A0A087YKM9_POEFO Loading...

ZP domain-containing protein

AlphaFold DB , UniProt , Accession A0A087YKM9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 817 aa.

						>A0A087YKM9_POEFO|A0A087YKM9
MLCFKLCLIGFSMLTAGSHQAFTSSAEMNISSCPITYYGQKYEKVYVGFEADRFAVCFKGLYQPGIQNDCILMSGGTADRGGLSVLSREIPTGSGVHKLLPNLKYAGKCVNVIPLTDSQQSQVEQVELGNFGAQSILAIKTYSGYTDVNVQVADAQVNGLTVSKQTFQTSETNSGVITDVSGCRFSGLAYETNTTVNDPRICCTVTCDVSGAATAVSHCGPMEHCQGDGSCAMNAVCSVTGSTVIGFTSRPQSVPDRCGYSLLRSSSLPGLHVLGIFKERRRKDLSFLDRVVLQLDREGAQISLEQGSKVKVNDDFLTVHATPQMVHSVALTKSHAGVTAKLEASNYTVSVVFDGQTAIIHLTGSSEAPVQGLCGDSSSAVNEQKSSEYSDTDLLLKSCEMQYDDDADSTSSCNTTAKRTAGQRCNLLQEGSFTACNSYVDPEPFVQACTQTLCKYPAVDDLTCHFLKGYAEVCKYKSNVTVQDWRSHTSCAVPQATCQDMFCGSHEFCAVDSSSGEARCHCRALFASKYKPTNSFGEPIVCADKGATVTLANCLLEDKGIDYSVLHLNDQSCRGQLDNLTHMVTFSFSSQNTCGTVVQANNSQIIYKNAIMTQNISMFGLITRHDKVHMDFSCYYSQPDVKTLSVRFRQSSVIQHISSGEWKYNLTMEAYTSRDRTKPIDSDADIDLNQRLWVELKTYGLEEDRVAVVTDSCWATDRPSPAGGLRYNLIINGCPNPKDPTVAVEGNGLGTSTVFSFNTFQFTGSSGNVFLHCKVELCVRQGDNCIQRCAQTARGRRSARPKYETVNLAFISVAWTY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31	Very low	32.3	Very low	238 Å²	238	149.4 Å²	149.4	100%	1.172	79%	0.787	S	S	*	*				0	81.6	0	-162	164.5	98.8	0	0	110.4
2	L	26	Very low	32.8	Very low	173 Å²	173	146 Å²	146	91%	0.906	79%	0.785	S	S	*	*			trans	-176.4	-13.3	160.6	-128.6	83.9	0	0	0	114.6	F4	L2-F4 PolarHBondContact O-N 2.76Å
3	C	25.1	Very low	32.8	Very low	131 Å²	131	149 Å²	149	89%	0.885	79%	0.794	S	S	*	*	G	3₁₀ helix	trans	-76.9	-11.2	-174.4	-83.3	0	0	0	0	117.2	K5	C3-K5 PolarHBondContact O-N 2.84Å
4	F	34.8	Very low	33	Very low	133 Å²	133	150.2 Å²	150.2	58%	0.583	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-81	-10.3	-172	-95.9	-85.5	0	0	0	115.5	L2 L6 S174	L2-F4 PolarHBondContact O-N 2.76Å; F4-L6 PolarHBondContact O-N 3.1Å; F4-S174 WeakPolarHBondContact CD1-O 3.31Å; F4-S174 WeakPolarHBondContact CE1-O 3.2Å
5	K	29.7	Very low	33.4	Very low	204 Å²	204	147.3 Å²	147.3	89%	0.887	79%	0.79	S	S	*	*	G	3₁₀ helix	trans	-90	12.1	-166.6	-89	-171.3	171.7	-176.5	0	117.2	C3	C3-K5 PolarHBondContact O-N 2.84Å
6	L	32.5	Very low	33.9	Very low	156 Å²	156	145 Å²	145	82%	0.817	80%	0.798	S	S	*	*	S	Bend	trans	-140	20.7	-163.6	-114.9	160.8	0	0	0	118.1	F4	F4-L6 PolarHBondContact O-N 3.1Å
7	C	36.4	Very low	35	Very low	85 Å²	85	139 Å²	139	57%	0.574	78%	0.777	S	S	*	*	S	Bend	trans	-112.3	0.9	-174.3	-99.9	0	0	0	0	118.8
8	L	38.8	Very low	36.5	Very low	80 Å²	80	134.5 Å²	134.5	42%	0.419	76%	0.756	S	S	.	*	S	Bend	trans	-135.1	-7.2	179.4	-73.9	172.9	0	0	0	117.4	R88	L8-R88 PolarHBondContact O-NH1 3.19Å; L8-R88 PolarHBondContact O-NH2 2.04Å
9	I	38.8	Very low	38.5	Very low	173 Å²	173	133.9 Å²	133.9	89%	0.887	75%	0.746	S	S	*	*			trans	-100.9	114.8	177.9	-54.7	177.4	0	0	0	109.8
10	G	30.8	Very low	40.7	Very low	57 Å²	57	130 Å²	130	59%	0.588	72%	0.722	S	S	*	*			trans	132	78.7	171.3	0	0	0	0	0	115.2
11	F	31.3	Very low	42.9	Very low	213 Å²	213	127.6 Å²	127.6	93%	0.934	72%	0.719	S	S	*	*				-177.6	131.8	116.1	-110.5	-80.3	0	0	0	109.6	M13	F11-M13 PolarHBondContact O-N 3.48Å
12	S	38.7	Very low	45.6	Very low	109 Å²	109	116.7 Å²	116.7	76%	0.762	67%	0.665	S	S	*	*			trans	-90.2	96.5	-173.6	52.7	0	0	0	0	112.2
13	M	32.8	Very low	48.4	Very low	185 Å²	185	113 Å²	113	91%	0.911	65%	0.65	S	S	*	*			trans	-147.8	91.8	143.7	-77.7	-148.8	-175.2	0	0	108.7	F11 T15	F11-M13 PolarHBondContact O-N 3.48Å; M13-T15 PolarHBondContact O-N 3.43Å
14	L	35.4	Very low	51.2	Low	166 Å²	166	110.3 Å²	110.3	87%	0.869	63%	0.632	S	S	*	*			trans	-80.8	100.2	173	-78.7	162.5	0	0	0	109.3
15	T	39.6	Very low	53.7	Low	106 Å²	106	107 Å²	107	65%	0.65	63%	0.626	S	S	*	*			trans	-72.8	139.7	157.9	49.4	0	0	0	0	109.1	M13 G17	M13-T15 PolarHBondContact O-N 3.43Å; T15-G17 PolarHBondContact O-N 2.69Å; T15-G17 VanDerWaalsContact O-N 3.1Å
16	A	40.7	Very low	56.6	Low	111 Å²	111	98.6 Å²	98.6	92%	0.917	59%	0.594	S	S	*	*			trans	-53.5	113.1	-170	0	0	0	0	0	113.5
17	G	52.1	Low	59.5	Low	43 Å²	43	95.8 Å²	95.8	44%	0.443	58%	0.577	S	S	.	*			trans	-85.1	142.2	169.3	0	0	0	0	0	111.1	T15 H19	T15-G17 PolarHBondContact O-N 2.69Å; T15-G17 VanDerWaalsContact O-N 3.1Å; G17-H19 PolarHBondContact O-N 3.29Å
18	S	62.5	Low	62.1	Low	58 Å²	58	92 Å²	92	41%	0.406	55%	0.551	S	S	.	*			trans	-73.6	121.8	171.9	53.9	0	0	0	0	110.2	V85	S18-V85 PolarHBondContact O-N 2.57Å
19	H	75.4	Confident	64.7	Low	123 Å²	123	92 Å²	92	57%	0.569	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.3	125.8	175	-174.9	-81.4	0	0	0	110.9	G17 L83 S84	G17-H19 PolarHBondContact O-N 3.29Å; H19-L83 WeakPolarHBondContact CA-O 3.03Å; H19-S84 PolarHBondContact CD2-OG 3.07Å
20	Q	82.4	Confident	67.3	Low	56 Å²	56	83.8 Å²	83.8	26%	0.262	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	124	175.4	-70	161.6	89.7	0	0	108.6	M28 N29 G82 L83	Q20-M28 HydrophobicContact CB-CE 4.15Å; Q20-M28 HydrophobicContact CB-SD 3.45Å; Q20-M28 WeakPolarHBondContact CB-SD 3.44Å; Q20-M28 HydrophobicContact CG-SD 4.21Å; Q20-N29 PolarHBondContact NE2-O 3.42Å; Q20-G82 CarbonylContact O-C 3.43Å; Q20-G82 WeakPolarHBondContact O-CA 3.41Å; Q20-L83 PolarHBondContact N-O 2.96Å; Q20-L83 PolarHBondContact O-N 3.35Å
21	A	85.8	Confident	70.3	Confident	79 Å²	79	84 Å²	84	65%	0.653	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	149.1	178.8	0	0	0	0	0	111.2
22	F	88.6	Confident	73.2	Confident	10 Å²	10	77.3 Å²	77.3	4%	0.044	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	144.8	178.4	63.8	-82	0	0	0	113.1	A26 M28 V47 F49 F54 R80 G81 I113 L115	F22-A26 HydrophobicContact CB-CB 4.23Å; F22-M28 HydrophobicContact CB-CE 3.65Å; F22-M28 HydrophobicContact CD1-CE 3.4Å; F22-M28 VanDerWaalsContact CD1-CE 3.4Å; F22-M28 HydrophobicContact CE1-CE 4.29Å; F22-M28 HydrophobicContact CG-CE 3.78Å; F22-V47 HydrophobicContact CD1-CG2 3.91Å; F22-V47 HydrophobicContact CD2-CB 4.46Å; F22-V47 HydrophobicContact CD2-CG2 3.73Å; F22-V47 HydrophobicContact CE1-CB 4.44Å; F22-V47 HydrophobicContact CE1-CG2 3.87Å; F22-V47 HydrophobicContact CE2-CB 4Å; F22-V47 HydrophobicContact CE2-CG2 3.72Å; F22-V47 HydrophobicContact CG-CG2 3.84Å; F22-V47 HydrophobicContact CZ-CB 3.97Å; F22-V47 HydrophobicContact CZ-CG1 4.4Å; F22-V47 HydrophobicContact CZ-CG2 3.79Å; F22-F49 AromaticContact CD2-CE2 3.7Å; F22-F49 HydrophobicContact CD2-CE2 3.7Å; F22-F49 HydrophobicContact CD2-CZ 4.32Å; F22-F49 HydrophobicContact CE2-CD2 4.43Å; F22-F49 AromaticContact CE2-CE2 3.45Å; F22-F49 HydrophobicContact CE2-CE2 3.45Å; F22-F49 VanDerWaalsContact CE2-CE2 3.45Å; F22-F49 AromaticContact CE2-CZ 3.63Å; F22-F49 HydrophobicContact CE2-CZ 3.63Å; F22-F49 HydrophobicContact CZ-CZ 4.45Å; F22-F54 AromaticContact CE2-CE2 3.73Å; F22-F54 HydrophobicContact CE2-CE2 3.73Å; F22-F54 HydrophobicContact CE2-CZ 4.43Å; F22-F54 AromaticContact CZ-CE2 3.81Å; F22-F54 HydrophobicContact CZ-CE2 3.81Å; F22-F54 HydrophobicContact CZ-CZ 4.06Å; F22-R80 WeakPolarHBondContact O-CA 3.37Å; F22-G81 WeakPolarHBondContact CD1-O 3.37Å; F22-G81 PolarHBondContact N-O 3.39Å; F22-G81 PolarHBondContact O-N 3.43Å; F22-I113 HydrophobicContact CE1-CG2 4.34Å; F22-I113 HydrophobicContact CZ-CG2 4.18Å; F22-L115 HydrophobicContact CE2-CD2 4.48Å; F22-L115 HydrophobicContact CZ-CD2 3.96Å
23	T	84.3	Confident	75.9	Confident	95 Å²	95	72.1 Å²	72.1	58%	0.583	45%	0.445	S	S	*	.	S	Bend	trans	-127.7	12.7	174.1	59.9	0	0	0	0	111.5	R80	T23-R80 HydrophobicContact CG2-CB 3.92Å
24	S	83.8	Confident	78.9	Confident	74 Å²	74	64.4 Å²	64.4	52%	0.517	41%	0.408	S	S	.	.	S	Bend	trans	-160.9	173.4	-177.1	63.7	0	0	0	0	108.5	A26	S24-A26 PolarHBondContact O-N 3.45Å
25	S	87.1	Confident	81.8	Confident	65 Å²	65	56.5 Å²	56.5	46%	0.455	37%	0.367	S	S	.	.			trans	-56	132.2	175.1	-55.3	0	0	0	0	112.6	V47	S25-V47 CarbonylContact C-O 3.59Å; S25-V47 WeakPolarHBondContact CA-O 3.01Å
26	A	89.8	Confident	84.3	Confident	26 Å²	26	52.4 Å²	52.4	22%	0.215	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	145.5	-172.5	0	0	0	0	0	113.1	F22 S24 M28 Y46 V47	F22-A26 HydrophobicContact CB-CB 4.23Å; S24-A26 PolarHBondContact O-N 3.45Å; A26-M28 HydrophobicContact CB-CE 3.83Å; A26-Y46 WeakPolarHBondContact O-CA 3.03Å; A26-V47 HydrophobicContact CB-CG2 4.17Å; A26-V47 PolarHBondContact N-O 3.49Å; A26-V47 PolarHBondContact O-N 3.4Å
27	E	93.5	Very high	86.7	Confident	98 Å²	98	47.1 Å²	47.1	46%	0.458	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	134.3	164.6	-176.3	179.4	117.7	0	0	109.4	K44 Y46	E27-K44 HydrophobicContact CG-CD 4.3Å; E27-K44 WeakPolarHBondContact OE1-CD 3.41Å; E27-K44 WeakPolarHBondContact OE1-CE 3.25Å; E27-K44 IonicContact OE1-NZ 3.48Å; E27-K44 PolarHBondContact OE1-NZ 2.94Å; E27-K44 IonicContact OE2-NZ 3.35Å; E27-Y46 HydrophobicContact CB-CD1 3.95Å; E27-Y46 HydrophobicContact CB-CE1 3.66Å; E27-Y46 HydrophobicContact CG-CD1 4.12Å; E27-Y46 HydrophobicContact CG-CE1 3.51Å; E27-Y46 WeakPolarHBondContact OE2-CE1 3.4Å; E27-Y46 VanDerWaalsContact OE2-CZ 3.27Å; E27-Y46 PolarHBondContact OE2-OH 3.19Å
28	M	92.3	Very high	88.6	Confident	5 Å²	5	45.5 Å²	45.5	3%	0.025	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	130.3	-173.6	-70.7	-72	172.3	0	0	110.6	Q20 F22 A26 K44 V45 V47 L83	Q20-M28 HydrophobicContact CB-CE 4.15Å; Q20-M28 HydrophobicContact CB-SD 3.45Å; Q20-M28 WeakPolarHBondContact CB-SD 3.44Å; Q20-M28 HydrophobicContact CG-SD 4.21Å; F22-M28 HydrophobicContact CB-CE 3.65Å; F22-M28 HydrophobicContact CD1-CE 3.4Å; F22-M28 VanDerWaalsContact CD1-CE 3.4Å; F22-M28 HydrophobicContact CE1-CE 4.29Å; F22-M28 HydrophobicContact CG-CE 3.78Å; A26-M28 HydrophobicContact CB-CE 3.83Å; M28-K44 WeakPolarHBondContact O-CA 3.37Å; M28-V45 HydrophobicContact CB-CG2 3.8Å; M28-V45 WeakPolarHBondContact CB-O 3.42Å; M28-V45 PolarHBondContact N-O 3.33Å; M28-V45 PolarHBondContact O-N 3.15Å; M28-V47 HydrophobicContact CE-CG2 3.94Å; M28-V47 HydrophobicContact CG-CG1 4.39Å; M28-V47 HydrophobicContact CG-CG2 3.76Å; M28-L83 HydrophobicContact CB-CD2 3.73Å; M28-L83 HydrophobicContact CG-CD2 4.34Å; M28-L83 HydrophobicContact SD-CB 4.14Å; M28-L83 HydrophobicContact SD-CD2 4.3Å
29	N	92.6	Very high	89.8	Confident	80 Å²	80	44.8 Å²	44.8	43%	0.428	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	124	179.5	-172.7	-1.2	0	0	0	111.5	Q20 S31 E43	Q20-N29 PolarHBondContact NE2-O 3.42Å; N29-S31 WeakPolarHBondContact OD1-CB 3.21Å; N29-S31 PolarHBondContact OD1-N 2.77Å; N29-S31 PolarHBondContact OD1-OG 3.35Å; N29-S31 VanDerWaalsContact OD1-OG 3.12Å; N29-E43 PolarHBondContact OD1-O 2.89Å
30	I	94.4	Very high	90.4	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	27%	0.271	C	S	.	.			trans	-122.6	20.1	173.5	64.2	156.9	0	0	0	112.2	S32 C33 P34 I35 E43 V45 L83 N111	I30-S32 PolarHBondContact O-N 3.2Å; I30-S32 VanDerWaalsContact O-N 3.17Å; I30-C33 CarbonylContact O-C 3.38Å; I30-C33 WeakPolarHBondContact O-CA 3.22Å; I30-C33 PolarHBondContact O-N 3.17Å; I30-C33 VanDerWaalsContact O-O 3.08Å; I30-P34 VanDerWaalsContact O-N 3.17Å; I30-I35 HydrophobicContact CD1-CB 4.2Å; I30-I35 HydrophobicContact CD1-CG1 3.88Å; I30-E43 CarbonylContact C-O 3.58Å; I30-E43 WeakPolarHBondContact CG1-O 3.46Å; I30-E43 PolarHBondContact N-O 2.86Å; I30-E43 VanDerWaalsContact N-O 3.07Å; I30-V45 HydrophobicContact CD1-CG1 3.76Å; I30-V45 HydrophobicContact CG1-CG1 4.29Å; I30-V45 HydrophobicContact CG2-CG2 4.03Å; I30-L83 HydrophobicContact CG2-CD1 4.36Å; I30-L83 HydrophobicContact CG2-CD2 3.72Å; I30-N111 WeakPolarHBondContact CB-OD1 3.44Å; I30-N111 HydrophobicContact CG2-CB 4.4Å; I30-N111 VanDerWaalsContact CG2-OD1 3.3Å; I30-N111 WeakPolarHBondContact CG2-OD1 3.38Å
31	S	94	Very high	90.9	Very high	60 Å²	60	45.9 Å²	45.9	42%	0.42	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-22.8	-172.3	70.8	0	0	0	0	114.6	N29 C33 E43	N29-S31 WeakPolarHBondContact OD1-CB 3.21Å; N29-S31 PolarHBondContact OD1-N 2.77Å; N29-S31 PolarHBondContact OD1-OG 3.35Å; N29-S31 VanDerWaalsContact OD1-OG 3.12Å; S31-C33 VanDerWaalsContact C-N 3.29Å; S31-E43 PolarHBondContact N-O 2.9Å
32	S	92.4	Very high	91.3	Very high	73 Å²	73	43.3 Å²	43.3	51%	0.51	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-13.9	170.1	52.3	0	0	0	0	113.6	I30 V85	I30-S32 PolarHBondContact O-N 3.2Å; I30-S32 VanDerWaalsContact O-N 3.17Å; S32-V85 WeakPolarHBondContact OG-CG1 3.24Å
33	C	94.6	Very high	91.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	-142.5	71.3	170.1	-168.7	0	0	0	0	111.8	I30 S31 V85 C109 N111	I30-C33 CarbonylContact O-C 3.38Å; I30-C33 WeakPolarHBondContact O-CA 3.22Å; I30-C33 PolarHBondContact O-N 3.17Å; I30-C33 VanDerWaalsContact O-O 3.08Å; S31-C33 VanDerWaalsContact C-N 3.29Å; C33-V85 HydrophobicContact CB-CG1 3.43Å; C33-V85 VanDerWaalsContact CB-CG1 3.43Å; C33-C109 WeakPolarHBondContact CA-SG 3.36Å; C33-C109 HydrophobicContact CB-CB 3.65Å; C33-C109 WeakPolarHBondContact CB-SG 3.29Å; C33-C109 WeakPolarHBondContact SG-CB 3.33Å; C33-C109 PolarHBondContact SG-O 2.89Å; C33-C109 CovalentContact SG-SG 2.03Å; C33-C109 PolarHBondContact SG-SG 2.87Å; C33-N111 PolarHBondContact O-ND2 2.83Å
34	P	95.6	Very high	92.1	Very high	23 Å²	23	47.1 Å²	47.1	15%	0.149	27%	0.268	C	S	.	.			trans	-69.9	150.1	-175	31.3	-36.3	0	0	0	111.3	I30 K41 Y42 E43 N130	I30-P34 VanDerWaalsContact O-N 3.17Å; P34-K41 VanDerWaalsContact CB-CE 3.44Å; P34-K41 HydrophobicContact CB-CG 4.3Å; P34-K41 VanDerWaalsContact CG-CE 3.43Å; P34-Y42 CarbonylContact C-O 3.55Å; P34-Y42 WeakPolarHBondContact CA-O 3.08Å; P34-Y42 VanDerWaalsContact CB-O 3.27Å; P34-Y42 WeakPolarHBondContact CB-O 3.04Å; P34-E43 HydrophobicContact CB-CG 4.05Å; P34-N130 WeakPolarHBondContact O-CB 3.32Å; P34-N130 PolarHBondContact O-ND2 3.1Å
35	I	95.3	Very high	92.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	133	-173	-64	-63.2	0	0	0	110.3	I30 K41 Y42 F58 N111 L128 N130	I30-I35 HydrophobicContact CD1-CB 4.2Å; I30-I35 HydrophobicContact CD1-CG1 3.88Å; I35-K41 WeakPolarHBondContact O-CA 3.41Å; I35-Y42 PolarHBondContact N-O 3.04Å; I35-Y42 PolarHBondContact O-N 3.13Å; I35-F58 HydrophobicContact CG2-CE1 4.4Å; I35-N111 WeakPolarHBondContact CG1-ND2 3.32Å; I35-L128 HydrophobicContact CD1-CB 3.78Å; I35-L128 WeakPolarHBondContact CD1-O 3.29Å; I35-L128 HydrophobicContact CG1-CB 3.83Å; I35-L128 HydrophobicContact CG1-CD1 4.49Å; I35-N130 HydrophobicContact CD1-CB 4.29Å
36	T	92.4	Very high	93.1	Very high	21 Å²	21	42.5 Å²	42.5	13%	0.129	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	106.4	169.5	-53.4	0	0	0	0	108.3	Q40 A133 S135	T36-Q40 CarbonylContact C-O 3.54Å; T36-Q40 WeakPolarHBondContact CA-O 3.28Å; T36-A133 WeakPolarHBondContact CB-O 3.3Å; T36-A133 PolarHBondContact OG1-O 2.77Å; T36-S135 PolarHBondContact N-OG 2.89Å; T36-S135 VanDerWaalsContact O-CB 3.29Å; T36-S135 WeakPolarHBondContact O-CB 3.4Å
37	Y	92.4	Very high	93.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	116.2	177.9	-177.2	-93.7	0	0	0	108.7	G39 Q40 Y42 F58 D69 C70 I71 A155 Q156 V157 V180	Y37-G39 PolarHBondContact O-N 2.87Å; Y37-Q40 PolarHBondContact N-O 2.89Å; Y37-Q40 PolarHBondContact O-N 3.25Å; Y37-Y42 HydrophobicContact CD1-CE2 4.48Å; Y37-F58 AromaticContact CD1-CD2 3.79Å; Y37-F58 HydrophobicContact CD1-CD2 3.79Å; Y37-F58 AromaticContact CD1-CE2 3.84Å; Y37-F58 HydrophobicContact CD1-CE2 3.84Å; Y37-F58 HydrophobicContact CD2-CD2 4.3Å; Y37-F58 AromaticContact CD2-CE2 3.5Å; Y37-F58 HydrophobicContact CD2-CE2 3.5Å; Y37-F58 AromaticContact CD2-CZ 3.88Å; Y37-F58 HydrophobicContact CD2-CZ 3.88Å; Y37-F58 HydrophobicContact CE1-CD2 4.11Å; Y37-F58 HydrophobicContact CE1-CE2 4.12Å; Y37-F58 AromaticContact CE2-CE2 3.8Å; Y37-F58 HydrophobicContact CE2-CE2 3.8Å; Y37-F58 HydrophobicContact CE2-CZ 4.5Å; Y37-F58 AromaticContact CG-CD2 3.88Å; Y37-F58 HydrophobicContact CG-CD2 3.88Å; Y37-F58 AromaticContact CG-CE2 3.51Å; Y37-F58 HydrophobicContact CG-CE2 3.51Å; Y37-F58 AromaticContact CG-CZ 3.98Å; Y37-F58 HydrophobicContact CG-CZ 3.98Å; Y37-D69 HydrophobicContact CD1-CB 4.03Å; Y37-D69 HydrophobicContact CE1-CB 3.84Å; Y37-C70 PolarHBondContact OH-O 2.88Å; Y37-I71 HydrophobicContact CE2-CD1 4.23Å; Y37-I71 HydrophobicContact CE2-CG1 3.96Å; Y37-A155 WeakPolarHBondContact OH-CB 3.12Å; Y37-Q156 VanDerWaalsContact CE1-O 3.24Å; Y37-Q156 WeakPolarHBondContact CE1-O 3.48Å; Y37-Q156 PolarHBondContact OH-N 2.67Å; Y37-Q156 PolarHBondContact OH-O 3.43Å; Y37-V157 HydrophobicContact CE1-CG2 3.88Å; Y37-V180 CarbonylContact C-O 3.44Å; Y37-V180 WeakPolarHBondContact CA-O 3.08Å; Y37-V180 HydrophobicContact CD2-CB 3.96Å; Y37-V180 HydrophobicContact CD2-CG2 4.07Å; Y37-V180 HydrophobicContact CE2-CB 4.24Å
38	Y	91.1	Very high	93.1	Very high	9 Å²	9	37.1 Å²	37.1	4%	0.035	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	41.5	61.6	-176.6	-70.1	-95.1	0	0	0	112.9	Q40 A155 V157 V162 S163 V180 G182 T192	Y38-Q40 PolarHBondContact O-N 2.9Å; Y38-Q40 VanDerWaalsContact O-N 3.15Å; Y38-A155 HydrophobicContact CE2-CB 4.25Å; Y38-V157 HydrophobicContact CD1-CG2 4.14Å; Y38-V157 HydrophobicContact CD2-CG2 3.73Å; Y38-V157 HydrophobicContact CE2-CG2 4.45Å; Y38-V157 HydrophobicContact CG-CG2 3.55Å; Y38-V162 HydrophobicContact CD1-CG2 4.26Å; Y38-V162 HydrophobicContact CD2-CG2 4.5Å; Y38-V162 HydrophobicContact CE1-CB 4.22Å; Y38-V162 HydrophobicContact CE1-CG2 3.65Å; Y38-V162 HydrophobicContact CE2-CG2 3.94Å; Y38-V162 VanDerWaalsContact CZ-CG2 3.47Å; Y38-S163 WeakPolarHBondContact OH-CB 3.24Å; Y38-V180 WeakPolarHBondContact CD2-O 3.22Å; Y38-V180 HydrophobicContact CE2-CB 4.3Å; Y38-V180 PolarHBondContact N-O 2.63Å; Y38-G182 VanDerWaalsContact CE1-O 3.3Å; Y38-G182 WeakPolarHBondContact CE1-O 3.38Å; Y38-T192 VanDerWaalsContact C-CG2 3.46Å; Y38-T192 HydrophobicContact CD1-CG2 4.31Å
39	G	86.9	Confident	92.9	Very high	42 Å²	42	39.1 Å²	39.1	43%	0.433	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	-15.3	179.7	0	0	0	0	0	116.7	Y37 S181 T192	Y37-G39 PolarHBondContact O-N 2.87Å; G39-S181 PolarHBondContact N-O 2.82Å; G39-T192 VanDerWaalsContact CA-OG1 3.26Å; G39-T192 WeakPolarHBondContact CA-OG1 3.49Å
40	Q	88.7	Confident	92.1	Very high	79 Å²	79	39.5 Å²	39.5	37%	0.369	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	134.1	-178.5	-61.6	-167.1	33.8	0	0	111.4	T36 Y37 Y38 Y42	T36-Q40 CarbonylContact C-O 3.54Å; T36-Q40 WeakPolarHBondContact CA-O 3.28Å; Y37-Q40 PolarHBondContact N-O 2.89Å; Y37-Q40 PolarHBondContact O-N 3.25Å; Y38-Q40 PolarHBondContact O-N 2.9Å; Y38-Q40 VanDerWaalsContact O-N 3.15Å; Q40-Y42 HydrophobicContact CB-CE1 4.44Å; Q40-Y42 HydrophobicContact CB-CE2 3.6Å; Q40-Y42 WeakPolarHBondContact CB-OH 3.45Å; Q40-Y42 VanDerWaalsContact CD-OH 3.27Å; Q40-Y42 WeakPolarHBondContact O-CD2 3.47Å; Q40-Y42 PolarHBondContact OE1-OH 3.18Å
41	K	92.3	Very high	91.1	Very high	123 Å²	123	44.8 Å²	44.8	54%	0.535	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126	178.3	-173.9	-164.7	175.4	-148.8	0	110.4	P34 I35 E43	P34-K41 VanDerWaalsContact CB-CE 3.44Å; P34-K41 HydrophobicContact CB-CG 4.3Å; P34-K41 VanDerWaalsContact CG-CE 3.43Å; I35-K41 WeakPolarHBondContact O-CA 3.41Å; K41-E43 IonicContact NZ-OE1 2.69Å; K41-E43 PolarHBondContact NZ-OE1 2.83Å
42	Y	95.1	Very high	90.1	Very high	25 Å²	25	45.7 Å²	45.7	10%	0.098	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	140.8	178.5	-60.7	-72.9	0	0	0	112.4	P34 I35 Y37 Q40 F58 K59 D69	P34-Y42 CarbonylContact C-O 3.55Å; P34-Y42 WeakPolarHBondContact CA-O 3.08Å; P34-Y42 VanDerWaalsContact CB-O 3.27Å; P34-Y42 WeakPolarHBondContact CB-O 3.04Å; I35-Y42 PolarHBondContact N-O 3.04Å; I35-Y42 PolarHBondContact O-N 3.13Å; Y37-Y42 HydrophobicContact CD1-CE2 4.48Å; Q40-Y42 HydrophobicContact CB-CE1 4.44Å; Q40-Y42 HydrophobicContact CB-CE2 3.6Å; Q40-Y42 WeakPolarHBondContact CB-OH 3.45Å; Q40-Y42 VanDerWaalsContact CD-OH 3.27Å; Q40-Y42 WeakPolarHBondContact O-CD2 3.47Å; Q40-Y42 PolarHBondContact OE1-OH 3.18Å; Y42-F58 HydrophobicContact CD1-CB 3.77Å; Y42-F58 HydrophobicContact CD2-CB 3.65Å; Y42-F58 AromaticContact CD2-CD1 3.56Å; Y42-F58 HydrophobicContact CD2-CD1 3.56Å; Y42-F58 HydrophobicContact CD2-CE1 4.36Å; Y42-F58 AromaticContact CD2-CG 3.69Å; Y42-F58 HydrophobicContact CD2-CG 3.69Å; Y42-F58 HydrophobicContact CE1-CB 3.89Å; Y42-F58 HydrophobicContact CE2-CB 3.73Å; Y42-F58 HydrophobicContact CE2-CD1 4.36Å; Y42-F58 HydrophobicContact CE2-CG 4.03Å; Y42-F58 HydrophobicContact CG-CB 3.66Å; Y42-F58 AromaticContact CG-CD1 3.69Å; Y42-F58 HydrophobicContact CG-CD1 3.69Å; Y42-F58 AromaticContact CG-CG 3.99Å; Y42-F58 HydrophobicContact CG-CG 3.99Å; Y42-K59 HydrophobicContact CE1-CG 4.32Å; Y42-K59 WeakPolarHBondContact OH-CE 3.39Å; Y42-D69 PolarHBondContact OH-OD2 2.84Å
43	E	95.7	Very high	89.6	Confident	93 Å²	93	47.5 Å²	47.5	44%	0.435	25%	0.249	S	C	.	.	S	Bend	trans	-115	3.8	179.3	-49.2	-159.3	154	0	0	112.1	N29 I30 S31 P34 K41	N29-E43 PolarHBondContact OD1-O 2.89Å; I30-E43 CarbonylContact C-O 3.58Å; I30-E43 WeakPolarHBondContact CG1-O 3.46Å; I30-E43 PolarHBondContact N-O 2.86Å; I30-E43 VanDerWaalsContact N-O 3.07Å; S31-E43 PolarHBondContact N-O 2.9Å; P34-E43 HydrophobicContact CB-CG 4.05Å; K41-E43 IonicContact NZ-OE1 2.69Å; K41-E43 PolarHBondContact NZ-OE1 2.83Å
44	K	94.9	Very high	89.4	Confident	93 Å²	93	47.8 Å²	47.8	40%	0.404	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	155.1	175.8	-63.2	-177.1	174.2	-166.5	0	109.7	E27 M28	E27-K44 HydrophobicContact CG-CD 4.3Å; E27-K44 WeakPolarHBondContact OE1-CD 3.41Å; E27-K44 WeakPolarHBondContact OE1-CE 3.25Å; E27-K44 IonicContact OE1-NZ 3.48Å; E27-K44 PolarHBondContact OE1-NZ 2.94Å; E27-K44 IonicContact OE2-NZ 3.35Å; M28-K44 WeakPolarHBondContact O-CA 3.37Å
45	V	95.9	Very high	89.2	Confident	1 Å²	1	47 Å²	47	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	157.6	166.6	-62.1	0	0	0	0	110.4	M28 I30 V47 V56 C57 F58 L128	M28-V45 HydrophobicContact CB-CG2 3.8Å; M28-V45 WeakPolarHBondContact CB-O 3.42Å; M28-V45 PolarHBondContact N-O 3.33Å; M28-V45 PolarHBondContact O-N 3.15Å; I30-V45 HydrophobicContact CD1-CG1 3.76Å; I30-V45 HydrophobicContact CG1-CG1 4.29Å; I30-V45 HydrophobicContact CG2-CG2 4.03Å; V45-V47 HydrophobicContact CG2-CG1 4.37Å; V45-V56 HydrophobicContact CB-CG1 4.01Å; V45-V56 HydrophobicContact CG1-CG1 4.23Å; V45-V56 HydrophobicContact CG2-CG1 4.37Å; V45-C57 CarbonylContact C-O 3.49Å; V45-C57 WeakPolarHBondContact CA-O 3Å; V45-F58 HydrophobicContact CG1-CD1 3.75Å; V45-F58 HydrophobicContact CG1-CE1 3.58Å; V45-F58 HydrophobicContact CG1-CZ 4.49Å; V45-L128 HydrophobicContact CG1-CD1 4.48Å
46	Y	94.8	Very high	89.2	Confident	40 Å²	40	47 Å²	47	16%	0.157	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	108	-177.6	-68.6	-84.2	0	0	0	107.5	A26 E27 C57 G60 L61	A26-Y46 WeakPolarHBondContact O-CA 3.03Å; E27-Y46 HydrophobicContact CB-CD1 3.95Å; E27-Y46 HydrophobicContact CB-CE1 3.66Å; E27-Y46 HydrophobicContact CG-CD1 4.12Å; E27-Y46 HydrophobicContact CG-CE1 3.51Å; E27-Y46 WeakPolarHBondContact OE2-CE1 3.4Å; E27-Y46 VanDerWaalsContact OE2-CZ 3.27Å; E27-Y46 PolarHBondContact OE2-OH 3.19Å; Y46-C57 PolarHBondContact N-O 3.05Å; Y46-C57 PolarHBondContact O-N 2.56Å; Y46-G60 VanDerWaalsContact CB-C 3.49Å; Y46-G60 WeakPolarHBondContact CB-O 3.45Å; Y46-G60 VanDerWaalsContact CD2-CA 3.47Å; Y46-L61 HydrophobicContact CD1-CD2 4.11Å; Y46-L61 HydrophobicContact CD1-CG 4.37Å
47	V	93.8	Very high	89.3	Confident	3 Å²	3	46 Å²	46	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	149.7	-177.4	-63	0	0	0	0	110.3	F22 S25 A26 M28 V45 F54 A55 V56 I113	F22-V47 HydrophobicContact CD1-CG2 3.91Å; F22-V47 HydrophobicContact CD2-CB 4.46Å; F22-V47 HydrophobicContact CD2-CG2 3.73Å; F22-V47 HydrophobicContact CE1-CB 4.44Å; F22-V47 HydrophobicContact CE1-CG2 3.87Å; F22-V47 HydrophobicContact CE2-CB 4Å; F22-V47 HydrophobicContact CE2-CG2 3.72Å; F22-V47 HydrophobicContact CG-CG2 3.84Å; F22-V47 HydrophobicContact CZ-CB 3.97Å; F22-V47 HydrophobicContact CZ-CG1 4.4Å; F22-V47 HydrophobicContact CZ-CG2 3.79Å; S25-V47 CarbonylContact C-O 3.59Å; S25-V47 WeakPolarHBondContact CA-O 3.01Å; A26-V47 HydrophobicContact CB-CG2 4.17Å; A26-V47 PolarHBondContact N-O 3.49Å; A26-V47 PolarHBondContact O-N 3.4Å; M28-V47 HydrophobicContact CE-CG2 3.94Å; M28-V47 HydrophobicContact CG-CG1 4.39Å; M28-V47 HydrophobicContact CG-CG2 3.76Å; V45-V47 HydrophobicContact CG2-CG1 4.37Å; V47-F54 HydrophobicContact CB-CE2 3.99Å; V47-F54 HydrophobicContact CB-CZ 4.09Å; V47-F54 HydrophobicContact CG1-CE2 4.47Å; V47-F54 HydrophobicContact CG1-CZ 4.06Å; V47-A55 CarbonylContact C-O 3.59Å; V47-A55 VanDerWaalsContact CA-O 3.3Å; V47-A55 WeakPolarHBondContact CA-O 3.31Å; V47-V56 HydrophobicContact CG1-CG1 4.45Å; V47-V56 HydrophobicContact CG1-CG2 4.38Å; V47-I113 HydrophobicContact CG1-CD1 4.37Å
48	G	89.9	Confident	89.4	Confident	8 Å²	8	46.3 Å²	46.3	8%	0.082	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173	161.3	175.5	0	0	0	0	0	114.1	F54 A55	G48-F54 WeakPolarHBondContact O-CA 3.33Å; G48-F54 VanDerWaalsContact O-CD2 3.23Å; G48-F54 WeakPolarHBondContact O-CD2 3.33Å; G48-A55 PolarHBondContact N-O 3.33Å; G48-A55 VanDerWaalsContact N-O 3.09Å; G48-A55 PolarHBondContact O-N 2.79Å
49	F	87.2	Confident	89.4	Confident	48 Å²	48	49.7 Å²	49.7	21%	0.211	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	130.6	175.8	-58	-80	0	0	0	109.1	F22 R53 F54 A78 L115	F22-F49 AromaticContact CD2-CE2 3.7Å; F22-F49 HydrophobicContact CD2-CE2 3.7Å; F22-F49 HydrophobicContact CD2-CZ 4.32Å; F22-F49 HydrophobicContact CE2-CD2 4.43Å; F22-F49 AromaticContact CE2-CE2 3.45Å; F22-F49 HydrophobicContact CE2-CE2 3.45Å; F22-F49 VanDerWaalsContact CE2-CE2 3.45Å; F22-F49 AromaticContact CE2-CZ 3.63Å; F22-F49 HydrophobicContact CE2-CZ 3.63Å; F22-F49 HydrophobicContact CZ-CZ 4.45Å; F49-R53 WeakPolarHBondContact CA-O 3.47Å; F49-F54 HydrophobicContact CD1-CB 4.17Å; F49-F54 AromaticContact CD1-CD2 3.78Å; F49-F54 HydrophobicContact CD1-CD2 3.78Å; F49-F54 HydrophobicContact CD1-CG 4.42Å; F49-F54 HydrophobicContact CE1-CB 4.21Å; F49-F54 AromaticContact CE1-CD2 3.48Å; F49-F54 HydrophobicContact CE1-CD2 3.48Å; F49-F54 VanDerWaalsContact CE1-CD2 3.48Å; F49-F54 HydrophobicContact CE1-CE2 4.24Å; F49-F54 HydrophobicContact CE1-CG 4.14Å; F49-F54 HydrophobicContact CG-CD2 4.45Å; F49-F54 AromaticContact CZ-CD2 3.94Å; F49-F54 HydrophobicContact CZ-CD2 3.94Å; F49-F54 HydrophobicContact CZ-CE2 4.25Å; F49-A78 WeakPolarHBondContact CD1-O 3.38Å; F49-A78 HydrophobicContact CE1-CB 3.93Å; F49-A78 WeakPolarHBondContact CE1-O 3.4Å; F49-L115 HydrophobicContact CE1-CD2 4.25Å; F49-L115 HydrophobicContact CZ-CD2 4.02Å
50	E	77.5	Confident	89.6	Confident	88 Å²	88	48.5 Å²	48.5	41%	0.411	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	116.5	176	-172.6	175.3	-170.4	0	0	109.7	D52 R53 Y62	E50-D52 PolarHBondContact O-N 2.81Å; E50-R53 PolarHBondContact N-O 3.32Å; E50-R53 PolarHBondContact O-N 2.67Å; E50-Y62 WeakPolarHBondContact OE2-CD1 3.47Å; E50-Y62 WeakPolarHBondContact OE2-CE1 3.34Å
51	A	72.9	Confident	89.6	Confident	112 Å²	112	48.3 Å²	48.3	93%	0.926	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.2	-95.1	-177.2	0	0	0	0	0	114.4
52	D	72.7	Confident	89.5	Confident	79 Å²	79	45.5 Å²	45.5	42%	0.422	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	14.1	-176.6	65.8	-38.7	0	0	0	113.4	E50 G75	E50-D52 PolarHBondContact O-N 2.81Å; D52-G75 PolarHBondContact O-N 2.8Å
53	R	82.1	Confident	89	Confident	110 Å²	110	49.5 Å²	49.5	42%	0.415	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	148.8	-166.9	-49.1	-176.7	-161.7	-154.8	-3.3	114.2	F49 E50 M73	F49-R53 WeakPolarHBondContact CA-O 3.47Å; E50-R53 PolarHBondContact N-O 3.32Å; E50-R53 PolarHBondContact O-N 2.67Å; R53-M73 CarbonylContact C-O 3.52Å; R53-M73 WeakPolarHBondContact CA-O 3.4Å; R53-M73 VanDerWaalsContact CB-O 3.28Å; R53-M73 WeakPolarHBondContact CB-O 3.43Å
54	F	89.4	Confident	88.3	Confident	6 Å²	6	49.3 Å²	49.3	3%	0.026	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.1	164.8	174.5	-111.8	0	0	0	109.7	F22 V47 G48 F49 V56 M73 I113 L115 V126	F22-F54 AromaticContact CE2-CE2 3.73Å; F22-F54 HydrophobicContact CE2-CE2 3.73Å; F22-F54 HydrophobicContact CE2-CZ 4.43Å; F22-F54 AromaticContact CZ-CE2 3.81Å; F22-F54 HydrophobicContact CZ-CE2 3.81Å; F22-F54 HydrophobicContact CZ-CZ 4.06Å; V47-F54 HydrophobicContact CB-CE2 3.99Å; V47-F54 HydrophobicContact CB-CZ 4.09Å; V47-F54 HydrophobicContact CG1-CE2 4.47Å; V47-F54 HydrophobicContact CG1-CZ 4.06Å; G48-F54 WeakPolarHBondContact O-CA 3.33Å; G48-F54 VanDerWaalsContact O-CD2 3.23Å; G48-F54 WeakPolarHBondContact O-CD2 3.33Å; F49-F54 HydrophobicContact CD1-CB 4.17Å; F49-F54 AromaticContact CD1-CD2 3.78Å; F49-F54 HydrophobicContact CD1-CD2 3.78Å; F49-F54 HydrophobicContact CD1-CG 4.42Å; F49-F54 HydrophobicContact CE1-CB 4.21Å; F49-F54 AromaticContact CE1-CD2 3.48Å; F49-F54 HydrophobicContact CE1-CD2 3.48Å; F49-F54 VanDerWaalsContact CE1-CD2 3.48Å; F49-F54 HydrophobicContact CE1-CE2 4.24Å; F49-F54 HydrophobicContact CE1-CG 4.14Å; F49-F54 HydrophobicContact CG-CD2 4.45Å; F49-F54 AromaticContact CZ-CD2 3.94Å; F49-F54 HydrophobicContact CZ-CD2 3.94Å; F49-F54 HydrophobicContact CZ-CE2 4.25Å; F54-V56 HydrophobicContact CD1-CG2 4.2Å; F54-V56 HydrophobicContact CE1-CG2 3.26Å; F54-V56 HydrophobicContact CZ-CG2 3.55Å; F54-M73 HydrophobicContact CB-CB 4.48Å; F54-M73 HydrophobicContact CD1-SD 4.13Å; F54-M73 PolarHBondContact N-O 2.74Å; F54-M73 PolarHBondContact O-N 2.91Å; F54-I113 HydrophobicContact CE1-CG2 4.31Å; F54-I113 HydrophobicContact CZ-CG2 3.98Å; F54-L115 HydrophobicContact CB-CD1 4.48Å; F54-L115 HydrophobicContact CD1-CD1 3.43Å; F54-L115 VanDerWaalsContact CD1-CD1 3.43Å; F54-L115 HydrophobicContact CD1-CD2 4.28Å; F54-L115 HydrophobicContact CD1-CG 4.48Å; F54-L115 HydrophobicContact CD2-CD1 4.49Å; F54-L115 HydrophobicContact CD2-CD2 4.11Å; F54-L115 HydrophobicContact CE1-CD1 3.66Å; F54-L115 HydrophobicContact CE1-CD2 4Å; F54-L115 HydrophobicContact CE1-CG 4.36Å; F54-L115 HydrophobicContact CE2-CD2 3.86Å; F54-L115 HydrophobicContact CG-CD1 3.88Å; F54-L115 HydrophobicContact CG-CD2 4.32Å; F54-L115 HydrophobicContact CZ-CD1 4.32Å; F54-L115 HydrophobicContact CZ-CD2 3.8Å; F54-V126 HydrophobicContact CE1-CG2 4.26Å
55	A	92.3	Very high	87.3	Confident	7 Å²	7	49 Å²	49	6%	0.058	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	137	179.8	0	0	0	0	0	111.4	V47 G48 Y62 I71 L72	V47-A55 CarbonylContact C-O 3.59Å; V47-A55 VanDerWaalsContact CA-O 3.3Å; V47-A55 WeakPolarHBondContact CA-O 3.31Å; G48-A55 PolarHBondContact N-O 3.33Å; G48-A55 VanDerWaalsContact N-O 3.09Å; G48-A55 PolarHBondContact O-N 2.79Å; A55-Y62 HydrophobicContact CB-CD1 4.48Å; A55-Y62 HydrophobicContact CB-CG 4.06Å; A55-I71 WeakPolarHBondContact CA-O 3.07Å; A55-L72 HydrophobicContact CB-CD2 3.67Å
56	V	94.7	Very high	86.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	105.1	165.8	-172.8	0	0	0	0	108.4	V45 V47 F54 C70 I71 I113 L128	V45-V56 HydrophobicContact CB-CG1 4.01Å; V45-V56 HydrophobicContact CG1-CG1 4.23Å; V45-V56 HydrophobicContact CG2-CG1 4.37Å; V47-V56 HydrophobicContact CG1-CG1 4.45Å; V47-V56 HydrophobicContact CG1-CG2 4.38Å; F54-V56 HydrophobicContact CD1-CG2 4.2Å; F54-V56 HydrophobicContact CE1-CG2 3.26Å; F54-V56 HydrophobicContact CZ-CG2 3.55Å; V56-C70 CarbonylContact O-C 3.59Å; V56-C70 WeakPolarHBondContact O-CA 3.11Å; V56-I71 HydrophobicContact CB-CB 4.39Å; V56-I71 PolarHBondContact N-O 3.37Å; V56-I71 PolarHBondContact O-N 3.44Å; V56-I113 HydrophobicContact CG1-CD1 4.26Å; V56-I113 HydrophobicContact CG2-CD1 4.14Å; V56-L128 HydrophobicContact CG1-CD1 4.37Å
57	C	95.2	Very high	86.2	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	160.7	-177.2	-64	0	0	0	0	113.1	V45 Y46 G60 N68 D69 C70	V45-C57 CarbonylContact C-O 3.49Å; V45-C57 WeakPolarHBondContact CA-O 3Å; Y46-C57 PolarHBondContact N-O 3.05Å; Y46-C57 PolarHBondContact O-N 2.56Å; C57-G60 WeakPolarHBondContact CB-O 3.31Å; C57-N68 WeakPolarHBondContact CB-ND2 3.31Å; C57-D69 CarbonylContact C-O 3.5Å; C57-D69 WeakPolarHBondContact CA-O 3.41Å; C57-C70 HydrophobicContact CB-CB 4.12Å; C57-C70 WeakPolarHBondContact CB-SG 3.39Å; C57-C70 WeakPolarHBondContact SG-CB 3.4Å; C57-C70 CovalentContact SG-SG 2.04Å; C57-C70 PolarHBondContact SG-SG 2.78Å
58	F	94.3	Very high	86	Confident	7 Å²	7	58.4 Å²	58.4	3%	0.031	33%	0.329	C	S	.	.	S	Bend	trans	-115.7	-22.7	-170.8	-64.9	-80.2	0	0	0	114.4	I35 Y37 Y42 V45 D69 I71 L128	I35-F58 HydrophobicContact CG2-CE1 4.4Å; Y37-F58 AromaticContact CD1-CD2 3.79Å; Y37-F58 HydrophobicContact CD1-CD2 3.79Å; Y37-F58 AromaticContact CD1-CE2 3.84Å; Y37-F58 HydrophobicContact CD1-CE2 3.84Å; Y37-F58 HydrophobicContact CD2-CD2 4.3Å; Y37-F58 AromaticContact CD2-CE2 3.5Å; Y37-F58 HydrophobicContact CD2-CE2 3.5Å; Y37-F58 AromaticContact CD2-CZ 3.88Å; Y37-F58 HydrophobicContact CD2-CZ 3.88Å; Y37-F58 HydrophobicContact CE1-CD2 4.11Å; Y37-F58 HydrophobicContact CE1-CE2 4.12Å; Y37-F58 AromaticContact CE2-CE2 3.8Å; Y37-F58 HydrophobicContact CE2-CE2 3.8Å; Y37-F58 HydrophobicContact CE2-CZ 4.5Å; Y37-F58 AromaticContact CG-CD2 3.88Å; Y37-F58 HydrophobicContact CG-CD2 3.88Å; Y37-F58 AromaticContact CG-CE2 3.51Å; Y37-F58 HydrophobicContact CG-CE2 3.51Å; Y37-F58 AromaticContact CG-CZ 3.98Å; Y37-F58 HydrophobicContact CG-CZ 3.98Å; Y42-F58 HydrophobicContact CD1-CB 3.77Å; Y42-F58 HydrophobicContact CD2-CB 3.65Å; Y42-F58 AromaticContact CD2-CD1 3.56Å; Y42-F58 HydrophobicContact CD2-CD1 3.56Å; Y42-F58 HydrophobicContact CD2-CE1 4.36Å; Y42-F58 AromaticContact CD2-CG 3.69Å; Y42-F58 HydrophobicContact CD2-CG 3.69Å; Y42-F58 HydrophobicContact CE1-CB 3.89Å; Y42-F58 HydrophobicContact CE2-CB 3.73Å; Y42-F58 HydrophobicContact CE2-CD1 4.36Å; Y42-F58 HydrophobicContact CE2-CG 4.03Å; Y42-F58 HydrophobicContact CG-CB 3.66Å; Y42-F58 AromaticContact CG-CD1 3.69Å; Y42-F58 HydrophobicContact CG-CD1 3.69Å; Y42-F58 AromaticContact CG-CG 3.99Å; Y42-F58 HydrophobicContact CG-CG 3.99Å; V45-F58 HydrophobicContact CG1-CD1 3.75Å; V45-F58 HydrophobicContact CG1-CE1 3.58Å; V45-F58 HydrophobicContact CG1-CZ 4.49Å; F58-D69 HydrophobicContact CB-CB 4.18Å; F58-D69 HydrophobicContact CD2-CB 4.21Å; F58-D69 WeakPolarHBondContact CD2-O 3.4Å; F58-D69 PolarHBondContact N-O 2.03Å; F58-I71 HydrophobicContact CE2-CD1 4.18Å; F58-I71 HydrophobicContact CE2-CG1 4.48Å; F58-I71 HydrophobicContact CZ-CD1 4.25Å; F58-L128 HydrophobicContact CE1-CD1 4.22Å; F58-L128 HydrophobicContact CZ-CD1 4.01Å
59	K	90.7	Very high	86.2	Confident	79 Å²	79	58 Å²	58	34%	0.343	33%	0.325	S	S	.	.	S	Bend	trans	-103.8	-17.9	-179.8	-63.9	169.4	177.4	155.7	0	114.2	Y42 N68 D69 N158	Y42-K59 HydrophobicContact CE1-CG 4.32Å; Y42-K59 WeakPolarHBondContact OH-CE 3.39Å; K59-N68 WeakPolarHBondContact CB-OD1 3.48Å; K59-N68 PolarHBondContact N-OD1 2.89Å; K59-N68 VanDerWaalsContact N-OD1 3.07Å; K59-D69 VanDerWaalsContact CE-CG 3.47Å; K59-D69 WeakPolarHBondContact CE-OD2 3.41Å; K59-D69 IonicContact NZ-OD1 3.85Å; K59-D69 PolarHBondContact NZ-OD1 2.85Å; K59-D69 IonicContact NZ-OD2 2.67Å; K59-D69 PolarHBondContact NZ-OD2 2.97Å; K59-N158 PolarHBondContact NZ-OD1 3.19Å
60	G	91.4	Very high	86.5	Confident	18 Å²	18	55.8 Å²	55.8	19%	0.186	32%	0.315	C	S	.	.	S	Bend	trans	174.3	-175.8	179.3	0	0	0	0	0	111.3	Y46 C57 N68	Y46-G60 VanDerWaalsContact CB-C 3.49Å; Y46-G60 WeakPolarHBondContact CB-O 3.45Å; Y46-G60 VanDerWaalsContact CD2-CA 3.47Å; C57-G60 WeakPolarHBondContact CB-O 3.31Å; G60-N68 PolarHBondContact O-ND2 3.01Å
61	L	89.8	Confident	87.3	Confident	75 Å²	75	51.6 Å²	51.6	39%	0.393	30%	0.296	S	S	.	.	S	Bend	trans	-59.5	147.4	171.2	-67.1	-179.9	0	0	0	111.1	Y46 N68	Y46-L61 HydrophobicContact CD1-CD2 4.11Å; Y46-L61 HydrophobicContact CD1-CG 4.37Å; L61-N68 PolarHBondContact O-ND2 2.84Å
