalsContact O-CA 3.31Å; I1320-F1324 WeakPolarHBondContact O-CA 3.39Å; I1320-F1324 WeakPolarHBondContact O-CB 3.27Å; I1320-F1324 PolarHBondContact O-N 3.11Å
1321	L	79.8	Confident	71.6	Confident	108 Å²	108	98.9 Å²	98.9	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-69.3	-31.9	177.1	-172	130.4	0	0	0	111.3	S1317 V1318 I1319 C1325	S1317-L1321 WeakPolarHBondContact O-CA 3.5Å; S1317-L1321 WeakPolarHBondContact O-CB 3.43Å; S1317-L1321 PolarHBondContact O-N 3.03Å; V1318-L1321 CarbonylContact O-C 3.58Å; V1318-L1321 PolarHBondContact O-N 2.94Å; I1319-L1321 VanDerWaalsContact C-N 3.35Å; L1321-C1325 WeakPolarHBondContact O-CA 3.21Å; L1321-C1325 WeakPolarHBondContact O-CB 3.39Å; L1321-C1325 PolarHBondContact O-N 3.49Å; L1321-C1325 PolarHBondContact O-SG 3.43Å
1322	V	80	Confident	69.1	Low	83 Å²	83	105.5 Å²	105.5	50%	0.503	53%	0.534	S	S	.	.	H	α-helix	trans	-72.7	-38.4	171.2	166.7	0	0	0	0	110.2	V1318 I1319 I1320 R1326	V1318-V1322 HydrophobicContact CG1-CG2 4.27Å; V1318-V1322 WeakPolarHBondContact O-CA 3.41Å; V1318-V1322 WeakPolarHBondContact O-CB 3.48Å; V1318-V1322 WeakPolarHBondContact O-CG2 3.37Å; V1318-V1322 PolarHBondContact O-N 3.37Å; I1319-V1322 CarbonylContact O-C 3.51Å; I1319-V1322 PolarHBondContact O-N 3.49Å; I1320-V1322 VanDerWaalsContact C-N 3.34Å; I1320-V1322 PolarHBondContact O-N 3.42Å; V1322-R1326 WeakPolarHBondContact O-CA 3.48Å; V1322-R1326 WeakPolarHBondContact O-CB 3.36Å; V1322-R1326 PolarHBondContact O-N 2.89Å
1323	L	76.8	Confident	66.6	Low	94 Å²	94	105.1 Å²	105.1	49%	0.492	55%	0.545	S	S	.	.	H	α-helix	trans	-71.3	-34	173.6	-73.8	172.9	0	0	0	111.2	I1319 I1320 R1326 H1327	I1319-L1323 HydrophobicContact CG2-CD1 3.84Å; I1319-L1323 HydrophobicContact CG2-CG 4.21Å; I1319-L1323 WeakPolarHBondContact O-CB 3.36Å; I1319-L1323 WeakPolarHBondContact O-CG 3.36Å; I1319-L1323 PolarHBondContact O-N 3.47Å; I1320-L1323 CarbonylContact O-C 3.35Å; I1320-L1323 PolarHBondContact O-N 2.62Å; L1323-R1326 CarbonylContact O-C 3.06Å; L1323-R1326 PolarHBondContact O-N 3.44Å; L1323-H1327 WeakPolarHBondContact O-CA 3.48Å; L1323-H1327 WeakPolarHBondContact O-CB 3.39Å; L1323-H1327 PolarHBondContact O-N 2.88Å