62	Y	89.2	Confident	88.1	Confident	64 Å²	64	46.5 Å²	46.5	25%	0.251	25%	0.253	S	S	.	.			trans	-65.3	133.9	172.5	-176.4	-109.2	0	0	0	110.6	E50 A55 P64 L72	E50-Y62 WeakPolarHBondContact OE2-CD1 3.47Å; E50-Y62 WeakPolarHBondContact OE2-CE1 3.34Å; A55-Y62 HydrophobicContact CB-CD1 4.48Å; A55-Y62 HydrophobicContact CB-CG 4.06Å; Y62-P64 HydrophobicContact CE1-CG 4.41Å; Y62-L72 HydrophobicContact CD2-CD2 3.61Å; Y62-L72 HydrophobicContact CE2-CD1 3.68Å; Y62-L72 HydrophobicContact CE2-CD2 3.6Å; Y62-L72 HydrophobicContact CE2-CG 4.27Å; Y62-L72 HydrophobicContact CG-CD2 4.11Å
63	Q	84.5	Confident	88.8	Confident	108 Å²	108	43.2 Å²	43.2	51%	0.505	24%	0.235	S	C	.	.			trans	-148.6	132.5	169.8	-66.1	-169.9	-5.2	0	0	108.7	G65 I66	Q63-G65 PolarHBondContact O-N 3Å; Q63-I66 HydrophobicContact CB-CB 4.37Å; Q63-I66 HydrophobicContact CB-CD1 3.85Å; Q63-I66 HydrophobicContact CB-CG1 3.97Å; Q63-I66 HydrophobicContact CG-CD1 4.33Å; Q63-I66 PolarHBondContact O-N 2.98Å; Q63-I66 VanDerWaalsContact O-N 3.17Å
64	P	80.9	Confident	88.9	Confident	89 Å²	89	39.1 Å²	39.1	58%	0.578	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	127.2	176.9	-28.2	35.7	0	0	0	112.8	Y62	Y62-P64 HydrophobicContact CE1-CG 4.41Å
65	G	74.9	Confident	88.1	Confident	87 Å²	87	40.5 Å²	40.5	90%	0.897	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.9	-4.4	178.8	0	0	0	0	0	115.9	Q63	Q63-G65 PolarHBondContact O-N 3Å
66	I	81.4	Confident	87.2	Confident	88 Å²	88	41.3 Å²	41.3	45%	0.451	25%	0.249	S	C	.	.	S	Bend	trans	-86	133.7	171.1	-63.2	-163.9	0	0	0	110.4	Q63 N68	Q63-I66 HydrophobicContact CB-CB 4.37Å; Q63-I66 HydrophobicContact CB-CD1 3.85Å; Q63-I66 HydrophobicContact CB-CG1 3.97Å; Q63-I66 HydrophobicContact CG-CD1 4.33Å; Q63-I66 PolarHBondContact O-N 2.98Å; Q63-I66 VanDerWaalsContact O-N 3.17Å; I66-N68 PolarHBondContact O-N 3.08Å; I66-N68 VanDerWaalsContact O-N 3.11Å
67	Q	86.3	Confident	86.5	Confident	148 Å²	148	44 Å²	44	69%	0.692	27%	0.265	S	S	*	.			trans	-68	107	172.3	-66.5	-175.6	-14.3	0	0	110	N158	Q67-N158 HydrophobicContact CB-CB 4.32Å
68	N	89.3	Confident	86	Confident	5 Å²	5	44.8 Å²	44.8	3%	0.027	27%	0.272	C	S	.	.			trans	-143.2	157.6	-178.7	-162.5	-10	0	0	0	109.5	C57 K59 G60 L61 I66 N158 G159	C57-N68 WeakPolarHBondContact CB-ND2 3.31Å; K59-N68 WeakPolarHBondContact CB-OD1 3.48Å; K59-N68 PolarHBondContact N-OD1 2.89Å; K59-N68 VanDerWaalsContact N-OD1 3.07Å; G60-N68 PolarHBondContact O-ND2 3.01Å; L61-N68 PolarHBondContact O-ND2 2.84Å; I66-N68 PolarHBondContact O-N 3.08Å; I66-N68 VanDerWaalsContact O-N 3.11Å; N68-N158 CarbonylContact O-C 3.17Å; N68-N158 PolarHBondContact O-N 3.41Å; N68-G159 PolarHBondContact O-N 2.87Å
69	D	93.4	Very high	85.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	28%	0.284	C	S	.	.			trans	-100.9	116.4	176.3	-67.8	10.7	0	0	0	105.5	Y37 Y42 C57 F58 K59 Q156 V157 N158	Y37-D69 HydrophobicContact CD1-CB 4.03Å; Y37-D69 HydrophobicContact CE1-CB 3.84Å; Y42-D69 PolarHBondContact OH-OD2 2.84Å; C57-D69 CarbonylContact C-O 3.5Å; C57-D69 WeakPolarHBondContact CA-O 3.41Å; F58-D69 HydrophobicContact CB-CB 4.18Å; F58-D69 HydrophobicContact CD2-CB 4.21Å; F58-D69 WeakPolarHBondContact CD2-O 3.4Å; F58-D69 PolarHBondContact N-O 2.03Å; K59-D69 VanDerWaalsContact CE-CG 3.47Å; K59-D69 WeakPolarHBondContact CE-OD2 3.41Å; K59-D69 IonicContact NZ-OD1 3.85Å; K59-D69 PolarHBondContact NZ-OD1 2.85Å; K59-D69 IonicContact NZ-OD2 2.67Å; K59-D69 PolarHBondContact NZ-OD2 2.97Å; D69-Q156 WeakPolarHBondContact CA-O 3.37Å; D69-V157 WeakPolarHBondContact OD1-CA 3.28Å; D69-N158 PolarHBondContact OD1-N 2.78Å
70	C	93.7	Very high	85.6	Confident	1 Å²	1	47 Å²	47	1%	0.007	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	146.7	-164.6	-65.2	0	0	0	0	112.3	Y37 V56 C57 L72 Q156	Y37-C70 PolarHBondContact OH-O 2.88Å; V56-C70 CarbonylContact O-C 3.59Å; V56-C70 WeakPolarHBondContact O-CA 3.11Å; C57-C70 HydrophobicContact CB-CB 4.12Å; C57-C70 WeakPolarHBondContact CB-SG 3.39Å; C57-C70 WeakPolarHBondContact SG-CB 3.4Å; C57-C70 CovalentContact SG-SG 2.04Å; C57-C70 PolarHBondContact SG-SG 2.78Å; C70-L72 HydrophobicContact CB-CD2 3.86Å; C70-L72 HydrophobicContact CB-CG 4.28Å; C70-Q156 HydrophobicContact CB-CB 4.5Å; C70-Q156 PolarHBondContact N-O 3.37Å; C70-Q156 PolarHBondContact O-N 2.98Å
71	I	93.5	Very high	85.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	115.2	163	-60.1	156.5	0	0	0	106	Y37 A55 V56 F58 M73 L128 L137 D154	Y37-I71 HydrophobicContact CE2-CD1 4.23Å; Y37-I71 HydrophobicContact CE2-CG1 3.96Å; A55-I71 WeakPolarHBondContact CA-O 3.07Å; V56-I71 HydrophobicContact CB-CB 4.39Å; V56-I71 PolarHBondContact N-O 3.37Å; V56-I71 PolarHBondContact O-N 3.44Å; F58-I71 HydrophobicContact CE2-CD1 4.18Å; F58-I71 HydrophobicContact CE2-CG1 4.48Å; F58-I71 HydrophobicContact CZ-CD1 4.25Å; I71-M73 HydrophobicContact CG2-CG 4.43Å; I71-L128 HydrophobicContact CD1-CD2 3.78Å; I71-L137 HydrophobicContact CD1-CD1 4.09Å; I71-L137 HydrophobicContact CD1-CD2 3.99Å; I71-L137 HydrophobicContact CG1-CD2 4.17Å; I71-L137 HydrophobicContact CG2-CD2 3.98Å; I71-D154 CarbonylContact C-O 3.57Å; I71-D154 WeakPolarHBondContact CA-O 3.47Å
72	L	90.9	Very high	85.6	Confident	5 Å²	5	43.2 Å²	43.2	3%	0.026	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	115.6	-179.2	-54.3	-176.5	0	0	0	109.5	A55 Y62 C70 A153 D154 Q156	A55-L72 HydrophobicContact CB-CD2 3.67Å; Y62-L72 HydrophobicContact CD2-CD2 3.61Å; Y62-L72 HydrophobicContact CE2-CD1 3.68Å; Y62-L72 HydrophobicContact CE2-CD2 3.6Å; Y62-L72 HydrophobicContact CE2-CG 4.27Å; Y62-L72 HydrophobicContact CG-CD2 4.11Å; C70-L72 HydrophobicContact CB-CD2 3.86Å; C70-L72 HydrophobicContact CB-CG 4.28Å; L72-A153 CarbonylContact O-C 3.5Å; L72-A153 VanDerWaalsContact O-CA 3.31Å; L72-A153 WeakPolarHBondContact O-CA 3.28Å; L72-D154 HydrophobicContact CB-CB 4.45Å; L72-D154 PolarHBondContact N-O 2.92Å; L72-D154 PolarHBondContact O-N 2.76Å; L72-Q156 HydrophobicContact CD1-CG 4.34Å
73	M	87.4	Confident	85.8	Confident	10 Å²	10	40.2 Å²	40.2	5%	0.049	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133.2	177.1	-65.3	176.3	58.9	0	0	109.4	R53 F54 I71 E124 V126 I139 A153	R53-M73 CarbonylContact C-O 3.52Å; R53-M73 WeakPolarHBondContact CA-O 3.4Å; R53-M73 VanDerWaalsContact CB-O 3.28Å; R53-M73 WeakPolarHBondContact CB-O 3.43Å; F54-M73 HydrophobicContact CB-CB 4.48Å; F54-M73 HydrophobicContact CD1-SD 4.13Å; F54-M73 PolarHBondContact N-O 2.74Å; F54-M73 PolarHBondContact O-N 2.91Å; I71-M73 HydrophobicContact CG2-CG 4.43Å; M73-E124 HydrophobicContact CE-CG 4.26Å; M73-E124 WeakPolarHBondContact CE-OE2 3.48Å; M73-V126 HydrophobicContact CE-CG2 4.09Å; M73-V126 HydrophobicContact SD-CG2 3.32Å; M73-V126 WeakPolarHBondContact SD-CG2 3.18Å; M73-I139 HydrophobicContact CE-CD1 4.39Å; M73-I139 HydrophobicContact CE-CG2 3.66Å; M73-I139 HydrophobicContact CG-CD1 4.34Å; M73-I139 HydrophobicContact SD-CD1 4.05Å; M73-I139 HydrophobicContact SD-CG1 4.49Å; M73-A153 HydrophobicContact CG-CB 4.01Å
74	S	83.4	Confident	86.2	Confident	24 Å²	24	36.4 Å²	36.4	17%	0.168	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	142.8	-175.2	-51.4	0	0	0	0	112.3	V152	S74-V152 PolarHBondContact N-O 2.68Å
75	G	72.6	Confident	86.8	Confident	35 Å²	35	32.5 Å²	32.5	36%	0.361	21%	0.209	S	C	.	.	S	Bend	trans	98.4	2.8	171.9	0	0	0	0	0	115.9	D52 Y145 Q151	D52-G75 PolarHBondContact O-N 2.8Å; G75-Y145 VanDerWaalsContact O-CD1 3.31Å; G75-Y145 WeakPolarHBondContact O-CD1 3.24Å; G75-Q151 PolarHBondContact O-NE2 3.13Å
76	G	74.4	Confident	87.5	Confident	25 Å²	25	30.9 Å²	30.9	26%	0.258	18%	0.18	S	C	.	.			trans	-84.1	157.1	178.3	0	0	0	0	0	115	Y145	G76-Y145 VanDerWaalsContact CA-CE1 3.45Å
77	T	79	Confident	87.8	Confident	57 Å²	57	31 Å²	31	35%	0.35	19%	0.188	S	C	.	.			trans	-98.3	9.8	174.7	49.4	0	0	0	0	113.3	D79 G144	T77-D79 PolarHBondContact O-N 3.27Å; T77-G144 WeakPolarHBondContact CB-O 3.49Å; T77-G144 WeakPolarHBondContact CG2-O 3.36Å; T77-G144 PolarHBondContact OG1-O 3.36Å
78	A	84.8	Confident	87.5	Confident	16 Å²	16	28.2 Å²	28.2	13%	0.132	17%	0.171	C	C	.	.			trans	-64.9	127.6	177	0	0	0	0	0	111.3	F49 L115 T116 V123	F49-A78 WeakPolarHBondContact CD1-O 3.38Å; F49-A78 HydrophobicContact CE1-CB 3.93Å; F49-A78 WeakPolarHBondContact CE1-O 3.4Å; A78-L115 HydrophobicContact CB-CB 3.89Å; A78-T116 WeakPolarHBondContact CA-O 3.4Å; A78-V123 HydrophobicContact CB-CG2 3.73Å
79	D	86.6	Confident	87.3	Confident	55 Å²	55	35.5 Å²	35.5	29%	0.294	21%	0.205	S	C	.	.			trans	-118.6	-4.5	176.3	74.8	-16.8	0	0	0	112.9	T77 T116 S118	T77-D79 PolarHBondContact O-N 3.27Å; D79-T116 PolarHBondContact N-O 2.98Å; D79-T116 VanDerWaalsContact N-O 3.11Å; D79-S118 PolarHBondContact OD1-N 2.63Å; D79-S118 WeakPolarHBondContact OD2-CA 3.28Å; D79-S118 WeakPolarHBondContact OD2-CB 3.16Å
80	R	90.1	Very high	87	Confident	76 Å²	76	36.4 Å²	36.4	29%	0.287	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	162.8	-179.5	69.6	-161.8	63.9	-118.5	-7.3	111.1	F22 T23 T116	F22-R80 WeakPolarHBondContact O-CA 3.37Å; T23-R80 HydrophobicContact CG2-CB 3.92Å; R80-T116 VanDerWaalsContact CD-OG1 3.32Å; R80-T116 WeakPolarHBondContact CD-OG1 3.44Å; R80-T116 WeakPolarHBondContact CG-OG1 3.41Å; R80-T116 PolarHBondContact N-O 2.99Å; R80-T116 PolarHBondContact O-N 3.11Å
81	G	90.9	Very high	86.8	Confident	11 Å²	11	40 Å²	40	11%	0.113	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	-178	176.7	0	0	0	0	0	113.7	F22 P114	F22-G81 WeakPolarHBondContact CD1-O 3.37Å; F22-G81 PolarHBondContact N-O 3.39Å; F22-G81 PolarHBondContact O-N 3.43Å; G81-P114 CarbonylContact C-O 3.38Å; G81-P114 WeakPolarHBondContact CA-O 3.33Å
82	G	91	Very high	86.4	Confident	3 Å²	3	44.4 Å²	44.4	3%	0.031	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	170.2	167.5	0	0	0	0	0	111.7	Q20 I113 P114	Q20-G82 CarbonylContact O-C 3.43Å; Q20-G82 WeakPolarHBondContact O-CA 3.41Å; G82-I113 VanDerWaalsContact O-CA 3.23Å; G82-I113 WeakPolarHBondContact O-CA 3.4Å; G82-I113 WeakPolarHBondContact O-CG2 3.42Å; G82-P114 PolarHBondContact N-O 2.81Å; G82-P114 WeakPolarHBondContact O-CD 3.08Å
83	L	93.1	Very high	86	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126	163.2	168.5	66.1	0	0	0	107.8	H19 Q20 M28 I30 V85 N111 I113	H19-L83 WeakPolarHBondContact CA-O 3.03Å; Q20-L83 PolarHBondContact N-O 2.96Å; Q20-L83 PolarHBondContact O-N 3.35Å; M28-L83 HydrophobicContact CB-CD2 3.73Å; M28-L83 HydrophobicContact CG-CD2 4.34Å; M28-L83 HydrophobicContact SD-CB 4.14Å; M28-L83 HydrophobicContact SD-CD2 4.3Å; I30-L83 HydrophobicContact CG2-CD1 4.36Å; I30-L83 HydrophobicContact CG2-CD2 3.72Å; L83-V85 HydrophobicContact CD1-CG2 4.25Å; L83-V85 HydrophobicContact CD2-CG2 4.14Å; L83-V85 HydrophobicContact CG-CG2 4.12Å; L83-N111 HydrophobicContact CD1-CB 3.91Å; L83-I113 HydrophobicContact CD1-CG1 3.83Å
84	S	92.9	Very high	86	Confident	29 Å²	29	47.2 Å²	47.2	20%	0.203	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	117	168.8	-63	0	0	0	0	109.4	H19 V112	H19-S84 PolarHBondContact CD2-OG 3.07Å; S84-V112 PolarHBondContact N-O 3.11Å; S84-V112 PolarHBondContact O-N 2.88Å
85	V	92.6	Very high	86	Confident	6 Å²	6	47 Å²	47	4%	0.036	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	115.9	174.8	-169.8	0	0	0	0	109.3	S18 S32 C33 L83 N111	S18-V85 PolarHBondContact O-N 2.57Å; S32-V85 WeakPolarHBondContact OG-CG1 3.24Å; C33-V85 HydrophobicContact CB-CG1 3.43Å; C33-V85 VanDerWaalsContact CB-CG1 3.43Å; L83-V85 HydrophobicContact CD1-CG2 4.25Å; L83-V85 HydrophobicContact CD2-CG2 4.14Å; L83-V85 HydrophobicContact CG-CG2 4.12Å; V85-N111 WeakPolarHBondContact CG1-OD1 3.5Å; V85-N111 WeakPolarHBondContact CG2-OD1 3.28Å
86	L	90.9	Very high	86.7	Confident	54 Å²	54	46.7 Å²	46.7	28%	0.283	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	116.8	-173.7	-57.1	-178.2	0	0	0	111.1	R88 C109 V110 V112	L86-R88 PolarHBondContact O-N 3.39Å; L86-R88 VanDerWaalsContact O-N 3.11Å; L86-C109 CarbonylContact O-C 2.9Å; L86-C109 WeakPolarHBondContact O-CA 3.37Å; L86-C109 VanDerWaalsContact O-CB 3.27Å; L86-C109 WeakPolarHBondContact O-CB 3.25Å; L86-V110 PolarHBondContact N-O 3.09Å; L86-V110 PolarHBondContact O-N 2.95Å; L86-V112 HydrophobicContact CD1-CG2 3.7Å; L86-V112 HydrophobicContact CG-CG2 4.26Å
87	S	87.1	Confident	87.4	Confident	90 Å²	90	46.3 Å²	46.3	63%	0.629	27%	0.273	S	S	*	.			trans	-72.2	99.4	163	-59.7	0	0	0	0	108.7
88	R	80	Confident	87.7	Confident	90 Å²	90	51.3 Å²	51.3	34%	0.34	29%	0.29	S	S	.	.			trans	-137.3	115.5	-177	-177	176.6	-173.6	151.8	5.5	109.2	L8 L86 K108 C109	L8-R88 PolarHBondContact O-NH1 3.19Å; L8-R88 PolarHBondContact O-NH2 2.04Å; L86-R88 PolarHBondContact O-N 3.39Å; L86-R88 VanDerWaalsContact O-N 3.11Å; R88-K108 PolarHBondContact N-O 2.78Å; R88-K108 CarbonylContact O-C 3.54Å; R88-C109 PolarHBondContact O-N 2.82Å
89	E	84.3	Confident	87.6	Confident	158 Å²	158	55.3 Å²	55.3	74%	0.738	31%	0.308	S	S	*	.			trans	-71.7	128.1	173	-167	170.7	-173.2	0	0	110.2	G107	E89-G107 CarbonylContact C-O 3.58Å; E89-G107 VanDerWaalsContact CA-O 3.31Å; E89-G107 WeakPolarHBondContact CA-O 3.02Å
90	I	88.3	Confident	87.5	Confident	18 Å²	18	53.3 Å²	53.3	9%	0.092	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-116.8	99.7	176.1	-61.2	173.8	0	0	0	106.9	S94 V96 A106 G107 V110 F131	I90-S94 VanDerWaalsContact CG2-OG 3.22Å; I90-S94 WeakPolarHBondContact CG2-OG 3.43Å; I90-V96 HydrophobicContact CG2-CB 4.46Å; I90-V96 HydrophobicContact CG2-CG2 4.45Å; I90-A106 CarbonylContact O-C 3.57Å; I90-A106 WeakPolarHBondContact O-CA 3.04Å; I90-G107 PolarHBondContact N-O 2.96Å; I90-G107 PolarHBondContact O-N 3.3Å; I90-V110 HydrophobicContact CD1-CG2 3.77Å; I90-F131 HydrophobicContact CB-CE1 4.07Å; I90-F131 HydrophobicContact CB-CZ 4.09Å; I90-F131 HydrophobicContact CD1-CE2 4.39Å; I90-F131 HydrophobicContact CD1-CZ 3.74Å; I90-F131 HydrophobicContact CG1-CZ 4.5Å; I90-F131 HydrophobicContact CG2-CE1 3.91Å; I90-F131 HydrophobicContact CG2-CZ 4Å
91	P	88.5	Confident	87.1	Confident	78 Å²	78	54.7 Å²	54.7	51%	0.506	32%	0.317	S	S	.	.			trans	-65.9	153.6	-171.7	26.6	-35.3	0	0	0	112.1	S94 H97	P91-S94 VanDerWaalsContact O-CB 3.22Å; P91-S94 WeakPolarHBondContact O-CB 3.41Å; P91-S94 PolarHBondContact O-N 3.32Å; P91-S94 VanDerWaalsContact O-N 3.15Å; P91-S94 PolarHBondContact O-OG 3.39Å; P91-H97 PolarHBondContact O-CE1 2.87Å; P91-H97 PolarHBondContact O-ND1 3.36Å; P91-H97 VanDerWaalsContact O-ND1 3.12Å
92	T	85.4	Confident	86.5	Confident	92 Å²	92	56.4 Å²	56.4	56%	0.564	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	137.2	171.2	47	0	0	0	0	110.3	A106	T92-A106 HydrophobicContact CG2-CB 4.37Å
93	G	82.4	Confident	86.3	Confident	49 Å²	49	56.7 Å²	56.7	51%	0.505	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	1.2	-173.6	0	0	0	0	0	115.8	K98	G93-K98 WeakPolarHBondContact O-CE 2.92Å
94	S	87.4	Confident	86	Confident	25 Å²	25	64.2 Å²	64.2	18%	0.175	36%	0.357	C	S	.	.	S	Bend	trans	-59.4	169.3	168.2	72.7	0	0	0	0	112.6	I90 P91 V96 H97 K98	I90-S94 VanDerWaalsContact CG2-OG 3.22Å; I90-S94 WeakPolarHBondContact CG2-OG 3.43Å; P91-S94 VanDerWaalsContact O-CB 3.22Å; P91-S94 WeakPolarHBondContact O-CB 3.41Å; P91-S94 PolarHBondContact O-N 3.32Å; P91-S94 VanDerWaalsContact O-N 3.15Å; P91-S94 PolarHBondContact O-OG 3.39Å; S94-V96 PolarHBondContact O-N 2.84Å; S94-V96 VanDerWaalsContact O-N 3.13Å; S94-H97 PolarHBondContact O-N 3.33Å; S94-H97 PolarHBondContact OG-ND1 3.2Å; S94-K98 PolarHBondContact O-N 3.16Å; S94-K98 VanDerWaalsContact O-N 3.1Å
95	G	84.6	Confident	85.8	Confident	19 Å²	19	68.5 Å²	68.5	20%	0.196	37%	0.369	C	S	.	.	H	α-helix	trans	-54.3	-32.7	176.3	0	0	0	0	0	113.8	K98 L99	G95-K98 PolarHBondContact O-N 2.84Å; G95-L99 WeakPolarHBondContact O-CG 3.16Å; G95-L99 PolarHBondContact O-N 3.32Å
96	V	86	Confident	85.7	Confident	29 Å²	29	69.8 Å²	69.8	18%	0.176	38%	0.38	C	S	.	.	H	α-helix	trans	-60.1	-46.8	173.4	170.6	0	0	0	0	111.6	I90 S94 K98 L99 L100 L103 F131 I136 I177	I90-V96 HydrophobicContact CG2-CB 4.46Å; I90-V96 HydrophobicContact CG2-CG2 4.45Å; S94-V96 PolarHBondContact O-N 2.84Å; S94-V96 VanDerWaalsContact O-N 3.13Å; V96-K98 VanDerWaalsContact C-N 3.3Å; V96-K98 PolarHBondContact O-N 3.07Å; V96-L99 PolarHBondContact O-N 2.77Å; V96-L100 PolarHBondContact O-N 3.06Å; V96-L103 HydrophobicContact CG1-CD2 3.57Å; V96-F131 HydrophobicContact CG1-CE1 4.01Å; V96-F131 HydrophobicContact CG1-CZ 3.79Å; V96-I136 HydrophobicContact CG1-CD1 4.07Å; V96-I177 HydrophobicContact CB-CD1 4.15Å; V96-I177 HydrophobicContact CG1-CD1 3.73Å; V96-I177 HydrophobicContact CG2-CD1 3.85Å
97	H	89.1	Confident	85.7	Confident	17 Å²	17	67.2 Å²	67.2	8%	0.079	37%	0.367	C	S	.	.	H	α-helix	trans	-69.2	-27.7	178.3	-63	85	0	0	0	112.6	P91 S94 L100 P101 L103 Y105 F131	P91-H97 PolarHBondContact O-CE1 2.87Å; P91-H97 PolarHBondContact O-ND1 3.36Å; P91-H97 VanDerWaalsContact O-ND1 3.12Å; S94-H97 PolarHBondContact O-N 3.33Å; S94-H97 PolarHBondContact OG-ND1 3.2Å; H97-L100 CarbonylContact O-C 3.52Å; H97-L100 VanDerWaalsContact O-C 3.23Å; H97-P101 WeakPolarHBondContact O-CA 3.42Å; H97-L103 PolarHBondContact CD2-O 2.8Å; H97-Y105 PolarHBondContact NE2-O 2.84Å; H97-Y105 VanDerWaalsContact NE2-O 3.14Å; H97-F131 AromaticContact CE1-CE1 3.87Å
98	K	85.2	Confident	85.9	Confident	162 Å²	162	69.5 Å²	69.5	70%	0.704	37%	0.366	S	S	*	.	H	α-helix	trans	-72.4	-35	173.6	-65.1	-179.1	-177.6	-177.6	0	112.2	G93 S94 G95 V96	G93-K98 WeakPolarHBondContact O-CE 2.92Å; S94-K98 PolarHBondContact O-N 3.16Å; S94-K98 VanDerWaalsContact O-N 3.1Å; G95-K98 PolarHBondContact O-N 2.84Å; V96-K98 VanDerWaalsContact C-N 3.3Å; V96-K98 PolarHBondContact O-N 3.07Å
99	L	83.5	Confident	86.6	Confident	99 Å²	99	65.6 Å²	65.6	52%	0.518	35%	0.352	S	S	.	.	H	α-helix	trans	-78.5	-31.3	174.9	-67.5	169.5	0	0	0	112.1	G95 V96 I177	G95-L99 WeakPolarHBondContact O-CG 3.16Å; G95-L99 PolarHBondContact O-N 3.32Å; V96-L99 PolarHBondContact O-N 2.77Å; L99-I177 HydrophobicContact CB-CG2 3.67Å; L99-I177 HydrophobicContact CD1-CG2 3.81Å; L99-I177 HydrophobicContact CG-CG2 4.32Å
100	L	85.1	Confident	87	Confident	13 Å²	13	58.7 Å²	58.7	7%	0.068	32%	0.32	C	S	.	.			trans	-122.9	80.6	177.3	-60.7	-175.6	0	0	0	111.5	V96 H97 N102 L103 I136 I177 D179	V96-L100 PolarHBondContact O-N 3.06Å; H97-L100 CarbonylContact O-C 3.52Å; H97-L100 VanDerWaalsContact O-C 3.23Å; L100-N102 PolarHBondContact O-N 2.94Å; L100-N102 VanDerWaalsContact O-N 3.07Å; L100-L103 HydrophobicContact CB-CB 4.24Å; L100-L103 VanDerWaalsContact O-CB 3.23Å; L100-L103 WeakPolarHBondContact O-CB 3.39Å; L100-L103 PolarHBondContact O-N 2.88Å; L100-I136 HydrophobicContact CD1-CB 4.43Å; L100-I136 HydrophobicContact CD1-CG2 3.62Å; L100-I177 HydrophobicContact CD1-CD1 4.32Å; L100-I177 HydrophobicContact CD1-CG1 3.92Å; L100-I177 HydrophobicContact CD2-CG2 4.5Å; L100-I177 HydrophobicContact CG-CG1 4.39Å; L100-I177 HydrophobicContact CG-CG2 4.31Å; L100-D179 HydrophobicContact CD1-CB 4.49Å
101	P	80.1	Confident	87.3	Confident	106 Å²	106	57.9 Å²	57.9	69%	0.688	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.7	-177.2	-25.5	35.6	0	0	0	115.2	H97 L103	H97-P101 WeakPolarHBondContact O-CA 3.42Å; P101-L103 VanDerWaalsContact C-N 3.26Å; P101-L103 PolarHBondContact O-N 3.4Å
102	N	80.2	Confident	87.6	Confident	47 Å²	47	55 Å²	55	25%	0.251	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-4	177.4	-63.9	-34.7	0	0	0	113.4	L100 K104 Q134	L100-N102 PolarHBondContact O-N 2.94Å; L100-N102 VanDerWaalsContact O-N 3.07Å; N102-K104 PolarHBondContact O-N 3.15Å; N102-Q134 PolarHBondContact O-NE2 2.04Å
103	L	86.3	Confident	88	Confident	9 Å²	9	50.7 Å²	50.7	5%	0.047	27%	0.271	C	S	.	.			trans	-81.5	113	178.9	-161.1	66.2	0	0	0	109.8	V96 H97 L100 P101 F131 Q134 I136	V96-L103 HydrophobicContact CG1-CD2 3.57Å; H97-L103 PolarHBondContact CD2-O 2.8Å; L100-L103 HydrophobicContact CB-CB 4.24Å; L100-L103 VanDerWaalsContact O-CB 3.23Å; L100-L103 WeakPolarHBondContact O-CB 3.39Å; L100-L103 PolarHBondContact O-N 2.88Å; P101-L103 VanDerWaalsContact C-N 3.26Å; P101-L103 PolarHBondContact O-N 3.4Å; L103-F131 HydrophobicContact CD1-CB 3.83Å; L103-F131 HydrophobicContact CD1-CD1 4.25Å; L103-F131 HydrophobicContact CD1-CG 3.99Å; L103-F131 HydrophobicContact CD2-CD1 3.38Å; L103-F131 HydrophobicContact CD2-CD2 4.35Å; L103-F131 HydrophobicContact CD2-CE1 3.56Å; L103-F131 HydrophobicContact CD2-CG 3.84Å; L103-F131 HydrophobicContact CD2-CZ 4.15Å; L103-F131 HydrophobicContact CG-CB 4.26Å; L103-F131 HydrophobicContact CG-CD1 3.85Å; L103-F131 HydrophobicContact CG-CE1 4.48Å; L103-F131 HydrophobicContact CG-CG 4.12Å; L103-Q134 HydrophobicContact CD1-CB 3.68Å; L103-Q134 HydrophobicContact CD1-CG 4.4Å; L103-I136 HydrophobicContact CD1-CG2 4.11Å; L103-I136 HydrophobicContact CD2-CG2 4.04Å
104	K	85.8	Confident	88.4	Confident	158 Å²	158	49.8 Å²	49.8	69%	0.687	26%	0.256	S	S	*	.			trans	-93.4	-29.9	-168.1	-65.3	179.2	-177.5	171.2	0	114.8	N102	N102-K104 PolarHBondContact O-N 3.15Å
105	Y	89.1	Confident	88.5	Confident	120 Å²	120	48.6 Å²	48.6	47%	0.471	25%	0.248	S	C	.	.	S	Bend	trans	-108.9	154.4	-170.2	-52.4	-73.2	0	0	0	111.3	H97 F131 A133	H97-Y105 PolarHBondContact NE2-O 2.84Å; H97-Y105 VanDerWaalsContact NE2-O 3.14Å; Y105-F131 WeakPolarHBondContact CB-O 3.33Å; Y105-F131 WeakPolarHBondContact CD2-O 3.25Å; Y105-F131 WeakPolarHBondContact O-CD1 3.38Å; Y105-A133 HydrophobicContact CE2-CB 4.11Å
106	A	89.9	Confident	88.7	Confident	32 Å²	32	49.2 Å²	49.2	26%	0.264	25%	0.248	S	C	.	.			trans	-63.9	145.6	169.9	0	0	0	0	0	111.4	I90 T92	I90-A106 CarbonylContact O-C 3.57Å; I90-A106 WeakPolarHBondContact O-CA 3.04Å; T92-A106 HydrophobicContact CG2-CB 4.37Å
107	G	91.6	Very high	88.7	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.01	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-72.9	135.2	173.7	0	0	0	0	0	110.4	E89 I90 N130 F131	E89-G107 CarbonylContact C-O 3.58Å; E89-G107 VanDerWaalsContact CA-O 3.31Å; E89-G107 WeakPolarHBondContact CA-O 3.02Å; I90-G107 PolarHBondContact N-O 2.96Å; I90-G107 PolarHBondContact O-N 3.3Å; G107-N130 CarbonylContact C-O 3.54Å; G107-N130 VanDerWaalsContact CA-O 3.31Å; G107-N130 WeakPolarHBondContact CA-O 3.43Å; G107-F131 VanDerWaalsContact CA-CE1 3.43Å
108	K	91.3	Very high	88.5	Confident	138 Å²	138	52.2 Å²	52.2	60%	0.6	27%	0.27	S	S	*	.			trans	-97.3	-34	-176.5	-62.1	-176.6	179.1	-178.1	0	112.5	R88 N130	R88-K108 PolarHBondContact N-O 2.78Å; R88-K108 CarbonylContact O-C 3.54Å; K108-N130 PolarHBondContact N-O 2.73Å
109	C	93.9	Very high	88.4	Confident	8 Å²	8	51.9 Å²	51.9	5%	0.054	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	164.9	-173.6	60.2	0	0	0	0	110.6	C33 L86 R88 N130	C33-C109 WeakPolarHBondContact CA-SG 3.36Å; C33-C109 HydrophobicContact CB-CB 3.65Å; C33-C109 WeakPolarHBondContact CB-SG 3.29Å; C33-C109 WeakPolarHBondContact SG-CB 3.33Å; C33-C109 PolarHBondContact SG-O 2.89Å; C33-C109 CovalentContact SG-SG 2.03Å; C33-C109 PolarHBondContact SG-SG 2.87Å; L86-C109 CarbonylContact O-C 2.9Å; L86-C109 WeakPolarHBondContact O-CA 3.37Å; L86-C109 VanDerWaalsContact O-CB 3.27Å; L86-C109 WeakPolarHBondContact O-CB 3.25Å; R88-C109 PolarHBondContact O-N 2.82Å; C109-N130 PolarHBondContact O-N 2.93Å
110	V	94.3	Very high	88.3	Confident	12 Å²	12	54.5 Å²	54.5	7%	0.073	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	131.5	177.2	-173.5	0	0	0	0	110.2	L86 I90 V112 E127 L128	L86-V110 PolarHBondContact N-O 3.09Å; L86-V110 PolarHBondContact O-N 2.95Å; I90-V110 HydrophobicContact CD1-CG2 3.77Å; V110-V112 HydrophobicContact CB-CG2 4.45Å; V110-V112 HydrophobicContact CG1-CG2 3.93Å; V110-E127 HydrophobicContact CG1-CB 3.92Å; V110-E127 HydrophobicContact CG1-CG 4.22Å; V110-L128 WeakPolarHBondContact CA-O 3.27Å
111	N	94.7	Very high	88.2	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	115.7	164.3	-58.9	-68.5	0	0	0	108.1	I30 C33 I35 L83 V85 E127 L128	I30-N111 WeakPolarHBondContact CB-OD1 3.44Å; I30-N111 HydrophobicContact CG2-CB 4.4Å; I30-N111 VanDerWaalsContact CG2-OD1 3.3Å; I30-N111 WeakPolarHBondContact CG2-OD1 3.38Å; C33-N111 PolarHBondContact O-ND2 2.83Å; I35-N111 WeakPolarHBondContact CG1-ND2 3.32Å; L83-N111 HydrophobicContact CD1-CB 3.91Å; V85-N111 WeakPolarHBondContact CG1-OD1 3.5Å; V85-N111 WeakPolarHBondContact CG2-OD1 3.28Å; N111-E127 CarbonylContact O-C 3.59Å; N111-E127 WeakPolarHBondContact O-CA 3.42Å; N111-L128 HydrophobicContact CB-CB 4.26Å; N111-L128 PolarHBondContact N-O 3.4Å; N111-L128 PolarHBondContact O-N 2.72Å
112	V	94.1	Very high	88.3	Confident	18 Å²	18	54.6 Å²	54.6	11%	0.109	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.1	179.6	-171.4	0	0	0	0	108.7	S84 L86 V110 P114 Q125 E127	S84-V112 PolarHBondContact N-O 3.11Å; S84-V112 PolarHBondContact O-N 2.88Å; L86-V112 HydrophobicContact CD1-CG2 3.7Å; L86-V112 HydrophobicContact CG-CG2 4.26Å; V110-V112 HydrophobicContact CB-CG2 4.45Å; V110-V112 HydrophobicContact CG1-CG2 3.93Å; V112-P114 VanDerWaalsContact O-CD 3.26Å; V112-P114 WeakPolarHBondContact O-CD 3.16Å; V112-Q125 HydrophobicContact CG1-CG 3.8Å; V112-E127 HydrophobicContact CG1-CG 4.22Å; V112-E127 HydrophobicContact CG2-CG 4.31Å
113	I	93.5	Very high	88.5	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	87.3	178.7	-57	172.1	0	0	0	107.7	F22 V47 F54 V56 G82 L83 L115 Q125 V126	F22-I113 HydrophobicContact CE1-CG2 4.34Å; F22-I113 HydrophobicContact CZ-CG2 4.18Å; V47-I113 HydrophobicContact CG1-CD1 4.37Å; F54-I113 HydrophobicContact CE1-CG2 4.31Å; F54-I113 HydrophobicContact CZ-CG2 3.98Å; V56-I113 HydrophobicContact CG1-CD1 4.26Å; V56-I113 HydrophobicContact CG2-CD1 4.14Å; G82-I113 VanDerWaalsContact O-CA 3.23Å; G82-I113 WeakPolarHBondContact O-CA 3.4Å; G82-I113 WeakPolarHBondContact O-CG2 3.42Å; L83-I113 HydrophobicContact CD1-CG1 3.83Å; I113-L115 HydrophobicContact CG2-CD2 4.04Å; I113-L115 HydrophobicContact CG2-CG 4.37Å; I113-Q125 WeakPolarHBondContact O-CA 3.06Å; I113-V126 HydrophobicContact CB-CB 4.19Å; I113-V126 PolarHBondContact N-O 2.94Å; I113-V126 PolarHBondContact O-N 3.14Å
114	P	91.2	Very high	88.5	Confident	30 Å²	30	52.1 Å²	52.1	20%	0.195	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	139.8	169.2	30.8	-35.2	0	0	0	109.8	G81 G82 V112	G81-P114 CarbonylContact C-O 3.38Å; G81-P114 WeakPolarHBondContact CA-O 3.33Å; G82-P114 PolarHBondContact N-O 2.81Å; G82-P114 WeakPolarHBondContact O-CD 3.08Å; V112-P114 VanDerWaalsContact O-CD 3.26Å; V112-P114 WeakPolarHBondContact O-CD 3.16Å
115	L	89.4	Confident	88.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	131.7	179.5	-64	173.8	0	0	0	108.5	F22 F49 F54 A78 I113 V123 E124 V126	F22-L115 HydrophobicContact CE2-CD2 4.48Å; F22-L115 HydrophobicContact CZ-CD2 3.96Å; F49-L115 HydrophobicContact CE1-CD2 4.25Å; F49-L115 HydrophobicContact CZ-CD2 4.02Å; F54-L115 HydrophobicContact CB-CD1 4.48Å; F54-L115 HydrophobicContact CD1-CD1 3.43Å; F54-L115 VanDerWaalsContact CD1-CD1 3.43Å; F54-L115 HydrophobicContact CD1-CD2 4.28Å; F54-L115 HydrophobicContact CD1-CG 4.48Å; F54-L115 HydrophobicContact CD2-CD1 4.49Å; F54-L115 HydrophobicContact CD2-CD2 4.11Å; F54-L115 HydrophobicContact CE1-CD1 3.66Å; F54-L115 HydrophobicContact CE1-CD2 4Å; F54-L115 HydrophobicContact CE1-CG 4.36Å; F54-L115 HydrophobicContact CE2-CD2 3.86Å; F54-L115 HydrophobicContact CG-CD1 3.88Å; F54-L115 HydrophobicContact CG-CD2 4.32Å; F54-L115 HydrophobicContact CZ-CD1 4.32Å; F54-L115 HydrophobicContact CZ-CD2 3.8Å; A78-L115 HydrophobicContact CB-CB 3.89Å; I113-L115 HydrophobicContact CG2-CD2 4.04Å; I113-L115 HydrophobicContact CG2-CG 4.37Å; L115-V123 PolarHBondContact O-N 2.81Å; L115-E124 HydrophobicContact CB-CB 3.8Å; L115-E124 HydrophobicContact CD1-CB 3.86Å; L115-E124 VanDerWaalsContact CD1-OE2 3.27Å; L115-E124 WeakPolarHBondContact CD1-OE2 3.27Å; L115-E124 HydrophobicContact CG-CB 4.35Å; L115-E124 PolarHBondContact N-O 2.89Å; L115-E124 PolarHBondContact O-N 3.42Å; L115-V126 HydrophobicContact CD1-CG2 4.35Å
116	T	87.9	Confident	88.7	Confident	31 Å²	31	40.1 Å²	40.1	19%	0.19	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	155.5	-177.3	70	0	0	0	0	111.3	A78 D79 R80 S121 Q122	A78-T116 WeakPolarHBondContact CA-O 3.4Å; D79-T116 PolarHBondContact N-O 2.98Å; D79-T116 VanDerWaalsContact N-O 3.11Å; R80-T116 VanDerWaalsContact CD-OG1 3.32Å; R80-T116 WeakPolarHBondContact CD-OG1 3.44Å; R80-T116 WeakPolarHBondContact CG-OG1 3.41Å; R80-T116 PolarHBondContact N-O 2.99Å; R80-T116 PolarHBondContact O-N 3.11Å; T116-S121 CarbonylContact C-O 3.52Å; T116-S121 WeakPolarHBondContact CA-O 3.29Å; T116-S121 VanDerWaalsContact CB-O 3.23Å; T116-S121 WeakPolarHBondContact CB-O 3.3Å; T116-Q122 HydrophobicContact CG2-CB 4.28Å
117	D	86.4	Confident	88.8	Confident	20 Å²	20	39.7 Å²	39.7	11%	0.107	21%	0.207	C	C	.	.			trans	-82.5	-179.9	174.5	68.3	12.1	0	0	0	112.3	Q119 Q120 S121 V123	D117-Q119 PolarHBondContact O-N 2.84Å; D117-Q119 VanDerWaalsContact O-N 3.14Å; D117-Q119 VanDerWaalsContact OD1-C 3.3Å; D117-Q119 VanDerWaalsContact OD1-CA 3.28Å; D117-Q119 WeakPolarHBondContact OD1-CA 3.44Å; D117-Q119 WeakPolarHBondContact OD1-CB 3.32Å; D117-Q119 PolarHBondContact OD1-N 2.89Å; D117-Q120 WeakPolarHBondContact O-CA 3Å; D117-Q120 PolarHBondContact O-N 3.43Å; D117-Q120 PolarHBondContact OD1-N 3.04Å; D117-S121 PolarHBondContact N-O 3.33Å; D117-S121 WeakPolarHBondContact OD1-CB 3.5Å; D117-S121 PolarHBondContact OD1-N 2.87Å; D117-V123 HydrophobicContact CB-CG1 3.87Å
118	S	84	Confident	89	Confident	89 Å²	89	39.7 Å²	39.7	62%	0.622	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.6	174.8	61.7	0	0	0	0	114.6	D79 Q120	D79-S118 PolarHBondContact OD1-N 2.63Å; D79-S118 WeakPolarHBondContact OD2-CA 3.28Å; D79-S118 WeakPolarHBondContact OD2-CB 3.16Å; S118-Q120 VanDerWaalsContact C-N 3.33Å
119	Q	84.2	Confident	89.1	Confident	156 Å²	156	33.1 Å²	33.1	73%	0.729	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	3.6	173.6	-55.6	-168.8	14.1	0	0	112.7	D117 S121	D117-Q119 PolarHBondContact O-N 2.84Å; D117-Q119 VanDerWaalsContact O-N 3.14Å; D117-Q119 VanDerWaalsContact OD1-C 3.3Å; D117-Q119 VanDerWaalsContact OD1-CA 3.28Å; D117-Q119 WeakPolarHBondContact OD1-CA 3.44Å; D117-Q119 WeakPolarHBondContact OD1-CB 3.32Å; D117-Q119 PolarHBondContact OD1-N 2.89Å; Q119-S121 PolarHBondContact O-N 2.04Å
120	Q	80.6	Confident	89.2	Confident	153 Å²	153	33.3 Å²	33.3	72%	0.715	18%	0.179	S	C	*	.			trans	64.6	16.1	-173.4	-49.1	-178.7	-0.5	0	0	114.1	D117 S118	D117-Q120 WeakPolarHBondContact O-CA 3Å; D117-Q120 PolarHBondContact O-N 3.43Å; D117-Q120 PolarHBondContact OD1-N 3.04Å; S118-Q120 VanDerWaalsContact C-N 3.33Å
121	S	84.1	Confident	89.1	Confident	52 Å²	52	32.7 Å²	32.7	36%	0.364	18%	0.176	S	C	.	.			trans	-74.9	133.9	171.2	-61.9	0	0	0	0	109.3	T116 D117 Q119 V123	T116-S121 CarbonylContact C-O 3.52Å; T116-S121 WeakPolarHBondContact CA-O 3.29Å; T116-S121 VanDerWaalsContact CB-O 3.23Å; T116-S121 WeakPolarHBondContact CB-O 3.3Å; D117-S121 PolarHBondContact N-O 3.33Å; D117-S121 WeakPolarHBondContact OD1-CB 3.5Å; D117-S121 PolarHBondContact OD1-N 2.87Å; Q119-S121 PolarHBondContact O-N 2.04Å; S121-V123 PolarHBondContact O-N 2.85Å
122	Q	82	Confident	88.8	Confident	69 Å²	69	33.8 Å²	33.8	32%	0.322	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	116.6	173.9	-170.2	176.2	3.5	0	0	109.9	T116 E124 Y142	T116-Q122 HydrophobicContact CG2-CB 4.28Å; Q122-E124 PolarHBondContact NE2-O 2.73Å; Q122-Y142 HydrophobicContact CG-CD2 4.04Å; Q122-Y142 HydrophobicContact CG-CE2 4.2Å; Q122-Y142 WeakPolarHBondContact O-CB 3.37Å
123	V	84.1	Confident	88.3	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	-37.8	-178.5	-62.4	0	0	0	0	111.2	A78 L115 D117 S121 Y142 S143	A78-V123 HydrophobicContact CB-CG2 3.73Å; L115-V123 PolarHBondContact O-N 2.81Å; D117-V123 HydrophobicContact CB-CG1 3.87Å; S121-V123 PolarHBondContact O-N 2.85Å; V123-Y142 PolarHBondContact O-N 2.88Å; V123-S143 VanDerWaalsContact CA-O 3.23Å; V123-S143 WeakPolarHBondContact CA-O 3.21Å; V123-S143 WeakPolarHBondContact CB-O 3.49Å; V123-S143 VanDerWaalsContact CG1-O 3.24Å; V123-S143 WeakPolarHBondContact CG1-O 3.38Å
124	E	85.5	Confident	88.2	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.019	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	161.3	-172.9	-79.6	172.2	-163.4	0	0	112.2	M73 L115 Q122 K140 Y145	M73-E124 HydrophobicContact CE-CG 4.26Å; M73-E124 WeakPolarHBondContact CE-OE2 3.48Å; L115-E124 HydrophobicContact CB-CB 3.8Å; L115-E124 HydrophobicContact CD1-CB 3.86Å; L115-E124 VanDerWaalsContact CD1-OE2 3.27Å; L115-E124 WeakPolarHBondContact CD1-OE2 3.27Å; L115-E124 HydrophobicContact CG-CB 4.35Å; L115-E124 PolarHBondContact N-O 2.89Å; L115-E124 PolarHBondContact O-N 3.42Å; Q122-E124 PolarHBondContact NE2-O 2.73Å; E124-K140 CarbonylContact C-O 3.53Å; E124-K140 WeakPolarHBondContact CA-O 3.17Å; E124-Y145 WeakPolarHBondContact CG-OH 3.47Å; E124-Y145 VanDerWaalsContact OE1-CE1 3.3Å; E124-Y145 WeakPolarHBondContact OE1-CE1 3.33Å; E124-Y145 VanDerWaalsContact OE1-CZ 3.28Å; E124-Y145 PolarHBondContact OE1-OH 3.35Å
125	Q	88.6	Confident	88.3	Confident	27 Å²	27	35.4 Å²	35.4	13%	0.126	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	124.1	168	-176.6	165.1	-53.7	0	0	110.8	V112 I113 E127 I139 K140 Y142	V112-Q125 HydrophobicContact CG1-CG 3.8Å; I113-Q125 WeakPolarHBondContact O-CA 3.06Å; Q125-E127 HydrophobicContact CG-CG 4.31Å; Q125-E127 PolarHBondContact NE2-OE1 2.8Å; Q125-I139 WeakPolarHBondContact O-CA 3.36Å; Q125-K140 HydrophobicContact CB-CB 4.34Å; Q125-K140 PolarHBondContact N-O 3.16Å; Q125-K140 PolarHBondContact O-N 2.85Å; Q125-Y142 HydrophobicContact CB-CE2 3.87Å
126	V	90.9	Very high	88.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	133.2	171.9	-173.3	0	0	0	0	109	F54 M73 I113 L115 L137 A138	F54-V126 HydrophobicContact CE1-CG2 4.26Å; M73-V126 HydrophobicContact CE-CG2 4.09Å; M73-V126 HydrophobicContact SD-CG2 3.32Å; M73-V126 WeakPolarHBondContact SD-CG2 3.18Å; I113-V126 HydrophobicContact CB-CB 4.19Å; I113-V126 PolarHBondContact N-O 2.94Å; I113-V126 PolarHBondContact O-N 3.14Å; L115-V126 HydrophobicContact CD1-CG2 4.35Å; V126-L137 HydrophobicContact CG1-CD1 3.56Å; V126-A138 CarbonylContact C-O 3.58Å
127	E	92.9	Very high	88.6	Confident	22 Å²	22	34.4 Å²	34.4	10%	0.103	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	117.8	176.7	-71.4	173.9	-168.1	0	0	109.4	V110 N111 V112 Q125 L137 A138 K140	V110-E127 HydrophobicContact CG1-CB 3.92Å; V110-E127 HydrophobicContact CG1-CG 4.22Å; N111-E127 CarbonylContact O-C 3.59Å; N111-E127 WeakPolarHBondContact O-CA 3.42Å; V112-E127 HydrophobicContact CG1-CG 4.22Å; V112-E127 HydrophobicContact CG2-CG 4.31Å; Q125-E127 HydrophobicContact CG-CG 4.31Å; Q125-E127 PolarHBondContact NE2-OE1 2.8Å; E127-L137 CarbonylContact O-C 3.58Å; E127-L137 WeakPolarHBondContact O-CA 3.14Å; E127-A138 HydrophobicContact CB-CB 4.17Å; E127-A138 PolarHBondContact N-O 3.24Å; E127-A138 PolarHBondContact O-N 2.85Å; E127-K140 IonicContact OE1-NZ 3.58Å; E127-K140 PolarHBondContact OE1-NZ 2.94Å; E127-K140 IonicContact OE2-NZ 2.61Å; E127-K140 PolarHBondContact OE2-NZ 3.44Å
128	L	95	Very high	88.8	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	109.9	169.9	-59	174.1	0	0	0	108.7	I35 V45 V56 F58 I71 V110 N111 I136 L137	I35-L128 HydrophobicContact CD1-CB 3.78Å; I35-L128 WeakPolarHBondContact CD1-O 3.29Å; I35-L128 HydrophobicContact CG1-CB 3.83Å; I35-L128 HydrophobicContact CG1-CD1 4.49Å; V45-L128 HydrophobicContact CG1-CD1 4.48Å; V56-L128 HydrophobicContact CG1-CD1 4.37Å; F58-L128 HydrophobicContact CE1-CD1 4.22Å; F58-L128 HydrophobicContact CZ-CD1 4.01Å; I71-L128 HydrophobicContact CD1-CD2 3.78Å; V110-L128 WeakPolarHBondContact CA-O 3.27Å; N111-L128 HydrophobicContact CB-CB 4.26Å; N111-L128 PolarHBondContact N-O 3.4Å; N111-L128 PolarHBondContact O-N 2.72Å; L128-I136 WeakPolarHBondContact CA-O 3.5Å; L128-L137 HydrophobicContact CD2-CB 4.26Å; L128-L137 HydrophobicContact CD2-CD1 3.82Å
129	G	94.6	Very high	88.9	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	131.6	-176.8	0	0	0	0	0	112.6	S135 I136	G129-S135 CarbonylContact O-C 3.32Å; G129-S135 WeakPolarHBondContact O-CA 3.21Å; G129-S135 WeakPolarHBondContact O-CB 3.47Å; G129-I136 PolarHBondContact N-O 2.94Å; G129-I136 PolarHBondContact O-N 2.75Å
130	N	94.8	Very high	88.9	Confident	12 Å²	12	24.4 Å²	24.4	6%	0.064	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	124.4	171.7	-178.9	-77.8	0	0	0	110.6	P34 I35 G107 K108 C109 G132	P34-N130 WeakPolarHBondContact O-CB 3.32Å; P34-N130 PolarHBondContact O-ND2 3.1Å; I35-N130 HydrophobicContact CD1-CB 4.29Å; G107-N130 CarbonylContact C-O 3.54Å; G107-N130 VanDerWaalsContact CA-O 3.31Å; G107-N130 WeakPolarHBondContact CA-O 3.43Å; K108-N130 PolarHBondContact N-O 2.73Å; C109-N130 PolarHBondContact O-N 2.93Å; N130-G132 PolarHBondContact OD1-N 2.65Å
131	F	92.9	Very high	88.8	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	54.6	176.3	-70.6	-107.5	0	0	0	109.2	I90 V96 H97 L103 Y105 G107 A133 Q134 I136	I90-F131 HydrophobicContact CB-CE1 4.07Å; I90-F131 HydrophobicContact CB-CZ 4.09Å; I90-F131 HydrophobicContact CD1-CE2 4.39Å; I90-F131 HydrophobicContact CD1-CZ 3.74Å; I90-F131 HydrophobicContact CG1-CZ 4.5Å; I90-F131 HydrophobicContact CG2-CE1 3.91Å; I90-F131 HydrophobicContact CG2-CZ 4Å; V96-F131 HydrophobicContact CG1-CE1 4.01Å; V96-F131 HydrophobicContact CG1-CZ 3.79Å; H97-F131 AromaticContact CE1-CE1 3.87Å; L103-F131 HydrophobicContact CD1-CB 3.83Å; L103-F131 HydrophobicContact CD1-CD1 4.25Å; L103-F131 HydrophobicContact CD1-CG 3.99Å; L103-F131 HydrophobicContact CD2-CD1 3.38Å; L103-F131 HydrophobicContact CD2-CD2 4.35Å; L103-F131 HydrophobicContact CD2-CE1 3.56Å; L103-F131 HydrophobicContact CD2-CG 3.84Å; L103-F131 HydrophobicContact CD2-CZ 4.15Å; L103-F131 HydrophobicContact CG-CB 4.26Å; L103-F131 HydrophobicContact CG-CD1 3.85Å; L103-F131 HydrophobicContact CG-CE1 4.48Å; L103-F131 HydrophobicContact CG-CG 4.12Å; Y105-F131 WeakPolarHBondContact CB-O 3.33Å; Y105-F131 WeakPolarHBondContact CD2-O 3.25Å; Y105-F131 WeakPolarHBondContact O-CD1 3.38Å; G107-F131 VanDerWaalsContact CA-CE1 3.43Å; F131-A133 PolarHBondContact O-N 3.29Å; F131-A133 VanDerWaalsContact O-N 3.16Å; F131-Q134 CarbonylContact C-O 3.51Å; F131-Q134 WeakPolarHBondContact CA-O 3.37Å; F131-Q134 HydrophobicContact CB-CB 4.32Å; F131-Q134 PolarHBondContact N-O 3.22Å; F131-Q134 PolarHBondContact O-N 3.27Å; F131-I136 HydrophobicContact CD2-CD1 4.41Å; F131-I136 HydrophobicContact CD2-CG1 4.09Å; F131-I136 HydrophobicContact CD2-CG2 4.16Å; F131-I136 HydrophobicContact CE2-CD1 3.5Å; F131-I136 VanDerWaalsContact CE2-CD1 3.5Å; F131-I136 HydrophobicContact CE2-CG1 3.61Å; F131-I136 HydrophobicContact CE2-CG2 4.21Å; F131-I136 HydrophobicContact CZ-CD1 3.95Å
132	G	87.6	Confident	88.4	Confident	23 Å²	23	18.7 Å²	18.7	24%	0.237	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	-105.9	-178.4	0	0	0	0	0	111.9	N130	N130-G132 PolarHBondContact OD1-N 2.65Å
133	A	84.3	Confident	87.6	Confident	61 Å²	61	18.3 Å²	18.3	50%	0.504	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-30.1	174.2	0	0	0	0	0	112.2	T36 Y105 F131	T36-A133 WeakPolarHBondContact CB-O 3.3Å; T36-A133 PolarHBondContact OG1-O 2.77Å; Y105-A133 HydrophobicContact CE2-CB 4.11Å; F131-A133 PolarHBondContact O-N 3.29Å; F131-A133 VanDerWaalsContact O-N 3.16Å
134	Q	90.7	Very high	86.5	Confident	24 Å²	24	19.9 Å²	19.9	11%	0.112	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	160.8	178.6	-67.6	176.1	-88	0	0	110.9	N102 L103 F131 D179	N102-Q134 PolarHBondContact O-NE2 2.04Å; L103-Q134 HydrophobicContact CD1-CB 3.68Å; L103-Q134 HydrophobicContact CD1-CG 4.4Å; F131-Q134 CarbonylContact C-O 3.51Å; F131-Q134 WeakPolarHBondContact CA-O 3.37Å; F131-Q134 HydrophobicContact CB-CB 4.32Å; F131-Q134 PolarHBondContact N-O 3.22Å; F131-Q134 PolarHBondContact O-N 3.27Å; Q134-D179 PolarHBondContact NE2-OD2 3Å
135	S	93.3	Very high	85.5	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	150.9	170.8	-62.6	0	0	0	0	110.5	T36 G129 D179 V180	T36-S135 PolarHBondContact N-OG 2.89Å; T36-S135 VanDerWaalsContact O-CB 3.29Å; T36-S135 WeakPolarHBondContact O-CB 3.4Å; G129-S135 CarbonylContact O-C 3.32Å; G129-S135 WeakPolarHBondContact O-CA 3.21Å; G129-S135 WeakPolarHBondContact O-CB 3.47Å; S135-D179 VanDerWaalsContact O-OD1 3.13Å; S135-V180 PolarHBondContact O-N 3.1Å
136	I	92.6	Very high	83.8	Confident	7 Å²	7	26.6 Å²	26.6	4%	0.036	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	152.6	-179.4	64.5	167.5	0	0	0	111	V96 L100 L103 L128 G129 F131 I177 T178	V96-I136 HydrophobicContact CG1-CD1 4.07Å; L100-I136 HydrophobicContact CD1-CB 4.43Å; L100-I136 HydrophobicContact CD1-CG2 3.62Å; L103-I136 HydrophobicContact CD1-CG2 4.11Å; L103-I136 HydrophobicContact CD2-CG2 4.04Å; L128-I136 WeakPolarHBondContact CA-O 3.5Å; G129-I136 PolarHBondContact N-O 2.94Å; G129-I136 PolarHBondContact O-N 2.75Å; F131-I136 HydrophobicContact CD2-CD1 4.41Å; F131-I136 HydrophobicContact CD2-CG1 4.09Å; F131-I136 HydrophobicContact CD2-CG2 4.16Å; F131-I136 HydrophobicContact CE2-CD1 3.5Å; F131-I136 VanDerWaalsContact CE2-CD1 3.5Å; F131-I136 HydrophobicContact CE2-CG1 3.61Å; F131-I136 HydrophobicContact CE2-CG2 4.21Å; F131-I136 HydrophobicContact CZ-CD1 3.95Å; I136-I177 HydrophobicContact CD1-CD1 3.81Å; I136-I177 HydrophobicContact CD1-CG1 4.25Å; I136-T178 CarbonylContact C-O 3.57Å; I136-T178 WeakPolarHBondContact CA-O 3.07Å; I136-T178 WeakPolarHBondContact CB-O 3.38Å
137	L	92.3	Very high	82	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.8	160	167.7	60.5	0	0	0	107.3	I71 V126 E127 L128 I139 I177 T178 V180	I71-L137 HydrophobicContact CD1-CD1 4.09Å; I71-L137 HydrophobicContact CD1-CD2 3.99Å; I71-L137 HydrophobicContact CG1-CD2 4.17Å; I71-L137 HydrophobicContact CG2-CD2 3.98Å; V126-L137 HydrophobicContact CG1-CD1 3.56Å; E127-L137 CarbonylContact O-C 3.58Å; E127-L137 WeakPolarHBondContact O-CA 3.14Å; L128-L137 HydrophobicContact CD2-CB 4.26Å; L128-L137 HydrophobicContact CD2-CD1 3.82Å; L137-I139 HydrophobicContact CD1-CD1 4.2Å; L137-I139 HydrophobicContact CD1-CG1 3.82Å; L137-I139 HydrophobicContact CD2-CD1 4.2Å; L137-I139 HydrophobicContact CG-CD1 4.3Å; L137-I139 HydrophobicContact CG-CG1 4.16Å; L137-I177 CarbonylContact O-C 3.58Å; L137-I177 WeakPolarHBondContact O-CA 3.13Å; L137-T178 HydrophobicContact CB-CG2 3.96Å; L137-T178 HydrophobicContact CD2-CG2 4.4Å; L137-T178 HydrophobicContact CG-CG2 4.41Å; L137-T178 PolarHBondContact N-O 2.82Å; L137-T178 PolarHBondContact O-N 2.99Å; L137-V180 HydrophobicContact CB-CG1 3.52Å; L137-V180 HydrophobicContact CB-CG2 4.37Å; L137-V180 HydrophobicContact CD2-CG1 4.27Å
138	A	89.9	Confident	80.1	Confident	8 Å²	8	36 Å²	36	7%	0.066	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.9	164.4	0	0	0	0	0	110.5	V126 E127 V176 I177	V126-A138 CarbonylContact C-O 3.58Å; E127-A138 HydrophobicContact CB-CB 4.17Å; E127-A138 PolarHBondContact N-O 3.24Å; E127-A138 PolarHBondContact O-N 2.85Å; A138-V176 CarbonylContact C-O 3.42Å; A138-V176 WeakPolarHBondContact CA-O 3.41Å; A138-I177 HydrophobicContact CB-CB 4.23Å; A138-I177 HydrophobicContact CB-CD1 4.47Å; A138-I177 HydrophobicContact CB-CG1 4.04Å
139	I	86.8	Confident	78.1	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.015	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	128.6	179.2	-62.9	175.3	0	0	0	107.8	M73 Q125 L137 A153 F167 G175 V176	M73-I139 HydrophobicContact CE-CD1 4.39Å; M73-I139 HydrophobicContact CE-CG2 3.66Å; M73-I139 HydrophobicContact CG-CD1 4.34Å; M73-I139 HydrophobicContact SD-CD1 4.05Å; M73-I139 HydrophobicContact SD-CG1 4.49Å; Q125-I139 WeakPolarHBondContact O-CA 3.36Å; L137-I139 HydrophobicContact CD1-CD1 4.2Å; L137-I139 HydrophobicContact CD1-CG1 3.82Å; L137-I139 HydrophobicContact CD2-CD1 4.2Å; L137-I139 HydrophobicContact CG-CD1 4.3Å; L137-I139 HydrophobicContact CG-CG1 4.16Å; I139-A153 HydrophobicContact CD1-CB 3.47Å; I139-A153 VanDerWaalsContact CD1-CB 3.47Å; I139-F167 HydrophobicContact CB-CE1 4.22Å; I139-F167 HydrophobicContact CB-CZ 3.93Å; I139-F167 HydrophobicContact CD1-CZ 4.19Å; I139-F167 HydrophobicContact CG2-CE1 4.17Å; I139-F167 HydrophobicContact CG2-CZ 3.93Å; I139-G175 CarbonylContact O-C 3.52Å; I139-G175 WeakPolarHBondContact O-CA 3.48Å; I139-V176 PolarHBondContact N-O 2.86Å; I139-V176 PolarHBondContact O-N 3.05Å
140	K	83.8	Confident	76.3	Confident	44 Å²	44	45.5 Å²	45.5	19%	0.191	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	140.5	177	-65.6	167	-171.4	156.1	0	110	E124 Q125 E127 Y142	E124-K140 CarbonylContact C-O 3.53Å; E124-K140 WeakPolarHBondContact CA-O 3.17Å; Q125-K140 HydrophobicContact CB-CB 4.34Å; Q125-K140 PolarHBondContact N-O 3.16Å; Q125-K140 PolarHBondContact O-N 2.85Å; E127-K140 IonicContact OE1-NZ 3.58Å; E127-K140 PolarHBondContact OE1-NZ 2.94Å; E127-K140 IonicContact OE2-NZ 2.61Å; E127-K140 PolarHBondContact OE2-NZ 3.44Å; K140-Y142 HydrophobicContact CB-CE2 4.14Å
141	T	78.6	Confident	75	Confident	11 Å²	11	45.8 Å²	45.8	7%	0.067	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	131.8	-178.3	55.2	0	0	0	0	109	Y145 N173	T141-Y145 HydrophobicContact CG2-CE2 4.02Å; T141-Y145 VanDerWaalsContact CG2-OH 3.23Å; T141-Y145 WeakPolarHBondContact CG2-OH 3Å; T141-N173 PolarHBondContact O-N 2.81Å
142	Y	74.8	Confident	74	Confident	74 Å²	74	47.1 Å²	47.1	29%	0.29	28%	0.282	S	S	.	.			trans	-115.7	-54.2	-170.4	-63.4	-78.6	0	0	0	112.6	Q122 V123 Q125 K140	Q122-Y142 HydrophobicContact CG-CD2 4.04Å; Q122-Y142 HydrophobicContact CG-CE2 4.2Å; Q122-Y142 WeakPolarHBondContact O-CB 3.37Å; V123-Y142 PolarHBondContact O-N 2.88Å; Q125-Y142 HydrophobicContact CB-CE2 3.87Å; K140-Y142 HydrophobicContact CB-CE2 4.14Å
143	S	66.5	Low	73.8	Confident	62 Å²	62	46.1 Å²	46.1	43%	0.434	27%	0.271	S	S	.	.	S	Bend	trans	-168.4	175.1	-179.2	50.2	0	0	0	0	110.3	V123	V123-S143 VanDerWaalsContact CA-O 3.23Å; V123-S143 WeakPolarHBondContact CA-O 3.21Å; V123-S143 WeakPolarHBondContact CB-O 3.49Å; V123-S143 VanDerWaalsContact CG1-O 3.24Å; V123-S143 WeakPolarHBondContact CG1-O 3.38Å
144	G	60.9	Low	74	Confident	33 Å²	33	44.4 Å²	44.4	34%	0.34	25%	0.254	S	S	.	.			trans	101.8	1.7	168.9	0	0	0	0	0	116.4	T77	T77-G144 WeakPolarHBondContact CB-O 3.49Å; T77-G144 WeakPolarHBondContact CG2-O 3.36Å; T77-G144 PolarHBondContact OG1-O 3.36Å
145	Y	62.9	Low	74	Confident	41 Å²	41	43.3 Å²	43.3	16%	0.161	25%	0.249	C	C	.	.			trans	-91.9	132.9	177	-58.1	-76	0	0	0	112.1	G75 G76 E124 T141	G75-Y145 VanDerWaalsContact O-CD1 3.31Å; G75-Y145 WeakPolarHBondContact O-CD1 3.24Å; G76-Y145 VanDerWaalsContact CA-CE1 3.45Å; E124-Y145 WeakPolarHBondContact CG-OH 3.47Å; E124-Y145 VanDerWaalsContact OE1-CE1 3.3Å; E124-Y145 WeakPolarHBondContact OE1-CE1 3.33Å; E124-Y145 VanDerWaalsContact OE1-CZ 3.28Å; E124-Y145 PolarHBondContact OE1-OH 3.35Å; T141-Y145 HydrophobicContact CG2-CE2 4.02Å; T141-Y145 VanDerWaalsContact CG2-OH 3.23Å; T141-Y145 WeakPolarHBondContact CG2-OH 3Å
146	T	53.1	Low	73.9	Confident	131 Å²	131	44.4 Å²	44.4	80%	0.804	25%	0.254	S	S	*	.			trans	-98.5	-11.2	-176.3	51.2	0	0	0	0	114.4
147	D	53.7	Low	73.7	Confident	88 Å²	88	44.2 Å²	44.2	47%	0.471	25%	0.253	S	S	.	.			trans	-109.9	138.2	-170.1	-132.7	-45.7	0	0	0	111.7	N149	D147-N149 PolarHBondContact O-N 2.93Å; D147-N149 PolarHBondContact OD1-ND2 3.27Å
148	V	53.3	Low	73.5	Confident	132 Å²	132	46.7 Å²	46.7	80%	0.8	27%	0.266	S	S	*	.			trans	-80.4	-5.2	179.4	-161.6	0	0	0	0	111.2
149	N	52.7	Low	73.3	Confident	109 Å²	109	47.9 Å²	47.9	58%	0.583	28%	0.279	S	S	*	.	S	Bend	trans	-69.8	147.4	-177.4	-74.6	-57.1	0	0	0	113.1	D147 Q151	D147-N149 PolarHBondContact O-N 2.93Å; D147-N149 PolarHBondContact OD1-ND2 3.27Å; N149-Q151 PolarHBondContact O-N 3.01Å
150	V	57	Low	73.4	Confident	90 Å²	90	52.7 Å²	52.7	55%	0.545	30%	0.304	S	S	.	.			trans	-63	115.2	177.2	170	0	0	0	0	110	T166	V150-T166 HydrophobicContact CG1-CG2 3.07Å
151	Q	67.8	Low	73.6	Confident	19 Å²	19	53.9 Å²	53.9	9%	0.089	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	159.8	-173.6	-65.7	-166.8	-5.9	0	0	113.1	G75 N149 T166 F167	G75-Q151 PolarHBondContact O-NE2 3.13Å; N149-Q151 PolarHBondContact O-N 3.01Å; Q151-T166 CarbonylContact O-C 3.59Å; Q151-T166 VanDerWaalsContact O-CA 3.29Å; Q151-T166 WeakPolarHBondContact O-CA 3.47Å; Q151-F167 PolarHBondContact N-O 3.3Å; Q151-F167 PolarHBondContact O-N 2.87Å
152	V	71.3	Confident	74	Confident	28 Å²	28	55 Å²	55	17%	0.17	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134.5	-163.7	173.9	0	0	0	0	112.1	S74 D154 K164 Q165	S74-V152 PolarHBondContact N-O 2.68Å; V152-D154 VanDerWaalsContact CG1-OD1 3.32Å; V152-D154 WeakPolarHBondContact CG1-OD1 3.45Å; V152-K164 HydrophobicContact CG1-CD 4.29Å; V152-K164 HydrophobicContact CG1-CG 4Å; V152-Q165 WeakPolarHBondContact CA-O 3.08Å
153	A	83.6	Confident	74.6	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.008	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	117.8	157.8	0	0	0	0	0	109.7	L72 M73 I139 Q165 F167	L72-A153 CarbonylContact O-C 3.5Å; L72-A153 VanDerWaalsContact O-CA 3.31Å; L72-A153 WeakPolarHBondContact O-CA 3.28Å; M73-A153 HydrophobicContact CG-CB 4.01Å; I139-A153 HydrophobicContact CD1-CB 3.47Å; I139-A153 VanDerWaalsContact CD1-CB 3.47Å; A153-Q165 HydrophobicContact CB-CB 4.39Å; A153-Q165 PolarHBondContact N-O 2.88Å; A153-Q165 PolarHBondContact O-N 3.47Å; A153-Q165 PolarHBondContact O-OE1 3.03Å; A153-F167 HydrophobicContact CB-CE2 4.02Å
154	D	88	Confident	75.5	Confident	26 Å²	26	55.9 Å²	55.9	14%	0.139	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119.2	178.6	-73.2	-34.2	0	0	0	109.8	I71 L72 V152 T161 K164	I71-D154 CarbonylContact C-O 3.57Å; I71-D154 WeakPolarHBondContact CA-O 3.47Å; L72-D154 HydrophobicContact CB-CB 4.45Å; L72-D154 PolarHBondContact N-O 2.92Å; L72-D154 PolarHBondContact O-N 2.76Å; V152-D154 VanDerWaalsContact CG1-OD1 3.32Å; V152-D154 WeakPolarHBondContact CG1-OD1 3.45Å; D154-T161 HydrophobicContact CB-CG2 3.87Å; D154-K164 VanDerWaalsContact OD1-CG 3.3Å; D154-K164 WeakPolarHBondContact OD1-CG 3.17Å
155	A	90.4	Very high	76.4	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	124.3	166.7	0	0	0	0	0	109.1	Y37 Y38 V162 S163	Y37-A155 WeakPolarHBondContact OH-CB 3.12Å; Y38-A155 HydrophobicContact CE2-CB 4.25Å; A155-V162 VanDerWaalsContact O-CG2 3.24Å; A155-V162 WeakPolarHBondContact O-CG2 3.4Å; A155-V162 PolarHBondContact O-N 3.21Å; A155-S163 PolarHBondContact N-O 2.98Å; A155-S163 PolarHBondContact O-N 3.13Å
156	Q	91.1	Very high	77	Confident	24 Å²	24	56.8 Å²	56.8	11%	0.112	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	147.5	-178	-55.9	-163.6	-39.9	0	0	112.3	Y37 D69 C70 L72 L160 T161	Y37-Q156 VanDerWaalsContact CE1-O 3.24Å; Y37-Q156 WeakPolarHBondContact CE1-O 3.48Å; Y37-Q156 PolarHBondContact OH-N 2.67Å; Y37-Q156 PolarHBondContact OH-O 3.43Å; D69-Q156 WeakPolarHBondContact CA-O 3.37Å; C70-Q156 HydrophobicContact CB-CB 4.5Å; C70-Q156 PolarHBondContact N-O 3.37Å; C70-Q156 PolarHBondContact O-N 2.98Å; L72-Q156 HydrophobicContact CD1-CG 4.34Å; Q156-L160 CarbonylContact C-O 3.6Å; Q156-L160 WeakPolarHBondContact CA-O 3.5Å; Q156-T161 PolarHBondContact NE2-OG1 3.07Å; Q156-T161 VanDerWaalsContact NE2-OG1 3.08Å
157	V	90.3	Very high	77.8	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.012	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	127.2	171.6	175	0	0	0	0	108	Y37 Y38 D69 G159 L160 V162 S210	Y37-V157 HydrophobicContact CE1-CG2 3.88Å; Y38-V157 HydrophobicContact CD1-CG2 4.14Å; Y38-V157 HydrophobicContact CD2-CG2 3.73Å; Y38-V157 HydrophobicContact CE2-CG2 4.45Å; Y38-V157 HydrophobicContact CG-CG2 3.55Å; D69-V157 WeakPolarHBondContact OD1-CA 3.28Å; V157-G159 PolarHBondContact O-N 2.9Å; V157-G159 VanDerWaalsContact O-N 3.12Å; V157-L160 PolarHBondContact N-O 3.36Å; V157-L160 WeakPolarHBondContact O-CB 3.14Å; V157-L160 PolarHBondContact O-N 3.32Å; V157-V162 HydrophobicContact CB-CG1 4.45Å; V157-V162 HydrophobicContact CG2-CG2 3.9Å; V157-S210 WeakPolarHBondContact CB-O 3.43Å; V157-S210 VanDerWaalsContact CG1-O 3.29Å; V157-S210 WeakPolarHBondContact CG1-O 3.19Å
158	N	87.7	Confident	78.2	Confident	55 Å²	55	52.8 Å²	52.8	29%	0.294	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	33.1	-170.5	-58.8	-45.4	0	0	0	113.3	K59 Q67 N68 D69 L160	K59-N158 PolarHBondContact NZ-OD1 3.19Å; Q67-N158 HydrophobicContact CB-CB 4.32Å; N68-N158 CarbonylContact O-C 3.17Å; N68-N158 PolarHBondContact O-N 3.41Å; D69-N158 PolarHBondContact OD1-N 2.78Å; N158-L160 VanDerWaalsContact C-N 3.32Å
159	G	85.9	Confident	78.4	Confident	32 Å²	32	48.6 Å²	48.6	33%	0.33	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	-0.8	-176.8	0	0	0	0	0	115.9	N68 V157	N68-G159 PolarHBondContact O-N 2.87Å; V157-G159 PolarHBondContact O-N 2.9Å; V157-G159 VanDerWaalsContact O-N 3.12Å
160	L	87.4	Confident	78.6	Confident	104 Å²	104	47.8 Å²	47.8	55%	0.545	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	127.1	173.6	-61.9	175.6	0	0	0	110	Q156 V157 N158 V162	Q156-L160 CarbonylContact C-O 3.6Å; Q156-L160 WeakPolarHBondContact CA-O 3.5Å; V157-L160 PolarHBondContact N-O 3.36Å; V157-L160 WeakPolarHBondContact O-CB 3.14Å; V157-L160 PolarHBondContact O-N 3.32Å; N158-L160 VanDerWaalsContact C-N 3.32Å; L160-V162 PolarHBondContact O-N 3Å
161	T	88.5	Confident	78.7	Confident	70 Å²	70	48.9 Å²	48.9	43%	0.429	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	118	174.5	-59	0	0	0	0	110.6	D154 Q156	D154-T161 HydrophobicContact CB-CG2 3.87Å; Q156-T161 PolarHBondContact NE2-OG1 3.07Å; Q156-T161 VanDerWaalsContact NE2-OG1 3.08Å
162	V	87.8	Confident	78.2	Confident	35 Å²	35	50.7 Å²	50.7	21%	0.212	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-20.1	-174.5	-71.2	0	0	0	0	114.1	Y38 A155 V157 L160 S210	Y38-V162 HydrophobicContact CD1-CG2 4.26Å; Y38-V162 HydrophobicContact CD2-CG2 4.5Å; Y38-V162 HydrophobicContact CE1-CB 4.22Å; Y38-V162 HydrophobicContact CE1-CG2 3.65Å; Y38-V162 HydrophobicContact CE2-CG2 3.94Å; Y38-V162 VanDerWaalsContact CZ-CG2 3.47Å; A155-V162 VanDerWaalsContact O-CG2 3.24Å; A155-V162 WeakPolarHBondContact O-CG2 3.4Å; A155-V162 PolarHBondContact O-N 3.21Å; V157-V162 HydrophobicContact CB-CG1 4.45Å; V157-V162 HydrophobicContact CG2-CG2 3.9Å; L160-V162 PolarHBondContact O-N 3Å; V162-S210 WeakPolarHBondContact CG1-O 3.25Å
163	S	85.9	Confident	77.6	Confident	25 Å²	25	54.6 Å²	54.6	18%	0.175	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	140.9	170.1	-179.1	0	0	0	0	109.5	Y38 A155 Q165	Y38-S163 WeakPolarHBondContact OH-CB 3.24Å; A155-S163 PolarHBondContact N-O 2.98Å; A155-S163 PolarHBondContact O-N 3.13Å; S163-Q165 PolarHBondContact OG-NE2 3.44Å
164	K	85.8	Confident	76.7	Confident	129 Å²	129	56.5 Å²	56.5	56%	0.561	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	117.3	178.1	-175.1	166.7	-157.9	-179.2	0	108.7	V152 D154	V152-K164 HydrophobicContact CG1-CD 4.29Å; V152-K164 HydrophobicContact CG1-CG 4Å; D154-K164 VanDerWaalsContact OD1-CG 3.3Å; D154-K164 WeakPolarHBondContact OD1-CG 3.17Å
165	Q	79.7	Confident	76	Confident	13 Å²	13	56 Å²	56	6%	0.061	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	145.9	170	-56.3	94.1	54.7	0	0	109.6	V152 A153 S163 F167 V176 T178	V152-Q165 WeakPolarHBondContact CA-O 3.08Å; A153-Q165 HydrophobicContact CB-CB 4.39Å; A153-Q165 PolarHBondContact N-O 2.88Å; A153-Q165 PolarHBondContact O-N 3.47Å; A153-Q165 PolarHBondContact O-OE1 3.03Å; S163-Q165 PolarHBondContact OG-NE2 3.44Å; Q165-F167 HydrophobicContact CB-CE2 3.93Å; Q165-F167 HydrophobicContact CB-CZ 4.1Å; Q165-V176 HydrophobicContact CB-CG1 4.49Å; Q165-V176 HydrophobicContact CG-CG1 4.33Å; Q165-T178 HydrophobicContact CG-CG2 4.5Å
166	T	75.8	Confident	75.5	Confident	79 Å²	79	58.4 Å²	58.4	49%	0.485	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	133.8	-165.6	-61.2	0	0	0	0	109.8	V150 Q151	V150-T166 HydrophobicContact CG1-CG2 3.07Å; Q151-T166 CarbonylContact O-C 3.59Å; Q151-T166 VanDerWaalsContact O-CA 3.29Å; Q151-T166 WeakPolarHBondContact O-CA 3.47Å
167	F	71	Confident	75.3	Confident	22 Å²	22	59 Å²	59	10%	0.096	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.1	-168.9	-53.1	-101	0	0	0	111.4	I139 Q151 A153 Q165 V176	I139-F167 HydrophobicContact CB-CE1 4.22Å; I139-F167 HydrophobicContact CB-CZ 3.93Å; I139-F167 HydrophobicContact CD1-CZ 4.19Å; I139-F167 HydrophobicContact CG2-CE1 4.17Å; I139-F167 HydrophobicContact CG2-CZ 3.93Å; Q151-F167 PolarHBondContact N-O 3.3Å; Q151-F167 PolarHBondContact O-N 2.87Å; A153-F167 HydrophobicContact CB-CE2 4.02Å; Q165-F167 HydrophobicContact CB-CE2 3.93Å; Q165-F167 HydrophobicContact CB-CZ 4.1Å; F167-V176 HydrophobicContact CD1-CB 4.39Å; F167-V176 HydrophobicContact CD1-CG2 3.69Å; F167-V176 HydrophobicContact CE1-CB 3.51Å; F167-V176 HydrophobicContact CE1-CG2 3.3Å; F167-V176 HydrophobicContact CZ-CB 3.93Å; F167-V176 HydrophobicContact CZ-CG2 4Å
168	Q	61.9	Low	75.2	Confident	113 Å²	113	59.5 Å²	59.5	53%	0.528	34%	0.339	S	S	.	.			trans	-95.1	135.4	168	-63.1	-166.8	4.5	0	0	110.4	S170 E171	Q168-S170 WeakPolarHBondContact CB-OG 3.43Å; Q168-S170 PolarHBondContact O-N 2.86Å; Q168-S170 PolarHBondContact OE1-OG 3.37Å; Q168-E171 HydrophobicContact CB-CG 4.23Å; Q168-E171 PolarHBondContact O-N 2.84Å
169	T	57.7	Low	75.2	Confident	45 Å²	45	57 Å²	57	28%	0.276	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-66.7	-19.7	179.4	43.7	0	0	0	0	113.6	E171	T169-E171 VanDerWaalsContact C-N 3.29Å; T169-E171 PolarHBondContact O-N 2.82Å
170	S	56.9	Low	75.5	Confident	92 Å²	92	55.4 Å²	55.4	64%	0.643	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-68.7	-20	169.7	49.3	0	0	0	0	114.3	Q168	Q168-S170 WeakPolarHBondContact CB-OG 3.43Å; Q168-S170 PolarHBondContact O-N 2.86Å; Q168-S170 PolarHBondContact OE1-OG 3.37Å
171	E	58.1	Low	75.5	Confident	112 Å²	112	51.3 Å²	51.3	52%	0.523	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-99.4	20.9	-176.4	-61.9	-168.7	146.2	0	0	113.6	Q168 T169 N173 S174	Q168-E171 HydrophobicContact CB-CG 4.23Å; Q168-E171 PolarHBondContact O-N 2.84Å; T169-E171 VanDerWaalsContact C-N 3.29Å; T169-E171 PolarHBondContact O-N 2.82Å; E171-N173 PolarHBondContact O-N 3.35Å; E171-S174 WeakPolarHBondContact O-CB 3.49Å; E171-S174 PolarHBondContact O-N 3.05Å; E171-S174 PolarHBondContact O-OG 2.86Å
172	T	57.5	Low	75.6	Confident	57 Å²	57	48.1 Å²	48.1	35%	0.35	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	136.6	176.2	35.8	0	0	0	0	111.8
173	N	58.8	Low	75.6	Confident	111 Å²	111	46.5 Å²	46.5	59%	0.594	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	0.1	-170.6	-45.4	-87.6	0	0	0	118.2	T141 E171	T141-N173 PolarHBondContact O-N 2.81Å; E171-N173 PolarHBondContact O-N 3.35Å
174	S	63.6	Low	75.5	Confident	40 Å²	40	48.7 Å²	48.7	28%	0.28	27%	0.265	S	S	.	.			trans	-75.9	-56.5	171.3	67.2	0	0	0	0	111.7	F4 E171	F4-S174 WeakPolarHBondContact CD1-O 3.31Å; F4-S174 WeakPolarHBondContact CE1-O 3.2Å; E171-S174 WeakPolarHBondContact O-CB 3.49Å; E171-S174 PolarHBondContact O-N 3.05Å; E171-S174 PolarHBondContact O-OG 2.86Å
175	G	73.8	Confident	75.3	Confident	17 Å²	17	45.8 Å²	45.8	18%	0.175	25%	0.253	C	S	.	.			trans	72.6	151	-175.3	0	0	0	0	0	113.6	I139	I139-G175 CarbonylContact O-C 3.52Å; I139-G175 WeakPolarHBondContact O-CA 3.48Å
176	V	80.3	Confident	75.3	Confident	50 Å²	50	49.4 Å²	49.4	30%	0.303	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	144.5	177.4	174.5	0	0	0	0	109.3	A138 I139 Q165 F167	A138-V176 CarbonylContact C-O 3.42Å; A138-V176 WeakPolarHBondContact CA-O 3.41Å; I139-V176 PolarHBondContact N-O 2.86Å; I139-V176 PolarHBondContact O-N 3.05Å; Q165-V176 HydrophobicContact CB-CG1 4.49Å; Q165-V176 HydrophobicContact CG-CG1 4.33Å; F167-V176 HydrophobicContact CD1-CB 4.39Å; F167-V176 HydrophobicContact CD1-CG2 3.69Å; F167-V176 HydrophobicContact CE1-CB 3.51Å; F167-V176 HydrophobicContact CE1-CG2 3.3Å; F167-V176 HydrophobicContact CZ-CB 3.93Å; F167-V176 HydrophobicContact CZ-CG2 4Å
177	I	86.7	Confident	75.2	Confident	35 Å²	35	48.3 Å²	48.3	18%	0.179	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	133.6	174.6	-168.6	171	0	0	0	109.5	V96 L99 L100 I136 L137 A138	V96-I177 HydrophobicContact CB-CD1 4.15Å; V96-I177 HydrophobicContact CG1-CD1 3.73Å; V96-I177 HydrophobicContact CG2-CD1 3.85Å; L99-I177 HydrophobicContact CB-CG2 3.67Å; L99-I177 HydrophobicContact CD1-CG2 3.81Å; L99-I177 HydrophobicContact CG-CG2 4.32Å; L100-I177 HydrophobicContact CD1-CD1 4.32Å; L100-I177 HydrophobicContact CD1-CG1 3.92Å; L100-I177 HydrophobicContact CD2-CG2 4.5Å; L100-I177 HydrophobicContact CG-CG1 4.39Å; L100-I177 HydrophobicContact CG-CG2 4.31Å; I136-I177 HydrophobicContact CD1-CD1 3.81Å; I136-I177 HydrophobicContact CD1-CG1 4.25Å; L137-I177 CarbonylContact O-C 3.58Å; L137-I177 WeakPolarHBondContact O-CA 3.13Å; A138-I177 HydrophobicContact CB-CB 4.23Å; A138-I177 HydrophobicContact CB-CD1 4.47Å; A138-I177 HydrophobicContact CB-CG1 4.04Å
178	T	88	Confident	75.7	Confident	13 Å²	13	48.6 Å²	48.6	8%	0.08	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	158.1	178.2	-172.2	0	0	0	0	111.2	I136 L137 Q165 V180 R184	I136-T178 CarbonylContact C-O 3.57Å; I136-T178 WeakPolarHBondContact CA-O 3.07Å; I136-T178 WeakPolarHBondContact CB-O 3.38Å; L137-T178 HydrophobicContact CB-CG2 3.96Å; L137-T178 HydrophobicContact CD2-CG2 4.4Å; L137-T178 HydrophobicContact CG-CG2 4.41Å; L137-T178 PolarHBondContact N-O 2.82Å; L137-T178 PolarHBondContact O-N 2.99Å; Q165-T178 HydrophobicContact CG-CG2 4.5Å; T178-V180 HydrophobicContact CG2-CG1 3.89Å; T178-R184 PolarHBondContact OG1-NE 3.37Å
179	D	88.8	Confident	76.8	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.011	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	129.2	167.9	-169.2	-29	0	0	0	107.1	L100 Q134 S135 S181 R184	L100-D179 HydrophobicContact CD1-CB 4.49Å; Q134-D179 PolarHBondContact NE2-OD2 3Å; S135-D179 VanDerWaalsContact O-OD1 3.13Å; D179-S181 WeakPolarHBondContact OD1-CB 3.33Å; D179-S181 PolarHBondContact OD1-N 3Å; D179-S181 PolarHBondContact OD1-OG 3.24Å; D179-R184 PolarHBondContact O-NE 3.06Å
180	V	90.8	Very high	78.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.263	C	S	.	.			trans	-116.5	11.1	179.5	-63	0	0	0	0	112.4	Y37 Y38 S135 L137 T178 G182	Y37-V180 CarbonylContact C-O 3.44Å; Y37-V180 WeakPolarHBondContact CA-O 3.08Å; Y37-V180 HydrophobicContact CD2-CB 3.96Å; Y37-V180 HydrophobicContact CD2-CG2 4.07Å; Y37-V180 HydrophobicContact CE2-CB 4.24Å; Y38-V180 WeakPolarHBondContact CD2-O 3.22Å; Y38-V180 HydrophobicContact CE2-CB 4.3Å; Y38-V180 PolarHBondContact N-O 2.63Å; S135-V180 PolarHBondContact O-N 3.1Å; L137-V180 HydrophobicContact CB-CG1 3.52Å; L137-V180 HydrophobicContact CB-CG2 4.37Å; L137-V180 HydrophobicContact CD2-CG1 4.27Å; T178-V180 HydrophobicContact CG2-CG1 3.89Å; V180-G182 VanDerWaalsContact C-N 3.29Å; V180-G182 PolarHBondContact O-N 3.29Å
181	S	88.9	Confident	79.5	Confident	18 Å²	18	45.5 Å²	45.5	13%	0.126	26%	0.263	C	S	.	.	S	Bend	trans	-75.6	-16.3	177.2	61.6	0	0	0	0	113.9	G39 D179	G39-S181 PolarHBondContact N-O 2.82Å; D179-S181 WeakPolarHBondContact OD1-CB 3.33Å; D179-S181 PolarHBondContact OD1-N 3Å; D179-S181 PolarHBondContact OD1-OG 3.24Å
182	G	89.5	Confident	80.9	Confident	3 Å²	3	41.4 Å²	41.4	3%	0.031	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	-169.3	176.8	0	0	0	0	0	113.6	Y38 V180 Y190	Y38-G182 VanDerWaalsContact CE1-O 3.3Å; Y38-G182 WeakPolarHBondContact CE1-O 3.38Å; V180-G182 VanDerWaalsContact C-N 3.29Å; V180-G182 PolarHBondContact O-N 3.29Å; G182-Y190 CarbonylContact C-O 3.56Å; G182-Y190 VanDerWaalsContact CA-O 3.32Å; G182-Y190 WeakPolarHBondContact CA-O 3.08Å
183	C	88.3	Confident	82.4	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.007	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	159.7	-177.9	-42.2	0	0	0	0	112.3	A189 Y190 C207 G211 A213	C183-A189 WeakPolarHBondContact O-CA 3.19Å; C183-Y190 PolarHBondContact N-O 2.98Å; C183-Y190 PolarHBondContact O-N 3.07Å; C183-C207 HydrophobicContact CB-CB 3.78Å; C183-C207 WeakPolarHBondContact CB-SG 3.09Å; C183-C207 PolarHBondContact N-SG 3.11Å; C183-C207 VanDerWaalsContact N-SG 3.36Å; C183-C207 WeakPolarHBondContact SG-CA 3.3Å; C183-C207 WeakPolarHBondContact SG-CB 3.39Å; C183-C207 CovalentContact SG-SG 2.01Å; C183-C207 PolarHBondContact SG-SG 2.97Å; C183-G211 VanDerWaalsContact SG-CA 3.56Å; C183-G211 PolarHBondContact SG-O 3.39Å; C183-A213 HydrophobicContact CB-CB 3.76Å
184	R	82.8	Confident	83.9	Confident	70 Å²	70	41 Å²	41	26%	0.264	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.7	167.1	-74.5	179.5	166.9	-88.8	-0.2	111.8	T178 D179 G187 L188	T178-R184 PolarHBondContact OG1-NE 3.37Å; D179-R184 PolarHBondContact O-NE 3.06Å; R184-G187 PolarHBondContact NH1-O 3.19Å; R184-L188 CarbonylContact C-O 3.58Å; R184-L188 WeakPolarHBondContact CA-O 3.45Å
185	F	83	Confident	85.4	Confident	69 Å²	69	43.5 Å²	43.5	30%	0.303	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	131	172.5	-172.7	-93.7	0	0	0	109.7	G187 L188 Y190 I201 V205 A213 A215	F185-G187 PolarHBondContact O-N 3.21Å; F185-L188 PolarHBondContact N-O 3.1Å; F185-L188 WeakPolarHBondContact O-CB 3.35Å; F185-L188 PolarHBondContact O-N 2.89Å; F185-Y190 HydrophobicContact CB-CD2 4.26Å; F185-Y190 HydrophobicContact CB-CE2 3.86Å; F185-I201 HydrophobicContact CD1-CD1 3.78Å; F185-I201 HydrophobicContact CE1-CD1 4Å; F185-V205 HydrophobicContact CB-CG1 4.14Å; F185-V205 HydrophobicContact CD1-CG2 4.01Å; F185-V205 HydrophobicContact CG-CG1 4.47Å; F185-A213 HydrophobicContact CB-CB 3.95Å; F185-A213 HydrophobicContact CD2-CB 4.35Å; F185-A215 HydrophobicContact CD1-CB 3.96Å; F185-A215 HydrophobicContact CD2-CB 4.17Å; F185-A215 HydrophobicContact CE1-CB 3.46Å; F185-A215 VanDerWaalsContact CE1-CB 3.46Å; F185-A215 HydrophobicContact CE2-CB 3.69Å; F185-A215 HydrophobicContact CG-CB 4.3Å; F185-A215 HydrophobicContact CZ-CB 3.32Å
186	S	78.9	Confident	86.3	Confident	89 Å²	89	45.4 Å²	45.4	62%	0.622	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	41.3	-174.8	-152.5	0	0	0	0	113.8	L188	S186-L188 PolarHBondContact O-N 3.23Å
187	G	74.9	Confident	86.9	Confident	56 Å²	56	47.9 Å²	47.9	58%	0.577	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	-12.2	-176.8	0	0	0	0	0	116.1	R184 F185	R184-G187 PolarHBondContact NH1-O 3.19Å; F185-G187 PolarHBondContact O-N 3.21Å
188	L	80.4	Confident	87.1	Confident	28 Å²	28	46.5 Å²	46.5	15%	0.147	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	151.7	176.4	-61	172.8	0	0	0	111	R184 F185 S186 Y190 I201	R184-L188 CarbonylContact C-O 3.58Å; R184-L188 WeakPolarHBondContact CA-O 3.45Å; F185-L188 PolarHBondContact N-O 3.1Å; F185-L188 WeakPolarHBondContact O-CB 3.35Å; F185-L188 PolarHBondContact O-N 2.89Å; S186-L188 PolarHBondContact O-N 3.23Å; L188-Y190 HydrophobicContact CB-CE2 3.69Å; L188-I201 HydrophobicContact CD1-CG2 4.14Å
189	A	84.3	Confident	87.2	Confident	29 Å²	29	48.7 Å²	48.7	24%	0.24	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	138.4	-179.5	0	0	0	0	0	110.8	C183	C183-A189 WeakPolarHBondContact O-CA 3.19Å
190	Y	86.1	Confident	87.1	Confident	15 Å²	15	54.9 Å²	54.9	6%	0.059	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	140.9	-177.2	-57.9	-92.2	0	0	0	109.9	G182 C183 F185 L188 V196 D198 I201 V205 C207	G182-Y190 CarbonylContact C-O 3.56Å; G182-Y190 VanDerWaalsContact CA-O 3.32Å; G182-Y190 WeakPolarHBondContact CA-O 3.08Å; C183-Y190 PolarHBondContact N-O 2.98Å; C183-Y190 PolarHBondContact O-N 3.07Å; F185-Y190 HydrophobicContact CB-CD2 4.26Å; F185-Y190 HydrophobicContact CB-CE2 3.86Å; L188-Y190 HydrophobicContact CB-CE2 3.69Å; Y190-V196 HydrophobicContact CD1-CB 4.19Å; Y190-V196 HydrophobicContact CD1-CG2 4.36Å; Y190-V196 HydrophobicContact CE1-CB 4.43Å; Y190-V196 HydrophobicContact CE1-CG1 4.49Å; Y190-D198 HydrophobicContact CE1-CB 4.36Å; Y190-D198 PolarHBondContact OH-OD2 3.39Å; Y190-I201 WeakPolarHBondContact OH-CD1 3.18Å; Y190-V205 HydrophobicContact CD1-CB 4.25Å; Y190-V205 HydrophobicContact CD1-CG1 4.19Å; Y190-V205 HydrophobicContact CD2-CG1 3.97Å; Y190-V205 HydrophobicContact CE1-CB 4.02Å; Y190-V205 HydrophobicContact CE1-CG1 4.26Å; Y190-V205 HydrophobicContact CE1-CG2 4.1Å; Y190-V205 HydrophobicContact CE2-CG1 4.05Å; Y190-V205 HydrophobicContact CE2-CG2 4.34Å; Y190-V205 HydrophobicContact CG-CG1 4.04Å; Y190-C207 PolarHBondContact O-SG 2.87Å
191	E	85.8	Confident	86.9	Confident	140 Å²	140	56.4 Å²	56.4	65%	0.654	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	141.9	179.1	-67.3	177.7	-176.5	0	0	110.8	T194 C207	E191-T194 HydrophobicContact CB-CG2 3.8Å; E191-T194 WeakPolarHBondContact O-CB 3.2Å; E191-T194 WeakPolarHBondContact O-CG2 3.46Å; E191-T194 PolarHBondContact O-N 3.16Å; E191-T194 PolarHBondContact O-OG1 3.28Å; E191-C207 VanDerWaalsContact C-SG 3.58Å; E191-C207 WeakPolarHBondContact O-CB 3.27Å; E191-C207 PolarHBondContact O-SG 3Å
192	T	88.1	Confident	87.1	Confident	27 Å²	27	55.5 Å²	55.5	17%	0.166	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	147.6	176.9	53	0	0	0	0	112.4	Y38 G39 T194 C207	Y38-T192 VanDerWaalsContact C-CG2 3.46Å; Y38-T192 HydrophobicContact CD1-CG2 4.31Å; G39-T192 VanDerWaalsContact CA-OG1 3.26Å; G39-T192 WeakPolarHBondContact CA-OG1 3.49Å; T192-T194 VanDerWaalsContact C-N 3.29Å; T192-C207 WeakPolarHBondContact CA-SG 3.35Å
193	N	89.1	Confident	87.2	Confident	121 Å²	121	56 Å²	56	65%	0.647	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	37.4	-175.3	-164.4	47.8	0	0	0	112.9	C207 D208 V209	N193-C207 VanDerWaalsContact CA-O 3.28Å; N193-C207 WeakPolarHBondContact CA-O 3.44Å; N193-C207 PolarHBondContact N-O 2.84Å; N193-D208 PolarHBondContact N-O 2.85Å; N193-V209 HydrophobicContact CB-CG1 3.88Å; N193-V209 WeakPolarHBondContact OD1-CG1 3.44Å
194	T	90.1	Very high	87.5	Confident	38 Å²	38	57.6 Å²	57.6	23%	0.233	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	150.1	175.6	72.7	0	0	0	0	112.5	E191 T192 T206 C207	E191-T194 HydrophobicContact CB-CG2 3.8Å; E191-T194 WeakPolarHBondContact O-CB 3.2Å; E191-T194 WeakPolarHBondContact O-CG2 3.46Å; E191-T194 PolarHBondContact O-N 3.16Å; E191-T194 PolarHBondContact O-OG1 3.28Å; T192-T194 VanDerWaalsContact C-N 3.29Å; T194-T206 WeakPolarHBondContact O-CA 3.33Å; T194-C207 PolarHBondContact N-O 2.85Å; T194-C207 VanDerWaalsContact N-O 3.08Å; T194-C207 PolarHBondContact O-N 3.16Å
195	T	94.3	Very high	88	Confident	92 Å²	92	54.3 Å²	54.3	56%	0.564	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	120	168.8	-63.2	0	0	0	0	108.1	T204 V205 T206	T195-T204 HydrophobicContact CG2-CG2 3.38Å; T195-V205 CarbonylContact C-O 3.59Å; T195-V205 WeakPolarHBondContact CA-O 3.46Å; T195-T206 WeakPolarHBondContact CG2-OG1 3.18Å; T195-T206 PolarHBondContact OG1-OG1 3.42Å
196	V	93.1	Very high	88.5	Confident	57 Å²	57	53.2 Å²	53.2	35%	0.345	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	124.7	-173.8	-178.9	0	0	0	0	109.1	Y190 D198 T204 V205	Y190-V196 HydrophobicContact CD1-CB 4.19Å; Y190-V196 HydrophobicContact CD1-CG2 4.36Å; Y190-V196 HydrophobicContact CE1-CB 4.43Å; Y190-V196 HydrophobicContact CE1-CG1 4.49Å; V196-D198 PolarHBondContact O-N 2.8Å; V196-T204 WeakPolarHBondContact O-CA 3.31Å; V196-V205 PolarHBondContact N-O 2.8Å; V196-V205 PolarHBondContact O-N 3.3Å
197	N	93.1	Very high	89.1	Confident	102 Å²	102	49 Å²	49	55%	0.545	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	113	164.6	-176.7	16.6	0	0	0	108.5	H218	N197-H218 PolarHBondContact ND2-NE2 2.9Å; N197-H218 PolarHBondContact OD1-NE2 3.35Å