1324	F	70.4	Confident	64	Low	117 Å²	117	107.9 Å²	107.9	51%	0.513	56%	0.56	S	S	.	*	H	α-helix	trans	-79	-41.4	-179.7	-160.8	-89.4	0	0	0	108.8	I1320 H1327 F1328	I1320-F1324 VanDerWaalsContact O-CA 3.31Å; I1320-F1324 WeakPolarHBondContact O-CA 3.39Å; I1320-F1324 WeakPolarHBondContact O-CB 3.27Å; I1320-F1324 PolarHBondContact O-N 3.11Å; F1324-H1327 CarbonylContact O-C 3.51Å; F1324-H1327 PolarHBondContact O-N 3.18Å; F1324-F1328 AromaticContact CD1-CD2 3.59Å; F1324-F1328 HydrophobicContact CD1-CD2 3.59Å; F1324-F1328 HydrophobicContact CD1-CE2 4.01Å; F1324-F1328 HydrophobicContact CD1-CG 4.44Å; F1324-F1328 AromaticContact CE1-CD2 3.31Å; F1324-F1328 HydrophobicContact CE1-CD2 3.31Å; F1324-F1328 AromaticContact CE1-CE2 3.24Å; F1324-F1328 HydrophobicContact CE1-CE2 3.24Å; F1324-F1328 HydrophobicContact CE1-CG 4.3Å; F1324-F1328 HydrophobicContact CE1-CZ 4.17Å; F1324-F1328 HydrophobicContact CE2-CE2 4.25Å; F1324-F1328 HydrophobicContact CG-CD2 4.31Å; F1324-F1328 AromaticContact CZ-CD2 3.85Å; F1324-F1328 HydrophobicContact CZ-CD2 3.85Å; F1324-F1328 AromaticContact CZ-CE2 3.39Å; F1324-F1328 HydrophobicContact CZ-CE2 3.39Å; F1324-F1328 HydrophobicContact CZ-CZ 4.36Å; F1324-F1328 WeakPolarHBondContact O-CA 3.42Å; F1324-F1328 WeakPolarHBondContact O-CB 3.36Å; F1324-F1328 PolarHBondContact O-N 2.97Å
1325	C	68.7	Low	61.7	Low	64 Å²	64	112.5 Å²	112.5	43%	0.432	57%	0.572	S	S	.	*	H	α-helix	trans	-63.6	-42.2	165.7	-72.6	0	0	0	0	110.3	L1321 H1327 F1328 T1329	L1321-C1325 WeakPolarHBondContact O-CA 3.21Å; L1321-C1325 WeakPolarHBondContact O-CB 3.39Å; L1321-C1325 PolarHBondContact O-N 3.49Å; L1321-C1325 PolarHBondContact O-SG 3.43Å; C1325-H1327 VanDerWaalsContact C-N 3.29Å; C1325-H1327 PolarHBondContact O-N 3.45Å; C1325-F1328 PolarHBondContact O-N 2.96Å; C1325-T1329 VanDerWaalsContact O-CB 3.29Å; C1325-T1329 WeakPolarHBondContact O-CB 3.45Å; C1325-T1329 WeakPolarHBondContact O-CG2 3.3Å; C1325-T1329 PolarHBondContact O-N 3.46Å; C1325-T1329 PolarHBondContact O-OG1 3.19Å
1326	R	55.4	Low	59.1	Low	182 Å²	182	119 Å²	119	69%	0.687	59%	0.59	S	S	*	*	H	α-helix	trans	-68.8	-26.6	176.5	-175	177.7	165	-172.3	-4.9	112.5	V1322 L1323 T1329	V1322-R1326 WeakPolarHBondContact O-CA 3.48Å; V1322-R1326 WeakPolarHBondContact O-CB 3.36Å; V1322-R1326 PolarHBondContact O-N 2.89Å; L1323-R1326 CarbonylContact O-C 3.06Å; L1323-R1326 PolarHBondContact O-N 3.44Å; R1326-T1329 WeakPolarHBondContact CA-OG1 3.15Å; R1326-T1329 PolarHBondContact O-OG1 3.49Å
1327	H	58.5	Low	56.8	Low	123 Å²	123	120.8 Å²	120.8	57%	0.569	60%	0.604	S	S	*	*	H	α-helix	trans	-83.1	-40	173.9	-168.5	61.8	0	0	0	111.3	L1323 F1324 C1325 F1330 E1331	L1323-H1327 WeakPolarHBondContact O-CA 3.48Å; L1323-H1327 WeakPolarHBondContact O-CB 3.39Å; L1323-H1327 PolarHBondContact O-N 2.88Å; F1324-H1327 CarbonylContact O-C 3.51Å; F1324-H1327 PolarHBondContact O-N 3.18Å; C1325-H1327 VanDerWaalsContact C-N 3.29Å; C1325-H1327 PolarHBondContact O-N 3.45Å; H1327-F1330 CarbonylContact O-C 3.53Å; H1327-F1330 WeakPolarHBondContact O-CA 3.4Å; H1327-F1330 PolarHBondContact O-N 3.46Å; H1327-E1331 PolarHBondContact O-N 3.33Å; H1327-E1331 VanDerWaalsContact O-N 3.13Å