198	D	90.2	Very high	89.8	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.032	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	104.9	-178.1	-164.4	-28	0	0	0	111.2	Y190 V196 R200 I201 C202 C203	Y190-D198 HydrophobicContact CE1-CB 4.36Å; Y190-D198 PolarHBondContact OH-OD2 3.39Å; V196-D198 PolarHBondContact O-N 2.8Å; D198-R200 PolarHBondContact O-N 3.24Å; D198-R200 VanDerWaalsContact OD1-CB 3.23Å; D198-R200 WeakPolarHBondContact OD1-CB 3.27Å; D198-R200 WeakPolarHBondContact OD1-CG 3.48Å; D198-R200 IonicContact OD1-CZ 2.82Å; D198-R200 PolarHBondContact OD1-N 2.94Å; D198-R200 IonicContact OD1-NE 3.68Å; D198-R200 PolarHBondContact OD1-NE 2.84Å; D198-R200 IonicContact OD1-NH2 2.63Å; D198-R200 IonicContact OD2-CZ 3.39Å; D198-R200 IonicContact OD2-NE 2.61Å; D198-R200 PolarHBondContact OD2-NE 3.49Å; D198-R200 IonicContact OD2-NH2 2.69Å; D198-R200 PolarHBondContact OD2-NH2 2.95Å; D198-I201 HydrophobicContact CB-CD1 4.28Å; D198-I201 HydrophobicContact CB-CG1 3.85Å; D198-I201 PolarHBondContact O-N 3.49Å; D198-C202 PolarHBondContact O-N 3.31Å; D198-C203 PolarHBondContact N-O 3.01Å; D198-C203 PolarHBondContact O-N 3.36Å
199	P	90.3	Very high	90	Very high	60 Å²	60	52.4 Å²	52.4	39%	0.39	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-19.9	-179.2	26.4	-34	0	0	0	113.1	I201 C202 G227 G229	P199-I201 PolarHBondContact O-N 2.6Å; P199-C202 PolarHBondContact O-N 3.33Å; P199-G227 CarbonylContact O-C 3.34Å; P199-G227 VanDerWaalsContact O-C 3.27Å; P199-G229 WeakPolarHBondContact O-CA 3.41Å; P199-G229 PolarHBondContact O-N 3.06Å
200	R	87.6	Confident	90	Very high	131 Å²	131	51.9 Å²	51.9	49%	0.494	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.5	-179.3	-57.8	171.9	-68.1	179.9	-0.5	113.1	D198 G227	D198-R200 PolarHBondContact O-N 3.24Å; D198-R200 VanDerWaalsContact OD1-CB 3.23Å; D198-R200 WeakPolarHBondContact OD1-CB 3.27Å; D198-R200 WeakPolarHBondContact OD1-CG 3.48Å; D198-R200 IonicContact OD1-CZ 2.82Å; D198-R200 PolarHBondContact OD1-N 2.94Å; D198-R200 IonicContact OD1-NE 3.68Å; D198-R200 PolarHBondContact OD1-NE 2.84Å; D198-R200 IonicContact OD1-NH2 2.63Å; D198-R200 IonicContact OD2-CZ 3.39Å; D198-R200 IonicContact OD2-NE 2.61Å; D198-R200 PolarHBondContact OD2-NE 3.49Å; D198-R200 IonicContact OD2-NH2 2.69Å; D198-R200 PolarHBondContact OD2-NH2 2.95Å; R200-G227 WeakPolarHBondContact CA-O 3.38Å
201	I	87.1	Confident	89.9	Confident	32 Å²	32	51.2 Å²	51.2	16%	0.164	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	2.6	178.3	56.9	167.9	0	0	0	112.3	F185 L188 Y190 D198 P199 C203 V205	F185-I201 HydrophobicContact CD1-CD1 3.78Å; F185-I201 HydrophobicContact CE1-CD1 4Å; L188-I201 HydrophobicContact CD1-CG2 4.14Å; Y190-I201 WeakPolarHBondContact OH-CD1 3.18Å; D198-I201 HydrophobicContact CB-CD1 4.28Å; D198-I201 HydrophobicContact CB-CG1 3.85Å; D198-I201 PolarHBondContact O-N 3.49Å; P199-I201 PolarHBondContact O-N 2.6Å; I201-C203 HydrophobicContact CD1-CB 3.98Å; I201-C203 HydrophobicContact CG1-CB 4.07Å; I201-C203 PolarHBondContact O-N 2.89Å; I201-C203 PolarHBondContact O-SG 2.92Å; I201-V205 HydrophobicContact CD1-CG2 3.66Å
202	C	91.3	Very high	89.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	40.7	-178.6	-54.6	0	0	0	0	113.1	D198 P199 H218 C219 C225 S230	D198-C202 PolarHBondContact O-N 3.31Å; P199-C202 PolarHBondContact O-N 3.33Å; C202-H218 VanDerWaalsContact C-CD2 3.48Å; C202-H218 WeakPolarHBondContact O-CB 3.35Å; C202-H218 PolarHBondContact O-CD2 2.8Å; C202-H218 PolarHBondContact O-N 3.14Å; C202-C219 WeakPolarHBondContact CB-SG 3.33Å; C202-C225 HydrophobicContact CB-CB 3.57Å; C202-C225 WeakPolarHBondContact CB-SG 3.38Å; C202-C225 PolarHBondContact N-SG 2.87Å; C202-C225 VanDerWaalsContact SG-CA 3.5Å; C202-C225 WeakPolarHBondContact SG-CB 3.48Å; C202-C225 CovalentContact SG-SG 2.03Å; C202-C225 PolarHBondContact SG-SG 2.84Å; C202-S230 PolarHBondContact SG-O 2.95Å; C202-S230 VanDerWaalsContact SG-O 3.34Å
203	C	93.1	Very high	89.8	Confident	13 Å²	13	46.4 Å²	46.4	9%	0.088	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	145.4	-179.1	-68.7	0	0	0	0	111.9	D198 I201 V205 A215 V216	D198-C203 PolarHBondContact N-O 3.01Å; D198-C203 PolarHBondContact O-N 3.36Å; I201-C203 HydrophobicContact CD1-CB 3.98Å; I201-C203 HydrophobicContact CG1-CB 4.07Å; I201-C203 PolarHBondContact O-N 2.89Å; I201-C203 PolarHBondContact O-SG 2.92Å; C203-V205 HydrophobicContact CB-CG2 4.26Å; C203-V205 PolarHBondContact O-N 2.93Å; C203-A215 HydrophobicContact CB-CB 4.19Å; C203-V216 CarbonylContact C-O 3.57Å; C203-V216 WeakPolarHBondContact CA-O 3.39Å
204	T	94.2	Very high	89.9	Confident	34 Å²	34	44.7 Å²	44.7	21%	0.209	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	109.9	154.8	-66.1	0	0	0	0	108.4	T195 V196 A215 V216 H218	T195-T204 HydrophobicContact CG2-CG2 3.38Å; V196-T204 WeakPolarHBondContact O-CA 3.31Å; T204-A215 WeakPolarHBondContact O-CA 3.49Å; T204-V216 PolarHBondContact N-O 3.44Å; T204-V216 PolarHBondContact O-N 2.82Å; T204-H218 PolarHBondContact N-NE2 2.04Å; T204-H218 VanDerWaalsContact N-NE2 3.11Å; T204-H218 PolarHBondContact OG1-CE1 2.66Å; T204-H218 PolarHBondContact OG1-NE2 3.31Å
205	V	93.5	Very high	89.9	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	127.2	174.7	-177.1	0	0	0	0	109.3	F185 Y190 T195 V196 I201 C203 T214 A215	F185-V205 HydrophobicContact CB-CG1 4.14Å; F185-V205 HydrophobicContact CD1-CG2 4.01Å; F185-V205 HydrophobicContact CG-CG1 4.47Å; Y190-V205 HydrophobicContact CD1-CB 4.25Å; Y190-V205 HydrophobicContact CD1-CG1 4.19Å; Y190-V205 HydrophobicContact CD2-CG1 3.97Å; Y190-V205 HydrophobicContact CE1-CB 4.02Å; Y190-V205 HydrophobicContact CE1-CG1 4.26Å; Y190-V205 HydrophobicContact CE1-CG2 4.1Å; Y190-V205 HydrophobicContact CE2-CG1 4.05Å; Y190-V205 HydrophobicContact CE2-CG2 4.34Å; Y190-V205 HydrophobicContact CG-CG1 4.04Å; T195-V205 CarbonylContact C-O 3.59Å; T195-V205 WeakPolarHBondContact CA-O 3.46Å; V196-V205 PolarHBondContact N-O 2.8Å; V196-V205 PolarHBondContact O-N 3.3Å; I201-V205 HydrophobicContact CD1-CG2 3.66Å; C203-V205 HydrophobicContact CB-CG2 4.26Å; C203-V205 PolarHBondContact O-N 2.93Å; V205-T214 CarbonylContact C-O 3.54Å; V205-T214 WeakPolarHBondContact CA-O 3.45Å; V205-A215 HydrophobicContact CG2-CB 4.1Å
206	T	94	Very high	89.7	Confident	47 Å²	47	45 Å²	45	29%	0.288	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	116.2	170.1	-64.3	0	0	0	0	109	T194 T195 T214	T194-T206 WeakPolarHBondContact O-CA 3.33Å; T195-T206 WeakPolarHBondContact CG2-OG1 3.18Å; T195-T206 PolarHBondContact OG1-OG1 3.42Å; T206-T214 PolarHBondContact N-O 3.35Å; T206-T214 PolarHBondContact O-N 3.22Å; T206-T214 PolarHBondContact O-OG1 3.18Å
207	C	91	Very high	89.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	109.4	173.3	172.9	0	0	0	0	107.6	C183 Y190 E191 T192 N193 T194	C183-C207 HydrophobicContact CB-CB 3.78Å; C183-C207 WeakPolarHBondContact CB-SG 3.09Å; C183-C207 PolarHBondContact N-SG 3.11Å; C183-C207 VanDerWaalsContact N-SG 3.36Å; C183-C207 WeakPolarHBondContact SG-CA 3.3Å; C183-C207 WeakPolarHBondContact SG-CB 3.39Å; C183-C207 CovalentContact SG-SG 2.01Å; C183-C207 PolarHBondContact SG-SG 2.97Å; Y190-C207 PolarHBondContact O-SG 2.87Å; E191-C207 VanDerWaalsContact C-SG 3.58Å; E191-C207 WeakPolarHBondContact O-CB 3.27Å; E191-C207 PolarHBondContact O-SG 3Å; T192-C207 WeakPolarHBondContact CA-SG 3.35Å; N193-C207 VanDerWaalsContact CA-O 3.28Å; N193-C207 WeakPolarHBondContact CA-O 3.44Å; N193-C207 PolarHBondContact N-O 2.84Å; T194-C207 PolarHBondContact N-O 2.85Å; T194-C207 VanDerWaalsContact N-O 3.08Å; T194-C207 PolarHBondContact O-N 3.16Å
208	D	89.3	Confident	89.3	Confident	58 Å²	58	45.6 Å²	45.6	31%	0.31	27%	0.268	S	S	.	.			trans	-79.4	179.6	-170.4	75.9	14.1	0	0	0	113.7	N193 S210 G211 A212	N193-D208 PolarHBondContact N-O 2.85Å; D208-S210 VanDerWaalsContact CG-OG 3.27Å; D208-S210 PolarHBondContact O-N 3.04Å; D208-S210 VanDerWaalsContact OD1-C 3.28Å; D208-S210 WeakPolarHBondContact OD1-CA 3.16Å; D208-S210 WeakPolarHBondContact OD1-CB 3.35Å; D208-S210 PolarHBondContact OD1-N 2.72Å; D208-S210 PolarHBondContact OD1-OG 2.97Å; D208-S210 PolarHBondContact OD2-OG 2.96Å; D208-G211 PolarHBondContact O-N 2.6Å; D208-G211 PolarHBondContact OD1-N 3.32Å; D208-A212 PolarHBondContact N-O 2.84Å; D208-A212 PolarHBondContact OD1-N 3.47Å
209	V	85.6	Confident	89.2	Confident	97 Å²	97	46 Å²	46	59%	0.588	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-15.2	176.9	-65.1	0	0	0	0	113.7	N193	N193-V209 HydrophobicContact CB-CG1 3.88Å; N193-V209 WeakPolarHBondContact OD1-CG1 3.44Å
210	S	84.1	Confident	88.8	Confident	18 Å²	18	44.4 Å²	44.4	13%	0.126	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-2.6	174.9	79.2	0	0	0	0	112.4	V157 V162 D208 A212	V157-S210 WeakPolarHBondContact CB-O 3.43Å; V157-S210 VanDerWaalsContact CG1-O 3.29Å; V157-S210 WeakPolarHBondContact CG1-O 3.19Å; V162-S210 WeakPolarHBondContact CG1-O 3.25Å; D208-S210 VanDerWaalsContact CG-OG 3.27Å; D208-S210 PolarHBondContact O-N 3.04Å; D208-S210 VanDerWaalsContact OD1-C 3.28Å; D208-S210 WeakPolarHBondContact OD1-CA 3.16Å; D208-S210 WeakPolarHBondContact OD1-CB 3.35Å; D208-S210 PolarHBondContact OD1-N 2.72Å; D208-S210 PolarHBondContact OD1-OG 2.97Å; D208-S210 PolarHBondContact OD2-OG 2.96Å; S210-A212 VanDerWaalsContact C-N 3.34Å
211	G	82.4	Confident	88.3	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.01	28%	0.276	C	S	.	.	S	Bend	trans	81.3	11.5	-177.5	0	0	0	0	0	114.4	C183 D208	C183-G211 VanDerWaalsContact SG-CA 3.56Å; C183-G211 PolarHBondContact SG-O 3.39Å; D208-G211 PolarHBondContact O-N 2.6Å; D208-G211 PolarHBondContact OD1-N 3.32Å
212	A	85.9	Confident	88	Confident	35 Å²	35	43.2 Å²	43.2	29%	0.289	28%	0.275	S	S	.	.			trans	-86.4	130.8	172	0	0	0	0	0	110.7	D208 S210	D208-A212 PolarHBondContact N-O 2.84Å; D208-A212 PolarHBondContact OD1-N 3.47Å; S210-A212 VanDerWaalsContact C-N 3.34Å
213	A	87.5	Confident	87.7	Confident	32 Å²	32	45.6 Å²	45.6	26%	0.264	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.5	172.8	0	0	0	0	0	111.3	C183 F185	C183-A213 HydrophobicContact CB-CB 3.76Å; F185-A213 HydrophobicContact CB-CB 3.95Å; F185-A213 HydrophobicContact CD2-CB 4.35Å
214	T	90.6	Very high	87.3	Confident	85 Å²	85	50 Å²	50	52%	0.521	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	150.9	166.3	56.2	0	0	0	0	108.8	V205 T206	V205-T214 CarbonylContact C-O 3.54Å; V205-T214 WeakPolarHBondContact CA-O 3.45Å; T206-T214 PolarHBondContact N-O 3.35Å; T206-T214 PolarHBondContact O-N 3.22Å; T206-T214 PolarHBondContact O-OG1 3.18Å
215	A	89.9	Confident	87	Confident	36 Å²	36	49.3 Å²	49.3	30%	0.298	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	139.5	179.1	0	0	0	0	0	110.9	F185 C203 T204 V205	F185-A215 HydrophobicContact CD1-CB 3.96Å; F185-A215 HydrophobicContact CD2-CB 4.17Å; F185-A215 HydrophobicContact CE1-CB 3.46Å; F185-A215 VanDerWaalsContact CE1-CB 3.46Å; F185-A215 HydrophobicContact CE2-CB 3.69Å; F185-A215 HydrophobicContact CG-CB 4.3Å; F185-A215 HydrophobicContact CZ-CB 3.32Å; C203-A215 HydrophobicContact CB-CB 4.19Å; T204-A215 WeakPolarHBondContact O-CA 3.49Å; V205-A215 HydrophobicContact CG2-CB 4.1Å
216	V	90.9	Very high	86.6	Confident	100 Å²	100	55.2 Å²	55.2	61%	0.606	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	116.9	173.2	-177.8	0	0	0	0	107.9	C203 T204	C203-V216 CarbonylContact C-O 3.57Å; C203-V216 WeakPolarHBondContact CA-O 3.39Å; T204-V216 PolarHBondContact N-O 3.44Å; T204-V216 PolarHBondContact O-N 2.82Å
217	S	88.2	Confident	86.1	Confident	64 Å²	64	54.6 Å²	54.6	45%	0.448	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	137.5	175.6	177.1	0	0	0	0	111	C219	S217-C219 PolarHBondContact OG-N 2.86Å; S217-C219 PolarHBondContact OG-O 3.32Å
218	H	89	Confident	86	Confident	107 Å²	107	59.6 Å²	59.6	50%	0.495	36%	0.359	S	S	.	.	S	Bend	trans	-84.6	-22.6	167	-56.1	-55.1	0	0	0	112	N197 C202 T204	N197-H218 PolarHBondContact ND2-NE2 2.9Å; N197-H218 PolarHBondContact OD1-NE2 3.35Å; C202-H218 VanDerWaalsContact C-CD2 3.48Å; C202-H218 WeakPolarHBondContact O-CB 3.35Å; C202-H218 PolarHBondContact O-CD2 2.8Å; C202-H218 PolarHBondContact O-N 3.14Å; T204-H218 PolarHBondContact N-NE2 2.04Å; T204-H218 VanDerWaalsContact N-NE2 3.11Å; T204-H218 PolarHBondContact OG1-CE1 2.66Å; T204-H218 PolarHBondContact OG1-NE2 3.31Å
219	C	86.9	Confident	85.8	Confident	15 Å²	15	58.6 Å²	58.6	10%	0.101	36%	0.363	C	S	.	.	S	Bend	trans	-78.9	141.5	175.2	-55.9	0	0	0	0	111.2	C202 S217 E223 C231	C202-C219 WeakPolarHBondContact CB-SG 3.33Å; S217-C219 PolarHBondContact OG-N 2.86Å; S217-C219 PolarHBondContact OG-O 3.32Å; C219-E223 WeakPolarHBondContact CA-OE2 3.23Å; C219-E223 HydrophobicContact CB-CB 3.94Å; C219-C231 WeakPolarHBondContact CA-SG 3.46Å; C219-C231 HydrophobicContact CB-CB 3.69Å; C219-C231 WeakPolarHBondContact CB-SG 3.31Å; C219-C231 PolarHBondContact N-SG 2.76Å; C219-C231 WeakPolarHBondContact SG-CB 3.45Å; C219-C231 CovalentContact SG-SG 2.04Å; C219-C231 PolarHBondContact SG-SG 2.82Å
220	G	82.3	Confident	85.8	Confident	27 Å²	27	56 Å²	56	28%	0.278	35%	0.349	S	S	.	.			trans	-67.2	167.3	173.6	0	0	0	0	0	113.3	M222 E223	G220-M222 PolarHBondContact O-N 2.82Å; G220-E223 PolarHBondContact N-OE2 3.19Å; G220-E223 WeakPolarHBondContact O-CB 3.41Å; G220-E223 PolarHBondContact O-N 2.89Å
221	P	78.4	Confident	86	Confident	108 Å²	108	56.6 Å²	56.6	70%	0.701	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.6	-173.2	27.4	-36.3	0	0	0	114.6	T248	P221-T248 HydrophobicContact CB-CG2 4.4Å; P221-T248 HydrophobicContact CG-CG2 4.48Å
222	M	80	Confident	86.3	Confident	29 Å²	29	57.5 Å²	57.5	14%	0.143	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	0.3	178.3	-63.9	177.9	49.5	0	0	113	G220 M233 N234 A235 F247 T248 V370	G220-M222 PolarHBondContact O-N 2.82Å; M222-M233 HydrophobicContact CB-CE 4.42Å; M222-M233 HydrophobicContact CB-SD 3.56Å; M222-M233 VanDerWaalsContact CB-SD 3.56Å; M222-M233 HydrophobicContact CE-CE 3.87Å; M222-M233 HydrophobicContact CE-SD 3.76Å; M222-N234 CarbonylContact O-C 3.57Å; M222-N234 PolarHBondContact O-N 2.57Å; M222-A235 HydrophobicContact CB-CB 4.22Å; M222-A235 HydrophobicContact CE-CB 3.8Å; M222-F247 HydrophobicContact CE-CB 3.87Å; M222-F247 HydrophobicContact CE-CD2 3.34Å; M222-F247 HydrophobicContact CE-CE2 4.06Å; M222-F247 HydrophobicContact CE-CG 3.88Å; M222-F247 HydrophobicContact CG-CB 3.96Å; M222-F247 HydrophobicContact SD-CB 4.06Å; M222-F247 HydrophobicContact SD-CD2 4.34Å; M222-T248 HydrophobicContact CG-CG2 4.49Å; M222-V370 HydrophobicContact CE-CG2 4.13Å
223	E	85.3	Confident	86.3	Confident	50 Å²	50	56.4 Å²	56.4	23%	0.234	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	161.8	-171.2	-67.3	169	-178	0	0	112.5	C219 G220 C231 A232 S366	C219-E223 WeakPolarHBondContact CA-OE2 3.23Å; C219-E223 HydrophobicContact CB-CB 3.94Å; G220-E223 PolarHBondContact N-OE2 3.19Å; G220-E223 WeakPolarHBondContact O-CB 3.41Å; G220-E223 PolarHBondContact O-N 2.89Å; E223-C231 HydrophobicContact CB-CB 4.24Å; E223-C231 VanDerWaalsContact OE2-CB 3.31Å; E223-C231 WeakPolarHBondContact OE2-CB 3.43Å; E223-A232 CarbonylContact C-O 3.48Å; E223-A232 VanDerWaalsContact CA-O 3.24Å; E223-A232 WeakPolarHBondContact CA-O 3.2Å; E223-S366 WeakPolarHBondContact OE1-CA 3.36Å; E223-S366 WeakPolarHBondContact OE1-CB 3.22Å
224	H	85.3	Confident	86.4	Confident	105 Å²	105	56.2 Å²	56.2	49%	0.486	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138.6	173.9	-174.7	71.8	0	0	0	109.7	A232 N234	H224-A232 PolarHBondContact N-O 2.86Å; H224-A232 PolarHBondContact O-N 2.57Å; H224-N234 HydrophobicContact CB-CB 3.91Å
225	C	85.9	Confident	86.4	Confident	21 Å²	21	52.1 Å²	52.1	14%	0.142	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	129	174.9	-177.9	0	0	0	0	110.6	C202 G227	C202-C225 HydrophobicContact CB-CB 3.57Å; C202-C225 WeakPolarHBondContact CB-SG 3.38Å; C202-C225 PolarHBondContact N-SG 2.87Å; C202-C225 VanDerWaalsContact SG-CA 3.5Å; C202-C225 WeakPolarHBondContact SG-CB 3.48Å; C202-C225 CovalentContact SG-SG 2.03Å; C202-C225 PolarHBondContact SG-SG 2.84Å; C225-G227 VanDerWaalsContact C-N 3.27Å; C225-G227 PolarHBondContact O-N 3.21Å; C225-G227 PolarHBondContact SG-N 3.09Å; C225-G227 VanDerWaalsContact SG-N 3.4Å
226	Q	85.2	Confident	86.5	Confident	124 Å²	124	50.8 Å²	50.8	58%	0.579	31%	0.306	S	S	*	.			trans	-80.5	-7	176.6	-58.4	-160.2	-15.4	0	0	113.6	S230 A232	Q226-S230 PolarHBondContact N-O 3.19Å; Q226-S230 PolarHBondContact OE1-OG 2.82Å; Q226-A232 HydrophobicContact CG-CB 4.19Å
227	G	85	Confident	86.7	Confident	35 Å²	35	46 Å²	46	36%	0.361	28%	0.278	S	S	.	.	S	Bend	trans	88.3	1.7	179.9	0	0	0	0	0	114.9	P199 R200 C225	P199-G227 CarbonylContact O-C 3.34Å; P199-G227 VanDerWaalsContact O-C 3.27Å; R200-G227 WeakPolarHBondContact CA-O 3.38Å; C225-G227 VanDerWaalsContact C-N 3.27Å; C225-G227 PolarHBondContact O-N 3.21Å; C225-G227 PolarHBondContact SG-N 3.09Å; C225-G227 VanDerWaalsContact SG-N 3.4Å
228	D	87.6	Confident	87.1	Confident	105 Å²	105	43.1 Å²	43.1	56%	0.561	26%	0.257	S	S	*	.	S	Bend	trans	-110.2	5.9	174.6	68.2	-11.8	0	0	0	113.1	S230	D228-S230 VanDerWaalsContact OD1-CB 3.25Å; D228-S230 WeakPolarHBondContact OD1-CB 3.18Å; D228-S230 PolarHBondContact OD1-N 2.78Å; D228-S230 PolarHBondContact OD1-OG 3.43Å; D228-S230 PolarHBondContact OD2-OG 2.7Å
229	G	84.9	Confident	87.4	Confident	37 Å²	37	38 Å²	38	38%	0.381	23%	0.234	S	C	.	.	S	Bend	trans	92.1	-4.4	-174	0	0	0	0	0	114.3	P199	P199-G229 WeakPolarHBondContact O-CA 3.41Å; P199-G229 PolarHBondContact O-N 3.06Å
230	S	87.4	Confident	87.7	Confident	43 Å²	43	37.5 Å²	37.5	30%	0.301	23%	0.23	S	C	.	.			trans	-90.3	151	173.1	76.8	0	0	0	0	112.5	C202 Q226 D228	C202-S230 PolarHBondContact SG-O 2.95Å; C202-S230 VanDerWaalsContact SG-O 3.34Å; Q226-S230 PolarHBondContact N-O 3.19Å; Q226-S230 PolarHBondContact OE1-OG 2.82Å; D228-S230 VanDerWaalsContact OD1-CB 3.25Å; D228-S230 WeakPolarHBondContact OD1-CB 3.18Å; D228-S230 PolarHBondContact OD1-N 2.78Å; D228-S230 PolarHBondContact OD1-OG 3.43Å; D228-S230 PolarHBondContact OD2-OG 2.7Å
231	C	87.8	Confident	88	Confident	29 Å²	29	36.3 Å²	36.3	20%	0.196	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	135.4	178.6	-57.6	0	0	0	0	109	C219 E223	C219-C231 WeakPolarHBondContact CA-SG 3.46Å; C219-C231 HydrophobicContact CB-CB 3.69Å; C219-C231 WeakPolarHBondContact CB-SG 3.31Å; C219-C231 PolarHBondContact N-SG 2.76Å; C219-C231 WeakPolarHBondContact SG-CB 3.45Å; C219-C231 CovalentContact SG-SG 2.04Å; C219-C231 PolarHBondContact SG-SG 2.82Å; E223-C231 HydrophobicContact CB-CB 4.24Å; E223-C231 VanDerWaalsContact OE2-CB 3.31Å; E223-C231 WeakPolarHBondContact OE2-CB 3.43Å
232	A	87.4	Confident	88.5	Confident	21 Å²	21	31.6 Å²	31.6	17%	0.174	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	147.9	176.3	0	0	0	0	0	111	E223 H224 Q226 N234	E223-A232 CarbonylContact C-O 3.48Å; E223-A232 VanDerWaalsContact CA-O 3.24Å; E223-A232 WeakPolarHBondContact CA-O 3.2Å; H224-A232 PolarHBondContact N-O 2.86Å; H224-A232 PolarHBondContact O-N 2.57Å; Q226-A232 HydrophobicContact CG-CB 4.19Å; A232-N234 PolarHBondContact O-N 2.7Å
233	M	86.8	Confident	89.2	Confident	11 Å²	11	30.5 Å²	30.5	5%	0.054	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	123.6	178.1	-174.5	68.6	86.3	0	0	109.4	M222 A235 L362 T363 G364 A368	M222-M233 HydrophobicContact CB-CE 4.42Å; M222-M233 HydrophobicContact CB-SD 3.56Å; M222-M233 VanDerWaalsContact CB-SD 3.56Å; M222-M233 HydrophobicContact CE-CE 3.87Å; M222-M233 HydrophobicContact CE-SD 3.76Å; M233-A235 HydrophobicContact CG-CB 4.35Å; M233-A235 HydrophobicContact SD-CB 3.9Å; M233-L362 HydrophobicContact CE-CD2 4.49Å; M233-L362 HydrophobicContact CG-CD2 4.25Å; M233-L362 HydrophobicContact CG-CG 4.06Å; M233-T363 VanDerWaalsContact O-CA 3.29Å; M233-T363 WeakPolarHBondContact O-CA 3.45Å; M233-G364 WeakPolarHBondContact CB-O 3.42Å; M233-G364 PolarHBondContact N-O 2.89Å; M233-G364 PolarHBondContact O-N 3.48Å; M233-A368 HydrophobicContact CE-CB 4.29Å
234	N	89.2	Confident	89.6	Confident	28 Å²	28	28.1 Å²	28.1	15%	0.15	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	73.4	170.8	-172.6	12.4	0	0	0	109.1	M222 H224 A232 H361 Y476 K477	M222-N234 CarbonylContact O-C 3.57Å; M222-N234 PolarHBondContact O-N 2.57Å; H224-N234 HydrophobicContact CB-CB 3.91Å; A232-N234 PolarHBondContact O-N 2.7Å; N234-H361 PolarHBondContact OD1-NE2 2.66Å; N234-Y476 PolarHBondContact ND2-O 2.82Å; N234-Y476 PolarHBondContact OD1-O 2.8Å; N234-K477 WeakPolarHBondContact O-CE 3.3Å; N234-K477 PolarHBondContact O-NZ 3.24Å
235	A	90.1	Very high	90	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	125.8	-171.3	0	0	0	0	0	110.2	M222 M233 F247 H361 L362	M222-A235 HydrophobicContact CB-CB 4.22Å; M222-A235 HydrophobicContact CE-CB 3.8Å; M233-A235 HydrophobicContact CG-CB 4.35Å; M233-A235 HydrophobicContact SD-CB 3.9Å; A235-F247 HydrophobicContact CB-CB 4.05Å; A235-F247 HydrophobicContact CB-CD1 3.56Å; A235-F247 HydrophobicContact CB-CD2 4.07Å; A235-F247 HydrophobicContact CB-CE1 3.86Å; A235-F247 HydrophobicContact CB-CE2 4.32Å; A235-F247 HydrophobicContact CB-CG 3.67Å; A235-F247 HydrophobicContact CB-CZ 4.23Å; A235-H361 WeakPolarHBondContact O-CA 3.48Å; A235-H361 PolarHBondContact O-CD2 3.06Å; A235-L362 HydrophobicContact CB-CB 4.32Å; A235-L362 PolarHBondContact N-O 3.21Å; A235-L362 PolarHBondContact O-N 3.17Å
236	V	93.3	Very high	90.3	Very high	7 Å²	7	22.7 Å²	22.7	4%	0.042	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.4	-179.3	-171	0	0	0	0	108.5	F247 I359 I360 V473 K477	V236-F247 VanDerWaalsContact C-CD1 3.43Å; V236-I359 HydrophobicContact CG1-CG2 3.7Å; V236-I360 WeakPolarHBondContact CA-O 3.47Å; V236-V473 HydrophobicContact CB-CG1 4.33Å; V236-V473 HydrophobicContact CG1-CB 4.3Å; V236-V473 HydrophobicContact CG1-CG1 4.09Å; V236-V473 HydrophobicContact CG1-CG2 3.89Å; V236-K477 HydrophobicContact CB-CD 4.4Å; V236-K477 HydrophobicContact CB-CG 4.23Å; V236-K477 HydrophobicContact CG2-CD 3.9Å; V236-K477 HydrophobicContact CG2-CG 3.82Å
237	C	95	Very high	90.5	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	137.2	176.2	173.1	0	0	0	0	108.4	I245 F247 I359 I360 C374	C237-I245 VanDerWaalsContact CA-O 3.31Å; C237-I245 WeakPolarHBondContact CA-O 3.41Å; C237-I245 PolarHBondContact SG-O 3.2Å; C237-F247 HydrophobicContact CB-CD1 3.61Å; C237-F247 HydrophobicContact CB-CE1 3.47Å; C237-F247 VanDerWaalsContact CB-CE1 3.47Å; C237-F247 HydrophobicContact CB-CZ 4.29Å; C237-I359 WeakPolarHBondContact O-CA 3.36Å; C237-I360 HydrophobicContact CB-CB 4.26Å; C237-I360 PolarHBondContact N-O 2.8Å; C237-I360 PolarHBondContact O-N 2.95Å; C237-C374 HydrophobicContact CB-CB 3.5Å; C237-C374 VanDerWaalsContact CB-CB 3.5Å; C237-C374 WeakPolarHBondContact CB-SG 3.44Å; C237-C374 VanDerWaalsContact SG-CA 3.51Å; C237-C374 WeakPolarHBondContact SG-CB 3.23Å; C237-C374 CovalentContact SG-SG 2.04Å; C237-C374 PolarHBondContact SG-SG 2.79Å
238	S	95.9	Very high	90.5	Very high	3 Å²	3	17.3 Å²	17.3	2%	0.021	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	132.3	178.2	-172.9	0	0	0	0	109.9	V244 I245 A358	S238-V244 CarbonylContact O-C 3.57Å; S238-I245 PolarHBondContact N-O 3.49Å; S238-I245 PolarHBondContact O-N 2.88Å; S238-A358 CarbonylContact C-O 3.57Å; S238-A358 WeakPolarHBondContact CA-O 3.31Å
239	V	96.3	Very high	90.3	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	110.6	173.2	-170.9	0	0	0	0	108.1	T243 V244 L262 F277 L288 T357 A358	V239-T243 WeakPolarHBondContact CA-O 3.44Å; V239-V244 HydrophobicContact CG1-CG2 3.96Å; V239-V244 HydrophobicContact CG2-CB 4.46Å; V239-V244 HydrophobicContact CG2-CG1 4.18Å; V239-V244 HydrophobicContact CG2-CG2 4.01Å; V239-L262 HydrophobicContact CG2-CD1 4.02Å; V239-L262 HydrophobicContact CG2-CD2 3.94Å; V239-F277 HydrophobicContact CG1-CE1 4.19Å; V239-F277 HydrophobicContact CG1-CZ 3.71Å; V239-L288 HydrophobicContact CB-CD2 4.04Å; V239-L288 HydrophobicContact CG1-CB 4.23Å; V239-L288 HydrophobicContact CG1-CD1 4.24Å; V239-L288 HydrophobicContact CG1-CD2 3.86Å; V239-L288 HydrophobicContact CG1-CG 4.34Å; V239-T357 CarbonylContact O-C 3.6Å; V239-T357 VanDerWaalsContact O-CA 3.27Å; V239-T357 WeakPolarHBondContact O-CA 3.22Å; V239-A358 HydrophobicContact CB-CB 4.25Å; V239-A358 PolarHBondContact N-O 3.01Å; V239-A358 PolarHBondContact O-N 3.48Å
240	T	92.5	Very high	90.3	Very high	5 Å²	5	19.5 Å²	19.5	3%	0.031	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	126.4	-177	-59.7	0	0	0	0	109.7	S242 T243 T357 H465 F466	T240-S242 PolarHBondContact O-N 2.93Å; T240-T243 PolarHBondContact N-O 3.28Å; T240-T243 PolarHBondContact O-N 3.45Å; T240-T357 WeakPolarHBondContact CG2-OG1 3.43Å; T240-T357 VanDerWaalsContact OG1-CG2 3.24Å; T240-T357 WeakPolarHBondContact OG1-CG2 3.47Å; T240-T357 PolarHBondContact OG1-OG1 3.44Å; T240-H465 HydrophobicContact CG2-CB 4.12Å; T240-F466 HydrophobicContact CG2-CD1 3.69Å; T240-F466 HydrophobicContact CG2-CD2 4.21Å; T240-F466 HydrophobicContact CG2-CE1 3.71Å; T240-F466 HydrophobicContact CG2-CE2 4.24Å; T240-F466 HydrophobicContact CG2-CG 3.94Å; T240-F466 HydrophobicContact CG2-CZ 4Å
241	G	89.5	Confident	90.4	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.01	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	-122.3	-176.2	0	0	0	0	0	111.3	F287 L288	G241-F287 WeakPolarHBondContact O-CA 3.44Å; G241-L288 PolarHBondContact O-N 3.35Å
242	S	89.1	Confident	90.5	Very high	10 Å²	10	18.9 Å²	18.9	7%	0.07	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	6.2	178.3	74.2	0	0	0	0	114.1	T240 V254 S286	T240-S242 PolarHBondContact O-N 2.93Å; S242-V254 PolarHBondContact O-N 2.81Å; S242-S286 WeakPolarHBondContact CB-O 3.3Å
243	T	93.3	Very high	90.6	Very high	5 Å²	5	20.7 Å²	20.7	3%	0.031	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131	-168	-52.7	0	0	0	0	112.5	V239 T240 I245 P251 Q252 A448	V239-T243 WeakPolarHBondContact CA-O 3.44Å; T240-T243 PolarHBondContact N-O 3.28Å; T240-T243 PolarHBondContact O-N 3.45Å; T243-I245 HydrophobicContact CG2-CG1 4.23Å; T243-P251 HydrophobicContact CG2-CB 4.09Å; T243-Q252 WeakPolarHBondContact CA-O 3.09Å; T243-A448 HydrophobicContact CG2-CB 3.65Å
244	V	94.5	Very high	90.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125.6	165.4	-178.6	0	0	0	0	108.3	S238 V239 P251 Q252 V254 L262 F277 L373	S238-V244 CarbonylContact O-C 3.57Å; V239-V244 HydrophobicContact CG1-CG2 3.96Å; V239-V244 HydrophobicContact CG2-CB 4.46Å; V239-V244 HydrophobicContact CG2-CG1 4.18Å; V239-V244 HydrophobicContact CG2-CG2 4.01Å; V244-P251 CarbonylContact O-C 3.58Å; V244-P251 WeakPolarHBondContact O-CA 3.41Å; V244-Q252 PolarHBondContact N-O 3.38Å; V244-Q252 PolarHBondContact O-N 3.26Å; V244-V254 HydrophobicContact CG2-CG2 4.04Å; V244-L262 HydrophobicContact CG2-CD2 3.84Å; V244-F277 HydrophobicContact CG2-CZ 4.47Å; V244-L373 HydrophobicContact CB-CB 4.21Å; V244-L373 HydrophobicContact CG1-CB 3.89Å; V244-L373 WeakPolarHBondContact CG1-O 3.05Å; V244-L373 HydrophobicContact CG2-CB 4.05Å; V244-L373 HydrophobicContact CG2-CD1 3.94Å
245	I	93.7	Very high	90.3	Very high	10 Å²	10	20.8 Å²	20.8	5%	0.051	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	104.1	168.4	-60.1	175.8	0	0	0	105.7	C237 S238 T243 P251 P444 F445 A448	C237-I245 VanDerWaalsContact CA-O 3.31Å; C237-I245 WeakPolarHBondContact CA-O 3.41Å; C237-I245 PolarHBondContact SG-O 3.2Å; S238-I245 PolarHBondContact N-O 3.49Å; S238-I245 PolarHBondContact O-N 2.88Å; T243-I245 HydrophobicContact CG2-CG1 4.23Å; I245-P251 HydrophobicContact CG1-CB 4.29Å; I245-P444 HydrophobicContact CD1-CB 4.43Å; I245-P444 HydrophobicContact CG2-CB 4.33Å; I245-F445 HydrophobicContact CD1-CB 4.33Å; I245-F445 HydrophobicContact CD1-CD1 3.55Å; I245-F445 HydrophobicContact CD1-CD2 3.82Å; I245-F445 HydrophobicContact CD1-CE1 3.67Å; I245-F445 HydrophobicContact CD1-CE2 3.92Å; I245-F445 HydrophobicContact CD1-CG 3.62Å; I245-F445 HydrophobicContact CD1-CZ 3.84Å; I245-F445 HydrophobicContact CG2-CE2 4.11Å; I245-F445 HydrophobicContact CG2-CZ 4.21Å; I245-A448 HydrophobicContact CD1-CB 4.23Å
246	G	91.5	Very high	90	Very high	3 Å²	3	21.3 Å²	21.3	3%	0.031	12%	0.119	C	C	.	.			trans	-73.4	179.9	-173.6	0	0	0	0	0	113.9	T248 S249 R250	G246-T248 PolarHBondContact O-N 2.86Å; G246-T248 VanDerWaalsContact O-N 3.15Å; G246-S249 WeakPolarHBondContact O-CA 3.41Å; G246-S249 PolarHBondContact O-N 3.07Å; G246-R250 PolarHBondContact N-O 3.07Å
247	F	89.3	Confident	89.6	Confident	2 Å²	2	21.9 Å²	21.9	1%	0.009	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.5	-176.4	-64.6	-38.8	0	0	0	114.7	M222 A235 V236 C237 S249 L263 I360 L362 V370 C374	M222-F247 HydrophobicContact CE-CB 3.87Å; M222-F247 HydrophobicContact CE-CD2 3.34Å; M222-F247 HydrophobicContact CE-CE2 4.06Å; M222-F247 HydrophobicContact CE-CG 3.88Å; M222-F247 HydrophobicContact CG-CB 3.96Å; M222-F247 HydrophobicContact SD-CB 4.06Å; M222-F247 HydrophobicContact SD-CD2 4.34Å; A235-F247 HydrophobicContact CB-CB 4.05Å; A235-F247 HydrophobicContact CB-CD1 3.56Å; A235-F247 HydrophobicContact CB-CD2 4.07Å; A235-F247 HydrophobicContact CB-CE1 3.86Å; A235-F247 HydrophobicContact CB-CE2 4.32Å; A235-F247 HydrophobicContact CB-CG 3.67Å; A235-F247 HydrophobicContact CB-CZ 4.23Å; V236-F247 VanDerWaalsContact C-CD1 3.43Å; C237-F247 HydrophobicContact CB-CD1 3.61Å; C237-F247 HydrophobicContact CB-CE1 3.47Å; C237-F247 VanDerWaalsContact CB-CE1 3.47Å; C237-F247 HydrophobicContact CB-CZ 4.29Å; F247-S249 VanDerWaalsContact C-N 3.33Å; F247-L263 HydrophobicContact CE2-CD1 3.57Å; F247-L263 HydrophobicContact CZ-CD1 3.77Å; F247-I360 HydrophobicContact CZ-CG2 4.35Å; F247-L362 HydrophobicContact CE2-CD2 4.22Å; F247-L362 HydrophobicContact CZ-CB 4.01Å; F247-L362 HydrophobicContact CZ-CD2 4.46Å; F247-V370 HydrophobicContact CD2-CG1 4.2Å; F247-V370 HydrophobicContact CE2-CB 4.48Å; F247-V370 HydrophobicContact CE2-CG1 3.88Å; F247-V370 HydrophobicContact CE2-CG2 4.13Å; F247-C374 WeakPolarHBondContact CB-O 3.47Å; F247-C374 HydrophobicContact CD2-CB 4.37Å; F247-C374 WeakPolarHBondContact CD2-O 3.16Å; F247-C374 HydrophobicContact CE1-CB 4.44Å; F247-C374 HydrophobicContact CE2-CB 4.16Å; F247-C374 WeakPolarHBondContact CG-O 3.46Å; F247-C374 HydrophobicContact CZ-CB 4.19Å; F247-C374 PolarHBondContact N-O 2.73Å
248	T	84.6	Confident	89	Confident	44 Å²	44	22 Å²	22	27%	0.27	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	17.5	173.7	54.7	0	0	0	0	113	P221 M222 G246 R250 D376	P221-T248 HydrophobicContact CB-CG2 4.4Å; P221-T248 HydrophobicContact CG-CG2 4.48Å; M222-T248 HydrophobicContact CG-CG2 4.49Å; G246-T248 PolarHBondContact O-N 2.86Å; G246-T248 VanDerWaalsContact O-N 3.15Å; T248-R250 PolarHBondContact O-N 3.42Å; T248-R250 VanDerWaalsContact O-N 3.1Å; T248-D376 HydrophobicContact CG2-CB 4.16Å
249	S	83.9	Confident	88.6	Confident	46 Å²	46	22 Å²	22	32%	0.322	12%	0.122	S	C	.	.	S	Bend	trans	60.2	12.8	-178.2	-56.4	0	0	0	0	115.6	G246 F247 P251 P444	G246-S249 WeakPolarHBondContact O-CA 3.41Å; G246-S249 PolarHBondContact O-N 3.07Å; F247-S249 VanDerWaalsContact C-N 3.33Å; S249-P251 WeakPolarHBondContact O-CD 3.5Å; S249-P444 VanDerWaalsContact O-CB 3.26Å; S249-P444 WeakPolarHBondContact O-CB 3.21Å; S249-P444 WeakPolarHBondContact O-CG 3.16Å
250	R	85.6	Confident	88.3	Confident	141 Å²	141	22 Å²	22	53%	0.532	12%	0.122	S	C	.	.			trans	-79.6	123	178.9	-171.9	175.1	178.5	-167.3	-1.4	110.9	G246 T248	G246-R250 PolarHBondContact N-O 3.07Å; T248-R250 PolarHBondContact O-N 3.42Å; T248-R250 VanDerWaalsContact O-N 3.1Å
251	P	89.5	Confident	88.2	Confident	35 Å²	35	22 Å²	22	23%	0.227	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	133.9	176.4	31.3	-31.8	0	0	0	111.2	T243 V244 I245 S249 P444	T243-P251 HydrophobicContact CG2-CB 4.09Å; V244-P251 CarbonylContact O-C 3.58Å; V244-P251 WeakPolarHBondContact O-CA 3.41Å; I245-P251 HydrophobicContact CG1-CB 4.29Å; S249-P251 WeakPolarHBondContact O-CD 3.5Å; P251-P444 HydrophobicContact CG-CB 4.34Å
252	Q	89.8	Confident	88.4	Confident	24 Å²	24	21.9 Å²	21.9	11%	0.112	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	119.7	177.2	-62.1	-176.5	-7.8	0	0	109.3	T243 V244 V381	T243-Q252 WeakPolarHBondContact CA-O 3.09Å; V244-Q252 PolarHBondContact N-O 3.38Å; V244-Q252 PolarHBondContact O-N 3.26Å; Q252-V381 HydrophobicContact CB-CG2 4.3Å
253	S	89.2	Confident	88.5	Confident	60 Å²	60	21.6 Å²	21.6	42%	0.42	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	132.3	175	-171.7	0	0	0	0	110.4	P255	S253-P255 WeakPolarHBondContact O-CD 3.48Å
254	V	89	Confident	88.2	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.006	13%	0.133	C	C	.	.			trans	-94.5	112.2	175.3	-179.9	0	0	0	0	108.8	S242 V244 Y260 F277 S286 L373	S242-V254 PolarHBondContact O-N 2.81Å; V244-V254 HydrophobicContact CG2-CG2 4.04Å; V254-Y260 HydrophobicContact CG1-CD2 3.59Å; V254-Y260 HydrophobicContact CG1-CE1 4.32Å; V254-Y260 HydrophobicContact CG1-CE2 3.16Å; V254-Y260 HydrophobicContact CG1-CG 4.3Å; V254-F277 HydrophobicContact CB-CD1 4.11Å; V254-F277 HydrophobicContact CB-CE1 3.92Å; V254-F277 HydrophobicContact CB-CZ 4.2Å; V254-F277 HydrophobicContact CG1-CB 4.44Å; V254-F277 HydrophobicContact CG1-CD1 3.85Å; V254-F277 HydrophobicContact CG1-CD2 3.98Å; V254-F277 HydrophobicContact CG1-CE1 4.05Å; V254-F277 HydrophobicContact CG1-CE2 4.16Å; V254-F277 HydrophobicContact CG1-CG 3.83Å; V254-F277 HydrophobicContact CG1-CZ 4.2Å; V254-F277 HydrophobicContact CG2-CE1 3.96Å; V254-F277 HydrophobicContact CG2-CE2 4.28Å; V254-F277 HydrophobicContact CG2-CZ 3.79Å; V254-S286 PolarHBondContact O-OG 3.07Å; V254-L373 HydrophobicContact CG2-CD1 4.04Å
255	P	81.3	Confident	87.6	Confident	39 Å²	39	26.3 Å²	26.3	25%	0.253	14%	0.138	S	C	.	.			trans	-86.6	-34.1	-173.3	31	-32.4	0	0	0	114	S253 Q402	S253-P255 WeakPolarHBondContact O-CD 3.48Å; P255-Q402 HydrophobicContact CB-CG 4.37Å; P255-Q402 WeakPolarHBondContact O-CG 3.46Å
256	D	83.5	Confident	86.7	Confident	11 Å²	11	30.3 Å²	30.3	6%	0.059	17%	0.167	C	C	.	.	S	Bend	trans	-102.4	161.9	-168.2	-51.5	-68.4	0	0	0	113.6	C258 Y260 S286 K385 M401 Q402	D256-C258 PolarHBondContact O-N 2.82Å; D256-Y260 WeakPolarHBondContact CB-OH 2.91Å; D256-Y260 PolarHBondContact N-OH 3.4Å; D256-Y260 PolarHBondContact OD2-OH 2.61Å; D256-S286 WeakPolarHBondContact O-CB 3.36Å; D256-K385 WeakPolarHBondContact OD2-CE 3.22Å; D256-K385 IonicContact OD2-NZ 2.78Å; D256-K385 PolarHBondContact OD2-NZ 2.91Å; D256-M401 VanDerWaalsContact OD1-CA 3.29Å; D256-M401 WeakPolarHBondContact OD1-CA 3.19Å; D256-Q402 PolarHBondContact OD1-N 2.7Å
257	R	84.4	Confident	85.9	Confident	20 Å²	20	32.1 Å²	32.1	8%	0.075	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-89.3	75.7	178.6	-59.6	-178.3	-61.2	-96.3	3.3	109.8	F277 E279 K283 E400	R257-F277 CarbonylContact C-O 3.58Å; R257-F277 VanDerWaalsContact C-O 3.23Å; R257-F277 WeakPolarHBondContact CA-O 3.42Å; R257-E279 WeakPolarHBondContact CD-OE2 3.28Å; R257-K283 PolarHBondContact NH1-O 2.95Å; R257-E400 HydrophobicContact CB-CB 4.48Å; R257-E400 IonicContact CZ-OE2 3.25Å; R257-E400 VanDerWaalsContact CZ-OE2 3.29Å; R257-E400 PolarHBondContact N-O 2.77Å; R257-E400 IonicContact NE-OE2 2.99Å; R257-E400 PolarHBondContact NE-OE2 2.85Å; R257-E400 VanDerWaalsContact NE-OE2 3.08Å; R257-E400 IonicContact NH2-OE2 2.88Å; R257-E400 PolarHBondContact NH2-OE2 2.85Å
258	C	83.7	Confident	85.2	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.014	18%	0.181	C	C	.	.	S	Bend	trans	-137	164.9	-169.1	-76.8	0	0	0	0	112.3	D256 Y260 F277 C399	D256-C258 PolarHBondContact O-N 2.82Å; C258-Y260 HydrophobicContact CB-CD2 4Å; C258-Y260 HydrophobicContact CB-CE2 3.5Å; C258-Y260 WeakPolarHBondContact O-CD2 3.39Å; C258-F277 PolarHBondContact N-O 2.87Å; C258-F277 PolarHBondContact O-N 2.93Å; C258-C399 HydrophobicContact CB-CB 4.47Å; C258-C399 WeakPolarHBondContact CB-SG 3.42Å; C258-C399 WeakPolarHBondContact SG-CA 3.31Å; C258-C399 WeakPolarHBondContact SG-CB 3.21Å; C258-C399 CovalentContact SG-SG 2.03Å; C258-C399 PolarHBondContact SG-SG 2.94Å
259	G	86.8	Confident	84.4	Confident	4 Å²	4	34.1 Å²	34.1	4%	0.041	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	130.1	158.4	0	0	0	0	0	110.8	G275 S386	G259-G275 WeakPolarHBondContact CA-O 3.45Å; G259-S386 PolarHBondContact O-N 2.67Å
260	Y	89.4	Confident	83.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	138.1	177.1	-72.8	-94.7	0	0	0	111.6	V254 D256 C258 L262 L274 G275 F277 L373 V381 Q384 K385	V254-Y260 HydrophobicContact CG1-CD2 3.59Å; V254-Y260 HydrophobicContact CG1-CE1 4.32Å; V254-Y260 HydrophobicContact CG1-CE2 3.16Å; V254-Y260 HydrophobicContact CG1-CG 4.3Å; D256-Y260 WeakPolarHBondContact CB-OH 2.91Å; D256-Y260 PolarHBondContact N-OH 3.4Å; D256-Y260 PolarHBondContact OD2-OH 2.61Å; C258-Y260 HydrophobicContact CB-CD2 4Å; C258-Y260 HydrophobicContact CB-CE2 3.5Å; C258-Y260 WeakPolarHBondContact O-CD2 3.39Å; Y260-L262 PolarHBondContact O-N 3.43Å; Y260-L262 VanDerWaalsContact O-N 3.13Å; Y260-L274 CarbonylContact O-C 3.51Å; Y260-L274 WeakPolarHBondContact O-CA 3.27Å; Y260-L274 WeakPolarHBondContact O-CD2 3.37Å; Y260-G275 PolarHBondContact N-O 3.4Å; Y260-G275 PolarHBondContact O-N 3.03Å; Y260-F277 AromaticContact CD2-CD2 3.77Å; Y260-F277 HydrophobicContact CD2-CD2 3.77Å; Y260-F277 HydrophobicContact CD2-CE2 4.15Å; Y260-F277 HydrophobicContact CE2-CD2 4.44Å; Y260-L373 HydrophobicContact CD1-CD1 4.01Å; Y260-L373 HydrophobicContact CG-CD1 4.1Å; Y260-V381 HydrophobicContact CD1-CG1 4.28Å; Y260-V381 HydrophobicContact CE1-CG1 3.76Å; Y260-V381 WeakPolarHBondContact CE1-O 3.35Å; Y260-Q384 WeakPolarHBondContact CA-O 3.29Å; Y260-Q384 HydrophobicContact CD1-CB 4.44Å; Y260-K385 HydrophobicContact CD1-CG 4.07Å; Y260-K385 HydrophobicContact CE1-CG 3.48Å; Y260-K385 VanDerWaalsContact CE1-CG 3.48Å; Y260-K385 WeakPolarHBondContact OH-CE 3.29Å
261	S	91.1	Very high	83.8	Confident	3 Å²	3	26.2 Å²	26.2	2%	0.021	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	105.3	171.3	177.7	0	0	0	0	109.8	R264 G372 L373 Q384	S261-R264 PolarHBondContact OG-NE 3.04Å; S261-G372 CarbonylContact O-C 3.47Å; S261-G372 WeakPolarHBondContact O-CA 3.26Å; S261-L373 PolarHBondContact O-N 3.07Å; S261-Q384 PolarHBondContact N-O 3.02Å
262	L	92.9	Very high	83.8	Confident	0 Å²	0	25 Å²	25	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-48.2	174.8	-64.5	178.6	0	0	0	110.4	V239 V244 Y260 V273 I360 G372 L373 C374	V239-L262 HydrophobicContact CG2-CD1 4.02Å; V239-L262 HydrophobicContact CG2-CD2 3.94Å; V244-L262 HydrophobicContact CG2-CD2 3.84Å; Y260-L262 PolarHBondContact O-N 3.43Å; Y260-L262 VanDerWaalsContact O-N 3.13Å; L262-V273 WeakPolarHBondContact CB-O 3.5Å; L262-V273 PolarHBondContact N-O 3.11Å; L262-I360 HydrophobicContact CB-CD1 3.92Å; L262-I360 HydrophobicContact CD1-CD1 3.91Å; L262-G372 CarbonylContact O-C 3.08Å; L262-L373 HydrophobicContact CD2-CB 4.33Å; L262-L373 HydrophobicContact CD2-CD1 4.3Å; L262-L373 PolarHBondContact O-N 3.44Å; L262-C374 VanDerWaalsContact O-CB 3.22Å; L262-C374 WeakPolarHBondContact O-CB 3.42Å; L262-C374 PolarHBondContact O-N 2.82Å
263	L	91.2	Very high	84	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.016	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	125.6	-177.6	-168	80.2	0	0	0	111.5	F247 V273 V349 I360 V370 Q371 C374	F247-L263 HydrophobicContact CE2-CD1 3.57Å; F247-L263 HydrophobicContact CZ-CD1 3.77Å; L263-V273 HydrophobicContact CB-CB 3.91Å; L263-V273 HydrophobicContact CB-CG2 3.99Å; L263-V273 HydrophobicContact CD2-CG2 4.24Å; L263-V273 PolarHBondContact N-O 3.36Å; L263-V273 VanDerWaalsContact N-O 3.17Å; L263-V273 PolarHBondContact O-N 3.31Å; L263-V349 HydrophobicContact CD2-CG1 4.14Å; L263-V349 HydrophobicContact CD2-CG2 4.17Å; L263-I360 HydrophobicContact CD2-CG2 4.1Å; L263-V370 HydrophobicContact CD1-CG1 3.45Å; L263-V370 VanDerWaalsContact CD1-CG1 3.45Å; L263-V370 HydrophobicContact CD1-CG2 4.4Å; L263-Q371 CarbonylContact C-O 3.33Å; L263-C374 HydrophobicContact CD1-CB 4.46Å
264	R	87.5	Confident	84.1	Confident	89 Å²	89	21 Å²	21	34%	0.336	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145.1	160.5	-64.9	178.7	-176.7	-153.6	-4.4	108.3	S261 H272 Q371	S261-R264 PolarHBondContact OG-NE 3.04Å; R264-H272 HydrophobicContact CG-CB 4.34Å; R264-H272 WeakPolarHBondContact CG-CD2 3.37Å; R264-H272 PolarHBondContact NE-CD2 2.88Å; R264-H272 PolarHBondContact NE-NE2 2.87Å; R264-H272 PolarHBondContact NH2-CE1 3.1Å; R264-H272 PolarHBondContact NH2-NE2 2.83Å; R264-Q371 HydrophobicContact CB-CB 4.29Å; R264-Q371 PolarHBondContact N-O 2.75Å; R264-Q371 PolarHBondContact O-N 3.14Å
265	S	81.3	Confident	84.3	Confident	15 Å²	15	21 Å²	21	11%	0.105	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	135.2	172	-178.4	0	0	0	0	111.2	S267 L268 P369	S265-S267 PolarHBondContact O-N 2.7Å; S265-S267 PolarHBondContact OG-N 3.16Å; S265-L268 CarbonylContact O-C 3.54Å; S265-L268 PolarHBondContact O-N 3.34Å; S265-L268 VanDerWaalsContact O-N 3.09Å; S265-P369 WeakPolarHBondContact CA-O 3.45Å; S265-P369 VanDerWaalsContact CB-O 3.29Å; S265-P369 WeakPolarHBondContact CB-O 3.42Å; S265-P369 PolarHBondContact OG-O 3.21Å
266	S	75.3	Confident	84.8	Confident	95 Å²	95	19.1 Å²	19.1	66%	0.664	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-16.7	173.2	57.7	0	0	0	0	113	L268 P269 P369	S266-L268 VanDerWaalsContact C-N 3.27Å; S266-P269 WeakPolarHBondContact O-CD 3.32Å; S266-P369 VanDerWaalsContact OG-CG 3.23Å; S266-P369 WeakPolarHBondContact OG-CG 3.29Å
267	S	73.8	Confident	85.1	Confident	40 Å²	40	18.6 Å²	18.6	28%	0.28	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-12.4	170.1	-61.2	0	0	0	0	113.4	S265 P269	S265-S267 PolarHBondContact O-N 2.7Å; S265-S267 PolarHBondContact OG-N 3.16Å; S267-P269 WeakPolarHBondContact O-CD 3.47Å
268	L	76.3	Confident	85.4	Confident	9 Å²	9	18.6 Å²	18.6	5%	0.047	11%	0.112	C	C	.	.	S	Bend	trans	-122.8	62	174	-66.9	166.9	0	0	0	109.5	S265 S266 G270 L271 A344 V349 L362	S265-L268 CarbonylContact O-C 3.54Å; S265-L268 PolarHBondContact O-N 3.34Å; S265-L268 VanDerWaalsContact O-N 3.09Å; S266-L268 VanDerWaalsContact C-N 3.27Å; L268-G270 PolarHBondContact O-N 3.1Å; L268-L271 HydrophobicContact CB-CB 4.34Å; L268-L271 HydrophobicContact CD1-CD2 4.43Å; L268-L271 PolarHBondContact O-N 2.74Å; L268-A344 HydrophobicContact CD2-CB 3.51Å; L268-V349 HydrophobicContact CD1-CG2 3.35Å; L268-L362 HydrophobicContact CD1-CD1 4.26Å
269	P	67	Low	85.6	Confident	80 Å²	80	19.2 Å²	19.2	52%	0.519	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	113.3	-176.2	28.5	-34	0	0	0	109.5	S266 S267 R297	S266-P269 WeakPolarHBondContact O-CD 3.32Å; S267-P269 WeakPolarHBondContact O-CD 3.47Å; P269-R297 PolarHBondContact O-NE 2.87Å
270	G	72.3	Confident	85.8	Confident	12 Å²	12	19.2 Å²	19.2	12%	0.124	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	108.9	8.7	-170.8	0	0	0	0	0	116.3	L268 L295 D296	L268-G270 PolarHBondContact O-N 3.1Å; G270-L295 VanDerWaalsContact O-CA 3.3Å; G270-L295 WeakPolarHBondContact O-CA 3.48Å; G270-D296 VanDerWaalsContact CA-OD2 3.3Å; G270-D296 WeakPolarHBondContact CA-OD2 3.32Å; G270-D296 PolarHBondContact N-OD2 3.11Å; G270-D296 PolarHBondContact O-N 3.11Å
271	L	85.5	Confident	85.6	Confident	8 Å²	8	22.4 Å²	22.4	4%	0.042	13%	0.125	C	C	.	.			trans	-123.2	121.8	169.4	179.8	66.9	0	0	0	111.9	L268 V273 L293 L295 L342 V349	L268-L271 HydrophobicContact CB-CB 4.34Å; L268-L271 HydrophobicContact CD1-CD2 4.43Å; L268-L271 PolarHBondContact O-N 2.74Å; L271-V273 HydrophobicContact CD1-CG2 4.15Å; L271-V273 HydrophobicContact CD2-CG2 4.27Å; L271-V273 HydrophobicContact CG-CG2 4.16Å; L271-L293 HydrophobicContact CD1-CB 4.32Å; L271-L293 HydrophobicContact CD1-CD2 4.2Å; L271-L293 HydrophobicContact CD1-CG 4.39Å; L271-L295 HydrophobicContact CD1-CD2 3.86Å; L271-L342 HydrophobicContact CB-CD2 3.96Å; L271-L342 HydrophobicContact CD1-CD2 4.38Å; L271-L342 HydrophobicContact CD2-CD2 3.83Å; L271-L342 HydrophobicContact CG-CD2 4.26Å; L271-V349 HydrophobicContact CD2-CB 4.1Å; L271-V349 HydrophobicContact CD2-CG1 4.01Å; L271-V349 HydrophobicContact CD2-CG2 4.2Å
272	H	88.8	Confident	85.3	Confident	10 Å²	10	23.9 Å²	23.9	5%	0.046	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	119.5	169	170.4	-142.3	0	0	0	109.7	R264 L274 Q294	R264-H272 HydrophobicContact CG-CB 4.34Å; R264-H272 WeakPolarHBondContact CG-CD2 3.37Å; R264-H272 PolarHBondContact NE-CD2 2.88Å; R264-H272 PolarHBondContact NE-NE2 2.87Å; R264-H272 PolarHBondContact NH2-CE1 3.1Å; R264-H272 PolarHBondContact NH2-NE2 2.83Å; H272-L274 WeakPolarHBondContact CE1-CD2 3.25Å; H272-L274 WeakPolarHBondContact CE1-CG 3.48Å; H272-L274 WeakPolarHBondContact NE2-CD2 3.33Å; H272-Q294 HydrophobicContact CB-CB 4.27Å; H272-Q294 PolarHBondContact CE1-OE1 3.48Å; H272-Q294 PolarHBondContact N-O 2.8Å; H272-Q294 PolarHBondContact ND1-OE1 3.45Å; H272-Q294 PolarHBondContact O-N 2.97Å
273	V	92.8	Very high	84.8	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.4	178.1	-170	0	0	0	0	109.5	L262 L263 L271 V291 V292 V351 I360	L262-V273 WeakPolarHBondContact CB-O 3.5Å; L262-V273 PolarHBondContact N-O 3.11Å; L263-V273 HydrophobicContact CB-CB 3.91Å; L263-V273 HydrophobicContact CB-CG2 3.99Å; L263-V273 HydrophobicContact CD2-CG2 4.24Å; L263-V273 PolarHBondContact N-O 3.36Å; L263-V273 VanDerWaalsContact N-O 3.17Å; L263-V273 PolarHBondContact O-N 3.31Å; L271-V273 HydrophobicContact CD1-CG2 4.15Å; L271-V273 HydrophobicContact CD2-CG2 4.27Å; L271-V273 HydrophobicContact CG-CG2 4.16Å; V273-V291 HydrophobicContact CG1-CG1 3.58Å; V273-V292 WeakPolarHBondContact CA-O 3.4Å; V273-V351 HydrophobicContact CG1-CG2 4.34Å; V273-V351 HydrophobicContact CG2-CG2 4.2Å; V273-I360 HydrophobicContact CG1-CD1 3.93Å
274	L	92.4	Very high	84.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	137.1	176.9	-75.6	170.4	0	0	0	110.7	Y260 H272 I276 V291 V292 Q294 Y389	Y260-L274 CarbonylContact O-C 3.51Å; Y260-L274 WeakPolarHBondContact O-CA 3.27Å; Y260-L274 WeakPolarHBondContact O-CD2 3.37Å; H272-L274 WeakPolarHBondContact CE1-CD2 3.25Å; H272-L274 WeakPolarHBondContact CE1-CG 3.48Å; H272-L274 WeakPolarHBondContact NE2-CD2 3.33Å; L274-I276 HydrophobicContact CB-CD1 4.46Å; L274-V291 CarbonylContact O-C 3.39Å; L274-V291 WeakPolarHBondContact O-CA 3.01Å; L274-V292 HydrophobicContact CB-CB 4.18Å; L274-V292 PolarHBondContact N-O 3.01Å; L274-V292 PolarHBondContact O-N 3.12Å; L274-Q294 HydrophobicContact CD1-CG 4.25Å; L274-Y389 HydrophobicContact CD1-CD2 3.85Å
275	G	93.3	Very high	83.9	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	124	163.3	0	0	0	0	0	108.9	G259 Y260 F277	G259-G275 WeakPolarHBondContact CA-O 3.45Å; Y260-G275 PolarHBondContact N-O 3.4Å; Y260-G275 PolarHBondContact O-N 3.03Å; G275-F277 WeakPolarHBondContact O-CD2 3.31Å
276	I	90.9	Very high	84.3	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	127.1	173.7	-50.2	-55.7	0	0	0	108.2	L274 D289 R290 V292 Y389 L396	L274-I276 HydrophobicContact CB-CD1 4.46Å; I276-D289 VanDerWaalsContact O-CB 3.29Å; I276-D289 WeakPolarHBondContact O-CB 3.19Å; I276-D289 PolarHBondContact O-N 2.96Å; I276-R290 HydrophobicContact CB-CG 3.79Å; I276-R290 HydrophobicContact CG1-CG 3.92Å; I276-R290 PolarHBondContact N-O 3.39Å; I276-V292 HydrophobicContact CG1-CG2 4.02Å; I276-Y389 HydrophobicContact CD1-CD1 3.94Å; I276-Y389 HydrophobicContact CD1-CD2 4.16Å; I276-Y389 HydrophobicContact CD1-CE1 4.03Å; I276-Y389 HydrophobicContact CD1-CE2 4.22Å; I276-Y389 HydrophobicContact CD1-CG 4.03Å; I276-Y389 HydrophobicContact CG1-CE1 4.47Å; I276-L396 HydrophobicContact CG2-CD2 3.99Å
277	F	90.9	Very high	85.1	Confident	1 Å²	1	19.4 Å²	19.4	0%	0.004	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.4	-179.5	-66.4	-105.2	0	0	0	110.6	V239 V244 V254 R257 C258 Y260 G275 F287 L288	V239-F277 HydrophobicContact CG1-CE1 4.19Å; V239-F277 HydrophobicContact CG1-CZ 3.71Å; V244-F277 HydrophobicContact CG2-CZ 4.47Å; V254-F277 HydrophobicContact CB-CD1 4.11Å; V254-F277 HydrophobicContact CB-CE1 3.92Å; V254-F277 HydrophobicContact CB-CZ 4.2Å; V254-F277 HydrophobicContact CG1-CB 4.44Å; V254-F277 HydrophobicContact CG1-CD1 3.85Å; V254-F277 HydrophobicContact CG1-CD2 3.98Å; V254-F277 HydrophobicContact CG1-CE1 4.05Å; V254-F277 HydrophobicContact CG1-CE2 4.16Å; V254-F277 HydrophobicContact CG1-CG 3.83Å; V254-F277 HydrophobicContact CG1-CZ 4.2Å; V254-F277 HydrophobicContact CG2-CE1 3.96Å; V254-F277 HydrophobicContact CG2-CE2 4.28Å; V254-F277 HydrophobicContact CG2-CZ 3.79Å; R257-F277 CarbonylContact C-O 3.58Å; R257-F277 VanDerWaalsContact C-O 3.23Å; R257-F277 WeakPolarHBondContact CA-O 3.42Å; C258-F277 PolarHBondContact N-O 2.87Å; C258-F277 PolarHBondContact O-N 2.93Å; Y260-F277 AromaticContact CD2-CD2 3.77Å; Y260-F277 HydrophobicContact CD2-CD2 3.77Å; Y260-F277 HydrophobicContact CD2-CE2 4.15Å; Y260-F277 HydrophobicContact CE2-CD2 4.44Å; G275-F277 WeakPolarHBondContact O-CD2 3.31Å; F277-F287 CarbonylContact C-O 3.57Å; F277-F287 VanDerWaalsContact CA-O 3.24Å; F277-F287 WeakPolarHBondContact CA-O 3.47Å; F277-L288 HydrophobicContact CD1-CB 4.44Å; F277-L288 HydrophobicContact CE1-CB 4.1Å; F277-L288 HydrophobicContact CE2-CD1 4.32Å; F277-L288 HydrophobicContact CZ-CD1 4.25Å
278	K	89.5	Confident	86	Confident	20 Å²	20	17.6 Å²	17.6	9%	0.087	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	168.9	175.2	-75.6	-166.9	173.2	-173.2	0	109.9	F287 D289 D393 L396	K278-F287 PolarHBondContact N-O 3.06Å; K278-F287 PolarHBondContact O-N 3.3Å; K278-D289 HydrophobicContact CB-CB 4.16Å; K278-D289 HydrophobicContact CG-CB 4.3Å; K278-D393 IonicContact NZ-OD2 3.97Å; K278-D393 PolarHBondContact NZ-OD2 2.89Å; K278-L396 VanDerWaalsContact CE-CD1 3.46Å
279	E	88.7	Confident	86.7	Confident	15 Å²	15	17.5 Å²	17.5	7%	0.07	9%	0.089	C	C	.	.			trans	-76.7	160.9	172.9	81.1	-69.6	179.9	0	0	113.1	R257 R282 R523 A524 L525	R257-E279 WeakPolarHBondContact CD-OE2 3.28Å; E279-R282 WeakPolarHBondContact CB-O 3.39Å; E279-R523 HydrophobicContact CG-CB 4.16Å; E279-R523 PolarHBondContact O-NH1 3.29Å; E279-R523 VanDerWaalsContact OE1-CB 3.24Å; E279-R523 WeakPolarHBondContact OE1-CB 3.48Å; E279-A524 HydrophobicContact CG-CB 4.36Å; E279-L525 VanDerWaalsContact CD-CD1 3.44Å; E279-L525 HydrophobicContact CG-CD1 4.19Å; E279-L525 HydrophobicContact CG-CG 4Å; E279-L525 VanDerWaalsContact OE1-CB 3.3Å; E279-L525 WeakPolarHBondContact OE1-CB 3.46Å; E279-L525 WeakPolarHBondContact OE1-CD1 3.29Å; E279-L525 WeakPolarHBondContact OE1-CG 3.44Å; E279-L525 PolarHBondContact OE1-N 2.91Å
280	R	89.9	Confident	88	Confident	4 Å²	4	14.3 Å²	14.3	2%	0.015	7%	0.067	C	C	.	.	S	Bend	trans	-117.5	-117.5	168.1	-65.2	-175.3	-178.5	-168.9	1.1	110.2	R282 F287 Q356 Y456 F508 A524	R280-R282 PolarHBondContact O-N 2.59Å; R280-F287 HydrophobicContact CB-CD2 4.05Å; R280-F287 HydrophobicContact CB-CE2 4.33Å; R280-F287 HydrophobicContact CB-CG 4.49Å; R280-F287 HydrophobicContact CG-CB 3.98Å; R280-F287 HydrophobicContact CG-CD1 4.45Å; R280-F287 HydrophobicContact CG-CD2 3.83Å; R280-F287 HydrophobicContact CG-CG 3.82Å; R280-Q356 VanDerWaalsContact NH2-OE1 3.11Å; R280-Y456 HydrophobicContact CB-CE2 4.29Å; R280-Y456 VanDerWaalsContact CB-OH 3.24Å; R280-Y456 WeakPolarHBondContact CB-OH 3.07Å; R280-F508 HydrophobicContact CB-CD1 4.16Å; R280-F508 HydrophobicContact CB-CD2 4.13Å; R280-F508 HydrophobicContact CB-CE1 3.98Å; R280-F508 HydrophobicContact CB-CE2 3.96Å; R280-F508 HydrophobicContact CB-CG 4.24Å; R280-F508 HydrophobicContact CB-CZ 3.9Å; R280-F508 HydrophobicContact CG-CD1 4.32Å; R280-F508 HydrophobicContact CG-CD2 3.82Å; R280-F508 HydrophobicContact CG-CE2 4.11Å; R280-F508 HydrophobicContact CG-CG 3.94Å; R280-F508 HydrophobicContact CG-CZ 4.5Å; R280-A524 VanDerWaalsContact O-CB 3.24Å; R280-A524 WeakPolarHBondContact O-CB 3.35Å; R280-A524 PolarHBondContact O-N 2.8Å
281	R	86.9	Confident	89	Confident	67 Å²	67	13.8 Å²	13.8	25%	0.253	6%	0.061	S	C	.	.	S	Bend	trans	-74.5	-6	179.4	-60.7	-179.8	-170.2	-82.5	1.6	115.1	Y456 D460 F508 H521	R281-Y456 HydrophobicContact CB-CE2 4.16Å; R281-Y456 WeakPolarHBondContact CB-OH 3.38Å; R281-Y456 VanDerWaalsContact CG-OH 3.3Å; R281-Y456 WeakPolarHBondContact CG-OH 3.48Å; R281-Y456 PolarHBondContact N-OH 3.18Å; R281-D460 IonicContact CZ-OD1 3.74Å; R281-D460 VanDerWaalsContact NE-CG 3.33Å; R281-D460 IonicContact NE-OD1 3.75Å; R281-D460 PolarHBondContact NE-OD1 2.86Å; R281-D460 IonicContact NE-OD2 3.34Å; R281-D460 PolarHBondContact NE-OD2 3.16Å; R281-D460 IonicContact NH2-OD1 2.65Å; R281-D460 PolarHBondContact NH2-OD1 3.04Å; R281-F508 HydrophobicContact CG-CE1 4.26Å; R281-F508 HydrophobicContact CG-CZ 3.66Å; R281-H521 PolarHBondContact NH1-ND1 2.86Å; R281-H521 PolarHBondContact NH2-CD2 3.5Å; R281-H521 PolarHBondContact NH2-CE1 3.43Å; R281-H521 VanDerWaalsContact NH2-CG 3.35Å; R281-H521 PolarHBondContact NH2-ND1 2.87Å; R281-H521 PolarHBondContact NH2-NE2 3.01Å
282	R	83.7	Confident	89.4	Confident	33 Å²	33	13.4 Å²	13.4	13%	0.125	6%	0.059	C	C	.	.			trans	-133.8	128.3	-172.8	-79.6	-63.3	-60.3	-139.8	-17	110.5	E279 R280 D284 L285 D408 S411 Y456	E279-R282 WeakPolarHBondContact CB-O 3.39Å; R280-R282 PolarHBondContact O-N 2.59Å; R282-D284 WeakPolarHBondContact CB-OD1 3.47Å; R282-D284 IonicContact CZ-OD1 2.67Å; R282-D284 VanDerWaalsContact CZ-OD1 3.32Å; R282-D284 IonicContact CZ-OD2 2.91Å; R282-D284 IonicContact NE-OD1 3.37Å; R282-D284 PolarHBondContact NE-OD1 2.86Å; R282-D284 IonicContact NE-OD2 3.7Å; R282-D284 VanDerWaalsContact NH2-CG 3.26Å; R282-D284 IonicContact NH2-OD1 3.74Å; R282-D284 PolarHBondContact NH2-OD1 3.18Å; R282-D284 VanDerWaalsContact NH2-OD1 3.15Å; R282-D284 IonicContact NH2-OD2 2.61Å; R282-D284 PolarHBondContact NH2-OD2 2.93Å; R282-L285 HydrophobicContact CB-CB 4.28Å; R282-L285 HydrophobicContact CB-CD1 3.95Å; R282-L285 HydrophobicContact CB-CG 4.26Å; R282-L285 HydrophobicContact CG-CD1 4.25Å; R282-D408 IonicContact NH1-OD2 2.7Å; R282-D408 PolarHBondContact NH1-OD2 3.09Å; R282-S411 VanDerWaalsContact CZ-OG 3.25Å; R282-S411 PolarHBondContact NH1-OG 3.1Å; R282-S411 PolarHBondContact NH2-OG 3.15Å; R282-Y456 HydrophobicContact CB-CD2 4.4Å; R282-Y456 HydrophobicContact CB-CE2 4.35Å; R282-Y456 HydrophobicContact CG-CD2 4.2Å; R282-Y456 HydrophobicContact CG-CE2 4.34Å
283	K	82.1	Confident	89.6	Confident	42 Å²	42	13 Å²	13	18%	0.183	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-28.8	-176.1	-67.3	-170.3	-83.9	161.6	0	113.2	R257 L285 D405 A524 L525	R257-K283 PolarHBondContact NH1-O 2.95Å; K283-L285 VanDerWaalsContact C-N 3.34Å; K283-D405 WeakPolarHBondContact CE-OD2 3.46Å; K283-D405 VanDerWaalsContact NZ-CG 3.33Å; K283-D405 IonicContact NZ-OD1 2.68Å; K283-D405 PolarHBondContact NZ-OD1 2.96Å; K283-D405 IonicContact NZ-OD2 2.63Å; K283-D405 PolarHBondContact NZ-OD2 3.17Å; K283-A524 HydrophobicContact CG-CB 3.73Å; K283-L525 HydrophobicContact CB-CD2 4.18Å; K283-L525 HydrophobicContact CD-CD2 3.66Å; K283-L525 HydrophobicContact CD-CG 4.49Å; K283-L525 HydrophobicContact CG-CD2 3.82Å; K283-L525 HydrophobicContact CG-CG 4.26Å
284	D	77.1	Confident	89.4	Confident	42 Å²	42	14.8 Å²	14.8	23%	0.225	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-2	-176.5	58.3	-47.7	0	0	0	114.5	R282 Q402	R282-D284 WeakPolarHBondContact CB-OD1 3.47Å; R282-D284 IonicContact CZ-OD1 2.67Å; R282-D284 VanDerWaalsContact CZ-OD1 3.32Å; R282-D284 IonicContact CZ-OD2 2.91Å; R282-D284 IonicContact NE-OD1 3.37Å; R282-D284 PolarHBondContact NE-OD1 2.86Å; R282-D284 IonicContact NE-OD2 3.7Å; R282-D284 VanDerWaalsContact NH2-CG 3.26Å; R282-D284 IonicContact NH2-OD1 3.74Å; R282-D284 PolarHBondContact NH2-OD1 3.18Å; R282-D284 VanDerWaalsContact NH2-OD1 3.15Å; R282-D284 IonicContact NH2-OD2 2.61Å; R282-D284 PolarHBondContact NH2-OD2 2.93Å; D284-Q402 PolarHBondContact O-NE2 3.36Å
285	L	84.5	Confident	89	Confident	21 Å²	21	15.4 Å²	15.4	11%	0.11	7%	0.069	C	C	.	.			trans	-124.5	137.6	-175.3	-63.8	174.5	0	0	0	111.6	R282 K283 F287 K455 Y456	R282-L285 HydrophobicContact CB-CB 4.28Å; R282-L285 HydrophobicContact CB-CD1 3.95Å; R282-L285 HydrophobicContact CB-CG 4.26Å; R282-L285 HydrophobicContact CG-CD1 4.25Å; K283-L285 VanDerWaalsContact C-N 3.34Å; L285-F287 HydrophobicContact CB-CE2 3.81Å; L285-K455 HydrophobicContact CD1-CB 3.96Å; L285-K455 HydrophobicContact CD2-CB 4.12Å; L285-K455 HydrophobicContact CD2-CD 3.91Å; L285-Y456 HydrophobicContact CD1-CD2 3.86Å
286	S	88.2	Confident	87.9	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.014	10%	0.098	C	C	.	.			trans	-95.8	149.6	173.2	92.4	0	0	0	0	110.8	S242 V254 D256	S242-S286 WeakPolarHBondContact CB-O 3.3Å; V254-S286 PolarHBondContact O-OG 3.07Å; D256-S286 WeakPolarHBondContact O-CB 3.36Å
287	F	92.1	Very high	86.5	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.009	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	140.8	174.3	-72.4	-96.1	0	0	0	109	G241 F277 K278 R280 L285 D289 T452 Y456 L462	G241-F287 WeakPolarHBondContact O-CA 3.44Å; F277-F287 CarbonylContact C-O 3.57Å; F277-F287 VanDerWaalsContact CA-O 3.24Å; F277-F287 WeakPolarHBondContact CA-O 3.47Å; K278-F287 PolarHBondContact N-O 3.06Å; K278-F287 PolarHBondContact O-N 3.3Å; R280-F287 HydrophobicContact CB-CD2 4.05Å; R280-F287 HydrophobicContact CB-CE2 4.33Å; R280-F287 HydrophobicContact CB-CG 4.49Å; R280-F287 HydrophobicContact CG-CB 3.98Å; R280-F287 HydrophobicContact CG-CD1 4.45Å; R280-F287 HydrophobicContact CG-CD2 3.83Å; R280-F287 HydrophobicContact CG-CG 3.82Å; L285-F287 HydrophobicContact CB-CE2 3.81Å; F287-D289 PolarHBondContact O-N 2.91Å; F287-T452 HydrophobicContact CE1-CG2 4.18Å; F287-T452 HydrophobicContact CZ-CG2 4.33Å; F287-Y456 HydrophobicContact CE1-CD2 4.48Å; F287-Y456 HydrophobicContact CE1-CE2 4.49Å; F287-Y456 AromaticContact CE2-CD2 3.76Å; F287-Y456 HydrophobicContact CE2-CD2 3.76Å; F287-Y456 AromaticContact CE2-CE2 3.6Å; F287-Y456 HydrophobicContact CE2-CE2 3.6Å; F287-Y456 HydrophobicContact CZ-CD1 4.38Å; F287-Y456 AromaticContact CZ-CD2 3.38Å; F287-Y456 HydrophobicContact CZ-CD2 3.38Å; F287-Y456 HydrophobicContact CZ-CE1 4.48Å; F287-Y456 AromaticContact CZ-CE2 3.49Å; F287-Y456 HydrophobicContact CZ-CE2 3.49Å; F287-Y456 VanDerWaalsContact CZ-CE2 3.49Å; F287-Y456 AromaticContact CZ-CG 3.85Å; F287-Y456 HydrophobicContact CZ-CG 3.85Å; F287-L462 HydrophobicContact CE1-CD1 4.25Å; F287-L462 HydrophobicContact CE1-CD2 3.8Å; F287-L462 HydrophobicContact CZ-CD2 4.3Å
288	L	93.4	Very high	85.1	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	123.8	168.9	-177.9	68.9	0	0	0	109.6	V239 G241 F277 V291 F353 A358	V239-L288 HydrophobicContact CB-CD2 4.04Å; V239-L288 HydrophobicContact CG1-CB 4.23Å; V239-L288 HydrophobicContact CG1-CD1 4.24Å; V239-L288 HydrophobicContact CG1-CD2 3.86Å; V239-L288 HydrophobicContact CG1-CG 4.34Å; G241-L288 PolarHBondContact O-N 3.35Å; F277-L288 HydrophobicContact CD1-CB 4.44Å; F277-L288 HydrophobicContact CE1-CB 4.1Å; F277-L288 HydrophobicContact CE2-CD1 4.32Å; F277-L288 HydrophobicContact CZ-CD1 4.25Å; L288-V291 HydrophobicContact CD1-CG2 4.29Å; L288-V291 HydrophobicContact CD2-CG2 4.26Å; L288-F353 HydrophobicContact CD2-CD2 4.1Å; L288-F353 HydrophobicContact CD2-CE2 3.61Å; L288-F353 HydrophobicContact CG-CE2 4.05Å; L288-A358 HydrophobicContact CD2-CB 3.71Å
289	D	91.5	Very high	84.2	Confident	8 Å²	8	38.4 Å²	38.4	4%	0.043	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-46.6	-175.6	-164.8	60.9	0	0	0	110.8	I276 K278 F287 Q306 F353 R523	I276-D289 VanDerWaalsContact O-CB 3.29Å; I276-D289 WeakPolarHBondContact O-CB 3.19Å; I276-D289 PolarHBondContact O-N 2.96Å; K278-D289 HydrophobicContact CB-CB 4.16Å; K278-D289 HydrophobicContact CG-CB 4.3Å; F287-D289 PolarHBondContact O-N 2.91Å; D289-Q306 VanDerWaalsContact O-CG 3.22Å; D289-Q306 WeakPolarHBondContact O-CG 3.33Å; D289-F353 WeakPolarHBondContact O-CZ 3.49Å; D289-R523 IonicContact OD1-CZ 3.15Å; D289-R523 IonicContact OD1-NH1 3.72Å; D289-R523 PolarHBondContact OD1-NH1 2.81Å; D289-R523 IonicContact OD1-NH2 3.43Å; D289-R523 PolarHBondContact OD1-NH2 3.08Å; D289-R523 IonicContact OD2-NH2 2.78Å
290	R	92.4	Very high	83.9	Confident	13 Å²	13	37.8 Å²	37.8	5%	0.049	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	163.6	-178.4	58.9	-179.5	-171.5	-94.4	3.2	111.2	I276 L304 E305 Y389 D391	I276-R290 HydrophobicContact CB-CG 3.79Å; I276-R290 HydrophobicContact CG1-CG 3.92Å; I276-R290 PolarHBondContact N-O 3.39Å; R290-L304 WeakPolarHBondContact CA-O 3.48Å; R290-L304 WeakPolarHBondContact CB-O 3.09Å; R290-E305 WeakPolarHBondContact CD-OE1 3.25Å; R290-E305 WeakPolarHBondContact CD-OE2 3.1Å; R290-Y389 PolarHBondContact NH2-OH 2.99Å; R290-D391 IonicContact CZ-OD2 3.67Å; R290-D391 IonicContact NH2-OD2 3.32Å; R290-D391 PolarHBondContact NH2-OD2 3.18Å
291	V	95.3	Very high	83.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.8	177.5	-174.9	0	0	0	0	109.7	V273 L274 L288 L293 L304 V351 F353 A358	V273-V291 HydrophobicContact CG1-CG1 3.58Å; L274-V291 CarbonylContact O-C 3.39Å; L274-V291 WeakPolarHBondContact O-CA 3.01Å; L288-V291 HydrophobicContact CD1-CG2 4.29Å; L288-V291 HydrophobicContact CD2-CG2 4.26Å; V291-L293 HydrophobicContact CG1-CD1 4.49Å; V291-L304 HydrophobicContact CB-CB 4.43Å; V291-L304 PolarHBondContact N-O 2.92Å; V291-L304 VanDerWaalsContact N-O 3.09Å; V291-L304 PolarHBondContact O-N 2.94Å; V291-V351 HydrophobicContact CG1-CG1 3.78Å; V291-F353 HydrophobicContact CG2-CB 4.29Å; V291-F353 HydrophobicContact CG2-CD2 3.89Å; V291-F353 HydrophobicContact CG2-CE2 4.38Å; V291-F353 HydrophobicContact CG2-CG 4.04Å; V291-A358 HydrophobicContact CG2-CB 3.58Å
292	V	93	Very high	84	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.2	-178.9	-180	0	0	0	0	110.1	V273 L274 I276 Q294 Q301 I302 Y389	V273-V292 WeakPolarHBondContact CA-O 3.4Å; L274-V292 HydrophobicContact CB-CB 4.18Å; L274-V292 PolarHBondContact N-O 3.01Å; L274-V292 PolarHBondContact O-N 3.12Å; I276-V292 HydrophobicContact CG1-CG2 4.02Å; V292-Q294 HydrophobicContact CG1-CG 4.23Å; V292-Q301 HydrophobicContact CG1-CG 3.35Å; V292-I302 CarbonylContact C-O 3.59Å; V292-I302 WeakPolarHBondContact CA-O 2.94Å; V292-Y389 HydrophobicContact CB-CE2 4.4Å; V292-Y389 HydrophobicContact CG1-CE2 4.14Å; V292-Y389 HydrophobicContact CG2-CE2 3.97Å
293	L	92.5	Very high	84.5	Confident	3 Å²	3	35 Å²	35	2%	0.016	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	112.2	169.3	-66.8	76	0	0	0	107.7	L271 V291 I302 L304 A340 V351	L271-L293 HydrophobicContact CD1-CB 4.32Å; L271-L293 HydrophobicContact CD1-CD2 4.2Å; L271-L293 HydrophobicContact CD1-CG 4.39Å; V291-L293 HydrophobicContact CG1-CD1 4.49Å; L293-I302 HydrophobicContact CB-CB 4.44Å; L293-I302 PolarHBondContact N-O 3.4Å; L293-I302 PolarHBondContact O-N 3.43Å; L293-L304 HydrophobicContact CD1-CD1 4.15Å; L293-L304 HydrophobicContact CD1-CG 4.14Å; L293-A340 HydrophobicContact CD1-CB 4.33Å; L293-A340 HydrophobicContact CD2-CB 3.85Å; L293-V351 HydrophobicContact CD1-CG1 4.42Å; L293-V351 HydrophobicContact CD2-CG2 4.38Å
294	Q	88	Confident	85.1	Confident	36 Å²	36	33.1 Å²	33.1	17%	0.168	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	132.1	169.8	-70.1	-178.8	-31.4	0	0	109.3	H272 L274 V292	H272-Q294 HydrophobicContact CB-CB 4.27Å; H272-Q294 PolarHBondContact CE1-OE1 3.48Å; H272-Q294 PolarHBondContact N-O 2.8Å; H272-Q294 PolarHBondContact ND1-OE1 3.45Å; H272-Q294 PolarHBondContact O-N 2.97Å; L274-Q294 HydrophobicContact CD1-CG 4.25Å; V292-Q294 HydrophobicContact CG1-CG 4.23Å
295	L	85.2	Confident	85.7	Confident	14 Å²	14	32.4 Å²	32.4	7%	0.073	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	94.9	-172.4	-58.2	174.6	0	0	0	111.8	G270 L271 R297 E298 G299 A300 I302 H327 V329	G270-L295 VanDerWaalsContact O-CA 3.3Å; G270-L295 WeakPolarHBondContact O-CA 3.48Å; L271-L295 HydrophobicContact CD1-CD2 3.86Å; L295-R297 PolarHBondContact O-N 3.21Å; L295-E298 PolarHBondContact O-N 3.24Å; L295-G299 PolarHBondContact O-N 2.04Å; L295-G299 VanDerWaalsContact O-N 3.07Å; L295-A300 WeakPolarHBondContact CB-O 2.99Å; L295-A300 PolarHBondContact N-O 3.18Å; L295-A300 PolarHBondContact O-N 2.89Å; L295-I302 HydrophobicContact CD1-CD1 3.95Å; L295-I302 HydrophobicContact CD1-CG1 4.33Å; L295-H327 HydrophobicContact CD1-CB 3.73Å; L295-V329 HydrophobicContact CD1-CG2 3.86Å; L295-V329 HydrophobicContact CD2-CG2 4.18Å
296	D	70	Confident	85.9	Confident	115 Å²	115	32.6 Å²	32.6	62%	0.615	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-26	-169.7	-48	-32.8	0	0	0	114.1	G270 E298	G270-D296 VanDerWaalsContact CA-OD2 3.3Å; G270-D296 WeakPolarHBondContact CA-OD2 3.32Å; G270-D296 PolarHBondContact N-OD2 3.11Å; G270-D296 PolarHBondContact O-N 3.11Å; D296-E298 VanDerWaalsContact C-N 3.29Å; D296-E298 PolarHBondContact O-N 2.03Å
297	R	62.6	Low	85.8	Confident	203 Å²	203	32.5 Å²	32.5	77%	0.766	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-25.5	-175.4	-66.8	-171.3	-176.8	-154.6	0.8	113.9	P269 L295	P269-R297 PolarHBondContact O-NE 2.87Å; L295-R297 PolarHBondContact O-N 3.21Å
298	E	61.3	Low	85.6	Confident	118 Å²	118	32.8 Å²	32.8	55%	0.551	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-130.7	0.9	-175.5	-64.5	-178.1	-163.8	0	0	112.4	L295 D296 A300 H327	L295-E298 PolarHBondContact O-N 3.24Å; D296-E298 VanDerWaalsContact C-N 3.29Å; D296-E298 PolarHBondContact O-N 2.03Å; E298-A300 HydrophobicContact CB-CB 4.39Å; E298-A300 PolarHBondContact O-N 3.21Å; E298-H327 IonicContact OE2-CE1 3.79Å; E298-H327 IonicContact OE2-CG 2.81Å; E298-H327 IonicContact OE2-ND1 3.17Å; E298-H327 PolarHBondContact OE2-ND1 3.08Å
299	G	69.4	Low	85.4	Confident	67 Å²	67	35.4 Å²	35.4	69%	0.691	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.1	12.9	-174.4	0	0	0	0	0	113.7	L295	L295-G299 PolarHBondContact O-N 2.04Å; L295-G299 VanDerWaalsContact O-N 3.07Å
300	A	81.9	Confident	85.5	Confident	3 Å²	3	35.1 Å²	35.1	3%	0.025	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	143.4	-173.2	0	0	0	0	0	111.7	L295 E298 N313 H327	L295-A300 WeakPolarHBondContact CB-O 2.99Å; L295-A300 PolarHBondContact N-O 3.18Å; L295-A300 PolarHBondContact O-N 2.89Å; E298-A300 HydrophobicContact CB-CB 4.39Å; E298-A300 PolarHBondContact O-N 3.21Å; A300-N313 WeakPolarHBondContact CA-OD1 3.17Å; A300-H327 HydrophobicContact CB-CB 4.13Å
301	Q	88	Confident	85.4	Confident	43 Å²	43	37 Å²	37	20%	0.201	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.1	176.6	-175.5	176.8	-57.8	0	0	110	V292 V312 N313 Y389	V292-Q301 HydrophobicContact CG1-CG 3.35Å; Q301-V312 WeakPolarHBondContact O-CA 3.21Å; Q301-N313 PolarHBondContact N-OD1 3.02Å; Q301-N313 PolarHBondContact O-N 3.03Å; Q301-Y389 PolarHBondContact NE2-OH 2.03Å
302	I	92.4	Very high	85.2	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	117.1	173.4	-55.7	179	0	0	0	108.5	V292 L293 L295 L304 V310 K311 V312 V326 V329 L331	V292-I302 CarbonylContact C-O 3.59Å; V292-I302 WeakPolarHBondContact CA-O 2.94Å; L293-I302 HydrophobicContact CB-CB 4.44Å; L293-I302 PolarHBondContact N-O 3.4Å; L293-I302 PolarHBondContact O-N 3.43Å; L295-I302 HydrophobicContact CD1-CD1 3.95Å; L295-I302 HydrophobicContact CD1-CG1 4.33Å; I302-L304 HydrophobicContact CG2-CD2 4.32Å; I302-V310 HydrophobicContact CG2-CG1 3.75Å; I302-K311 CarbonylContact C-O 3.51Å; I302-K311 WeakPolarHBondContact CA-O 3.34Å; I302-V312 HydrophobicContact CG1-CG2 4.47Å; I302-V326 HydrophobicContact CD1-CG1 4.23Å; I302-V329 HydrophobicContact CD1-CB 3.95Å; I302-V329 HydrophobicContact CD1-CG1 4.39Å; I302-V329 HydrophobicContact CD1-CG2 4.04Å; I302-L331 HydrophobicContact CG2-CD1 4.41Å; I302-L331 HydrophobicContact CG2-CD2 4.24Å
303	S	93.1	Very high	84.8	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.5	177	-167.8	0	0	0	0	110.6	E305 V310 K311	S303-E305 VanDerWaalsContact CB-OE1 3.28Å; S303-E305 WeakPolarHBondContact CB-OE1 3.48Å; S303-E305 PolarHBondContact OG-OE1 2.87Å; S303-V310 CarbonylContact O-C 3.55Å; S303-V310 VanDerWaalsContact O-CA 3.29Å; S303-V310 WeakPolarHBondContact O-CA 3.01Å; S303-K311 PolarHBondContact N-O 2.92Å; S303-K311 PolarHBondContact O-N 3.31Å
304	L	94.7	Very high	84.2	Confident	1 Å²	1	45 Å²	45	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	104.7	171.5	-51.3	-174	0	0	0	107.9	R290 V291 L293 I302 V310 L331 V338 A340 V351 F353	R290-L304 WeakPolarHBondContact CA-O 3.48Å; R290-L304 WeakPolarHBondContact CB-O 3.09Å; V291-L304 HydrophobicContact CB-CB 4.43Å; V291-L304 PolarHBondContact N-O 2.92Å; V291-L304 VanDerWaalsContact N-O 3.09Å; V291-L304 PolarHBondContact O-N 2.94Å; L293-L304 HydrophobicContact CD1-CD1 4.15Å; L293-L304 HydrophobicContact CD1-CG 4.14Å; I302-L304 HydrophobicContact CG2-CD2 4.32Å; L304-V310 HydrophobicContact CD2-CG1 4.4Å; L304-V310 HydrophobicContact CD2-CG2 4.01Å; L304-L331 HydrophobicContact CD2-CD2 4.36Å; L304-V338 HydrophobicContact CD2-CB 4.42Å; L304-V338 HydrophobicContact CD2-CG1 3.77Å; L304-A340 HydrophobicContact CD1-CB 4.07Å; L304-A340 HydrophobicContact CD2-CB 4.33Å; L304-V351 HydrophobicContact CD1-CG1 3.98Å; L304-F353 HydrophobicContact CB-CB 4.04Å; L304-F353 HydrophobicContact CB-CD1 3.95Å; L304-F353 HydrophobicContact CB-CG 4.4Å; L304-F353 HydrophobicContact CD1-CB 4.06Å; L304-F353 WeakPolarHBondContact O-CD1 3.04Å; L304-F353 VanDerWaalsContact O-CE1 3.24Å; L304-F353 WeakPolarHBondContact O-CE1 3.35Å
305	E	91	Very high	84.2	Confident	28 Å²	28	49.5 Å²	49.5	13%	0.131	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	167.1	-170.2	-62	-65.4	165.1	0	0	112.4	R290 S303 K309 K311	R290-E305 WeakPolarHBondContact CD-OE1 3.25Å; R290-E305 WeakPolarHBondContact CD-OE2 3.1Å; S303-E305 VanDerWaalsContact CB-OE1 3.28Å; S303-E305 WeakPolarHBondContact CB-OE1 3.48Å; S303-E305 PolarHBondContact OG-OE1 2.87Å; E305-K309 HydrophobicContact CB-CB 4.07Å; E305-K309 PolarHBondContact N-O 2.86Å; E305-K311 HydrophobicContact CG-CD 4.38Å; E305-K311 HydrophobicContact CG-CG 4.19Å
306	Q	88.4	Confident	84.3	Confident	24 Å²	24	53.3 Å²	53.3	11%	0.112	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-54.5	148.6	167.9	-61.1	-149.6	-60.4	0	0	111.3	D289 G355 C509	D289-Q306 VanDerWaalsContact O-CG 3.22Å; D289-Q306 WeakPolarHBondContact O-CG 3.33Å; Q306-G355 PolarHBondContact NE2-O 3.46Å; Q306-C509 VanDerWaalsContact OE1-N 3.12Å
307	G	85.4	Confident	85.4	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.01	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	71.5	25.4	-179.7	0	0	0	0	0	115.9	K309 C498 D500	G307-K309 PolarHBondContact O-N 2.78Å; G307-C498 WeakPolarHBondContact CA-O 2.97Å; G307-D500 WeakPolarHBondContact O-CA 3.16Å; G307-D500 PolarHBondContact O-N 3.05Å
308	S	88.3	Confident	86.7	Confident	8 Å²	8	45.8 Å²	45.8	6%	0.056	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	60.9	28.6	179.8	-52.7	0	0	0	0	113.8	V338 Q499	S308-V338 VanDerWaalsContact O-CG2 3.25Å; S308-V338 WeakPolarHBondContact O-CG2 3.31Å; S308-Q499 PolarHBondContact OG-NE2 2.85Å
309	K	89.3	Confident	88.2	Confident	56 Å²	56	40.6 Å²	40.6	24%	0.243	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	155.1	173.6	-63.9	-169.1	178.1	-153.2	0	110.4	E305 G307 F316 D500 F502	E305-K309 HydrophobicContact CB-CB 4.07Å; E305-K309 PolarHBondContact N-O 2.86Å; G307-K309 PolarHBondContact O-N 2.78Å; K309-F316 HydrophobicContact CB-CD1 4.4Å; K309-F316 HydrophobicContact CB-CE1 4.23Å; K309-F316 HydrophobicContact CD-CD1 4.48Å; K309-F316 HydrophobicContact CD-CE1 4.1Å; K309-D500 WeakPolarHBondContact CE-O 3.4Å; K309-F502 HydrophobicContact CD-CD2 4.09Å
310	V	93.1	Very high	89.2	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.8	175.8	-178	0	0	0	0	109.2	I302 S303 L304 V312 F316 L317 V319 L331 V338	I302-V310 HydrophobicContact CG2-CG1 3.75Å; S303-V310 CarbonylContact O-C 3.55Å; S303-V310 VanDerWaalsContact O-CA 3.29Å; S303-V310 WeakPolarHBondContact O-CA 3.01Å; L304-V310 HydrophobicContact CD2-CG1 4.4Å; L304-V310 HydrophobicContact CD2-CG2 4.01Å; V310-V312 HydrophobicContact CG1-CG2 4.36Å; V310-F316 WeakPolarHBondContact O-CA 3.32Å; V310-L317 PolarHBondContact O-N 2.82Å; V310-V319 HydrophobicContact CB-CG2 4.01Å; V310-V319 HydrophobicContact CG2-CG2 3.7Å; V310-L331 HydrophobicContact CG1-CD1 4.15Å; V310-V338 HydrophobicContact CG2-CB 4.39Å; V310-V338 HydrophobicContact CG2-CG1 3.72Å; V310-V338 HydrophobicContact CG2-CG2 4Å