1328	F	51.8	Low	54.8	Low	104 Å²	104	129.2 Å²	129.2	46%	0.456	63%	0.627	S	S	.	*	H	α-helix	trans	-74.9	-26.2	175.5	-102.1	-96.6	0	0	0	113.1	F1324 C1325 F1330 E1331	F1324-F1328 AromaticContact CD1-CD2 3.59Å; F1324-F1328 HydrophobicContact CD1-CD2 3.59Å; F1324-F1328 HydrophobicContact CD1-CE2 4.01Å; F1324-F1328 HydrophobicContact CD1-CG 4.44Å; F1324-F1328 AromaticContact CE1-CD2 3.31Å; F1324-F1328 HydrophobicContact CE1-CD2 3.31Å; F1324-F1328 AromaticContact CE1-CE2 3.24Å; F1324-F1328 HydrophobicContact CE1-CE2 3.24Å; F1324-F1328 HydrophobicContact CE1-CG 4.3Å; F1324-F1328 HydrophobicContact CE1-CZ 4.17Å; F1324-F1328 HydrophobicContact CE2-CE2 4.25Å; F1324-F1328 HydrophobicContact CG-CD2 4.31Å; F1324-F1328 AromaticContact CZ-CD2 3.85Å; F1324-F1328 HydrophobicContact CZ-CD2 3.85Å; F1324-F1328 AromaticContact CZ-CE2 3.39Å; F1324-F1328 HydrophobicContact CZ-CE2 3.39Å; F1324-F1328 HydrophobicContact CZ-CZ 4.36Å; F1324-F1328 WeakPolarHBondContact O-CA 3.42Å; F1324-F1328 WeakPolarHBondContact O-CB 3.36Å; F1324-F1328 PolarHBondContact O-N 2.97Å; C1325-F1328 PolarHBondContact O-N 2.96Å; F1328-F1330 PolarHBondContact O-N 2.55Å; F1328-E1331 WeakPolarHBondContact CE1-OE2 3.27Å; F1328-E1331 PolarHBondContact O-N 3.35Å
1329	T	51.5	Low	52.5	Low	108 Å²	108	134.3 Å²	134.3	66%	0.663	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	6.3	164.8	59.4	0	0	0	0	112.1	C1325 R1326	C1325-T1329 VanDerWaalsContact O-CB 3.29Å; C1325-T1329 WeakPolarHBondContact O-CB 3.45Å; C1325-T1329 WeakPolarHBondContact O-CG2 3.3Å; C1325-T1329 PolarHBondContact O-N 3.46Å; C1325-T1329 PolarHBondContact O-OG1 3.19Å; R1326-T1329 WeakPolarHBondContact CA-OG1 3.15Å; R1326-T1329 PolarHBondContact O-OG1 3.49Å
1330	F	36.5	Very low	50.5	Low	166 Å²	166	134.4 Å²	134.4	73%	0.728	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.3	37.9	165.8	-112.9	-82.7	0	0	0	111.9	H1327 F1328 Q1332	H1327-F1330 CarbonylContact O-C 3.53Å; H1327-F1330 WeakPolarHBondContact O-CA 3.4Å; H1327-F1330 PolarHBondContact O-N 3.46Å; F1328-F1330 PolarHBondContact O-N 2.55Å; F1330-Q1332 PolarHBondContact O-N 3.03Å