311	K	91.4	Very high	89.6	Confident	52 Å²	52	46.1 Å²	46.1	23%	0.226	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	147.1	163.6	-62.9	177.6	175.6	-178.2	0	110.5	I302 S303 E305 D315 F316	I302-K311 CarbonylContact C-O 3.51Å; I302-K311 WeakPolarHBondContact CA-O 3.34Å; S303-K311 PolarHBondContact N-O 2.92Å; S303-K311 PolarHBondContact O-N 3.31Å; E305-K311 HydrophobicContact CG-CD 4.38Å; E305-K311 HydrophobicContact CG-CG 4.19Å; K311-D315 CarbonylContact C-O 3.08Å; K311-D315 WeakPolarHBondContact CA-O 3.45Å; K311-F316 HydrophobicContact CD-CE1 4.34Å; K311-F316 HydrophobicContact CD-CZ 4.42Å; K311-F316 HydrophobicContact CG-CD1 3.77Å; K311-F316 HydrophobicContact CG-CE1 3.75Å; K311-F316 HydrophobicContact CG-CG 4.29Å; K311-F316 HydrophobicContact CG-CZ 4.26Å
312	V	91.1	Very high	89.8	Confident	21 Å²	21	48.5 Å²	48.5	13%	0.127	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	112.3	171.8	-175.3	0	0	0	0	106.7	Q301 I302 V310 D314 D315 L317 V326	Q301-V312 WeakPolarHBondContact O-CA 3.21Å; I302-V312 HydrophobicContact CG1-CG2 4.47Å; V310-V312 HydrophobicContact CG1-CG2 4.36Å; V312-D314 VanDerWaalsContact C-N 3.35Å; V312-D314 PolarHBondContact O-N 2.81Å; V312-D315 PolarHBondContact N-O 3.42Å; V312-D315 PolarHBondContact O-N 2.87Å; V312-L317 HydrophobicContact CG2-CB 4.09Å; V312-L317 HydrophobicContact CG2-CD2 3.96Å; V312-V326 HydrophobicContact CG1-CG1 4.14Å; V312-V326 HydrophobicContact CG2-CG1 4.04Å
313	N	83.4	Confident	89.8	Confident	83 Å²	83	53 Å²	53	44%	0.444	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	53	-174.3	-50.9	-31.9	0	0	0	112.2	A300 Q301 D315	A300-N313 WeakPolarHBondContact CA-OD1 3.17Å; Q301-N313 PolarHBondContact N-OD1 3.02Å; Q301-N313 PolarHBondContact O-N 3.03Å; N313-D315 PolarHBondContact O-N 3.09Å; N313-D315 VanDerWaalsContact O-N 3.09Å
314	D	81.3	Confident	89.9	Confident	69 Å²	69	54.9 Å²	54.9	37%	0.369	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	-19.5	-174.6	-66.8	-34.7	0	0	0	118.1	V312	V312-D314 VanDerWaalsContact C-N 3.35Å; V312-D314 PolarHBondContact O-N 2.81Å
315	D	86.2	Confident	89.7	Confident	129 Å²	129	61 Å²	61	69%	0.69	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	138.1	176.5	-78.8	-40	0	0	0	113	K311 V312 N313	K311-D315 CarbonylContact C-O 3.08Å; K311-D315 WeakPolarHBondContact CA-O 3.45Å; V312-D315 PolarHBondContact N-O 3.42Å; V312-D315 PolarHBondContact O-N 2.87Å; N313-D315 PolarHBondContact O-N 3.09Å; N313-D315 VanDerWaalsContact O-N 3.09Å
316	F	88.9	Confident	89.7	Confident	95 Å²	95	61 Å²	61	42%	0.417	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	127.6	179.4	-78	-74.4	0	0	0	113.1	K309 V310 K311 F502	K309-F316 HydrophobicContact CB-CD1 4.4Å; K309-F316 HydrophobicContact CB-CE1 4.23Å; K309-F316 HydrophobicContact CD-CD1 4.48Å; K309-F316 HydrophobicContact CD-CE1 4.1Å; V310-F316 WeakPolarHBondContact O-CA 3.32Å; K311-F316 HydrophobicContact CD-CE1 4.34Å; K311-F316 HydrophobicContact CD-CZ 4.42Å; K311-F316 HydrophobicContact CG-CD1 3.77Å; K311-F316 HydrophobicContact CG-CE1 3.75Å; K311-F316 HydrophobicContact CG-CG 4.29Å; K311-F316 HydrophobicContact CG-CZ 4.26Å; F316-F502 HydrophobicContact CE2-CE2 4.42Å; F316-F502 HydrophobicContact CZ-CD2 4.43Å; F316-F502 AromaticContact CZ-CE2 3.74Å; F316-F502 HydrophobicContact CZ-CE2 3.74Å; F316-F502 HydrophobicContact CZ-CZ 4.49Å
317	L	91.9	Very high	89.6	Confident	57 Å²	57	62.9 Å²	62.9	30%	0.298	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.9	174.2	-179.5	67.9	0	0	0	111.4	V310 V312 V319 V326 L331	V310-L317 PolarHBondContact O-N 2.82Å; V312-L317 HydrophobicContact CG2-CB 4.09Å; V312-L317 HydrophobicContact CG2-CD2 3.96Å; L317-V319 HydrophobicContact CD2-CG2 4.01Å; L317-V319 HydrophobicContact CG-CG2 4.14Å; L317-V319 PolarHBondContact O-N 2.63Å; L317-V326 HydrophobicContact CD2-CG2 3.77Å; L317-L331 HydrophobicContact CD2-CD1 3.75Å
318	T	91.2	Very high	89.6	Confident	103 Å²	103	66.7 Å²	66.7	63%	0.632	37%	0.369	S	S	*	.			trans	-86.9	105.1	173.9	-58.9	0	0	0	0	110.9	Q324	T318-Q324 PolarHBondContact O-NE2 2.61Å; T318-Q324 PolarHBondContact O-OE1 2.69Å
319	V	91.6	Very high	89.8	Confident	9 Å²	9	66.3 Å²	66.3	6%	0.055	37%	0.367	C	S	.	.			trans	-95.3	139.1	-180	-177.5	0	0	0	0	111.4	V310 L317 L331 K333	V310-V319 HydrophobicContact CB-CG2 4.01Å; V310-V319 HydrophobicContact CG2-CG2 3.7Å; L317-V319 HydrophobicContact CD2-CG2 4.01Å; L317-V319 HydrophobicContact CG-CG2 4.14Å; L317-V319 PolarHBondContact O-N 2.63Å; V319-L331 HydrophobicContact CG1-CB 3.97Å; V319-L331 HydrophobicContact CG2-CB 4.17Å; V319-L331 HydrophobicContact CG2-CD1 4.28Å; V319-K333 HydrophobicContact CB-CB 4.32Å; V319-K333 HydrophobicContact CG1-CB 3.98Å
320	H	90.4	Very high	90	Very high	105 Å²	105	64.5 Å²	64.5	49%	0.486	36%	0.363	S	S	.	.			trans	-112.1	177.4	-179.8	-59.6	-40.5	0	0	0	112.2	T322 Q324 T332 K333	H320-T322 VanDerWaalsContact C-N 3.3Å; H320-T322 PolarHBondContact O-N 2.85Å; H320-Q324 PolarHBondContact CD2-NE2 2.82Å; H320-Q324 VanDerWaalsContact CD2-NE2 3.29Å; H320-T332 WeakPolarHBondContact O-CA 3.09Å; H320-K333 PolarHBondContact O-N 2.61Å
321	A	90	Very high	90.2	Very high	80 Å²	80	64.5 Å²	64.5	66%	0.661	36%	0.362	S	S	*	.	S	Bend	trans	-68.7	-26.1	176.9	0	0	0	0	0	113.7	K333	A321-K333 VanDerWaalsContact CA-O 3.26Å; A321-K333 WeakPolarHBondContact CA-O 3.39Å
322	T	92.2	Very high	90.4	Very high	93 Å²	93	63.6 Å²	63.6	57%	0.571	36%	0.361	S	S	*	.	S	Bend	trans	-78	135.5	172.1	50.6	0	0	0	0	110.7	H320 Q324	H320-T322 VanDerWaalsContact C-N 3.3Å; H320-T322 PolarHBondContact O-N 2.85Å; T322-Q324 PolarHBondContact O-N 2.77Å
323	P	93.1	Very high	90.5	Very high	95 Å²	95	64.3 Å²	64.3	62%	0.617	36%	0.363	S	S	*	.			trans	-55	127.1	177.7	-25.5	32.8	0	0	0	113.5	L331 T332	P323-L331 WeakPolarHBondContact CA-O 3.11Å; P323-T332 VanDerWaalsContact CA-CG2 3.46Å; P323-T332 HydrophobicContact CB-CG2 3.9Å; P323-T332 HydrophobicContact CG-CG2 3.63Å
324	Q	94.3	Very high	90.7	Very high	43 Å²	43	62.5 Å²	62.5	20%	0.201	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.9	172.7	-61.3	179	6.7	0	0	108.9	T318 H320 T322 L331	T318-Q324 PolarHBondContact O-NE2 2.61Å; T318-Q324 PolarHBondContact O-OE1 2.69Å; H320-Q324 PolarHBondContact CD2-NE2 2.82Å; H320-Q324 VanDerWaalsContact CD2-NE2 3.29Å; T322-Q324 PolarHBondContact O-N 2.77Å; Q324-L331 PolarHBondContact N-O 2.8Å; Q324-L331 PolarHBondContact O-N 2.84Å
325	M	92.1	Very high	90.7	Very high	129 Å²	129	66.2 Å²	66.2	64%	0.635	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	123.1	177.6	-65.8	-56.1	-59	0	0	110.7	S328 V329 A330	M325-S328 WeakPolarHBondContact CE-O 3.39Å; M325-V329 WeakPolarHBondContact CA-O 3.27Å; M325-A330 HydrophobicContact CE-CB 4.48Å; M325-A330 HydrophobicContact SD-CB 3.6Å
326	V	90	Very high	90.4	Very high	27 Å²	27	60.9 Å²	60.9	16%	0.164	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	119.1	179.1	177.7	0	0	0	0	108.6	I302 V312 L317 S328 V329 L331	I302-V326 HydrophobicContact CD1-CG1 4.23Å; V312-V326 HydrophobicContact CG1-CG1 4.14Å; V312-V326 HydrophobicContact CG2-CG1 4.04Å; L317-V326 HydrophobicContact CD2-CG2 3.77Å; V326-S328 PolarHBondContact O-N 2.86Å; V326-V329 PolarHBondContact N-O 3.29Å; V326-V329 WeakPolarHBondContact O-CA 3.36Å; V326-V329 WeakPolarHBondContact O-CB 3.38Å; V326-V329 PolarHBondContact O-N 2.81Å; V326-L331 HydrophobicContact CB-CD1 4.01Å; V326-L331 HydrophobicContact CG2-CD1 3.98Å
327	H	86.4	Confident	90.4	Very high	65 Å²	65	56.4 Å²	56.4	30%	0.301	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	44.5	-177.8	-58.2	-64.7	0	0	0	113.2	L295 E298 A300 V329	L295-H327 HydrophobicContact CD1-CB 3.73Å; E298-H327 IonicContact OE2-CE1 3.79Å; E298-H327 IonicContact OE2-CG 2.81Å; E298-H327 IonicContact OE2-ND1 3.17Å; E298-H327 PolarHBondContact OE2-ND1 3.08Å; A300-H327 HydrophobicContact CB-CB 4.13Å; H327-V329 PolarHBondContact O-N 2.94Å
328	S	86.2	Confident	90.5	Very high	80 Å²	80	53.8 Å²	53.8	56%	0.559	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	4	-173.6	-53.2	0	0	0	0	117	M325 V326 L342	M325-S328 WeakPolarHBondContact CE-O 3.39Å; V326-S328 PolarHBondContact O-N 2.86Å; S328-L342 WeakPolarHBondContact O-CD1 3.48Å
329	V	91.3	Very high	90.7	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.9	172.1	179.6	0	0	0	0	110	L295 I302 M325 V326 H327 L331 A340 L342	L295-V329 HydrophobicContact CD1-CG2 3.86Å; L295-V329 HydrophobicContact CD2-CG2 4.18Å; I302-V329 HydrophobicContact CD1-CB 3.95Å; I302-V329 HydrophobicContact CD1-CG1 4.39Å; I302-V329 HydrophobicContact CD1-CG2 4.04Å; M325-V329 WeakPolarHBondContact CA-O 3.27Å; V326-V329 PolarHBondContact N-O 3.29Å; V326-V329 WeakPolarHBondContact O-CA 3.36Å; V326-V329 WeakPolarHBondContact O-CB 3.38Å; V326-V329 PolarHBondContact O-N 2.81Å; H327-V329 PolarHBondContact O-N 2.94Å; V329-L331 HydrophobicContact CG1-CD2 4.13Å; V329-L331 HydrophobicContact CG1-CG 4.38Å; V329-A340 HydrophobicContact CG1-CB 3.8Å; V329-L342 HydrophobicContact CG2-CD1 4.18Å
330	A	94.9	Very high	90.9	Very high	19 Å²	19	49.6 Å²	49.6	16%	0.157	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	112	171.1	0	0	0	0	0	110	M325 K341	M325-A330 HydrophobicContact CE-CB 4.48Å; M325-A330 HydrophobicContact SD-CB 3.6Å; A330-K341 HydrophobicContact CB-CB 4.33Å; A330-K341 PolarHBondContact N-O 3.49Å; A330-K341 PolarHBondContact O-N 2.91Å
331	L	96.1	Very high	91.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	131.3	177.4	-65.6	171.5	0	0	0	110.8	I302 L304 V310 L317 V319 P323 Q324 V326 V329 T339 A340	I302-L331 HydrophobicContact CG2-CD1 4.41Å; I302-L331 HydrophobicContact CG2-CD2 4.24Å; L304-L331 HydrophobicContact CD2-CD2 4.36Å; V310-L331 HydrophobicContact CG1-CD1 4.15Å; L317-L331 HydrophobicContact CD2-CD1 3.75Å; V319-L331 HydrophobicContact CG1-CB 3.97Å; V319-L331 HydrophobicContact CG2-CB 4.17Å; V319-L331 HydrophobicContact CG2-CD1 4.28Å; P323-L331 WeakPolarHBondContact CA-O 3.11Å; Q324-L331 PolarHBondContact N-O 2.8Å; Q324-L331 PolarHBondContact O-N 2.84Å; V326-L331 HydrophobicContact CB-CD1 4.01Å; V326-L331 HydrophobicContact CG2-CD1 3.98Å; V329-L331 HydrophobicContact CG1-CD2 4.13Å; V329-L331 HydrophobicContact CG1-CG 4.38Å; L331-T339 WeakPolarHBondContact CA-O 3.34Å; L331-A340 HydrophobicContact CD2-CB 3.69Å
332	T	95.6	Very high	91.1	Very high	33 Å²	33	45.7 Å²	45.7	20%	0.202	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	149.5	171.7	48.8	0	0	0	0	110.8	H320 P323 V338 T339	H320-T332 WeakPolarHBondContact O-CA 3.09Å; P323-T332 VanDerWaalsContact CA-CG2 3.46Å; P323-T332 HydrophobicContact CB-CG2 3.9Å; P323-T332 HydrophobicContact CG-CG2 3.63Å; T332-V338 CarbonylContact O-C 3.54Å; T332-V338 WeakPolarHBondContact O-CA 3.22Å; T332-T339 PolarHBondContact N-O 2.86Å; T332-T339 PolarHBondContact O-N 2.8Å; T332-T339 WeakPolarHBondContact OG1-CB 3.24Å
333	K	92.9	Very high	90.9	Very high	37 Å²	37	47.5 Å²	47.5	16%	0.161	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	132.2	175.5	-179.1	-175.7	166.2	-159.9	0	110.6	V319 H320 A321 V338 D500	V319-K333 HydrophobicContact CB-CB 4.32Å; V319-K333 HydrophobicContact CG1-CB 3.98Å; H320-K333 PolarHBondContact O-N 2.61Å; A321-K333 VanDerWaalsContact CA-O 3.26Å; A321-K333 WeakPolarHBondContact CA-O 3.39Å; K333-V338 HydrophobicContact CB-CG2 4.48Å; K333-V338 HydrophobicContact CG-CG2 4.4Å; K333-D500 IonicContact NZ-OD1 2.68Å; K333-D500 PolarHBondContact NZ-OD1 3.01Å; K333-D500 IonicContact NZ-OD2 3.29Å; K333-D500 PolarHBondContact NZ-OD2 3.16Å
334	S	88.4	Confident	90.3	Very high	45 Å²	45	45 Å²	45	32%	0.315	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	-177.8	179.3	72.9	0	0	0	0	111.5	A336 G337 Q499	S334-A336 PolarHBondContact O-N 3.06Å; S334-A336 WeakPolarHBondContact OG-CB 3.17Å; S334-A336 PolarHBondContact OG-N 3.02Å; S334-A336 VanDerWaalsContact OG-N 3.11Å; S334-G337 PolarHBondContact N-O 3.06Å; S334-G337 PolarHBondContact O-N 3.17Å; S334-G337 VanDerWaalsContact O-N 3.11Å; S334-Q499 PolarHBondContact O-NE2 3Å
335	H	80.8	Confident	89.4	Confident	146 Å²	146	49 Å²	49	68%	0.676	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-16.6	170.3	64.9	-96.7	0	0	0	113.1	G337	H335-G337 VanDerWaalsContact C-N 3.34Å
336	A	79.5	Confident	89	Confident	17 Å²	17	47.9 Å²	47.9	14%	0.14	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-7.4	175.7	0	0	0	0	0	113.2	S334 D354	S334-A336 PolarHBondContact O-N 3.06Å; S334-A336 WeakPolarHBondContact OG-CB 3.17Å; S334-A336 PolarHBondContact OG-N 3.02Å; S334-A336 VanDerWaalsContact OG-N 3.11Å; A336-D354 VanDerWaalsContact O-CB 3.31Å; A336-D354 WeakPolarHBondContact O-CB 3.18Å
337	G	89.4	Confident	88.8	Confident	2 Å²	2	47.5 Å²	47.5	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118.7	-158.8	-174.5	0	0	0	0	0	112.8	S334 H335 F353	S334-G337 PolarHBondContact N-O 3.06Å; S334-G337 PolarHBondContact O-N 3.17Å; S334-G337 VanDerWaalsContact O-N 3.11Å; H335-G337 VanDerWaalsContact C-N 3.34Å; G337-F353 WeakPolarHBondContact CA-O 3.34Å
338	V	94.3	Very high	89	Confident	2 Å²	2	46 Å²	46	1%	0.012	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	135	169.4	179.2	0	0	0	0	109.5	L304 S308 V310 T332 K333 V352 F353	L304-V338 HydrophobicContact CD2-CB 4.42Å; L304-V338 HydrophobicContact CD2-CG1 3.77Å; S308-V338 VanDerWaalsContact O-CG2 3.25Å; S308-V338 WeakPolarHBondContact O-CG2 3.31Å; V310-V338 HydrophobicContact CG2-CB 4.39Å; V310-V338 HydrophobicContact CG2-CG1 3.72Å; V310-V338 HydrophobicContact CG2-CG2 4Å; T332-V338 CarbonylContact O-C 3.54Å; T332-V338 WeakPolarHBondContact O-CA 3.22Å; K333-V338 HydrophobicContact CB-CG2 4.48Å; K333-V338 HydrophobicContact CG-CG2 4.4Å; V338-V352 CarbonylContact O-C 3.39Å; V338-V352 WeakPolarHBondContact O-CA 3.45Å; V338-F353 PolarHBondContact N-O 3.36Å; V338-F353 PolarHBondContact O-N 2.77Å
339	T	95.6	Very high	89.3	Confident	23 Å²	23	42.3 Å²	42.3	14%	0.141	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.5	170.6	-59.1	0	0	0	0	109.5	L331 T332 S350 V351 V352	L331-T339 WeakPolarHBondContact CA-O 3.34Å; T332-T339 PolarHBondContact N-O 2.86Å; T332-T339 PolarHBondContact O-N 2.8Å; T332-T339 WeakPolarHBondContact OG1-CB 3.24Å; T339-S350 WeakPolarHBondContact CG2-OG 3.45Å; T339-V351 CarbonylContact C-O 3.58Å; T339-V351 WeakPolarHBondContact CA-O 3.3Å; T339-V352 HydrophobicContact CG2-CG2 3.94Å; T339-V352 WeakPolarHBondContact OG1-CG2 3.46Å
340	A	95.6	Very high	89.4	Confident	1 Å²	1	43 Å²	43	1%	0.008	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	111.2	168.2	0	0	0	0	0	109.1	L293 L304 V329 L331 V351	L293-A340 HydrophobicContact CD1-CB 4.33Å; L293-A340 HydrophobicContact CD2-CB 3.85Å; L304-A340 HydrophobicContact CD1-CB 4.07Å; L304-A340 HydrophobicContact CD2-CB 4.33Å; V329-A340 HydrophobicContact CG1-CB 3.8Å; L331-A340 HydrophobicContact CD2-CB 3.69Å; A340-V351 HydrophobicContact CB-CB 4.48Å; A340-V351 PolarHBondContact N-O 3.2Å; A340-V351 PolarHBondContact O-N 2.93Å
341	K	94.4	Very high	89.5	Confident	77 Å²	77	42 Å²	42	34%	0.335	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.9	-178.4	-169.4	-169.5	-173.7	-164.9	0	110.6	A330 E343 T348 V349	A330-K341 HydrophobicContact CB-CB 4.33Å; A330-K341 PolarHBondContact N-O 3.49Å; A330-K341 PolarHBondContact O-N 2.91Å; K341-E343 HydrophobicContact CD-CG 4.48Å; K341-E343 WeakPolarHBondContact CE-OE1 3.37Å; K341-E343 IonicContact NZ-OE1 2.64Å; K341-E343 PolarHBondContact NZ-OE1 2.81Å; K341-T348 HydrophobicContact CD-CG2 4.33Å; K341-T348 HydrophobicContact CG-CG2 4.06Å; K341-V349 CarbonylContact C-O 3.56Å; K341-V349 WeakPolarHBondContact CA-O 3.33Å
342	L	90.6	Very high	89.5	Confident	26 Å²	26	42.5 Å²	42.5	14%	0.136	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.9	171.1	-175.8	70.9	0	0	0	109.1	L271 S328 V329 T348 V349	L271-L342 HydrophobicContact CB-CD2 3.96Å; L271-L342 HydrophobicContact CD1-CD2 4.38Å; L271-L342 HydrophobicContact CD2-CD2 3.83Å; L271-L342 HydrophobicContact CG-CD2 4.26Å; S328-L342 WeakPolarHBondContact O-CD1 3.48Å; V329-L342 HydrophobicContact CG2-CD1 4.18Å; L342-T348 WeakPolarHBondContact O-CA 3.3Å; L342-V349 PolarHBondContact N-O 2.84Å; L342-V349 PolarHBondContact O-N 3.48Å
343	E	87.4	Confident	89.4	Confident	130 Å²	130	41 Å²	41	61%	0.607	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.8	173.9	-65.2	-178	-179.3	0	0	109.5	K341 T348	K341-E343 HydrophobicContact CD-CG 4.48Å; K341-E343 WeakPolarHBondContact CE-OE1 3.37Å; K341-E343 IonicContact NZ-OE1 2.64Å; K341-E343 PolarHBondContact NZ-OE1 2.81Å; E343-T348 HydrophobicContact CG-CG2 4.34Å
344	A	79.8	Confident	89.2	Confident	43 Å²	43	40.6 Å²	40.6	36%	0.355	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	164.9	171.4	0	0	0	0	0	109.2	L268 N346 Y347	L268-A344 HydrophobicContact CD2-CB 3.51Å; A344-N346 PolarHBondContact O-N 3.15Å; A344-Y347 CarbonylContact C-O 3.57Å; A344-Y347 PolarHBondContact N-O 2.88Å; A344-Y347 PolarHBondContact O-N 3.22Å; A344-Y347 VanDerWaalsContact O-N 3.08Å
345	S	76.8	Confident	89.2	Confident	126 Å²	126	38.5 Å²	38.5	88%	0.881	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-36.5	-166.5	-46.2	0	0	0	0	115.7
346	N	83.2	Confident	89.4	Confident	106 Å²	106	32.2 Å²	32.2	57%	0.567	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.7	1.9	-178.3	-61	5.8	0	0	0	113.3	A344 G364 S365	A344-N346 PolarHBondContact O-N 3.15Å; N346-G364 CarbonylContact O-C 3.58Å; N346-G364 WeakPolarHBondContact O-CA 3.4Å; N346-S365 PolarHBondContact O-N 2.86Å; N346-S365 VanDerWaalsContact O-N 3.14Å
347	Y	85.9	Confident	90	Very high	19 Å²	19	31.7 Å²	31.7	8%	0.075	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	139.6	-167.1	-65.5	-72.9	0	0	0	112.3	A344 L362 T363 S365 A368	A344-Y347 CarbonylContact C-O 3.57Å; A344-Y347 PolarHBondContact N-O 2.88Å; A344-Y347 PolarHBondContact O-N 3.22Å; A344-Y347 VanDerWaalsContact O-N 3.08Å; Y347-L362 HydrophobicContact CD1-CD1 4.24Å; Y347-T363 CarbonylContact C-O 3.51Å; Y347-T363 VanDerWaalsContact CA-O 3.31Å; Y347-T363 WeakPolarHBondContact CA-O 3.24Å; Y347-S365 WeakPolarHBondContact CE1-O 3.44Å; Y347-S365 PolarHBondContact OH-O 3.08Å; Y347-S365 PolarHBondContact OH-OG 3.35Å; Y347-A368 HydrophobicContact CD1-CB 4.14Å; Y347-A368 HydrophobicContact CE1-CB 3.46Å; Y347-A368 VanDerWaalsContact CE1-CB 3.46Å; Y347-A368 HydrophobicContact CE2-CB 4.33Å; Y347-A368 PolarHBondContact OH-N 3.31Å; Y347-A368 VanDerWaalsContact OH-N 3.12Å
348	T	90.3	Very high	90.3	Very high	35 Å²	35	31.6 Å²	31.6	22%	0.215	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.5	169.8	-66.3	0	0	0	0	109.2	K341 L342 E343 L362 T363	K341-T348 HydrophobicContact CD-CG2 4.33Å; K341-T348 HydrophobicContact CG-CG2 4.06Å; L342-T348 WeakPolarHBondContact O-CA 3.3Å; E343-T348 HydrophobicContact CG-CG2 4.34Å; T348-L362 WeakPolarHBondContact O-CA 3.42Å; T348-T363 PolarHBondContact N-O 2.91Å; T348-T363 PolarHBondContact O-N 2.96Å
349	V	92	Very high	90.4	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.012	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	128.7	168.1	173.4	0	0	0	0	109	L263 L268 L271 K341 L342 V351 H361 L362	L263-V349 HydrophobicContact CD2-CG1 4.14Å; L263-V349 HydrophobicContact CD2-CG2 4.17Å; L268-V349 HydrophobicContact CD1-CG2 3.35Å; L271-V349 HydrophobicContact CD2-CB 4.1Å; L271-V349 HydrophobicContact CD2-CG1 4.01Å; L271-V349 HydrophobicContact CD2-CG2 4.2Å; K341-V349 CarbonylContact C-O 3.56Å; K341-V349 WeakPolarHBondContact CA-O 3.33Å; L342-V349 PolarHBondContact N-O 2.84Å; L342-V349 PolarHBondContact O-N 3.48Å; V349-V351 HydrophobicContact CG1-CG2 4.01Å; V349-H361 CarbonylContact C-O 3.59Å; V349-H361 WeakPolarHBondContact CA-O 3.22Å; V349-L362 HydrophobicContact CG2-CD1 3.61Å
350	S	94.5	Very high	90.4	Very high	13 Å²	13	30.7 Å²	30.7	9%	0.091	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.1	171.2	-179.5	0	0	0	0	109	T339 H361	T339-S350 WeakPolarHBondContact CG2-OG 3.45Å; S350-H361 PolarHBondContact N-O 2.93Å; S350-H361 PolarHBondContact O-N 3.04Å
351	V	96.3	Very high	90.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	113.2	173	-177.5	0	0	0	0	107.7	V273 V291 L293 L304 T339 A340 V349 I360	V273-V351 HydrophobicContact CG1-CG2 4.34Å; V273-V351 HydrophobicContact CG2-CG2 4.2Å; V291-V351 HydrophobicContact CG1-CG1 3.78Å; L293-V351 HydrophobicContact CD1-CG1 4.42Å; L293-V351 HydrophobicContact CD2-CG2 4.38Å; L304-V351 HydrophobicContact CD1-CG1 3.98Å; T339-V351 CarbonylContact C-O 3.58Å; T339-V351 WeakPolarHBondContact CA-O 3.3Å; A340-V351 HydrophobicContact CB-CB 4.48Å; A340-V351 PolarHBondContact N-O 3.2Å; A340-V351 PolarHBondContact O-N 2.93Å; V349-V351 HydrophobicContact CG1-CG2 4.01Å; V351-I360 HydrophobicContact CG1-CG1 4.28Å; V351-I360 HydrophobicContact CG2-CG1 4.31Å
352	V	95.6	Very high	90.2	Very high	10 Å²	10	28.5 Å²	28.5	6%	0.061	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129.8	173.7	-171.9	0	0	0	0	109	V338 T339 A358 I359 Y476	V338-V352 CarbonylContact O-C 3.39Å; V338-V352 WeakPolarHBondContact O-CA 3.45Å; T339-V352 HydrophobicContact CG2-CG2 3.94Å; T339-V352 WeakPolarHBondContact OG1-CG2 3.46Å; V352-A358 CarbonylContact O-C 3.42Å; V352-A358 WeakPolarHBondContact O-CA 3.37Å; V352-I359 HydrophobicContact CB-CB 4.49Å; V352-I359 PolarHBondContact N-O 2.73Å; V352-I359 PolarHBondContact O-N 3.37Å; V352-Y476 WeakPolarHBondContact CG2-OH 3.48Å
353	F	94.5	Very high	90.2	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.009	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	125	174.6	-176.5	-123.7	0	0	0	110.8	L288 D289 V291 L304 G337 V338 G355 T357 A358	L288-F353 HydrophobicContact CD2-CD2 4.1Å; L288-F353 HydrophobicContact CD2-CE2 3.61Å; L288-F353 HydrophobicContact CG-CE2 4.05Å; D289-F353 WeakPolarHBondContact O-CZ 3.49Å; V291-F353 HydrophobicContact CG2-CB 4.29Å; V291-F353 HydrophobicContact CG2-CD2 3.89Å; V291-F353 HydrophobicContact CG2-CE2 4.38Å; V291-F353 HydrophobicContact CG2-CG 4.04Å; L304-F353 HydrophobicContact CB-CB 4.04Å; L304-F353 HydrophobicContact CB-CD1 3.95Å; L304-F353 HydrophobicContact CB-CG 4.4Å; L304-F353 HydrophobicContact CD1-CB 4.06Å; L304-F353 WeakPolarHBondContact O-CD1 3.04Å; L304-F353 VanDerWaalsContact O-CE1 3.24Å; L304-F353 WeakPolarHBondContact O-CE1 3.35Å; G337-F353 WeakPolarHBondContact CA-O 3.34Å; V338-F353 PolarHBondContact N-O 3.36Å; V338-F353 PolarHBondContact O-N 2.77Å; F353-G355 VanDerWaalsContact CE1-CA 3.48Å; F353-G355 WeakPolarHBondContact CZ-O 3.3Å; F353-T357 WeakPolarHBondContact CD2-O 3.43Å; F353-A358 HydrophobicContact CD2-CB 3.99Å
354	D	88.4	Confident	90.2	Very high	27 Å²	27	24.2 Å²	24.2	14%	0.144	15%	0.153	C	C	.	.			trans	-96.2	0.5	-179.3	75.3	-1.4	0	0	0	114.1	A336 Q356 T357 K468	A336-D354 VanDerWaalsContact O-CB 3.31Å; A336-D354 WeakPolarHBondContact O-CB 3.18Å; D354-Q356 WeakPolarHBondContact OD1-CA 3.01Å; D354-Q356 PolarHBondContact OD1-N 3.19Å; D354-T357 PolarHBondContact N-O 3.35Å; D354-T357 PolarHBondContact OD1-N 3.24Å; D354-K468 WeakPolarHBondContact OD2-CE 3.2Å; D354-K468 IonicContact OD2-NZ 2.7Å; D354-K468 PolarHBondContact OD2-NZ 2.01Å
355	G	87.8	Confident	90.1	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.01	15%	0.151	C	C	.	.	S	Bend	trans	101.3	-12	-172.5	0	0	0	0	0	114.5	Q306 F353	Q306-G355 PolarHBondContact NE2-O 3.46Å; F353-G355 VanDerWaalsContact CE1-CA 3.48Å; F353-G355 WeakPolarHBondContact CZ-O 3.3Å
356	Q	86.4	Confident	89.6	Confident	14 Å²	14	21 Å²	21	7%	0.065	13%	0.128	C	C	.	.	S	Bend	trans	-140.2	-31.1	-179.3	-54.8	-149.2	40.6	0	0	114.5	R280 D354 H465	R280-Q356 VanDerWaalsContact NH2-OE1 3.11Å; D354-Q356 WeakPolarHBondContact OD1-CA 3.01Å; D354-Q356 PolarHBondContact OD1-N 3.19Å; Q356-H465 VanDerWaalsContact CD-NE2 3.34Å; Q356-H465 PolarHBondContact NE2-CE1 3.1Å; Q356-H465 PolarHBondContact NE2-NE2 3.43Å; Q356-H465 PolarHBondContact OE1-CE1 3.16Å; Q356-H465 PolarHBondContact OE1-ND1 3.4Å
357	T	92.1	Very high	88.8	Confident	6 Å²	6	24 Å²	24	4%	0.037	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.8	177.3	-69.4	0	0	0	0	109.7	V239 T240 F353 D354 I359	V239-T357 CarbonylContact O-C 3.6Å; V239-T357 VanDerWaalsContact O-CA 3.27Å; V239-T357 WeakPolarHBondContact O-CA 3.22Å; T240-T357 WeakPolarHBondContact CG2-OG1 3.43Å; T240-T357 VanDerWaalsContact OG1-CG2 3.24Å; T240-T357 WeakPolarHBondContact OG1-CG2 3.47Å; T240-T357 PolarHBondContact OG1-OG1 3.44Å; F353-T357 WeakPolarHBondContact CD2-O 3.43Å; D354-T357 PolarHBondContact N-O 3.35Å; D354-T357 PolarHBondContact OD1-N 3.24Å; T357-I359 HydrophobicContact CG2-CD1 3.93Å; T357-I359 HydrophobicContact CG2-CG1 4.39Å
358	A	95.9	Very high	87.9	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134.3	168.8	0	0	0	0	0	111.1	S238 V239 L288 V291 V352 F353	S238-A358 CarbonylContact C-O 3.57Å; S238-A358 WeakPolarHBondContact CA-O 3.31Å; V239-A358 HydrophobicContact CB-CB 4.25Å; V239-A358 PolarHBondContact N-O 3.01Å; V239-A358 PolarHBondContact O-N 3.48Å; L288-A358 HydrophobicContact CD2-CB 3.71Å; V291-A358 HydrophobicContact CG2-CB 3.58Å; V352-A358 CarbonylContact O-C 3.42Å; V352-A358 WeakPolarHBondContact O-CA 3.37Å; F353-A358 HydrophobicContact CD2-CB 3.99Å
359	I	96.1	Very high	87.1	Confident	7 Å²	7	25 Å²	25	4%	0.036	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.9	169.3	-54.1	-60.2	0	0	0	107.9	V236 C237 V352 T357 E472 V473 Y476	V236-I359 HydrophobicContact CG1-CG2 3.7Å; C237-I359 WeakPolarHBondContact O-CA 3.36Å; V352-I359 HydrophobicContact CB-CB 4.49Å; V352-I359 PolarHBondContact N-O 2.73Å; V352-I359 PolarHBondContact O-N 3.37Å; T357-I359 HydrophobicContact CG2-CD1 3.93Å; T357-I359 HydrophobicContact CG2-CG1 4.39Å; I359-E472 HydrophobicContact CD1-CB 4.32Å; I359-E472 HydrophobicContact CG1-CB 4.07Å; I359-V473 HydrophobicContact CD1-CG2 3.89Å; I359-Y476 HydrophobicContact CB-CE2 4.41Å; I359-Y476 HydrophobicContact CG2-CD2 3.68Å; I359-Y476 HydrophobicContact CG2-CE2 3.8Å
360	I	95.8	Very high	86.7	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	113.2	175.7	-61.8	172.3	0	0	0	107.2	V236 C237 F247 L262 L263 V273 V351	V236-I360 WeakPolarHBondContact CA-O 3.47Å; C237-I360 HydrophobicContact CB-CB 4.26Å; C237-I360 PolarHBondContact N-O 2.8Å; C237-I360 PolarHBondContact O-N 2.95Å; F247-I360 HydrophobicContact CZ-CG2 4.35Å; L262-I360 HydrophobicContact CB-CD1 3.92Å; L262-I360 HydrophobicContact CD1-CD1 3.91Å; L263-I360 HydrophobicContact CD2-CG2 4.1Å; V273-I360 HydrophobicContact CG1-CD1 3.93Å; V351-I360 HydrophobicContact CG1-CG1 4.28Å; V351-I360 HydrophobicContact CG2-CG1 4.31Å
361	H	93.9	Very high	86.3	Confident	30 Å²	30	31.5 Å²	31.5	14%	0.139	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.2	179.9	-177	-150.1	0	0	0	109.9	N234 A235 V349 S350 T363 Y476	N234-H361 PolarHBondContact OD1-NE2 2.66Å; A235-H361 WeakPolarHBondContact O-CA 3.48Å; A235-H361 PolarHBondContact O-CD2 3.06Å; V349-H361 CarbonylContact C-O 3.59Å; V349-H361 WeakPolarHBondContact CA-O 3.22Å; S350-H361 PolarHBondContact N-O 2.93Å; S350-H361 PolarHBondContact O-N 3.04Å; H361-T363 VanDerWaalsContact CE1-CG2 3.42Å; H361-T363 WeakPolarHBondContact CE1-CG2 3.37Å; H361-T363 VanDerWaalsContact NE2-CG2 3.27Å; H361-T363 WeakPolarHBondContact NE2-CG2 3.18Å; H361-Y476 HydrophobicContact CB-CD1 4.14Å; H361-Y476 HydrophobicContact CB-CE1 4.48Å; H361-Y476 AromaticContact CE1-CD1 3.79Å; H361-Y476 AromaticContact CG-CD1 3.8Å; H361-Y476 AromaticContact ND1-CD1 3.35Å; H361-Y476 WeakPolarHBondContact ND1-CD1 3.46Å; H361-Y476 AromaticContact ND1-CE1 3.91Å
362	L	91.3	Very high	86	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	122.4	176.2	170.9	68.1	0	0	0	109.1	M233 A235 F247 L268 Y347 T348 V349 V370	M233-L362 HydrophobicContact CE-CD2 4.49Å; M233-L362 HydrophobicContact CG-CD2 4.25Å; M233-L362 HydrophobicContact CG-CG 4.06Å; A235-L362 HydrophobicContact CB-CB 4.32Å; A235-L362 PolarHBondContact N-O 3.21Å; A235-L362 PolarHBondContact O-N 3.17Å; F247-L362 HydrophobicContact CE2-CD2 4.22Å; F247-L362 HydrophobicContact CZ-CB 4.01Å; F247-L362 HydrophobicContact CZ-CD2 4.46Å; L268-L362 HydrophobicContact CD1-CD1 4.26Å; Y347-L362 HydrophobicContact CD1-CD1 4.24Å; T348-L362 WeakPolarHBondContact O-CA 3.42Å; V349-L362 HydrophobicContact CG2-CD1 3.61Å; L362-V370 HydrophobicContact CD2-CG2 3.84Å
363	T	90.1	Very high	85.8	Confident	42 Å²	42	31 Å²	31	26%	0.258	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	154.2	173	56.7	0	0	0	0	111.2	M233 Y347 T348 H361	M233-T363 VanDerWaalsContact O-CA 3.29Å; M233-T363 WeakPolarHBondContact O-CA 3.45Å; Y347-T363 CarbonylContact C-O 3.51Å; Y347-T363 VanDerWaalsContact CA-O 3.31Å; Y347-T363 WeakPolarHBondContact CA-O 3.24Å; T348-T363 PolarHBondContact N-O 2.91Å; T348-T363 PolarHBondContact O-N 2.96Å; H361-T363 VanDerWaalsContact CE1-CG2 3.42Å; H361-T363 WeakPolarHBondContact CE1-CG2 3.37Å; H361-T363 VanDerWaalsContact NE2-CG2 3.27Å; H361-T363 WeakPolarHBondContact NE2-CG2 3.18Å
364	G	86.8	Confident	85.6	Confident	25 Å²	25	31 Å²	31	26%	0.258	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	150.7	-158.3	-179	0	0	0	0	0	114.3	M233 N346	M233-G364 WeakPolarHBondContact CB-O 3.42Å; M233-G364 PolarHBondContact N-O 2.89Å; M233-G364 PolarHBondContact O-N 3.48Å; N346-G364 CarbonylContact O-C 3.58Å; N346-G364 WeakPolarHBondContact O-CA 3.4Å
365	S	78.8	Confident	85.5	Confident	45 Å²	45	29.8 Å²	29.8	32%	0.315	17%	0.171	S	C	.	.	S	Bend	trans	-67.3	151.3	176.2	50.3	0	0	0	0	113.2	N346 Y347 E367	N346-S365 PolarHBondContact O-N 2.86Å; N346-S365 VanDerWaalsContact O-N 3.14Å; Y347-S365 WeakPolarHBondContact CE1-O 3.44Å; Y347-S365 PolarHBondContact OH-O 3.08Å; Y347-S365 PolarHBondContact OH-OG 3.35Å; S365-E367 VanDerWaalsContact C-N 3.26Å; S365-E367 PolarHBondContact O-N 3.24Å
366	S	67.2	Low	84.6	Confident	56 Å²	56	34.8 Å²	34.8	39%	0.392	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	60.1	179.7	49.6	0	0	0	0	113.4	E223	E223-S366 WeakPolarHBondContact OE1-CA 3.36Å; E223-S366 WeakPolarHBondContact OE1-CB 3.22Å
367	E	65.6	Low	83.2	Confident	169 Å²	169	34.7 Å²	34.7	79%	0.79	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-163.7	8.1	176	-122.9	166.3	-139.4	0	0	117.8	S365 P369	S365-E367 VanDerWaalsContact C-N 3.26Å; S365-E367 PolarHBondContact O-N 3.24Å; E367-P369 WeakPolarHBondContact O-CD 3.43Å
368	A	66.6	Low	81.6	Confident	10 Å²	10	40.6 Å²	40.6	8%	0.083	24%	0.24	C	C	.	.			trans	-73.7	113.9	-178.6	0	0	0	0	0	112.9	M233 Y347 V370	M233-A368 HydrophobicContact CE-CB 4.29Å; Y347-A368 HydrophobicContact CD1-CB 4.14Å; Y347-A368 HydrophobicContact CE1-CB 3.46Å; Y347-A368 VanDerWaalsContact CE1-CB 3.46Å; Y347-A368 HydrophobicContact CE2-CB 4.33Å; Y347-A368 PolarHBondContact OH-N 3.31Å; Y347-A368 VanDerWaalsContact OH-N 3.12Å; A368-V370 PolarHBondContact O-N 3.03Å
369	P	74.3	Confident	80.1	Confident	66 Å²	66	42.2 Å²	42.2	43%	0.429	25%	0.251	S	S	.	.			trans	-68.3	129.2	168	30.6	-35.3	0	0	0	109.4	S265 S266 E367	S265-P369 WeakPolarHBondContact CA-O 3.45Å; S265-P369 VanDerWaalsContact CB-O 3.29Å; S265-P369 WeakPolarHBondContact CB-O 3.42Å; S265-P369 PolarHBondContact OG-O 3.21Å; S266-P369 VanDerWaalsContact OG-CG 3.23Å; S266-P369 WeakPolarHBondContact OG-CG 3.29Å; E367-P369 WeakPolarHBondContact O-CD 3.43Å
370	V	83.6	Confident	79	Confident	24 Å²	24	44.3 Å²	44.3	15%	0.145	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	139.1	178.4	175.7	0	0	0	0	110.1	M222 F247 L263 L362 A368	M222-V370 HydrophobicContact CE-CG2 4.13Å; F247-V370 HydrophobicContact CD2-CG1 4.2Å; F247-V370 HydrophobicContact CE2-CB 4.48Å; F247-V370 HydrophobicContact CE2-CG1 3.88Å; F247-V370 HydrophobicContact CE2-CG2 4.13Å; L263-V370 HydrophobicContact CD1-CG1 3.45Å; L263-V370 VanDerWaalsContact CD1-CG1 3.45Å; L263-V370 HydrophobicContact CD1-CG2 4.4Å; L362-V370 HydrophobicContact CD2-CG2 3.84Å; A368-V370 PolarHBondContact O-N 3.03Å
371	Q	86.4	Confident	78.2	Confident	127 Å²	127	45.8 Å²	45.8	59%	0.593	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	163.8	171.4	-60	174.6	3.9	0	0	109.7	L263 R264	L263-Q371 CarbonylContact C-O 3.33Å; R264-Q371 HydrophobicContact CB-CB 4.29Å; R264-Q371 PolarHBondContact N-O 2.75Å; R264-Q371 PolarHBondContact O-N 3.14Å
372	G	88.6	Confident	77.4	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	30%	0.296	C	S	.	.	S	Bend	trans	97.4	173	-171	0	0	0	0	0	112.9	S261 L262 C374 G375	S261-G372 CarbonylContact O-C 3.47Å; S261-G372 WeakPolarHBondContact O-CA 3.26Å; L262-G372 CarbonylContact O-C 3.08Å; G372-C374 PolarHBondContact O-N 3.2Å; G372-G375 PolarHBondContact O-N 2.89Å
373	L	91.5	Very high	76.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.8	-174.2	-59.1	176.1	0	0	0	114	V244 V254 Y260 S261 L262 V381 Q384	V244-L373 HydrophobicContact CB-CB 4.21Å; V244-L373 HydrophobicContact CG1-CB 3.89Å; V244-L373 WeakPolarHBondContact CG1-O 3.05Å; V244-L373 HydrophobicContact CG2-CB 4.05Å; V244-L373 HydrophobicContact CG2-CD1 3.94Å; V254-L373 HydrophobicContact CG2-CD1 4.04Å; Y260-L373 HydrophobicContact CD1-CD1 4.01Å; Y260-L373 HydrophobicContact CG-CD1 4.1Å; S261-L373 PolarHBondContact O-N 3.07Å; L262-L373 HydrophobicContact CD2-CB 4.33Å; L262-L373 HydrophobicContact CD2-CD1 4.3Å; L262-L373 PolarHBondContact O-N 3.44Å; L373-V381 HydrophobicContact CD2-CB 4.31Å; L373-V381 HydrophobicContact CD2-CG1 4.1Å; L373-V381 HydrophobicContact CD2-CG2 4.13Å; L373-Q384 HydrophobicContact CD2-CB 3.8Å; L373-Q384 HydrophobicContact CD2-CG 3.75Å; L373-Q384 HydrophobicContact CG-CB 4.04Å; L373-Q384 HydrophobicContact CG-CG 4.25Å
374	C	91.6	Very high	76.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-21.9	171.7	-69.7	0	0	0	0	113.4	C237 F247 L262 L263 G372	C237-C374 HydrophobicContact CB-CB 3.5Å; C237-C374 VanDerWaalsContact CB-CB 3.5Å; C237-C374 WeakPolarHBondContact CB-SG 3.44Å; C237-C374 VanDerWaalsContact SG-CA 3.51Å; C237-C374 WeakPolarHBondContact SG-CB 3.23Å; C237-C374 CovalentContact SG-SG 2.04Å; C237-C374 PolarHBondContact SG-SG 2.79Å; F247-C374 WeakPolarHBondContact CB-O 3.47Å; F247-C374 HydrophobicContact CD2-CB 4.37Å; F247-C374 WeakPolarHBondContact CD2-O 3.16Å; F247-C374 HydrophobicContact CE1-CB 4.44Å; F247-C374 HydrophobicContact CE2-CB 4.16Å; F247-C374 WeakPolarHBondContact CG-O 3.46Å; F247-C374 HydrophobicContact CZ-CB 4.19Å; F247-C374 PolarHBondContact N-O 2.73Å; L262-C374 VanDerWaalsContact O-CB 3.22Å; L262-C374 WeakPolarHBondContact O-CB 3.42Å; L262-C374 PolarHBondContact O-N 2.82Å; L263-C374 HydrophobicContact CD1-CB 4.46Å; G372-C374 PolarHBondContact O-N 3.2Å
375	G	85.3	Confident	76.1	Confident	3 Å²	3	55.7 Å²	55.7	3%	0.031	32%	0.317	C	S	.	.	S	Bend	trans	-82.9	176.6	175.8	0	0	0	0	0	112.7	G372 S377	G372-G375 PolarHBondContact O-N 2.89Å; G375-S377 PolarHBondContact O-N 3.39Å
376	D	68.3	Low	75.7	Confident	105 Å²	105	54.1 Å²	54.1	56%	0.561	31%	0.306	S	S	*	.			trans	-82.5	67.1	171	-163.6	20.1	0	0	0	110.5	T248 S378	T248-D376 HydrophobicContact CG2-CB 4.16Å; D376-S378 PolarHBondContact O-N 3.4Å
377	S	56.7	Low	75.3	Confident	12 Å²	12	57.2 Å²	57.2	8%	0.084	33%	0.328	C	S	.	.			trans	-77.7	113.8	-178.9	81.3	0	0	0	0	110.5	G375 S379	G375-S377 PolarHBondContact O-N 3.39Å; S377-S379 WeakPolarHBondContact CB-OG 3.3Å; S377-S379 PolarHBondContact O-N 2.92Å
378	S	60	Low	74.6	Confident	131 Å²	131	55.9 Å²	55.9	92%	0.916	32%	0.322	S	S	*	.			trans	-66.6	-18.7	168.3	55.2	0	0	0	0	113	D376	D376-S378 PolarHBondContact O-N 3.4Å
379	S	63	Low	74	Confident	33 Å²	33	56.2 Å²	56.2	23%	0.231	32%	0.321	C	S	.	.	S	Bend	trans	-65.1	147.1	172.9	37.8	0	0	0	0	112.8	S377 E383 Q384	S377-S379 WeakPolarHBondContact CB-OG 3.3Å; S377-S379 PolarHBondContact O-N 2.92Å; S379-E383 VanDerWaalsContact CA-OE2 3.3Å; S379-E383 WeakPolarHBondContact CA-OE2 3.41Å; S379-E383 WeakPolarHBondContact CB-OE2 3.47Å; S379-Q384 PolarHBondContact OG-NE2 2.76Å
380	A	73.3	Confident	72.6	Confident	52 Å²	52	57.4 Å²	57.4	43%	0.43	33%	0.331	S	S	.	.			trans	-67.5	152.3	176.5	0	0	0	0	0	111.3	N382 E383	A380-N382 PolarHBondContact O-N 3.31Å; A380-E383 HydrophobicContact CB-CG 4.46Å; A380-E383 PolarHBondContact N-OE2 2.93Å; A380-E383 WeakPolarHBondContact O-CB 3.36Å; A380-E383 PolarHBondContact O-N 3.23Å
381	V	79.2	Confident	71	Confident	31 Å²	31	56.8 Å²	56.8	19%	0.188	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-52	-34.9	177	176.3	0	0	0	0	111.9	Q252 Y260 L373 E383 Q384	Q252-V381 HydrophobicContact CB-CG2 4.3Å; Y260-V381 HydrophobicContact CD1-CG1 4.28Å; Y260-V381 HydrophobicContact CE1-CG1 3.76Å; Y260-V381 WeakPolarHBondContact CE1-O 3.35Å; L373-V381 HydrophobicContact CD2-CB 4.31Å; L373-V381 HydrophobicContact CD2-CG1 4.1Å; L373-V381 HydrophobicContact CD2-CG2 4.13Å; V381-E383 VanDerWaalsContact C-N 3.29Å; V381-E383 PolarHBondContact O-N 3.03Å; V381-Q384 PolarHBondContact O-N 3.41Å; V381-Q384 VanDerWaalsContact O-N 3.17Å
382	N	77.4	Confident	69	Low	95 Å²	95	55.8 Å²	55.8	51%	0.508	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-64.4	-26.3	176.6	-79.5	-10.2	0	0	0	114.7	A380 Q384 K385	A380-N382 PolarHBondContact O-N 3.31Å; N382-Q384 VanDerWaalsContact C-N 3.28Å; N382-K385 WeakPolarHBondContact O-CG 3.41Å; N382-K385 VanDerWaalsContact OD1-CE 3.27Å; N382-K385 WeakPolarHBondContact OD1-CE 3.45Å; N382-K385 PolarHBondContact OD1-NZ 3.07Å
383	E	76.4	Confident	67.1	Low	133 Å²	133	57.5 Å²	57.5	62%	0.621	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-79.5	-13.7	177.6	-64.6	165.8	-161.4	0	0	112	S379 A380 V381	S379-E383 VanDerWaalsContact CA-OE2 3.3Å; S379-E383 WeakPolarHBondContact CA-OE2 3.41Å; S379-E383 WeakPolarHBondContact CB-OE2 3.47Å; A380-E383 HydrophobicContact CB-CG 4.46Å; A380-E383 PolarHBondContact N-OE2 2.93Å; A380-E383 WeakPolarHBondContact O-CB 3.36Å; A380-E383 PolarHBondContact O-N 3.23Å; V381-E383 VanDerWaalsContact C-N 3.29Å; V381-E383 PolarHBondContact O-N 3.03Å
384	Q	81.9	Confident	64.8	Low	28 Å²	28	64.1 Å²	64.1	13%	0.131	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-91.6	4	175.2	-60.2	-58	-32.3	0	0	113.4	Y260 S261 L373 S379 V381 N382 S386	Y260-Q384 WeakPolarHBondContact CA-O 3.29Å; Y260-Q384 HydrophobicContact CD1-CB 4.44Å; S261-Q384 PolarHBondContact N-O 3.02Å; L373-Q384 HydrophobicContact CD2-CB 3.8Å; L373-Q384 HydrophobicContact CD2-CG 3.75Å; L373-Q384 HydrophobicContact CG-CB 4.04Å; L373-Q384 HydrophobicContact CG-CG 4.25Å; S379-Q384 PolarHBondContact OG-NE2 2.76Å; V381-Q384 PolarHBondContact O-N 3.41Å; V381-Q384 VanDerWaalsContact O-N 3.17Å; N382-Q384 VanDerWaalsContact C-N 3.28Å; Q384-S386 PolarHBondContact O-N 3.24Å
385	K	82.3	Confident	62.4	Low	49 Å²	49	69.9 Å²	69.9	21%	0.213	40%	0.403	C	S	.	.	B	Isolated β-bridge	trans	-64.8	128.8	172.4	-71.2	176.6	177.7	177.8	0	109.9	D256 Y260 N382	D256-K385 WeakPolarHBondContact OD2-CE 3.22Å; D256-K385 IonicContact OD2-NZ 2.78Å; D256-K385 PolarHBondContact OD2-NZ 2.91Å; Y260-K385 HydrophobicContact CD1-CG 4.07Å; Y260-K385 HydrophobicContact CE1-CG 3.48Å; Y260-K385 VanDerWaalsContact CE1-CG 3.48Å; Y260-K385 WeakPolarHBondContact OH-CE 3.29Å; N382-K385 WeakPolarHBondContact O-CG 3.41Å; N382-K385 VanDerWaalsContact OD1-CE 3.27Å; N382-K385 WeakPolarHBondContact OD1-CE 3.45Å; N382-K385 PolarHBondContact OD1-NZ 3.07Å
386	S	71.4	Confident	60.5	Low	12 Å²	12	71 Å²	71	8%	0.084	41%	0.409	C	S	.	.			trans	-88.5	114.8	173.6	-175.2	0	0	0	0	110.3	G259 Q384 E388	G259-S386 PolarHBondContact O-N 2.67Å; Q384-S386 PolarHBondContact O-N 3.24Å; S386-E388 VanDerWaalsContact C-N 3.29Å
387	S	57.3	Low	59.3	Low	121 Å²	121	72.9 Å²	72.9	85%	0.846	41%	0.412	S	S	*	.	S	Bend	trans	-81	-7.2	172.5	54	0	0	0	0	113.8
388	E	52.3	Low	59	Low	142 Å²	142	76 Å²	76	66%	0.664	43%	0.434	S	S	*	.			trans	-101.5	-4.6	-170.7	-66.2	175.6	139.7	0	0	113.4	S386 S390	S386-E388 VanDerWaalsContact C-N 3.29Å; E388-S390 PolarHBondContact O-N 3.39Å
389	Y	52.7	Low	59	Low	17 Å²	17	72.4 Å²	72.4	7%	0.067	41%	0.408	C	S	.	.			trans	-75.9	85.5	177.1	-170.5	-95	0	0	0	111.2	L274 I276 R290 V292 Q301 D391 L396	L274-Y389 HydrophobicContact CD1-CD2 3.85Å; I276-Y389 HydrophobicContact CD1-CD1 3.94Å; I276-Y389 HydrophobicContact CD1-CD2 4.16Å; I276-Y389 HydrophobicContact CD1-CE1 4.03Å; I276-Y389 HydrophobicContact CD1-CE2 4.22Å; I276-Y389 HydrophobicContact CD1-CG 4.03Å; I276-Y389 HydrophobicContact CG1-CE1 4.47Å; R290-Y389 PolarHBondContact NH2-OH 2.99Å; V292-Y389 HydrophobicContact CB-CE2 4.4Å; V292-Y389 HydrophobicContact CG1-CE2 4.14Å; V292-Y389 HydrophobicContact CG2-CE2 3.97Å; Q301-Y389 PolarHBondContact NE2-OH 2.03Å; Y389-D391 HydrophobicContact CD1-CB 4.26Å; Y389-D391 HydrophobicContact CE1-CB 3.68Å; Y389-D391 PolarHBondContact O-N 2.84Å; Y389-D391 VanDerWaalsContact O-N 3.17Å; Y389-L396 HydrophobicContact CD1-CD2 4Å; Y389-L396 HydrophobicContact CE1-CD2 4.15Å
390	S	45.6	Very low	58.8	Low	91 Å²	91	74 Å²	74	64%	0.636	41%	0.411	S	S	*	.			trans	-80.8	83.8	172.6	174.8	0	0	0	0	110.9	E388	E388-S390 PolarHBondContact O-N 3.39Å
391	D	48.7	Very low	58.1	Low	11 Å²	11	78 Å²	78	6%	0.059	42%	0.423	C	S	.	.			trans	-61.6	150.6	164	-148.8	-31.2	0	0	0	111.2	R290 Y389 D393 L396	R290-D391 IonicContact CZ-OD2 3.67Å; R290-D391 IonicContact NH2-OD2 3.32Å; R290-D391 PolarHBondContact NH2-OD2 3.18Å; Y389-D391 HydrophobicContact CD1-CB 4.26Å; Y389-D391 HydrophobicContact CE1-CB 3.68Å; Y389-D391 PolarHBondContact O-N 2.84Å; Y389-D391 VanDerWaalsContact O-N 3.17Å; D391-D393 VanDerWaalsContact C-N 3.28Å; D391-D393 HydrophobicContact CB-CB 4.15Å; D391-D393 PolarHBondContact OD1-N 2.83Å; D391-D393 VanDerWaalsContact OD1-N 3.09Å; D391-L396 HydrophobicContact CB-CB 3.76Å; D391-L396 HydrophobicContact CB-CD1 4.38Å; D391-L396 HydrophobicContact CB-CG 4.49Å
392	T	45.3	Very low	56.9	Low	106 Å²	106	81.8 Å²	81.8	65%	0.65	44%	0.439	S	S	*	.	S	Bend	trans	-76.5	-20.8	165.4	52.1	0	0	0	0	111.4	L394	T392-L394 PolarHBondContact O-N 2.85Å
393	D	49.1	Very low	55.9	Low	35 Å²	35	82.6 Å²	82.6	19%	0.187	44%	0.435	C	S	.	.	S	Bend	trans	-62.3	102.3	167.7	-159.3	17.9	0	0	0	109.6	K278 D391 L395 L396	K278-D393 IonicContact NZ-OD2 3.97Å; K278-D393 PolarHBondContact NZ-OD2 2.89Å; D391-D393 VanDerWaalsContact C-N 3.28Å; D391-D393 HydrophobicContact CB-CB 4.15Å; D391-D393 PolarHBondContact OD1-N 2.83Å; D391-D393 VanDerWaalsContact OD1-N 3.09Å; D393-L395 PolarHBondContact O-N 2.66Å; D393-L396 HydrophobicContact CB-CD1 4.46Å; D393-L396 PolarHBondContact O-N 2.86Å
394	L	42.1	Very low	54.5	Low	139 Å²	139	84.1 Å²	84.1	73%	0.728	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-55.9	-15.9	-170	-74.7	167.1	0	0	0	115	T392	T392-L394 PolarHBondContact O-N 2.85Å
395	L	42.9	Very low	52.9	Low	121 Å²	121	86.2 Å²	86.2	63%	0.634	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-78.3	-15.9	178.2	-63.5	171.4	0	0	0	114.1	D393	D393-L395 PolarHBondContact O-N 2.66Å
396	L	43.8	Very low	51.1	Low	27 Å²	27	91.7 Å²	91.7	14%	0.141	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-93.9	-4.1	-179.5	-97.7	113.7	0	0	0	115	I276 K278 Y389 D391 D393 S398	I276-L396 HydrophobicContact CG2-CD2 3.99Å; K278-L396 VanDerWaalsContact CE-CD1 3.46Å; Y389-L396 HydrophobicContact CD1-CD2 4Å; Y389-L396 HydrophobicContact CE1-CD2 4.15Å; D391-L396 HydrophobicContact CB-CB 3.76Å; D391-L396 HydrophobicContact CB-CD1 4.38Å; D391-L396 HydrophobicContact CB-CG 4.49Å; D393-L396 HydrophobicContact CB-CD1 4.46Å; D393-L396 PolarHBondContact O-N 2.86Å; L396-S398 PolarHBondContact O-N 2.99Å; L396-S398 VanDerWaalsContact O-N 3.16Å
397	K	43.8	Very low	49.9	Very low	145 Å²	145	94.8 Å²	94.8	63%	0.63	52%	0.518	S	S	*	.	S	Bend	trans	-68.3	-11.7	-177.1	-80.8	-174	174.2	177.6	0	115.2
398	S	49.5	Very low	49.3	Very low	78 Å²	78	92.8 Å²	92.8	55%	0.545	50%	0.497	S	S	.	.	S	Bend	trans	-127.9	125.8	165.1	53	0	0	0	0	108.4	L396 E400	L396-S398 PolarHBondContact O-N 2.99Å; L396-S398 VanDerWaalsContact O-N 3.16Å; S398-E400 PolarHBondContact O-N 3.49Å
399	C	60.9	Low	49	Very low	54 Å²	54	91 Å²	91	37%	0.365	50%	0.501	S	S	.	.			trans	-53.4	104.2	168.4	-124.8	0	0	0	0	108.9	C258 M401	C258-C399 HydrophobicContact CB-CB 4.47Å; C258-C399 WeakPolarHBondContact CB-SG 3.42Å; C258-C399 WeakPolarHBondContact SG-CA 3.31Å; C258-C399 WeakPolarHBondContact SG-CB 3.21Å; C258-C399 CovalentContact SG-SG 2.03Å; C258-C399 PolarHBondContact SG-SG 2.94Å; C399-M401 VanDerWaalsContact C-N 3.35Å; C399-M401 PolarHBondContact O-N 2.67Å
400	E	59.6	Low	48.8	Very low	66 Å²	66	95.8 Å²	95.8	31%	0.308	53%	0.532	S	S	.	.	B	Isolated β-bridge	trans	-75.3	93.3	-179.7	-68.8	-166.9	159	0	0	108.8	R257 S398	R257-E400 HydrophobicContact CB-CB 4.48Å; R257-E400 IonicContact CZ-OE2 3.25Å; R257-E400 VanDerWaalsContact CZ-OE2 3.29Å; R257-E400 PolarHBondContact N-O 2.77Å; R257-E400 IonicContact NE-OE2 2.99Å; R257-E400 PolarHBondContact NE-OE2 2.85Å; R257-E400 VanDerWaalsContact NE-OE2 3.08Å; R257-E400 IonicContact NH2-OE2 2.88Å; R257-E400 PolarHBondContact NH2-OE2 2.85Å; S398-E400 PolarHBondContact O-N 3.49Å
401	M	57.4	Low	49.2	Very low	138 Å²	138	93 Å²	93	68%	0.68	51%	0.512	S	S	*	.			trans	-54.6	146.2	164.8	-61.7	-173	-67.8	0	0	109.1	D256 C399 Y403	D256-M401 VanDerWaalsContact OD1-CA 3.29Å; D256-M401 WeakPolarHBondContact OD1-CA 3.19Å; C399-M401 VanDerWaalsContact C-N 3.35Å; C399-M401 PolarHBondContact O-N 2.67Å; M401-Y403 PolarHBondContact O-N 2.99Å
402	Q	54.6	Low	49.8	Very low	110 Å²	110	96.1 Å²	96.1	51%	0.514	54%	0.535	S	S	.	.			trans	-36.2	130	-170.9	-68.1	-172.4	-73.5	0	0	113.9	P255 D256 D284 D404	P255-Q402 HydrophobicContact CB-CG 4.37Å; P255-Q402 WeakPolarHBondContact O-CG 3.46Å; D256-Q402 PolarHBondContact OD1-N 2.7Å; D284-Q402 PolarHBondContact O-NE2 3.36Å; Q402-D404 PolarHBondContact O-N 2.84Å
403	Y	55.5	Low	51.2	Low	111 Å²	111	93.6 Å²	93.6	44%	0.435	52%	0.521	S	S	.	.			trans	-66.3	118.6	-179.3	-162.9	-79	0	0	0	109.4	M401 D405 L525	M401-Y403 PolarHBondContact O-N 2.99Å; Y403-D405 HydrophobicContact CD1-CB 4.26Å; Y403-D405 VanDerWaalsContact CD1-CG 3.46Å; Y403-D405 WeakPolarHBondContact CD1-OD2 3.37Å; Y403-D405 VanDerWaalsContact CE1-CG 3.5Å; Y403-D405 WeakPolarHBondContact CE1-OD1 3.48Å; Y403-D405 WeakPolarHBondContact CE1-OD2 3.39Å; Y403-D405 PolarHBondContact O-N 2.87Å; Y403-L525 HydrophobicContact CD2-CD2 3.72Å; Y403-L525 HydrophobicContact CE2-CD2 4.09Å; Y403-L525 HydrophobicContact CG-CD2 4.31Å
404	D	47.3	Very low	52.8	Low	166 Å²	166	95.5 Å²	95.5	89%	0.888	53%	0.532	S	S	*	.			trans	-80	61.1	-177.1	-155.7	23.1	0	0	0	110.7	Q402	Q402-D404 PolarHBondContact O-N 2.84Å
405	D	48	Very low	54.8	Low	71 Å²	71	94.3 Å²	94.3	38%	0.38	53%	0.53	S	S	.	.	S	Bend	trans	-81.5	143.2	154.7	-70.9	-59	0	0	0	107.5	K283 Y403 A407	K283-D405 WeakPolarHBondContact CE-OD2 3.46Å; K283-D405 VanDerWaalsContact NZ-CG 3.33Å; K283-D405 IonicContact NZ-OD1 2.68Å; K283-D405 PolarHBondContact NZ-OD1 2.96Å; K283-D405 IonicContact NZ-OD2 2.63Å; K283-D405 PolarHBondContact NZ-OD2 3.17Å; Y403-D405 HydrophobicContact CD1-CB 4.26Å; Y403-D405 VanDerWaalsContact CD1-CG 3.46Å; Y403-D405 WeakPolarHBondContact CD1-OD2 3.37Å; Y403-D405 VanDerWaalsContact CE1-CG 3.5Å; Y403-D405 WeakPolarHBondContact CE1-OD1 3.48Å; Y403-D405 WeakPolarHBondContact CE1-OD2 3.39Å; Y403-D405 PolarHBondContact O-N 2.87Å; D405-A407 PolarHBondContact O-N 2.86Å
406	D	45.9	Very low	56.7	Low	164 Å²	164	92.4 Å²	92.4	88%	0.877	52%	0.524	S	S	*	.			trans	-47.5	113.1	160.3	-83.9	-50.3	0	0	0	108.6	D408	D406-D408 PolarHBondContact O-N 2.86Å
407	A	45.6	Very low	58.6	Low	77 Å²	77	92.7 Å²	92.7	64%	0.636	53%	0.53	S	S	*	.			trans	-53.6	108.1	-174.3	0	0	0	0	0	109.2	D405 S409	D405-A407 PolarHBondContact O-N 2.86Å; A407-S409 WeakPolarHBondContact O-CA 3.39Å; A407-S409 PolarHBondContact O-N 3.16Å
408	D	45.3	Very low	60.6	Low	79 Å²	79	91.4 Å²	91.4	42%	0.422	52%	0.524	S	S	.	.			trans	-43.1	106.5	-167.7	174.3	-1.1	0	0	0	109.6	R282 D406 T410 S411	R282-D408 IonicContact NH1-OD2 2.7Å; R282-D408 PolarHBondContact NH1-OD2 3.09Å; D406-D408 PolarHBondContact O-N 2.86Å; D408-T410 PolarHBondContact O-N 2.91Å; D408-T410 PolarHBondContact OD1-OG1 2.9Å; D408-T410 PolarHBondContact OD2-OG1 3.14Å; D408-S411 WeakPolarHBondContact O-CB 3.33Å; D408-S411 PolarHBondContact O-N 3.09Å; D408-S411 PolarHBondContact O-OG 3.35Å
409	S	45.4	Very low	62.4	Low	105 Å²	105	94.9 Å²	94.9	73%	0.734	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-66.3	-14.2	-158.2	56.4	0	0	0	0	113	A407 S411	A407-S409 WeakPolarHBondContact O-CA 3.39Å; A407-S409 PolarHBondContact O-N 3.16Å; S409-S411 PolarHBondContact O-N 3.05Å
410	T	48.6	Very low	63.6	Low	118 Å²	118	95.9 Å²	95.9	72%	0.724	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-65.2	-15.7	169	68	0	0	0	0	114.4	D408	D408-T410 PolarHBondContact O-N 2.91Å; D408-T410 PolarHBondContact OD1-OG1 2.9Å; D408-T410 PolarHBondContact OD2-OG1 3.14Å
411	S	55	Low	64.9	Low	31 Å²	31	93 Å²	93	22%	0.217	52%	0.517	C	S	.	.	G	3₁₀ helix	trans	-123.9	17	-167.2	66.1	0	0	0	0	114.9	R282 D408 S409 C413	R282-S411 VanDerWaalsContact CZ-OG 3.25Å; R282-S411 PolarHBondContact NH1-OG 3.1Å; R282-S411 PolarHBondContact NH2-OG 3.15Å; D408-S411 WeakPolarHBondContact O-CB 3.33Å; D408-S411 PolarHBondContact O-N 3.09Å; D408-S411 PolarHBondContact O-OG 3.35Å; S409-S411 PolarHBondContact O-N 3.05Å; S411-C413 PolarHBondContact O-N 3.35Å
412	S	60.4	Low	66.4	Low	77 Å²	77	86.9 Å²	86.9	54%	0.538	49%	0.489	S	S	.	.			trans	-59.1	134.1	169.6	61.7	0	0	0	0	110.5	N414	S412-N414 PolarHBondContact O-N 3.02Å
413	C	74.9	Confident	68	Low	53 Å²	53	87.7 Å²	87.7	36%	0.358	49%	0.493	S	S	.	.			trans	-69.8	75.5	177.7	173.3	0	0	0	0	110.5	S411 C454 K455	S411-C413 PolarHBondContact O-N 3.35Å; C413-C454 WeakPolarHBondContact CA-SG 3.01Å; C413-C454 HydrophobicContact CB-CB 3.99Å; C413-C454 WeakPolarHBondContact CB-SG 3.22Å; C413-C454 WeakPolarHBondContact SG-CB 3.45Å; C413-C454 CovalentContact SG-SG 2.03Å; C413-C454 PolarHBondContact SG-SG 3.39Å; C413-K455 HydrophobicContact CB-CG 4.05Å
414	N	82.6	Confident	69.5	Low	76 Å²	76	86.7 Å²	86.7	41%	0.406	49%	0.489	S	S	.	.			trans	-76.2	168.5	-179.1	70.1	50.4	0	0	0	111.4	S412 T416 A417 K418	S412-N414 PolarHBondContact O-N 3.02Å; N414-T416 PolarHBondContact O-N 3.49Å; N414-T416 WeakPolarHBondContact OD1-CA 3.43Å; N414-T416 WeakPolarHBondContact OD1-CB 3.29Å; N414-T416 PolarHBondContact OD1-N 2.9Å; N414-A417 PolarHBondContact O-N 3.45Å; N414-A417 PolarHBondContact OD1-N 3.49Å; N414-K418 WeakPolarHBondContact O-CB 3.43Å; N414-K418 PolarHBondContact O-N 2.82Å
415	T	83.1	Confident	71.7	Confident	113 Å²	113	78.8 Å²	78.8	69%	0.693	45%	0.446	S	S	*	.	H	α-helix	trans	-60.3	-29.3	-176.8	37.5	0	0	0	0	114	R419	T415-R419 WeakPolarHBondContact O-CB 3.36Å; T415-R419 PolarHBondContact O-N 3.21Å; T415-R419 VanDerWaalsContact O-N 3.14Å
416	T	84.1	Confident	73.7	Confident	82 Å²	82	78 Å²	78	50%	0.503	44%	0.443	S	S	.	.	H	α-helix	trans	-75.2	-50.2	176	-58.3	0	0	0	0	111	N414 K418 R419 T420	N414-T416 PolarHBondContact O-N 3.49Å; N414-T416 WeakPolarHBondContact OD1-CA 3.43Å; N414-T416 WeakPolarHBondContact OD1-CB 3.29Å; N414-T416 PolarHBondContact OD1-N 2.9Å; T416-K418 VanDerWaalsContact C-N 3.28Å; T416-K418 PolarHBondContact O-N 3.22Å; T416-R419 WeakPolarHBondContact O-CB 3.39Å; T416-R419 PolarHBondContact O-N 3.21Å; T416-R419 VanDerWaalsContact O-N 3.08Å; T416-T420 PolarHBondContact O-N 3.34Å; T416-T420 PolarHBondContact O-OG1 3.16Å
417	A	83.4	Confident	75.8	Confident	32 Å²	32	72.6 Å²	72.6	26%	0.264	41%	0.413	S	S	.	.	H	α-helix	trans	-56.9	-43.2	175.9	0	0	0	0	0	111.4	N414 R419 T420 A421	N414-A417 PolarHBondContact O-N 3.45Å; N414-A417 PolarHBondContact OD1-N 3.49Å; A417-R419 PolarHBondContact O-N 3.22Å; A417-T420 PolarHBondContact O-N 2.6Å; A417-A421 VanDerWaalsContact O-CB 3.31Å; A417-A421 WeakPolarHBondContact O-CB 3.34Å; A417-A421 PolarHBondContact O-N 3.37Å
418	K	85.8	Confident	78	Confident	118 Å²	118	68.9 Å²	68.9	51%	0.513	38%	0.383	S	S	.	.	H	α-helix	trans	-63.7	-38.2	176.5	-166.5	177.2	178.5	-177.5	0	112.3	N414 T416 G422 T450 C454	N414-K418 WeakPolarHBondContact O-CB 3.43Å; N414-K418 PolarHBondContact O-N 2.82Å; T416-K418 VanDerWaalsContact C-N 3.28Å; T416-K418 PolarHBondContact O-N 3.22Å; K418-G422 PolarHBondContact O-N 2.55Å; K418-T450 HydrophobicContact CG-CG2 3.9Å; K418-C454 WeakPolarHBondContact CA-SG 3.43Å; K418-C454 PolarHBondContact N-SG 3.15Å
419	R	86.3	Confident	80	Confident	152 Å²	152	68.7 Å²	68.7	57%	0.574	38%	0.379	S	S	*	.	H	α-helix	trans	-67	-46.3	175.9	-171.3	-173.7	-61.4	117.8	-0.7	111.5	T415 T416 A417 G422 Q423	T415-R419 WeakPolarHBondContact O-CB 3.36Å; T415-R419 PolarHBondContact O-N 3.21Å; T415-R419 VanDerWaalsContact O-N 3.14Å; T416-R419 WeakPolarHBondContact O-CB 3.39Å; T416-R419 PolarHBondContact O-N 3.21Å; T416-R419 VanDerWaalsContact O-N 3.08Å; A417-R419 PolarHBondContact O-N 3.22Å; R419-G422 PolarHBondContact O-N 3.05Å; R419-Q423 WeakPolarHBondContact O-CG 3.48Å; R419-Q423 PolarHBondContact O-N 2.83Å
420	T	86.7	Confident	81.8	Confident	74 Å²	74	69 Å²	69	45%	0.454	37%	0.369	S	S	.	.	H	α-helix	trans	-65.9	-38.6	178.7	-56.4	0	0	0	0	112	T416 A417 R424	T416-T420 PolarHBondContact O-N 3.34Å; T416-T420 PolarHBondContact O-OG1 3.16Å; A417-T420 PolarHBondContact O-N 2.6Å; T420-R424 PolarHBondContact O-N 3.29Å
421	A	87.7	Confident	83.4	Confident	5 Å²	5	66.1 Å²	66.1	4%	0.041	36%	0.363	C	S	.	.	H	α-helix	trans	-61.9	-49.5	170.5	0	0	0	0	0	111	A417 Q423 R424 C425 T450 L453 C454	A417-A421 VanDerWaalsContact O-CB 3.31Å; A417-A421 WeakPolarHBondContact O-CB 3.34Å; A417-A421 PolarHBondContact O-N 3.37Å; A421-Q423 PolarHBondContact O-N 3Å; A421-R424 WeakPolarHBondContact O-CB 3.26Å; A421-R424 PolarHBondContact O-N 3.49Å; A421-C425 PolarHBondContact O-N 3.05Å; A421-C425 PolarHBondContact O-SG 3.23Å; A421-T450 HydrophobicContact CB-CG2 4.17Å; A421-L453 HydrophobicContact CB-CB 3.86Å; A421-C454 HydrophobicContact CB-CB 4.25Å
422	G	88.7	Confident	84.8	Confident	10 Å²	10	66.3 Å²	66.3	10%	0.103	36%	0.364	C	S	.	.	H	α-helix	trans	-55.8	-46.7	177.4	0	0	0	0	0	113.1	K418 R419 R424 C425 N426	K418-G422 PolarHBondContact O-N 2.55Å; R419-G422 PolarHBondContact O-N 3.05Å; G422-R424 PolarHBondContact O-N 3.23Å; G422-C425 PolarHBondContact O-N 2.97Å; G422-N426 WeakPolarHBondContact O-CB 3.46Å; G422-N426 PolarHBondContact O-N 2.85Å; G422-N426 PolarHBondContact O-OD1 2.67Å
423	Q	88.3	Confident	86.1	Confident	128 Å²	128	62.8 Å²	62.8	60%	0.598	34%	0.339	S	S	*	.	H	α-helix	trans	-55.9	-34.3	175.8	-75	173.7	-43.7	0	0	113.4	R419 A421	R419-Q423 WeakPolarHBondContact O-CG 3.48Å; R419-Q423 PolarHBondContact O-N 2.83Å; A421-Q423 PolarHBondContact O-N 3Å
424	R	87.3	Confident	86.6	Confident	89 Å²	89	64.1 Å²	64.1	34%	0.336	35%	0.346	S	S	.	.	H	α-helix	trans	-79.2	-28.5	176.4	-67.2	173.3	64.2	172.5	5.4	113.1	T420 A421 G422 L427 A458 T463	T420-R424 PolarHBondContact O-N 3.29Å; A421-R424 WeakPolarHBondContact O-CB 3.26Å; A421-R424 PolarHBondContact O-N 3.49Å; G422-R424 PolarHBondContact O-N 3.23Å; R424-L427 WeakPolarHBondContact O-CD1 3.3Å; R424-L427 WeakPolarHBondContact O-CG 3.23Å; R424-A458 VanDerWaalsContact NH1-CB 3.32Å; R424-T463 HydrophobicContact CB-CG2 4.12Å; R424-T463 VanDerWaalsContact CZ-OG1 3.27Å; R424-T463 PolarHBondContact NE-OG1 3.07Å; R424-T463 PolarHBondContact NH2-OG1 3.3Å
425	C	92.1	Very high	86.6	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-85.3	-31.3	-179.5	-60.1	0	0	0	0	112.8	A421 G422 L427 L428 V446 C449 T450	A421-C425 PolarHBondContact O-N 3.05Å; A421-C425 PolarHBondContact O-SG 3.23Å; G422-C425 PolarHBondContact O-N 2.97Å; C425-L427 PolarHBondContact O-N 2.96Å; C425-L428 WeakPolarHBondContact O-CG 3.44Å; C425-L428 PolarHBondContact O-N 3.03Å; C425-V446 HydrophobicContact CB-CG1 4.26Å; C425-C449 HydrophobicContact CB-CB 3.68Å; C425-C449 WeakPolarHBondContact CB-SG 3.24Å; C425-C449 WeakPolarHBondContact SG-CB 3.35Å; C425-C449 CovalentContact SG-SG 2.04Å; C425-C449 PolarHBondContact SG-SG 2.84Å; C425-T450 PolarHBondContact SG-N 3.3Å
426	N	90.8	Very high	86.8	Confident	56 Å²	56	57.7 Å²	57.7	30%	0.299	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-62.2	-11.7	178.6	-74.1	13.7	0	0	0	113.7	G422 L428 Q429 V446	G422-N426 WeakPolarHBondContact O-CB 3.46Å; G422-N426 PolarHBondContact O-N 2.85Å; G422-N426 PolarHBondContact O-OD1 2.67Å; N426-L428 PolarHBondContact O-N 3.45Å; N426-Q429 WeakPolarHBondContact O-CB 3.23Å; N426-Q429 PolarHBondContact O-N 3.47Å; N426-V446 WeakPolarHBondContact OD1-CG1 3.38Å
427	L	89.8	Confident	86.9	Confident	49 Å²	49	56 Å²	56	26%	0.257	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-53.3	-25.1	169.4	-63	175.1	0	0	0	112.9	R424 C425 Q429 E430 F433 L467 T489	R424-L427 WeakPolarHBondContact O-CD1 3.3Å; R424-L427 WeakPolarHBondContact O-CG 3.23Å; C425-L427 PolarHBondContact O-N 2.96Å; L427-Q429 PolarHBondContact O-N 2.83Å; L427-E430 PolarHBondContact O-N 2.89Å; L427-F433 VanDerWaalsContact O-CD2 3.24Å; L427-F433 WeakPolarHBondContact O-CD2 3.38Å; L427-L467 HydrophobicContact CB-CD2 4.32Å; L427-T489 HydrophobicContact CB-CG2 4.2Å; L427-T489 HydrophobicContact CD1-CG2 3.88Å; L427-T489 HydrophobicContact CG-CG2 4.49Å
428	L	91.1	Very high	86.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-63.4	-25	171.4	-68.1	175.8	0	0	0	114	C425 N426 E430 F433 N437 P442 F445 V446 L467 Y470	C425-L428 WeakPolarHBondContact O-CG 3.44Å; C425-L428 PolarHBondContact O-N 3.03Å; N426-L428 PolarHBondContact O-N 3.45Å; L428-E430 VanDerWaalsContact C-N 3.34Å; L428-F433 HydrophobicContact CD2-CD1 3.98Å; L428-F433 HydrophobicContact CD2-CE1 3.96Å; L428-F433 HydrophobicContact CD2-CG 4.3Å; L428-F433 HydrophobicContact CD2-CZ 4.27Å; L428-F433 VanDerWaalsContact O-CB 3.22Å; L428-F433 WeakPolarHBondContact O-CB 3.48Å; L428-N437 PolarHBondContact O-ND2 2.68Å; L428-N437 PolarHBondContact O-OD1 3.45Å; L428-P442 HydrophobicContact CB-CB 3.94Å; L428-F445 HydrophobicContact CD1-CB 3.52Å; L428-V446 HydrophobicContact CB-CG2 3.98Å; L428-V446 HydrophobicContact CD1-CG2 3.96Å; L428-V446 HydrophobicContact CG-CG2 4.5Å; L428-L467 HydrophobicContact CD1-CD2 4.45Å; L428-L467 HydrophobicContact CD2-CD2 3.44Å; L428-L467 VanDerWaalsContact CD2-CD2 3.44Å; L428-L467 HydrophobicContact CG-CD2 3.58Å; L428-Y470 HydrophobicContact CD2-CD1 3.56Å; L428-Y470 HydrophobicContact CD2-CD2 4.47Å; L428-Y470 HydrophobicContact CD2-CE1 4.37Å; L428-Y470 HydrophobicContact CD2-CG 3.62Å
429	Q	88	Confident	86.6	Confident	75 Å²	75	59.9 Å²	59.9	35%	0.35	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-89.4	-4.1	179.5	-63.2	176.3	-8.8	0	0	111.9	N426 L427 P442 E443 V446	N426-Q429 WeakPolarHBondContact O-CB 3.23Å; N426-Q429 PolarHBondContact O-N 3.47Å; L427-Q429 PolarHBondContact O-N 2.83Å; Q429-P442 HydrophobicContact CG-CB 4.2Å; Q429-P442 HydrophobicContact CG-CG 3.86Å; Q429-E443 PolarHBondContact NE2-OE2 2.94Å; Q429-E443 VanDerWaalsContact NE2-OE2 3.09Å; Q429-V446 HydrophobicContact CG-CG2 4.29Å
430	E	83.9	Confident	86.8	Confident	111 Å²	111	53 Å²	53	52%	0.519	30%	0.298	S	S	.	.	S	Bend	trans	-128	168.6	-166.7	-63	179.1	-164.5	0	0	113	L427 L428 S432 F433	L427-E430 PolarHBondContact O-N 2.89Å; L428-E430 VanDerWaalsContact C-N 3.34Å; E430-S432 PolarHBondContact O-N 2.96Å; E430-F433 PolarHBondContact O-N 2.93Å
431	G	82.6	Confident	86.9	Confident	58 Å²	58	53.9 Å²	53.9	60%	0.598	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	52.6	-135.2	171.2	0	0	0	0	0	114.6	F433 T434	G431-F433 PolarHBondContact O-N 2.79Å; G431-F433 VanDerWaalsContact O-N 3.16Å; G431-T434 WeakPolarHBondContact O-CB 3.42Å; G431-T434 WeakPolarHBondContact O-CG2 3.24Å; G431-T434 PolarHBondContact O-N 2.89Å; G431-T434 PolarHBondContact O-OG1 2.87Å
432	S	84.3	Confident	87.2	Confident	35 Å²	35	54.2 Å²	54.2	25%	0.245	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-57.1	-26.9	-179	-59.3	0	0	0	0	114.4	E430 T434 Q483	E430-S432 PolarHBondContact O-N 2.96Å; S432-T434 VanDerWaalsContact C-N 3.29Å; S432-T434 PolarHBondContact O-N 2.8Å; S432-Q483 VanDerWaalsContact CB-O 3.29Å; S432-Q483 WeakPolarHBondContact CB-O 2.94Å; S432-Q483 PolarHBondContact OG-O 2.78Å; S432-Q483 VanDerWaalsContact OG-O 3.04Å
433	F	87.9	Confident	87.4	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.009	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-73.4	-20.1	-177.5	-67.3	-78.2	0	0	0	113.2	L427 L428 E430 G431 A435 C436 N437 L467 Y470 A471 V482 W485 T489	L427-F433 VanDerWaalsContact O-CD2 3.24Å; L427-F433 WeakPolarHBondContact O-CD2 3.38Å; L428-F433 HydrophobicContact CD2-CD1 3.98Å; L428-F433 HydrophobicContact CD2-CE1 3.96Å; L428-F433 HydrophobicContact CD2-CG 4.3Å; L428-F433 HydrophobicContact CD2-CZ 4.27Å; L428-F433 VanDerWaalsContact O-CB 3.22Å; L428-F433 WeakPolarHBondContact O-CB 3.48Å; E430-F433 PolarHBondContact O-N 2.93Å; G431-F433 PolarHBondContact O-N 2.79Å; G431-F433 VanDerWaalsContact O-N 3.16Å; F433-A435 PolarHBondContact O-N 3.45Å; F433-A435 VanDerWaalsContact O-N 3.11Å; F433-C436 WeakPolarHBondContact O-CA 3.32Å; F433-C436 VanDerWaalsContact O-CB 3.31Å; F433-C436 WeakPolarHBondContact O-CB 3.19Å; F433-C436 PolarHBondContact O-N 3.29Å; F433-N437 PolarHBondContact O-N 2.84Å; F433-N437 PolarHBondContact O-OD1 2.85Å; F433-L467 HydrophobicContact CE2-CD2 4.23Å; F433-L467 HydrophobicContact CZ-CB 4Å; F433-L467 HydrophobicContact CZ-CD2 4.16Å; F433-L467 HydrophobicContact CZ-CG 4.5Å; F433-Y470 HydrophobicContact CB-CE1 4.39Å; F433-Y470 AromaticContact CD1-CD1 3.6Å; F433-Y470 HydrophobicContact CD1-CD1 3.6Å; F433-Y470 AromaticContact CD1-CE1 3.85Å; F433-Y470 HydrophobicContact CD1-CE1 3.85Å; F433-Y470 HydrophobicContact CE1-CD1 4.04Å; F433-A471 HydrophobicContact CE1-CB 4.26Å; F433-V482 HydrophobicContact CD1-CG1 3.93Å; F433-V482 HydrophobicContact CD1-CG2 4.39Å; F433-V482 HydrophobicContact CE1-CG1 4.13Å; F433-V482 HydrophobicContact CG-CG1 4.4Å; F433-W485 HydrophobicContact CD2-CB 4.44Å; F433-W485 HydrophobicContact CE1-CB 4.27Å; F433-W485 HydrophobicContact CE1-CD2 4.31Å; F433-W485 HydrophobicContact CE1-CG 4.16Å; F433-W485 HydrophobicContact CE2-CB 3.71Å; F433-W485 HydrophobicContact CE2-CD2 4.41Å; F433-W485 HydrophobicContact CE2-CE3 4.26Å; F433-W485 HydrophobicContact CE2-CG 4.25Å; F433-W485 HydrophobicContact CZ-CB 3.61Å; F433-W485 AromaticContact CZ-CD2 3.61Å; F433-W485 HydrophobicContact CZ-CD2 3.61Å; F433-W485 AromaticContact CZ-CE3 3.65Å; F433-W485 HydrophobicContact CZ-CE3 3.65Å; F433-W485 AromaticContact CZ-CG 3.64Å; F433-W485 HydrophobicContact CZ-CG 3.64Å; F433-W485 HydrophobicContact CZ-CZ3 4.45Å; F433-T489 HydrophobicContact CE2-CG2 4.07Å
434	T	83.8	Confident	87.7	Confident	81 Å²	81	52.6 Å²	52.6	50%	0.497	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-55.5	-30.7	177.4	57.7	0	0	0	0	113.8	G431 S432 C436 N437	G431-T434 WeakPolarHBondContact O-CB 3.42Å; G431-T434 WeakPolarHBondContact O-CG2 3.24Å; G431-T434 PolarHBondContact O-N 2.89Å; G431-T434 PolarHBondContact O-OG1 2.87Å; S432-T434 VanDerWaalsContact C-N 3.29Å; S432-T434 PolarHBondContact O-N 2.8Å; T434-C436 PolarHBondContact O-N 2.94Å; T434-N437 PolarHBondContact O-N 2.04Å
435	A	82.6	Confident	88.1	Confident	54 Å²	54	48.5 Å²	48.5	45%	0.446	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-64	-22.7	173.9	0	0	0	0	0	113.5	F433 V480	F433-A435 PolarHBondContact O-N 3.45Å; F433-A435 VanDerWaalsContact O-N 3.11Å; A435-V480 HydrophobicContact CB-CG1 4.4Å
436	C	88.1	Confident	88.2	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-27.8	177.2	-165.6	0	0	0	0	114	F433 T434 S438 Y439 V440 Y470 C474 V482	F433-C436 WeakPolarHBondContact O-CA 3.32Å; F433-C436 VanDerWaalsContact O-CB 3.31Å; F433-C436 WeakPolarHBondContact O-CB 3.19Å; F433-C436 PolarHBondContact O-N 3.29Å; T434-C436 PolarHBondContact O-N 2.94Å; C436-S438 PolarHBondContact O-N 3.17Å; C436-Y439 PolarHBondContact O-N 3.08Å; C436-V440 PolarHBondContact O-N 3.31Å; C436-Y470 HydrophobicContact CB-CE1 3.7Å; C436-Y470 WeakPolarHBondContact CB-OH 3.12Å; C436-Y470 PolarHBondContact SG-OH 2.95Å; C436-Y470 VanDerWaalsContact SG-OH 3.34Å; C436-C474 HydrophobicContact CB-CB 4.11Å; C436-C474 WeakPolarHBondContact CB-SG 3.47Å; C436-C474 WeakPolarHBondContact SG-CB 3.48Å; C436-C474 CovalentContact SG-SG 2.01Å; C436-C474 PolarHBondContact SG-SG 2.77Å; C436-V482 HydrophobicContact CB-CG2 4.19Å
437	N	86.3	Confident	88.3	Confident	46 Å²	46	49.8 Å²	49.8	25%	0.246	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-13.5	-171.8	-67	-12.3	0	0	0	114.4	L428 F433 T434 Y470	L428-N437 PolarHBondContact O-ND2 2.68Å; L428-N437 PolarHBondContact O-OD1 3.45Å; F433-N437 PolarHBondContact O-N 2.84Å; F433-N437 PolarHBondContact O-OD1 2.85Å; T434-N437 PolarHBondContact O-N 2.04Å; N437-Y470 PolarHBondContact N-OH 3.43Å; N437-Y470 PolarHBondContact OD1-OH 3.36Å
438	S	80	Confident	88.4	Confident	94 Å²	94	47.5 Å²	47.5	66%	0.657	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-12.5	171.7	55.2	0	0	0	0	114.7	C436	C436-S438 PolarHBondContact O-N 3.17Å
439	Y	83.3	Confident	88.5	Confident	139 Å²	139	47.5 Å²	47.5	55%	0.545	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-31.4	-177.9	-59.4	-78.4	0	0	0	113.2	C436 V480	C436-Y439 PolarHBondContact O-N 3.08Å; Y439-V480 HydrophobicContact CD2-CG2 4.01Å; Y439-V480 HydrophobicContact CE2-CG2 3.63Å
440	V	88.9	Confident	88.7	Confident	8 Å²	8	44.6 Å²	44.6	5%	0.048	26%	0.257	C	S	.	.	S	Bend	trans	-134.4	120.9	178.8	-172.3	0	0	0	0	108.9	C436 P442 F445 Y470 V473 K477	C436-V440 PolarHBondContact O-N 3.31Å; V440-P442 WeakPolarHBondContact O-CD 3.24Å; V440-F445 HydrophobicContact CG1-CE2 4.11Å; V440-Y470 HydrophobicContact CB-CE2 3.83Å; V440-Y470 HydrophobicContact CG1-CD2 4.14Å; V440-Y470 HydrophobicContact CG1-CE2 3.61Å; V440-Y470 PolarHBondContact O-OH 2.9Å; V440-V473 HydrophobicContact CG1-CG1 4.04Å; V440-V473 HydrophobicContact CG2-CG1 4.29Å; V440-K477 HydrophobicContact CG2-CB 3.94Å; V440-K477 HydrophobicContact CG2-CG 4.18Å
441	D	89.4	Confident	88.9	Confident	91 Å²	91	43.4 Å²	43.4	49%	0.487	25%	0.251	S	S	.	.			trans	-60.9	121.1	173.2	179.2	7.3	0	0	0	110.2	E443	D441-E443 VanDerWaalsContact C-N 3.35Å; D441-E443 WeakPolarHBondContact OD1-CB 3.27Å; D441-E443 PolarHBondContact OD1-N 3.46Å
442	P	94	Very high	89.2	Confident	12 Å²	12	40.9 Å²	40.9	8%	0.078	22%	0.224	C	C	.	.	S	Bend	trans	-73.8	-21	177.4	30.5	-35.9	0	0	0	113.5	L428 Q429 V440 F445 V446 Y470	L428-P442 HydrophobicContact CB-CB 3.94Å; Q429-P442 HydrophobicContact CG-CB 4.2Å; Q429-P442 HydrophobicContact CG-CG 3.86Å; V440-P442 WeakPolarHBondContact O-CD 3.24Å; P442-F445 WeakPolarHBondContact O-CB 3.42Å; P442-F445 PolarHBondContact O-N 3.41Å; P442-V446 HydrophobicContact CB-CG2 4.49Å; P442-V446 WeakPolarHBondContact O-CG2 3.24Å; P442-V446 PolarHBondContact O-N 2.99Å; P442-Y470 HydrophobicContact CB-CE2 4.07Å
443	E	94	Very high	89.4	Confident	92 Å²	92	40 Å²	40	43%	0.43	22%	0.217	S	C	.	.	H	α-helix	trans	-59.7	-42.8	-169.9	-173.7	61	-159	0	0	114	Q429 D441 F445 V446 Q447	Q429-E443 PolarHBondContact NE2-OE2 2.94Å; Q429-E443 VanDerWaalsContact NE2-OE2 3.09Å; D441-E443 VanDerWaalsContact C-N 3.35Å; D441-E443 WeakPolarHBondContact OD1-CB 3.27Å; D441-E443 PolarHBondContact OD1-N 3.46Å; E443-F445 VanDerWaalsContact C-N 3.25Å; E443-F445 PolarHBondContact O-N 3.13Å; E443-V446 PolarHBondContact O-N 2.87Å; E443-Q447 WeakPolarHBondContact O-CB 3.45Å; E443-Q447 PolarHBondContact O-N 2.88Å
444	P	93.8	Very high	89.4	Confident	12 Å²	12	40.4 Å²	40.4	8%	0.078	22%	0.219	C	C	.	.	H	α-helix	trans	-57.4	-35.7	173.2	-28	37.1	0	0	0	114	I245 S249 P251 A448	I245-P444 HydrophobicContact CD1-CB 4.43Å; I245-P444 HydrophobicContact CG2-CB 4.33Å; S249-P444 VanDerWaalsContact O-CB 3.26Å; S249-P444 WeakPolarHBondContact O-CB 3.21Å; S249-P444 WeakPolarHBondContact O-CG 3.16Å; P251-P444 HydrophobicContact CG-CB 4.34Å; P444-A448 VanDerWaalsContact O-CB 3.31Å; P444-A448 WeakPolarHBondContact O-CB 3.46Å; P444-A448 PolarHBondContact O-N 3.34Å
445	F	94.8	Very high	89.4	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.018	22%	0.218	C	C	.	.	H	α-helix	trans	-77.9	-39.9	178.9	-68.4	-101.6	0	0	0	111.4	I245 L428 V440 P442 E443 Q447 A448 C449 Y470 V473	I245-F445 HydrophobicContact CD1-CB 4.33Å; I245-F445 HydrophobicContact CD1-CD1 3.55Å; I245-F445 HydrophobicContact CD1-CD2 3.82Å; I245-F445 HydrophobicContact CD1-CE1 3.67Å; I245-F445 HydrophobicContact CD1-CE2 3.92Å; I245-F445 HydrophobicContact CD1-CG 3.62Å; I245-F445 HydrophobicContact CD1-CZ 3.84Å; I245-F445 HydrophobicContact CG2-CE2 4.11Å; I245-F445 HydrophobicContact CG2-CZ 4.21Å; L428-F445 HydrophobicContact CD1-CB 3.52Å; V440-F445 HydrophobicContact CG1-CE2 4.11Å; P442-F445 WeakPolarHBondContact O-CB 3.42Å; P442-F445 PolarHBondContact O-N 3.41Å; E443-F445 VanDerWaalsContact C-N 3.25Å; E443-F445 PolarHBondContact O-N 3.13Å; F445-Q447 VanDerWaalsContact C-N 3.33Å; F445-A448 PolarHBondContact O-N 2.89Å; F445-C449 WeakPolarHBondContact O-CB 3.41Å; F445-C449 PolarHBondContact O-N 2.88Å; F445-Y470 HydrophobicContact CB-CD2 4.23Å; F445-Y470 HydrophobicContact CD1-CD2 4.19Å; F445-Y470 AromaticContact CD2-CD2 3.63Å; F445-Y470 HydrophobicContact CD2-CD2 3.63Å; F445-Y470 HydrophobicContact CD2-CE2 4.33Å; F445-Y470 HydrophobicContact CE1-CD2 4.48Å; F445-Y470 AromaticContact CE2-CD2 3.96Å; F445-Y470 HydrophobicContact CE2-CD2 3.96Å; F445-Y470 AromaticContact CG-CD2 3.76Å; F445-Y470 HydrophobicContact CG-CD2 3.76Å; F445-Y470 HydrophobicContact CG-CG 4.41Å; F445-Y470 HydrophobicContact CZ-CD2 4.39Å; F445-V473 HydrophobicContact CE1-CG2 4.25Å; F445-V473 HydrophobicContact CZ-CB 4.14Å; F445-V473 HydrophobicContact CZ-CG1 4.2Å; F445-V473 HydrophobicContact CZ-CG2 3.93Å
446	V	94.4	Very high	89.5	Confident	6 Å²	6	39.5 Å²	39.5	4%	0.036	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-45.5	171.6	173.1	0	0	0	0	110.2	C425 N426 L428 Q429 P442 E443 T450	C425-V446 HydrophobicContact CB-CG1 4.26Å; N426-V446 WeakPolarHBondContact OD1-CG1 3.38Å; L428-V446 HydrophobicContact CB-CG2 3.98Å; L428-V446 HydrophobicContact CD1-CG2 3.96Å; L428-V446 HydrophobicContact CG-CG2 4.5Å; Q429-V446 HydrophobicContact CG-CG2 4.29Å; P442-V446 HydrophobicContact CB-CG2 4.49Å; P442-V446 WeakPolarHBondContact O-CG2 3.24Å; P442-V446 PolarHBondContact O-N 2.99Å; E443-V446 PolarHBondContact O-N 2.87Å; V446-T450 WeakPolarHBondContact O-CB 3.35Å; V446-T450 PolarHBondContact O-N 2.92Å; V446-T450 PolarHBondContact O-OG1 2.03Å
447	Q	92.6	Very high	89	Confident	77 Å²	77	42.3 Å²	42.3	36%	0.36	22%	0.217	S	C	.	.	H	α-helix	trans	-60.5	-52.2	175.8	-177.8	-175.9	-22.2	0	0	111.4	E443 F445 T450 Q451	E443-Q447 WeakPolarHBondContact O-CB 3.45Å; E443-Q447 PolarHBondContact O-N 2.88Å; F445-Q447 VanDerWaalsContact C-N 3.33Å; Q447-T450 PolarHBondContact O-N 3.47Å; Q447-Q451 HydrophobicContact CG-CG 4.41Å; Q447-Q451 VanDerWaalsContact NE2-NE2 3.16Å; Q447-Q451 WeakPolarHBondContact O-CB 3.48Å; Q447-Q451 VanDerWaalsContact O-CG 3.31Å; Q447-Q451 WeakPolarHBondContact O-CG 3.45Å; Q447-Q451 PolarHBondContact O-N 2.78Å