1331	E	32.8	Very low	48.7	Very low	118 Å²	118	140 Å²	140	55%	0.551	68%	0.68	S	S	*	*			trans	-81.9	92	153.2	-78.7	-164.7	164.3	0	0	108	H1327 F1328 G1333	H1327-E1331 PolarHBondContact O-N 3.33Å; H1327-E1331 VanDerWaalsContact O-N 3.13Å; F1328-E1331 WeakPolarHBondContact CE1-OE2 3.27Å; F1328-E1331 PolarHBondContact O-N 3.35Å; E1331-G1333 PolarHBondContact O-N 2.65Å
1332	Q	34.3	Very low	47.2	Very low	166 Å²	166	137.4 Å²	137.4	78%	0.776	68%	0.68	S	S	*	*			trans	-64.2	121.3	153.5	-92.7	-178.7	-23.8	0	0	107	F1330 D1334	F1330-Q1332 PolarHBondContact O-N 3.03Å; Q1332-D1334 PolarHBondContact O-N 3.19Å
1333	G	33	Very low	45.7	Very low	65 Å²	65	136.7 Å²	136.7	67%	0.67	68%	0.683	S	S	*	*			trans	-61.4	108.8	179.6	0	0	0	0	0	111.7	E1331	E1331-G1333 PolarHBondContact O-N 2.65Å
1334	D	30.2	Very low	44.3	Very low	158 Å²	158	138 Å²	138	85%	0.845	70%	0.7	S	S	*	*			trans	-99.5	105.3	169.2	-90	-15.7	0	0	0	110	Q1332	Q1332-D1334 PolarHBondContact O-N 3.19Å
1335	Y	36.7	Very low	43.5	Very low	207 Å²	207	143.7 Å²	143.7	81%	0.812	72%	0.718	S	S	*	*			trans	-79.8	116.5	169.6	41.1	-86.9	0	0	0	109.8	T1337	Y1335-T1337 PolarHBondContact O-N 2.67Å
1336	R	29.8	Very low	42.9	Very low	240 Å²	240	143.8 Å²	143.8	91%	0.906	71%	0.712	S	S	*	*			trans	-79.9	110.1	176.4	-93.3	-178.4	169.3	173.9	-0.1	111.7
1337	T	37.1	Very low	43.1	Very low	122 Å²	122	144.6 Å²	144.6	75%	0.748	72%	0.721	S	S	*	*			trans	-95.6	124.7	157.1	51.1	0	0	0	0	109.2	Y1335 E1339	Y1335-T1337 PolarHBondContact O-N 2.67Å; T1337-E1339 PolarHBondContact O-N 3.33Å
1338	R	39.9	Very low	43.1	Very low	232 Å²	232	142.4 Å²	142.4	88%	0.875	72%	0.716	S	S	*	*			trans	-82.9	95.7	178	-75.4	-178	173.9	173.8	-0.1	109.8
1339	E	35.3	Very low	43.2	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-76.8	145.7	160.8	-74	-171.3	166.9	0	0	111.3	T1337 K1341	T1337-E1339 PolarHBondContact O-N 3.33Å; E1339-K1341 PolarHBondContact O-N 2.96Å
1340	A	41.4	Very low	43.5	Very low	84 Å²	84	142 Å²	142	69%	0.694	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-63.8	121.9	-165.4	0	0	0	0	0	113.7
1341	K	42.3	Very low	44.3	Very low	218 Å²	218	137.8 Å²	137.8	95%	0.948	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	118.9	168	-74.7	-177	175.7	-178.8	0	109.9	E1339	E1339-K1341 PolarHBondContact O-N 2.96Å
1342	G	49.6	Very low	45.3	Very low	55 Å²	55	133.8 Å²	133.8	57%	0.567	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	151.1	-11.8	167.8	0	0	0	0	0	117.3	S1344	G1342-S1344 VanDerWaalsContact C-N 3.32Å; G1342-S1344 PolarHBondContact O-N 3.03Å
1343	A	47.8	Very low	46.3	Very low	68 Å²	68	132.6 Å²	132.6	56%	0.562	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-75.2	-10.2	-171.9	0	0	0	0	0	115.7	R1345 A1352	A1343-R1345 PolarHBondContact O-N 3.27Å; A1343-A1352 HydrophobicContact CB-CB 4.2Å
1344	S	47.9	Very low	47.2	Very low	121 Å²	121	137.1 Å²	137.1	85%	0.846	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-84.1	-3.2	-175.1	57.1	0	0	0	0	115.7	G1342	G1342-S1344 VanDerWaalsContact C-N 3.32Å; G1342-S1344 PolarHBondContact O-N 3.03Å
1345	R	53	Low	48.3	Very low	236 Å²	236	137.6 Å²	137.6	89%	0.891	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-107.6	2.7	177	-70.3	-172.7	178.4	-177.5	0	114.3	A1343	A1343-R1345 PolarHBondContact O-N 3.27Å
1346	M	56.5	Low	48.6	Very low	66 Å²	66	129.7 Å²	129.7	33%	0.325	67%	0.669	S	S	.	*			trans	-108	130.3	-173.3	-67.7	-80.8	-122.7	0	0	110.6	T1348 M1351 Y1355	M1346-T1348 VanDerWaalsContact C-N 3.33Å; M1346-T1348 PolarHBondContact O-N 3.43Å; M1346-M1351 HydrophobicContact CB-CB 4.12Å; M1346-M1351 HydrophobicContact CE-CB 4.05Å; M1346-M1351 WeakPolarHBondContact CE-O 3.35Å; M1346-M1351 HydrophobicContact CG-CB 4.48Å; M1346-M1351 HydrophobicContact SD-CB 4.04Å; M1346-M1351 HydrophobicContact SD-SD 4.15Å; M1346-Y1355 HydrophobicContact CE-CD2 3.44Å; M1346-Y1355 VanDerWaalsContact CE-CD2 3.44Å; M1346-Y1355 HydrophobicContact CE-CE2 4.13Å; M1346-Y1355 HydrophobicContact CE-CG 3.84Å
1347	K	59.8	Low	49.3	Very low	200 Å²	200	130.3 Å²	130.3	87%	0.87	67%	0.671	S	S	*	*	S	Bend	trans	-74.7	-13.7	-168.8	-73.3	-177.1	176.5	179.9	0	115.1	M1351	K1347-M1351 HydrophobicContact CB-CE 4.17Å
1348	T	58.1	Low	49.5	Very low	76 Å²	76	131.2 Å²	131.2	47%	0.466	68%	0.677	S	S	.	*	S	Bend	trans	-144	152.8	-179.1	59.8	0	0	0	0	111.4	M1346 D1350 M1351 A1352	M1346-T1348 VanDerWaalsContact C-N 3.33Å; M1346-T1348 PolarHBondContact O-N 3.43Å; T1348-D1350 VanDerWaalsContact C-N 3.33Å; T1348-D1350 PolarHBondContact O-N 3.5Å; T1348-M1351 HydrophobicContact CG2-CE 4.29Å; T1348-M1351 WeakPolarHBondContact O-CB 3.45Å; T1348-M1351 PolarHBondContact O-N 2.84Å; T1348-M1351 WeakPolarHBondContact OG1-CE 3.48Å; T1348-A1352 PolarHBondContact O-N 2.79Å
1349	A	53.6	Low	49.7	Very low	73 Å²	73	123.8 Å²	123.8	60%	0.603	67%	0.672	S	S	*	*	H	α-helix	trans	-62.1	-36.5	-176.4	0	0	0	0	0	113.2	M1351 A1352 I1353	A1349-M1351 VanDerWaalsContact C-N 3.28Å; A1349-M1351 PolarHBondContact O-N 3.31Å; A1349-A1352 WeakPolarHBondContact O-CB 3.47Å; A1349-A1352 PolarHBondContact O-N 3.48Å; A1349-I1353 PolarHBondContact O-N 3.48Å
1350	D	57.8	Low	49.8	Very low	132 Å²	132	124.3 Å²	124.3	71%	0.706	68%	0.675	S	S	*	*	H	α-helix	trans	-64	-34.2	177.6	-61.3	-34.4	0	0	0	112.2	T1348 A1352	T1348-D1350 VanDerWaalsContact C-N 3.33Å; T1348-D1350 PolarHBondContact O-N 3.5Å; D1350-A1352 VanDerWaalsContact C-N 3.31Å; D1350-A1352 PolarHBondContact O-N 2.9Å
1351	M	52.8	Low	49.8	Very low	76 Å²	76	125.5 Å²	125.5	37%	0.374	68%	0.676	S	S	.	*	H	α-helix	trans	-66.4	-32.4	174	-88.7	-171.8	-84.6	0	0	112.2	M1346 K1347 T1348 A1349	M1346-M1351 HydrophobicContact CB-CB 4.12Å; M1346-M1351 HydrophobicContact CE-CB 4.05Å; M1346-M1351 WeakPolarHBondContact CE-O 3.35Å; M1346-M1351 HydrophobicContact CG-CB 4.48Å; M1346-M1351 HydrophobicContact SD-CB 4.04Å; M1346-M1351 HydrophobicContact SD-SD 4.15Å; K1347-M1351 HydrophobicContact CB-CE 4.17Å; T1348-M1351 HydrophobicContact CG2-CE 4.29Å; T1348-M1351 WeakPolarHBondContact O-CB 3.45Å; T1348-M1351 PolarHBondContact O-N 2.84Å; T1348-M1351 WeakPolarHBondContact OG1-CE 3.48Å; A1349-M1351 VanDerWaalsContact C-N 3.28Å; A1349-M1351 PolarHBondContact O-N 3.31Å
1352	A	54.9	Low	49.4	Very low	34 Å²	34	123.7 Å²	123.7	28%	0.281	67%	0.67	S	S	.	*	H	α-helix	trans	-71.9	-34.6	-178.3	0	0	0	0	0	112.9	A1343 T1348 A1349 D1350	A1343-A1352 HydrophobicContact CB-CB 4.2Å; T1348-A1352 PolarHBondContact O-N 2.79Å; A1349-A1352 WeakPolarHBondContact O-CB 3.47Å; A1349-A1352 PolarHBondContact O-N 3.48Å; D1350-A1352 VanDerWaalsContact C-N 3.31Å; D1350-A1352 PolarHBondContact O-N 2.9Å
1353	I	54.2	Low	48.7	Very low	141 Å²	141	127.9 Å²	127.9	72%	0.723	69%	0.685	S	S	*	*	H	α-helix	trans	-71.3	-34.6	-179.6	-64.8	172.6	0	0	0	111.4	A1349 Y1355	A1349-I1353 PolarHBondContact O-N 3.48Å; I1353-Y1355 PolarHBondContact O-N 3.45Å
1354	Q	52.9	Low	48.1	Very low	161 Å²	161	133.2 Å²	133.2	75%	0.752	70%	0.698	S	S	*	*	H	α-helix	trans	-73.2	-23.5	-174	-136.5	-179.8	16.6	0	0	114.3
1355	Y	52.8	Low	47.5	Very low	168 Å²	168	130.7 Å²	130.7	66%	0.659	69%	0.691	S	S	*	*	H	α-helix	trans	-112.5	-4.7	-169.6	-81.3	-85.9	0	0	0	115.5	M1346 I1353 R1357	M1346-Y1355 HydrophobicContact CE-CD2 3.44Å; M1346-Y1355 VanDerWaalsContact CE-CD2 3.44Å; M1346-Y1355 HydrophobicContact CE-CE2 4.13Å; M1346-Y1355 HydrophobicContact CE-CG 3.84Å; I1353-Y1355 PolarHBondContact O-N 3.45Å; Y1355-R1357 PolarHBondContact O-N 3.45Å; Y1355-R1357 VanDerWaalsContact O-N 3.13Å
1356	G	42.4	Very low	46.6	Very low	40 Å²	40	128.7 Å²	128.7	41%	0.412	69%	0.689	S	S	.	*			trans	-75.9	95.4	176.3	0	0	0	0	0	112.4	T1358	G1356-T1358 PolarHBondContact O-N 2.83Å; G1356-T1358 VanDerWaalsContact O-N 3.15Å
1357	R	45.6	Very low	45.3	Very low	253 Å²	253	132.8 Å²	132.8	96%	0.955	71%	0.707	S	S	*	*			trans	-67.9	107.2	174.3	-80.7	-175.8	176	176.8	-1.1	111.3	Y1355	Y1355-R1357 PolarHBondContact O-N 3.45Å; Y1355-R1357 VanDerWaalsContact O-N 3.13Å
1358	T	40.4	Very low	43.9	Very low	142 Å²	142	134.4 Å²	134.4	87%	0.871	71%	0.708	S	S	*	*			trans	-80	127.6	169.6	50.5	0	0	0	0	110.7	G1356	G1356-T1358 PolarHBondContact O-N 2.83Å; G1356-T1358 VanDerWaalsContact O-N 3.15Å
1359	G	43.7	Very low	42.5	Very low	75 Å²	75	141 Å²	141	77%	0.773	72%	0.724	S	S	*	*			trans	-151.1	132.4	172.5	0	0	0	0	0	111.5
1360	Q	39.3	Very low	41.4	Very low	192 Å²	192	148.9 Å²	148.9	90%	0.897	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-63.4	141.3	-173.2	-75.6	174.6	-35.1	0	0	112.8
1361	P	39.5	Very low	40.6	Very low	109 Å²	109	149.7 Å²	149.7	71%	0.708	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-77.2	129.1	174.9	28.6	-30	0	0	0	112.1
1362	E	34.9	Very low	40	Very low	179 Å²	179	153.6 Å²	153.6	84%	0.836	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-77.9	135.5	171.2	-84.9	179.3	145.2	0	0	111.7
1363	V	35.6	Very low	39.1	Very low	144 Å²	144	160.2 Å²	160.2	87%	0.873	80%	0.804	S	S	*	*			trans	-95.2	111.9	172.6	179.8	0	0	0	0	107.9
1364	Q	33.8	Very low	38.2	Very low	180 Å²	180	161.4 Å²	161.4	84%	0.841	81%	0.809	S	S	*	*			trans	-127.6	97.7	167.5	-78.4	-169.3	-1.1	0	0	109.4
1365	G	36.8	Very low	37.3	Very low	68 Å²	68	161.4 Å²	161.4	70%	0.701	81%	0.812	S	S	*	*			trans	-131.7	110.1	166.1	0	0	0	0	0	108.6
1366	K	33.9	Very low	36.3	Very low	194 Å²	194	160.9 Å²	160.9	84%	0.843	82%	0.823	S	S	*	*			trans	-78.8	119.8	172.1	-88.7	179.6	173.4	178	0	108.8
1367	E	27.5	Very low	35.9	Very low	151 Å²	151	169.6 Å²	169.6	71%	0.706	85%	0.852	S	S	*	*			trans	-65.5	132.8	165.9	-64.4	174.9	169.2	0	0	110	W1369	E1367-W1369 PolarHBondContact OE2-NE1 3.48Å
1368	W	31.5	Very low	35.1	Very low	234 Å²	234	163.2 Å²	163.2	89%	0.886	84%	0.844	S	S	*	*			trans	-115.1	119.5	157.2	-71	89.2	0	0	0	106.9
1369	W	29.2	Very low	34.7	Very low	214 Å²	214	164.9 Å²	164.9	81%	0.811	84%	0.842	S	S	*	*			trans	-78.8	127	175.4	-64.4	80.6	0	0	0	109	E1367	E1367-W1369 PolarHBondContact OE2-NE1 3.48Å
1370	I	30.3	Very low	33.9	Very low	239 Å²	239	173.1 Å²	173.1	100%	1.226	85%	0.848	S	S	*	*			trans	-113.6	0	149.8	-69.2	177.7	0	0	0	106.1

Retrieved 1,370 of 1,370 residues in 3202.7 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).