448	A	92.6	Very high	88.7	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-58.5	-49.2	-179.7	0	0	0	0	0	112.3	T243 I245 P444 F445 T450 Q451 T452 F466	T243-A448 HydrophobicContact CG2-CB 3.65Å; I245-A448 HydrophobicContact CD1-CB 4.23Å; P444-A448 VanDerWaalsContact O-CB 3.31Å; P444-A448 WeakPolarHBondContact O-CB 3.46Å; P444-A448 PolarHBondContact O-N 3.34Å; F445-A448 PolarHBondContact O-N 2.89Å; A448-T450 PolarHBondContact O-N 2.91Å; A448-Q451 PolarHBondContact O-N 3.32Å; A448-T452 PolarHBondContact O-N 3.12Å; A448-T452 VanDerWaalsContact O-N 3.08Å; A448-T452 PolarHBondContact O-OG1 3.4Å; A448-F466 HydrophobicContact CB-CD1 4.25Å; A448-F466 HydrophobicContact CB-CE1 3.76Å
449	C	93.3	Very high	88.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-57.2	-49.5	175.6	173.7	0	0	0	0	111.2	C425 F445 Q451 T452 L453 F466	C425-C449 HydrophobicContact CB-CB 3.68Å; C425-C449 WeakPolarHBondContact CB-SG 3.24Å; C425-C449 WeakPolarHBondContact SG-CB 3.35Å; C425-C449 CovalentContact SG-SG 2.04Å; C425-C449 PolarHBondContact SG-SG 2.84Å; F445-C449 WeakPolarHBondContact O-CB 3.41Å; F445-C449 PolarHBondContact O-N 2.88Å; C449-Q451 PolarHBondContact O-N 2.68Å; C449-T452 PolarHBondContact O-N 3.23Å; C449-L453 WeakPolarHBondContact O-CB 3.47Å; C449-L453 WeakPolarHBondContact O-CG 3.27Å; C449-L453 PolarHBondContact O-N 2.85Å; C449-L453 VanDerWaalsContact SG-CD1 3.58Å; C449-F466 HydrophobicContact CB-CB 3.79Å; C449-F466 HydrophobicContact CB-CD1 4.09Å; C449-F466 HydrophobicContact CB-CD2 3.88Å; C449-F466 HydrophobicContact CB-CG 3.65Å
450	T	92.3	Very high	88.6	Confident	14 Å²	14	34.3 Å²	34.3	9%	0.086	19%	0.187	C	C	.	.	H	α-helix	trans	-65.6	-43.1	-177.3	-59.8	0	0	0	0	111.6	K418 A421 C425 V446 Q447 A448 T452 C454	K418-T450 HydrophobicContact CG-CG2 3.9Å; A421-T450 HydrophobicContact CB-CG2 4.17Å; C425-T450 PolarHBondContact SG-N 3.3Å; V446-T450 WeakPolarHBondContact O-CB 3.35Å; V446-T450 PolarHBondContact O-N 2.92Å; V446-T450 PolarHBondContact O-OG1 2.03Å; Q447-T450 PolarHBondContact O-N 3.47Å; A448-T450 PolarHBondContact O-N 2.91Å; T450-T452 PolarHBondContact O-N 3.33Å; T450-C454 WeakPolarHBondContact O-CB 3.44Å; T450-C454 PolarHBondContact O-N 3.3Å; T450-C454 VanDerWaalsContact O-N 3.09Å
451	Q	88.3	Confident	88.3	Confident	85 Å²	85	36.4 Å²	36.4	40%	0.397	20%	0.198	S	C	.	.	H	α-helix	trans	-64.8	-39.5	179.4	-72.7	-173.3	7.8	0	0	112.1	Q447 A448 C449	Q447-Q451 HydrophobicContact CG-CG 4.41Å; Q447-Q451 VanDerWaalsContact NE2-NE2 3.16Å; Q447-Q451 WeakPolarHBondContact O-CB 3.48Å; Q447-Q451 VanDerWaalsContact O-CG 3.31Å; Q447-Q451 WeakPolarHBondContact O-CG 3.45Å; Q447-Q451 PolarHBondContact O-N 2.78Å; A448-Q451 PolarHBondContact O-N 3.32Å; C449-Q451 PolarHBondContact O-N 2.68Å
452	T	88.6	Confident	88.1	Confident	6 Å²	6	32.1 Å²	32.1	4%	0.037	18%	0.175	C	C	.	.	H	α-helix	trans	-73.9	-51.3	-180	-46.2	0	0	0	0	111.3	F287 A448 C449 T450 C454 K455 Y456 L462 F466	F287-T452 HydrophobicContact CE1-CG2 4.18Å; F287-T452 HydrophobicContact CZ-CG2 4.33Å; A448-T452 PolarHBondContact O-N 3.12Å; A448-T452 VanDerWaalsContact O-N 3.08Å; A448-T452 PolarHBondContact O-OG1 3.4Å; C449-T452 PolarHBondContact O-N 3.23Å; T450-T452 PolarHBondContact O-N 3.33Å; T452-C454 PolarHBondContact O-N 2.88Å; T452-K455 PolarHBondContact O-N 3.36Å; T452-K455 VanDerWaalsContact O-N 3.13Å; T452-Y456 WeakPolarHBondContact O-CB 3.36Å; T452-Y456 PolarHBondContact O-N 3.43Å; T452-L462 HydrophobicContact CG2-CD2 3.79Å; T452-F466 HydrophobicContact CG2-CE2 4.28Å; T452-F466 HydrophobicContact CG2-CZ 4.38Å; T452-F466 WeakPolarHBondContact OG1-CZ 3.5Å
453	L	88.3	Confident	87.8	Confident	17 Å²	17	31.9 Å²	31.9	9%	0.089	17%	0.173	C	C	.	.	H	α-helix	trans	-66.5	-18	-179.6	-68.9	177.7	0	0	0	114.1	A421 C449 Y456 L462 T463	A421-L453 HydrophobicContact CB-CB 3.86Å; C449-L453 WeakPolarHBondContact O-CB 3.47Å; C449-L453 WeakPolarHBondContact O-CG 3.27Å; C449-L453 PolarHBondContact O-N 2.85Å; C449-L453 VanDerWaalsContact SG-CD1 3.58Å; L453-Y456 VanDerWaalsContact O-O 3.1Å; L453-L462 HydrophobicContact CD2-CB 3.84Å; L453-L462 HydrophobicContact CD2-CD2 4.04Å; L453-L462 HydrophobicContact CD2-CG 3.97Å; L453-T463 HydrophobicContact CD1-CG2 4.31Å; L453-T463 WeakPolarHBondContact CD1-OG1 3.49Å
454	C	87.9	Confident	87.5	Confident	9 Å²	9	28 Å²	28	6%	0.061	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-20.2	175.6	-170.9	0	0	0	0	113.4	C413 K418 A421 T450 T452	C413-C454 WeakPolarHBondContact CA-SG 3.01Å; C413-C454 HydrophobicContact CB-CB 3.99Å; C413-C454 WeakPolarHBondContact CB-SG 3.22Å; C413-C454 WeakPolarHBondContact SG-CB 3.45Å; C413-C454 CovalentContact SG-SG 2.03Å; C413-C454 PolarHBondContact SG-SG 3.39Å; K418-C454 WeakPolarHBondContact CA-SG 3.43Å; K418-C454 PolarHBondContact N-SG 3.15Å; A421-C454 HydrophobicContact CB-CB 4.25Å; T450-C454 WeakPolarHBondContact O-CB 3.44Å; T450-C454 PolarHBondContact O-N 3.3Å; T450-C454 VanDerWaalsContact O-N 3.09Å; T452-C454 PolarHBondContact O-N 2.88Å
455	K	84.3	Confident	87.3	Confident	109 Å²	109	28.4 Å²	28.4	47%	0.474	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-19.1	177.6	-61.1	-177.5	-179.2	-178.6	0	113.1	L285 C413 T452	L285-K455 HydrophobicContact CD1-CB 3.96Å; L285-K455 HydrophobicContact CD2-CB 4.12Å; L285-K455 HydrophobicContact CD2-CD 3.91Å; C413-K455 HydrophobicContact CB-CG 4.05Å; T452-K455 PolarHBondContact O-N 3.36Å; T452-K455 VanDerWaalsContact O-N 3.13Å
456	Y	84.6	Confident	87.1	Confident	8 Å²	8	28.3 Å²	28.3	3%	0.031	16%	0.157	C	C	.	.	S	Bend	trans	-104	140.7	-178.5	-158.2	-105.3	0	0	0	111.1	R280 R281 R282 L285 F287 T452 L453 V459 D460 L462	R280-Y456 HydrophobicContact CB-CE2 4.29Å; R280-Y456 VanDerWaalsContact CB-OH 3.24Å; R280-Y456 WeakPolarHBondContact CB-OH 3.07Å; R281-Y456 HydrophobicContact CB-CE2 4.16Å; R281-Y456 WeakPolarHBondContact CB-OH 3.38Å; R281-Y456 VanDerWaalsContact CG-OH 3.3Å; R281-Y456 WeakPolarHBondContact CG-OH 3.48Å; R281-Y456 PolarHBondContact N-OH 3.18Å; R282-Y456 HydrophobicContact CB-CD2 4.4Å; R282-Y456 HydrophobicContact CB-CE2 4.35Å; R282-Y456 HydrophobicContact CG-CD2 4.2Å; R282-Y456 HydrophobicContact CG-CE2 4.34Å; L285-Y456 HydrophobicContact CD1-CD2 3.86Å; F287-Y456 HydrophobicContact CE1-CD2 4.48Å; F287-Y456 HydrophobicContact CE1-CE2 4.49Å; F287-Y456 AromaticContact CE2-CD2 3.76Å; F287-Y456 HydrophobicContact CE2-CD2 3.76Å; F287-Y456 AromaticContact CE2-CE2 3.6Å; F287-Y456 HydrophobicContact CE2-CE2 3.6Å; F287-Y456 HydrophobicContact CZ-CD1 4.38Å; F287-Y456 AromaticContact CZ-CD2 3.38Å; F287-Y456 HydrophobicContact CZ-CD2 3.38Å; F287-Y456 HydrophobicContact CZ-CE1 4.48Å; F287-Y456 AromaticContact CZ-CE2 3.49Å; F287-Y456 HydrophobicContact CZ-CE2 3.49Å; F287-Y456 VanDerWaalsContact CZ-CE2 3.49Å; F287-Y456 AromaticContact CZ-CG 3.85Å; F287-Y456 HydrophobicContact CZ-CG 3.85Å; T452-Y456 WeakPolarHBondContact O-CB 3.36Å; T452-Y456 PolarHBondContact O-N 3.43Å; L453-Y456 VanDerWaalsContact O-O 3.1Å; Y456-V459 HydrophobicContact CE1-CG2 4.08Å; Y456-D460 HydrophobicContact CE1-CB 4.31Å; Y456-D460 VanDerWaalsContact CE1-OD2 3.23Å; Y456-D460 WeakPolarHBondContact CE1-OD2 3.29Å; Y456-D460 VanDerWaalsContact CZ-OD2 3.29Å; Y456-D460 PolarHBondContact OH-OD2 3.09Å; Y456-L462 HydrophobicContact CD1-CD2 3.71Å; Y456-L462 HydrophobicContact CE1-CD2 4.37Å; Y456-L462 HydrophobicContact CG-CD2 4.11Å
457	P	78.4	Confident	87	Confident	59 Å²	59	28 Å²	28	38%	0.383	16%	0.155	S	C	.	.			trans	-57	155.3	173.6	21.8	-32.3	0	0	0	112.2	V459	P457-V459 HydrophobicContact CB-CG2 4.03Å; P457-V459 HydrophobicContact CG-CG2 3.84Å; P457-V459 PolarHBondContact O-N 3.11Å
458	A	78.6	Confident	86.9	Confident	72 Å²	72	25.9 Å²	25.9	60%	0.595	14%	0.144	S	C	*	.	S	Bend	trans	-73.6	49.8	-176.1	0	0	0	0	0	114	R424	R424-A458 VanDerWaalsContact NH1-CB 3.32Å
459	V	79.8	Confident	86.8	Confident	38 Å²	38	25.9 Å²	25.9	23%	0.23	14%	0.144	C	C	.	.			trans	-129.9	-175.6	-173.4	-61.9	0	0	0	0	110.8	Y456 P457 D461 L462	Y456-V459 HydrophobicContact CE1-CG2 4.08Å; P457-V459 HydrophobicContact CB-CG2 4.03Å; P457-V459 HydrophobicContact CG-CG2 3.84Å; P457-V459 PolarHBondContact O-N 3.11Å; V459-D461 PolarHBondContact O-N 2.02Å; V459-D461 VanDerWaalsContact O-N 3.11Å; V459-L462 PolarHBondContact O-N 3.08Å
460	D	81.3	Confident	86.9	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	23.9	176	-51	-23.3	0	0	0	114.7	R281 Y456 L462 H465 A510	R281-D460 IonicContact CZ-OD1 3.74Å; R281-D460 VanDerWaalsContact NE-CG 3.33Å; R281-D460 IonicContact NE-OD1 3.75Å; R281-D460 PolarHBondContact NE-OD1 2.86Å; R281-D460 IonicContact NE-OD2 3.34Å; R281-D460 PolarHBondContact NE-OD2 3.16Å; R281-D460 IonicContact NH2-OD1 2.65Å; R281-D460 PolarHBondContact NH2-OD1 3.04Å; Y456-D460 HydrophobicContact CE1-CB 4.31Å; Y456-D460 VanDerWaalsContact CE1-OD2 3.23Å; Y456-D460 WeakPolarHBondContact CE1-OD2 3.29Å; Y456-D460 VanDerWaalsContact CZ-OD2 3.29Å; Y456-D460 PolarHBondContact OH-OD2 3.09Å; D460-L462 PolarHBondContact O-N 3.09Å; D460-H465 PolarHBondContact O-CE1 3.39Å; D460-H465 PolarHBondContact O-ND1 3.25Å; D460-A510 HydrophobicContact CB-CB 3.78Å; D460-A510 WeakPolarHBondContact OD1-CB 3.24Å
461	D	82.8	Confident	86.9	Confident	51 Å²	51	25.6 Å²	25.6	27%	0.273	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	29	-177	-152.2	26.9	0	0	0	115	V459 T463 C464 H465	V459-D461 PolarHBondContact O-N 2.02Å; V459-D461 VanDerWaalsContact O-N 3.11Å; D461-T463 VanDerWaalsContact C-N 3.29Å; D461-T463 PolarHBondContact O-N 2.78Å; D461-T463 VanDerWaalsContact O-N 3.16Å; D461-C464 WeakPolarHBondContact O-CB 2.98Å; D461-C464 PolarHBondContact O-N 3.42Å; D461-C464 PolarHBondContact OD1-SG 2.84Å; D461-C464 VanDerWaalsContact OD2-CB 3.26Å; D461-C464 WeakPolarHBondContact OD2-CB 3.22Å; D461-H465 PolarHBondContact O-N 3.06Å; D461-H465 PolarHBondContact O-ND1 2.92Å; D461-H465 VanDerWaalsContact O-ND1 3.16Å
462	L	85.3	Confident	87	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-63	-29.9	-165	-174.2	58.8	0	0	0	114	F287 T452 L453 Y456 V459 D460 H465 F466	F287-L462 HydrophobicContact CE1-CD1 4.25Å; F287-L462 HydrophobicContact CE1-CD2 3.8Å; F287-L462 HydrophobicContact CZ-CD2 4.3Å; T452-L462 HydrophobicContact CG2-CD2 3.79Å; L453-L462 HydrophobicContact CD2-CB 3.84Å; L453-L462 HydrophobicContact CD2-CD2 4.04Å; L453-L462 HydrophobicContact CD2-CG 3.97Å; Y456-L462 HydrophobicContact CD1-CD2 3.71Å; Y456-L462 HydrophobicContact CE1-CD2 4.37Å; Y456-L462 HydrophobicContact CG-CD2 4.11Å; V459-L462 PolarHBondContact O-N 3.08Å; D460-L462 PolarHBondContact O-N 3.09Å; L462-H465 PolarHBondContact O-N 3.01Å; L462-F466 HydrophobicContact CD1-CD2 4.48Å; L462-F466 HydrophobicContact CD1-CE2 4.06Å; L462-F466 HydrophobicContact CG-CD2 4.45Å; L462-F466 HydrophobicContact CG-CE2 4.11Å; L462-F466 VanDerWaalsContact O-CD2 3.3Å; L462-F466 WeakPolarHBondContact O-CD2 3.18Å; L462-F466 PolarHBondContact O-N 3.11Å
463	T	88.3	Confident	87.2	Confident	6 Å²	6	23.2 Å²	23.2	4%	0.037	13%	0.133	C	C	.	.	H	α-helix	trans	-58	-48.8	170.4	-51.6	0	0	0	0	110.9	R424 L453 D461 H465 F466 L467	R424-T463 HydrophobicContact CB-CG2 4.12Å; R424-T463 VanDerWaalsContact CZ-OG1 3.27Å; R424-T463 PolarHBondContact NE-OG1 3.07Å; R424-T463 PolarHBondContact NH2-OG1 3.3Å; L453-T463 HydrophobicContact CD1-CG2 4.31Å; L453-T463 WeakPolarHBondContact CD1-OG1 3.49Å; D461-T463 VanDerWaalsContact C-N 3.29Å; D461-T463 PolarHBondContact O-N 2.78Å; D461-T463 VanDerWaalsContact O-N 3.16Å; T463-H465 VanDerWaalsContact C-N 3.26Å; T463-H465 PolarHBondContact O-N 3.32Å; T463-F466 PolarHBondContact O-N 3.49Å; T463-F466 VanDerWaalsContact O-N 3.1Å; T463-L467 HydrophobicContact CG2-CD1 4.21Å; T463-L467 HydrophobicContact CG2-CG 4.36Å; T463-L467 WeakPolarHBondContact O-CG 3.39Å; T463-L467 PolarHBondContact O-N 3.15Å
464	C	88.1	Confident	87.4	Confident	10 Å²	10	22.4 Å²	22.4	7%	0.068	13%	0.128	C	C	.	.	H	α-helix	trans	-68.8	-24.9	-175.6	-60.3	0	0	0	0	112.6	D461 K468 C491	D461-C464 WeakPolarHBondContact O-CB 2.98Å; D461-C464 PolarHBondContact O-N 3.42Å; D461-C464 PolarHBondContact OD1-SG 2.84Å; D461-C464 VanDerWaalsContact OD2-CB 3.26Å; D461-C464 WeakPolarHBondContact OD2-CB 3.22Å; C464-K468 VanDerWaalsContact O-CB 3.23Å; C464-K468 WeakPolarHBondContact O-CB 3.03Å; C464-K468 PolarHBondContact O-N 2.73Å; C464-C491 HydrophobicContact CB-CB 3.74Å; C464-C491 WeakPolarHBondContact CB-SG 3.43Å; C464-C491 WeakPolarHBondContact SG-CA 2.86Å; C464-C491 WeakPolarHBondContact SG-CB 3.33Å; C464-C491 CovalentContact SG-SG 2.02Å; C464-C491 PolarHBondContact SG-SG 3.18Å
465	H	88.5	Confident	87.6	Confident	21 Å²	21	26 Å²	26	10%	0.097	14%	0.143	C	C	.	.	H	α-helix	trans	-65.8	-43.3	168.7	-63	116.3	0	0	0	112.6	T240 Q356 D460 D461 L462 T463 K468 G469	T240-H465 HydrophobicContact CG2-CB 4.12Å; Q356-H465 VanDerWaalsContact CD-NE2 3.34Å; Q356-H465 PolarHBondContact NE2-CE1 3.1Å; Q356-H465 PolarHBondContact NE2-NE2 3.43Å; Q356-H465 PolarHBondContact OE1-CE1 3.16Å; Q356-H465 PolarHBondContact OE1-ND1 3.4Å; D460-H465 PolarHBondContact O-CE1 3.39Å; D460-H465 PolarHBondContact O-ND1 3.25Å; D461-H465 PolarHBondContact O-N 3.06Å; D461-H465 PolarHBondContact O-ND1 2.92Å; D461-H465 VanDerWaalsContact O-ND1 3.16Å; L462-H465 PolarHBondContact O-N 3.01Å; T463-H465 VanDerWaalsContact C-N 3.26Å; T463-H465 PolarHBondContact O-N 3.32Å; H465-K468 PolarHBondContact O-N 3.36Å; H465-G469 PolarHBondContact O-N 2.86Å
466	F	91.5	Very high	87.8	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-66	-41.5	173.5	-76.5	-75.2	0	0	0	112.3	T240 A448 C449 T452 L462 T463 K468 G469 Y470	T240-F466 HydrophobicContact CG2-CD1 3.69Å; T240-F466 HydrophobicContact CG2-CD2 4.21Å; T240-F466 HydrophobicContact CG2-CE1 3.71Å; T240-F466 HydrophobicContact CG2-CE2 4.24Å; T240-F466 HydrophobicContact CG2-CG 3.94Å; T240-F466 HydrophobicContact CG2-CZ 4Å; A448-F466 HydrophobicContact CB-CD1 4.25Å; A448-F466 HydrophobicContact CB-CE1 3.76Å; C449-F466 HydrophobicContact CB-CB 3.79Å; C449-F466 HydrophobicContact CB-CD1 4.09Å; C449-F466 HydrophobicContact CB-CD2 3.88Å; C449-F466 HydrophobicContact CB-CG 3.65Å; T452-F466 HydrophobicContact CG2-CE2 4.28Å; T452-F466 HydrophobicContact CG2-CZ 4.38Å; T452-F466 WeakPolarHBondContact OG1-CZ 3.5Å; L462-F466 HydrophobicContact CD1-CD2 4.48Å; L462-F466 HydrophobicContact CD1-CE2 4.06Å; L462-F466 HydrophobicContact CG-CD2 4.45Å; L462-F466 HydrophobicContact CG-CE2 4.11Å; L462-F466 VanDerWaalsContact O-CD2 3.3Å; L462-F466 WeakPolarHBondContact O-CD2 3.18Å; L462-F466 PolarHBondContact O-N 3.11Å; T463-F466 PolarHBondContact O-N 3.49Å; T463-F466 VanDerWaalsContact O-N 3.1Å; F466-K468 PolarHBondContact O-N 3.33Å; F466-G469 PolarHBondContact O-N 3.48Å; F466-Y470 PolarHBondContact O-N 2.89Å
467	L	91.9	Very high	87.9	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.3	-42.2	174.8	-63.2	-178.7	0	0	0	112.1	L427 L428 F433 T463 A471 W485 T489	L427-L467 HydrophobicContact CB-CD2 4.32Å; L428-L467 HydrophobicContact CD1-CD2 4.45Å; L428-L467 HydrophobicContact CD2-CD2 3.44Å; L428-L467 VanDerWaalsContact CD2-CD2 3.44Å; L428-L467 HydrophobicContact CG-CD2 3.58Å; F433-L467 HydrophobicContact CE2-CD2 4.23Å; F433-L467 HydrophobicContact CZ-CB 4Å; F433-L467 HydrophobicContact CZ-CD2 4.16Å; F433-L467 HydrophobicContact CZ-CG 4.5Å; T463-L467 HydrophobicContact CG2-CD1 4.21Å; T463-L467 HydrophobicContact CG2-CG 4.36Å; T463-L467 WeakPolarHBondContact O-CG 3.39Å; T463-L467 PolarHBondContact O-N 3.15Å; L467-A471 WeakPolarHBondContact O-CB 3.23Å; L467-A471 PolarHBondContact O-N 3.21Å; L467-W485 HydrophobicContact CB-CE3 4.02Å; L467-W485 HydrophobicContact CB-CH2 3.82Å; L467-W485 HydrophobicContact CB-CZ3 3.41Å; L467-W485 VanDerWaalsContact CB-CZ3 3.41Å; L467-W485 HydrophobicContact CD1-CE3 4.31Å; L467-W485 HydrophobicContact CD1-CZ3 3.98Å; L467-W485 HydrophobicContact CG-CZ3 4.35Å; L467-T489 HydrophobicContact CD1-CG2 3.95Å
468	K	89.8	Confident	88.1	Confident	32 Å²	32	23 Å²	23	14%	0.139	13%	0.125	C	C	.	.	H	α-helix	trans	-64.6	-44.8	174.5	-176.1	-175.6	176.6	-171.4	0	111.6	D354 C464 H465 F466 Y470 A471 E472 W485	D354-K468 WeakPolarHBondContact OD2-CE 3.2Å; D354-K468 IonicContact OD2-NZ 2.7Å; D354-K468 PolarHBondContact OD2-NZ 2.01Å; C464-K468 VanDerWaalsContact O-CB 3.23Å; C464-K468 WeakPolarHBondContact O-CB 3.03Å; C464-K468 PolarHBondContact O-N 2.73Å; H465-K468 PolarHBondContact O-N 3.36Å; F466-K468 PolarHBondContact O-N 3.33Å; K468-Y470 PolarHBondContact O-N 3.31Å; K468-A471 PolarHBondContact O-N 3.47Å; K468-E472 HydrophobicContact CG-CG 4.41Å; K468-E472 PolarHBondContact O-N 3.46Å; K468-W485 HydrophobicContact CB-CH2 3.89Å; K468-W485 HydrophobicContact CB-CZ2 3.88Å; K468-W485 HydrophobicContact CG-CZ2 4.4Å
469	G	91.7	Very high	88.1	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-55.5	-49.8	177.4	0	0	0	0	0	111.7	H465 F466 A471 E472 V473	H465-G469 PolarHBondContact O-N 2.86Å; F466-G469 PolarHBondContact O-N 3.48Å; G469-A471 PolarHBondContact O-N 3.19Å; G469-E472 PolarHBondContact O-N 3.05Å; G469-V473 WeakPolarHBondContact O-CG2 3.4Å; G469-V473 PolarHBondContact O-N 2.97Å
470	Y	94.1	Very high	88.4	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.7	-45.4	174.7	-179.2	-96.2	0	0	0	112.6	L428 F433 C436 N437 V440 P442 F445 F466 K468 E472 V473 C474	L428-Y470 HydrophobicContact CD2-CD1 3.56Å; L428-Y470 HydrophobicContact CD2-CD2 4.47Å; L428-Y470 HydrophobicContact CD2-CE1 4.37Å; L428-Y470 HydrophobicContact CD2-CG 3.62Å; F433-Y470 HydrophobicContact CB-CE1 4.39Å; F433-Y470 AromaticContact CD1-CD1 3.6Å; F433-Y470 HydrophobicContact CD1-CD1 3.6Å; F433-Y470 AromaticContact CD1-CE1 3.85Å; F433-Y470 HydrophobicContact CD1-CE1 3.85Å; F433-Y470 HydrophobicContact CE1-CD1 4.04Å; C436-Y470 HydrophobicContact CB-CE1 3.7Å; C436-Y470 WeakPolarHBondContact CB-OH 3.12Å; C436-Y470 PolarHBondContact SG-OH 2.95Å; C436-Y470 VanDerWaalsContact SG-OH 3.34Å; N437-Y470 PolarHBondContact N-OH 3.43Å; N437-Y470 PolarHBondContact OD1-OH 3.36Å; V440-Y470 HydrophobicContact CB-CE2 3.83Å; V440-Y470 HydrophobicContact CG1-CD2 4.14Å; V440-Y470 HydrophobicContact CG1-CE2 3.61Å; V440-Y470 PolarHBondContact O-OH 2.9Å; P442-Y470 HydrophobicContact CB-CE2 4.07Å; F445-Y470 HydrophobicContact CB-CD2 4.23Å; F445-Y470 HydrophobicContact CD1-CD2 4.19Å; F445-Y470 AromaticContact CD2-CD2 3.63Å; F445-Y470 HydrophobicContact CD2-CD2 3.63Å; F445-Y470 HydrophobicContact CD2-CE2 4.33Å; F445-Y470 HydrophobicContact CE1-CD2 4.48Å; F445-Y470 AromaticContact CE2-CD2 3.96Å; F445-Y470 HydrophobicContact CE2-CD2 3.96Å; F445-Y470 AromaticContact CG-CD2 3.76Å; F445-Y470 HydrophobicContact CG-CD2 3.76Å; F445-Y470 HydrophobicContact CG-CG 4.41Å; F445-Y470 HydrophobicContact CZ-CD2 4.39Å; F466-Y470 PolarHBondContact O-N 2.89Å; K468-Y470 PolarHBondContact O-N 3.31Å; Y470-E472 PolarHBondContact O-N 3.31Å; Y470-V473 PolarHBondContact O-N 2.77Å; Y470-C474 WeakPolarHBondContact O-CB 3.02Å; Y470-C474 PolarHBondContact O-N 3.05Å
471	A	92.3	Very high	88.6	Confident	8 Å²	8	31 Å²	31	7%	0.066	16%	0.161	C	C	.	.	H	α-helix	trans	-62.6	-38	178.8	0	0	0	0	0	113.5	F433 L467 K468 G469 C474 K475 V482 W485	F433-A471 HydrophobicContact CE1-CB 4.26Å; L467-A471 WeakPolarHBondContact O-CB 3.23Å; L467-A471 PolarHBondContact O-N 3.21Å; K468-A471 PolarHBondContact O-N 3.47Å; G469-A471 PolarHBondContact O-N 3.19Å; A471-C474 VanDerWaalsContact O-CB 3.3Å; A471-C474 WeakPolarHBondContact O-CB 2.99Å; A471-K475 PolarHBondContact O-N 2.59Å; A471-V482 HydrophobicContact CB-CB 4.39Å; A471-V482 HydrophobicContact CB-CG2 4.35Å; A471-W485 HydrophobicContact CB-CZ2 4.49Å
472	E	91	Very high	88.7	Confident	35 Å²	35	29.2 Å²	29.2	16%	0.164	15%	0.151	C	C	.	.	H	α-helix	trans	-71.6	-43	174.5	-68.6	-62.2	148.8	0	0	111.2	I359 K468 G469 Y470 C474 K475 Y476	I359-E472 HydrophobicContact CD1-CB 4.32Å; I359-E472 HydrophobicContact CG1-CB 4.07Å; K468-E472 HydrophobicContact CG-CG 4.41Å; K468-E472 PolarHBondContact O-N 3.46Å; G469-E472 PolarHBondContact O-N 3.05Å; Y470-E472 PolarHBondContact O-N 3.31Å; E472-C474 PolarHBondContact O-N 2.89Å; E472-K475 WeakPolarHBondContact O-CB 3.37Å; E472-K475 PolarHBondContact O-N 2.88Å; E472-K475 IonicContact OE1-NZ 2.73Å; E472-K475 IonicContact OE2-NZ 3.62Å; E472-K475 PolarHBondContact OE2-NZ 3.46Å; E472-Y476 WeakPolarHBondContact O-CD2 3.29Å; E472-Y476 PolarHBondContact O-N 3.4Å
473	V	92.9	Very high	88.4	Confident	7 Å²	7	34.8 Å²	34.8	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-57.6	-40.1	174.4	173	0	0	0	0	111.2	V236 I359 V440 F445 G469 Y470 K475 Y476 K477	V236-V473 HydrophobicContact CB-CG1 4.33Å; V236-V473 HydrophobicContact CG1-CB 4.3Å; V236-V473 HydrophobicContact CG1-CG1 4.09Å; V236-V473 HydrophobicContact CG1-CG2 3.89Å; I359-V473 HydrophobicContact CD1-CG2 3.89Å; V440-V473 HydrophobicContact CG1-CG1 4.04Å; V440-V473 HydrophobicContact CG2-CG1 4.29Å; F445-V473 HydrophobicContact CE1-CG2 4.25Å; F445-V473 HydrophobicContact CZ-CB 4.14Å; F445-V473 HydrophobicContact CZ-CG1 4.2Å; F445-V473 HydrophobicContact CZ-CG2 3.93Å; G469-V473 WeakPolarHBondContact O-CG2 3.4Å; G469-V473 PolarHBondContact O-N 2.97Å; Y470-V473 PolarHBondContact O-N 2.77Å; V473-K475 VanDerWaalsContact C-N 3.3Å; V473-K475 PolarHBondContact O-N 3.26Å; V473-Y476 PolarHBondContact O-N 2.93Å; V473-K477 HydrophobicContact CG1-CG 4.16Å; V473-K477 WeakPolarHBondContact O-CB 3.4Å; V473-K477 PolarHBondContact O-N 3.05Å
474	C	92.4	Very high	88	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-52.3	-48.4	173	-160	0	0	0	0	113	C436 Y470 A471 E472 Y476 K477 S478 V482	C436-C474 HydrophobicContact CB-CB 4.11Å; C436-C474 WeakPolarHBondContact CB-SG 3.47Å; C436-C474 WeakPolarHBondContact SG-CB 3.48Å; C436-C474 CovalentContact SG-SG 2.01Å; C436-C474 PolarHBondContact SG-SG 2.77Å; Y470-C474 WeakPolarHBondContact O-CB 3.02Å; Y470-C474 PolarHBondContact O-N 3.05Å; A471-C474 VanDerWaalsContact O-CB 3.3Å; A471-C474 WeakPolarHBondContact O-CB 2.99Å; E472-C474 PolarHBondContact O-N 2.89Å; C474-Y476 VanDerWaalsContact C-N 3.33Å; C474-Y476 PolarHBondContact O-N 2.99Å; C474-K477 PolarHBondContact O-N 3.23Å; C474-S478 WeakPolarHBondContact O-CA 3.3Å; C474-S478 WeakPolarHBondContact O-CB 3.48Å; C474-S478 PolarHBondContact O-N 3.39Å; C474-S478 VanDerWaalsContact O-O 3.07Å; C474-S478 PolarHBondContact O-OG 3.2Å; C474-V482 HydrophobicContact CB-CG2 4.34Å
475	K	91.3	Very high	87.8	Confident	83 Å²	83	39.8 Å²	39.8	36%	0.361	20%	0.202	S	C	.	.	H	α-helix	trans	-73.9	-18.4	-176.8	169.9	-176.4	151	-144.6	0	113.7	A471 E472 V473 S478	A471-K475 PolarHBondContact O-N 2.59Å; E472-K475 WeakPolarHBondContact O-CB 3.37Å; E472-K475 PolarHBondContact O-N 2.88Å; E472-K475 IonicContact OE1-NZ 2.73Å; E472-K475 IonicContact OE2-NZ 3.62Å; E472-K475 PolarHBondContact OE2-NZ 3.46Å; V473-K475 VanDerWaalsContact C-N 3.3Å; V473-K475 PolarHBondContact O-N 3.26Å; K475-S478 CarbonylContact C-O 3.6Å; K475-S478 WeakPolarHBondContact CA-O 3.44Å
476	Y	89.5	Confident	87.5	Confident	51 Å²	51	41.7 Å²	41.7	20%	0.2	21%	0.209	C	C	.	.	H	α-helix	trans	-92.5	-36.2	170.9	-74.9	-73	0	0	0	112.8	N234 V352 I359 H361 E472 V473 C474	N234-Y476 PolarHBondContact ND2-O 2.82Å; N234-Y476 PolarHBondContact OD1-O 2.8Å; V352-Y476 WeakPolarHBondContact CG2-OH 3.48Å; I359-Y476 HydrophobicContact CB-CE2 4.41Å; I359-Y476 HydrophobicContact CG2-CD2 3.68Å; I359-Y476 HydrophobicContact CG2-CE2 3.8Å; H361-Y476 HydrophobicContact CB-CD1 4.14Å; H361-Y476 HydrophobicContact CB-CE1 4.48Å; H361-Y476 AromaticContact CE1-CD1 3.79Å; H361-Y476 AromaticContact CG-CD1 3.8Å; H361-Y476 AromaticContact ND1-CD1 3.35Å; H361-Y476 WeakPolarHBondContact ND1-CD1 3.46Å; H361-Y476 AromaticContact ND1-CE1 3.91Å; E472-Y476 WeakPolarHBondContact O-CD2 3.29Å; E472-Y476 PolarHBondContact O-N 3.4Å; V473-Y476 PolarHBondContact O-N 2.93Å; C474-Y476 VanDerWaalsContact C-N 3.33Å; C474-Y476 PolarHBondContact O-N 2.99Å
477	K	86	Confident	86.9	Confident	47 Å²	47	45.6 Å²	45.6	20%	0.204	24%	0.236	C	C	.	.	H	α-helix	trans	-74.9	-26	175.3	-77.4	-67.6	-168	170	0	113.1	N234 V236 V440 V473 C474	N234-K477 WeakPolarHBondContact O-CE 3.3Å; N234-K477 PolarHBondContact O-NZ 3.24Å; V236-K477 HydrophobicContact CB-CD 4.4Å; V236-K477 HydrophobicContact CB-CG 4.23Å; V236-K477 HydrophobicContact CG2-CD 3.9Å; V236-K477 HydrophobicContact CG2-CG 3.82Å; V440-K477 HydrophobicContact CG2-CB 3.94Å; V440-K477 HydrophobicContact CG2-CG 4.18Å; V473-K477 HydrophobicContact CG1-CG 4.16Å; V473-K477 WeakPolarHBondContact O-CB 3.4Å; V473-K477 PolarHBondContact O-N 3.05Å; C474-K477 PolarHBondContact O-N 3.23Å
478	S	82.4	Confident	86.1	Confident	15 Å²	15	52.1 Å²	52.1	11%	0.105	27%	0.266	C	S	.	.	S	Bend	trans	-145.9	162.8	-178.3	77.5	0	0	0	0	110.7	C474 K475 V480	C474-S478 WeakPolarHBondContact O-CA 3.3Å; C474-S478 WeakPolarHBondContact O-CB 3.48Å; C474-S478 PolarHBondContact O-N 3.39Å; C474-S478 VanDerWaalsContact O-O 3.07Å; C474-S478 PolarHBondContact O-OG 3.2Å; K475-S478 CarbonylContact C-O 3.6Å; K475-S478 WeakPolarHBondContact CA-O 3.44Å; S478-V480 PolarHBondContact O-N 2.95Å; S478-V480 WeakPolarHBondContact OG-CB 3.48Å; S478-V480 PolarHBondContact OG-N 3.46Å; S478-V480 VanDerWaalsContact OG-N 3.15Å
479	N	79.6	Confident	85.4	Confident	171 Å²	171	51.6 Å²	51.6	91%	0.914	27%	0.266	S	S	*	.	S	Bend	trans	-79.2	13.5	171	-70.7	-27.5	0	0	0	113.3
480	V	84.8	Confident	84.6	Confident	36 Å²	36	57.4 Å²	57.4	22%	0.218	31%	0.306	C	S	.	.			trans	-81	123.4	176.6	-177.7	0	0	0	0	109.6	A435 Y439 S478	A435-V480 HydrophobicContact CB-CG1 4.4Å; Y439-V480 HydrophobicContact CD2-CG2 4.01Å; Y439-V480 HydrophobicContact CE2-CG2 3.63Å; S478-V480 PolarHBondContact O-N 2.95Å; S478-V480 WeakPolarHBondContact OG-CB 3.48Å; S478-V480 PolarHBondContact OG-N 3.46Å; S478-V480 VanDerWaalsContact OG-N 3.15Å
481	T	85.6	Confident	83.9	Confident	74 Å²	74	57.8 Å²	57.8	45%	0.454	31%	0.309	S	S	.	.			trans	-102.6	118.9	168.9	-57.8	0	0	0	0	108.8	Q483	T481-Q483 PolarHBondContact O-N 2.9Å; T481-Q483 VanDerWaalsContact O-N 3.09Å
482	V	85.4	Confident	82.7	Confident	12 Å²	12	60.5 Å²	60.5	7%	0.073	33%	0.331	C	S	.	.			trans	-67.4	106.3	176	-173.1	0	0	0	0	108.9	F433 C436 A471 C474 W485	F433-V482 HydrophobicContact CD1-CG1 3.93Å; F433-V482 HydrophobicContact CD1-CG2 4.39Å; F433-V482 HydrophobicContact CE1-CG1 4.13Å; F433-V482 HydrophobicContact CG-CG1 4.4Å; C436-V482 HydrophobicContact CB-CG2 4.19Å; A471-V482 HydrophobicContact CB-CB 4.39Å; A471-V482 HydrophobicContact CB-CG2 4.35Å; C474-V482 HydrophobicContact CB-CG2 4.34Å; V482-W485 HydrophobicContact CG1-CB 3.88Å; V482-W485 HydrophobicContact CG1-CG 4.14Å
483	Q	80.1	Confident	81	Confident	120 Å²	120	64.4 Å²	64.4	56%	0.561	36%	0.357	S	S	*	.			trans	-82.4	148.6	-179.8	-58.2	-58.8	-24	0	0	111.6	S432 T481 W485	S432-Q483 VanDerWaalsContact CB-O 3.29Å; S432-Q483 WeakPolarHBondContact CB-O 2.94Å; S432-Q483 PolarHBondContact OG-O 2.78Å; S432-Q483 VanDerWaalsContact OG-O 3.04Å; T481-Q483 PolarHBondContact O-N 2.9Å; T481-Q483 VanDerWaalsContact O-N 3.09Å; Q483-W485 PolarHBondContact O-N 3.2Å
484	D	78.8	Confident	79.2	Confident	110 Å²	110	68 Å²	68	59%	0.588	38%	0.381	S	S	*	.	S	Bend	trans	52	17.4	168.8	-54.8	-39.2	0	0	0	116.8	R486 S487 H488	D484-R486 VanDerWaalsContact C-N 3.32Å; D484-R486 PolarHBondContact O-N 2.7Å; D484-S487 PolarHBondContact O-N 3.5Å; D484-S487 PolarHBondContact O-OG 2.91Å; D484-H488 PolarHBondContact O-ND1 3.37Å
485	W	84.7	Confident	77.2	Confident	11 Å²	11	76.1 Å²	76.1	4%	0.042	42%	0.419	C	S	.	.	H	α-helix	trans	-62.7	-39.4	-177.2	66.6	-97.1	0	0	0	112.2	F433 L467 K468 A471 V482 Q483 S487 H488 T489 C491	F433-W485 HydrophobicContact CD2-CB 4.44Å; F433-W485 HydrophobicContact CE1-CB 4.27Å; F433-W485 HydrophobicContact CE1-CD2 4.31Å; F433-W485 HydrophobicContact CE1-CG 4.16Å; F433-W485 HydrophobicContact CE2-CB 3.71Å; F433-W485 HydrophobicContact CE2-CD2 4.41Å; F433-W485 HydrophobicContact CE2-CE3 4.26Å; F433-W485 HydrophobicContact CE2-CG 4.25Å; F433-W485 HydrophobicContact CZ-CB 3.61Å; F433-W485 AromaticContact CZ-CD2 3.61Å; F433-W485 HydrophobicContact CZ-CD2 3.61Å; F433-W485 AromaticContact CZ-CE3 3.65Å; F433-W485 HydrophobicContact CZ-CE3 3.65Å; F433-W485 AromaticContact CZ-CG 3.64Å; F433-W485 HydrophobicContact CZ-CG 3.64Å; F433-W485 HydrophobicContact CZ-CZ3 4.45Å; L467-W485 HydrophobicContact CB-CE3 4.02Å; L467-W485 HydrophobicContact CB-CH2 3.82Å; L467-W485 HydrophobicContact CB-CZ3 3.41Å; L467-W485 VanDerWaalsContact CB-CZ3 3.41Å; L467-W485 HydrophobicContact CD1-CE3 4.31Å; L467-W485 HydrophobicContact CD1-CZ3 3.98Å; L467-W485 HydrophobicContact CG-CZ3 4.35Å; K468-W485 HydrophobicContact CB-CH2 3.89Å; K468-W485 HydrophobicContact CB-CZ2 3.88Å; K468-W485 HydrophobicContact CG-CZ2 4.4Å; A471-W485 HydrophobicContact CB-CZ2 4.49Å; V482-W485 HydrophobicContact CG1-CB 3.88Å; V482-W485 HydrophobicContact CG1-CG 4.14Å; Q483-W485 PolarHBondContact O-N 3.2Å; W485-S487 VanDerWaalsContact C-N 3.33Å; W485-S487 PolarHBondContact O-N 3.02Å; W485-H488 PolarHBondContact O-N 3Å; W485-T489 WeakPolarHBondContact O-CG2 3.3Å; W485-T489 PolarHBondContact O-N 2.94Å; W485-T489 VanDerWaalsContact O-N 3.08Å; W485-T489 PolarHBondContact O-OG1 2.88Å; W485-C491 HydrophobicContact CZ3-CB 4.13Å
486	R	82.4	Confident	75.5	Confident	61 Å²	61	74.1 Å²	74.1	23%	0.23	42%	0.418	C	S	.	.	H	α-helix	trans	-58.5	-40.7	-177.7	-70.5	-178.1	172.5	85	0.7	113.2	D484 H488 T489 C491 A492	D484-R486 VanDerWaalsContact C-N 3.32Å; D484-R486 PolarHBondContact O-N 2.7Å; R486-H488 PolarHBondContact O-N 3.49Å; R486-T489 PolarHBondContact O-N 2.64Å; R486-C491 HydrophobicContact CB-CB 4.19Å; R486-C491 HydrophobicContact CG-CB 4.17Å; R486-C491 PolarHBondContact O-N 3.34Å; R486-A492 WeakPolarHBondContact CD-O 3.47Å
487	S	77.9	Confident	74.4	Confident	84 Å²	84	74.4 Å²	74.4	59%	0.587	43%	0.425	S	S	*	.	H	α-helix	trans	-70.4	-19.5	178.9	53.6	0	0	0	0	113.3	D484 W485	D484-S487 PolarHBondContact O-N 3.5Å; D484-S487 PolarHBondContact O-OG 2.91Å; W485-S487 VanDerWaalsContact C-N 3.33Å; W485-S487 PolarHBondContact O-N 3.02Å
488	H	74.9	Confident	74.1	Confident	137 Å²	137	72.7 Å²	72.7	63%	0.634	42%	0.419	S	S	*	.	H	α-helix	trans	-95	-18.2	177.7	-65.3	91.5	0	0	0	113.2	D484 W485 R486	D484-H488 PolarHBondContact O-ND1 3.37Å; W485-H488 PolarHBondContact O-N 3Å; R486-H488 PolarHBondContact O-N 3.49Å
489	T	75.2	Confident	73.9	Confident	20 Å²	20	74.8 Å²	74.8	12%	0.123	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	17.2	-176	62.8	0	0	0	0	114.2	L427 F433 L467 W485 R486 C491	L427-T489 HydrophobicContact CB-CG2 4.2Å; L427-T489 HydrophobicContact CD1-CG2 3.88Å; L427-T489 HydrophobicContact CG-CG2 4.49Å; F433-T489 HydrophobicContact CE2-CG2 4.07Å; L467-T489 HydrophobicContact CD1-CG2 3.95Å; W485-T489 WeakPolarHBondContact O-CG2 3.3Å; W485-T489 PolarHBondContact O-N 2.94Å; W485-T489 VanDerWaalsContact O-N 3.08Å; W485-T489 PolarHBondContact O-OG1 2.88Å; R486-T489 PolarHBondContact O-N 2.64Å; T489-C491 PolarHBondContact O-N 2.82Å; T489-C491 VanDerWaalsContact O-N 3.11Å; T489-C491 PolarHBondContact OG1-SG 3.28Å
490	S	75.6	Confident	73.8	Confident	123 Å²	123	71.3 Å²	71.3	86%	0.86	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	25.6	-175.8	-58.8	0	0	0	0	114.5
491	C	78.6	Confident	73.8	Confident	8 Å²	8	72.3 Å²	72.3	5%	0.054	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-88.5	140.4	177.2	-63.7	0	0	0	0	110	C464 W485 R486 T489 V493	C464-C491 HydrophobicContact CB-CB 3.74Å; C464-C491 WeakPolarHBondContact CB-SG 3.43Å; C464-C491 WeakPolarHBondContact SG-CA 2.86Å; C464-C491 WeakPolarHBondContact SG-CB 3.33Å; C464-C491 CovalentContact SG-SG 2.02Å; C464-C491 PolarHBondContact SG-SG 3.18Å; W485-C491 HydrophobicContact CZ3-CB 4.13Å; R486-C491 HydrophobicContact CB-CB 4.19Å; R486-C491 HydrophobicContact CG-CB 4.17Å; R486-C491 PolarHBondContact O-N 3.34Å; T489-C491 PolarHBondContact O-N 2.82Å; T489-C491 VanDerWaalsContact O-N 3.11Å; T489-C491 PolarHBondContact OG1-SG 3.28Å; C491-V493 PolarHBondContact O-N 2.64Å
492	A	66.7	Low	73.7	Confident	66 Å²	66	71.1 Å²	71.1	55%	0.545	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-59.8	139.9	179.4	0	0	0	0	0	112.1	R486	R486-A492 WeakPolarHBondContact CD-O 3.47Å
493	V	56.9	Low	73.9	Confident	116 Å²	116	71.5 Å²	71.5	70%	0.703	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-67.4	145.8	178.2	-177.9	0	0	0	0	108.8	C491 Q495	C491-V493 PolarHBondContact O-N 2.64Å; V493-Q495 PolarHBondContact O-N 3.02Å
494	P	53.6	Low	74.1	Confident	84 Å²	84	65.9 Å²	65.9	55%	0.545	38%	0.377	S	S	.	.	S	Bend	trans	-82.2	77.8	-152.6	34.1	-38.1	0	0	0	113.8
495	Q	52	Low	74.5	Confident	169 Å²	169	63.9 Å²	63.9	79%	0.79	37%	0.371	S	S	*	.			trans	-80.2	124.2	136.2	-73.5	179.8	-20.8	0	0	106.4	V493 T497	V493-Q495 PolarHBondContact O-N 3.02Å; Q495-T497 VanDerWaalsContact C-N 3.3Å; Q495-T497 PolarHBondContact O-N 3.35Å
496	A	55.2	Low	74.7	Confident	41 Å²	41	64.2 Å²	64.2	34%	0.339	37%	0.374	S	S	.	.			trans	-67.4	96.2	174.3	0	0	0	0	0	106.7	C498 Q499	A496-C498 PolarHBondContact O-N 2.96Å; A496-C498 VanDerWaalsContact O-N 3.08Å; A496-Q499 HydrophobicContact CB-CB 3.65Å; A496-Q499 WeakPolarHBondContact O-CB 3.42Å; A496-Q499 PolarHBondContact O-N 3.17Å
497	T	65.9	Low	75.1	Confident	58 Å²	58	61.4 Å²	61.4	36%	0.356	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-34.5	-155.6	-13.6	0	0	0	0	112.4	Q495 V511 A518	Q495-T497 VanDerWaalsContact C-N 3.3Å; Q495-T497 PolarHBondContact O-N 3.35Å; T497-V511 HydrophobicContact CG2-CG2 3.96Å; T497-A518 VanDerWaalsContact C-CB 3.48Å; T497-A518 HydrophobicContact CG2-CB 3.82Å; T497-A518 WeakPolarHBondContact O-CB 3.41Å
498	C	79.6	Confident	75.8	Confident	10 Å²	10	57.4 Å²	57.4	7%	0.068	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-0.1	176.1	-67.7	0	0	0	0	115.2	G307 A496 D500 M501 C509	G307-C498 WeakPolarHBondContact CA-O 2.97Å; A496-C498 PolarHBondContact O-N 2.96Å; A496-C498 VanDerWaalsContact O-N 3.08Å; C498-D500 PolarHBondContact O-N 3.25Å; C498-M501 WeakPolarHBondContact O-CB 3.49Å; C498-M501 PolarHBondContact O-N 3.21Å; C498-C509 WeakPolarHBondContact CA-SG 3.42Å; C498-C509 HydrophobicContact CB-CB 3.78Å; C498-C509 WeakPolarHBondContact CB-SG 3.15Å; C498-C509 VanDerWaalsContact SG-C 3.59Å; C498-C509 WeakPolarHBondContact SG-CB 3.39Å; C498-C509 CovalentContact SG-SG 2.03Å; C498-C509 PolarHBondContact SG-SG 2.79Å
499	Q	78.3	Confident	76.4	Confident	60 Å²	60	50.9 Å²	50.9	28%	0.28	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	134.2	-172.6	178.5	155.8	65	0	0	111.9	S308 S334 A496 M501	S308-Q499 PolarHBondContact OG-NE2 2.85Å; S334-Q499 PolarHBondContact O-NE2 3Å; A496-Q499 HydrophobicContact CB-CB 3.65Å; A496-Q499 WeakPolarHBondContact O-CB 3.42Å; A496-Q499 PolarHBondContact O-N 3.17Å; Q499-M501 PolarHBondContact O-N 3.43Å
500	D	78.4	Confident	76.9	Confident	97 Å²	97	50 Å²	50	52%	0.519	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	-7	-170.4	-66.4	-62.6	0	0	0	116	G307 K309 K333 C498 F502	G307-D500 WeakPolarHBondContact O-CA 3.16Å; G307-D500 PolarHBondContact O-N 3.05Å; K309-D500 WeakPolarHBondContact CE-O 3.4Å; K333-D500 IonicContact NZ-OD1 2.68Å; K333-D500 PolarHBondContact NZ-OD1 3.01Å; K333-D500 IonicContact NZ-OD2 3.29Å; K333-D500 PolarHBondContact NZ-OD2 3.16Å; C498-D500 PolarHBondContact O-N 3.25Å; D500-F502 PolarHBondContact O-N 3.08Å
501	M	83.9	Confident	77.1	Confident	58 Å²	58	45.2 Å²	45.2	29%	0.286	27%	0.265	S	S	.	.			trans	-66.8	130.3	174.3	-167.2	158.6	-166.7	0	0	110.7	C498 Q499 A518 R519 C520	C498-M501 WeakPolarHBondContact O-CB 3.49Å; C498-M501 PolarHBondContact O-N 3.21Å; Q499-M501 PolarHBondContact O-N 3.43Å; M501-A518 HydrophobicContact SD-CB 4.23Å; M501-R519 HydrophobicContact CE-CB 4.46Å; M501-C520 HydrophobicContact CE-CB 4.44Å; M501-C520 VanDerWaalsContact CE-SG 3.53Å
502	F	84.3	Confident	77	Confident	49 Å²	49	45.8 Å²	45.8	22%	0.215	27%	0.267	C	S	.	.			trans	-96.1	145.6	167.9	-168.6	-120.4	0	0	0	109.5	K309 F316 D500 C520 N579 L580 H582	K309-F502 HydrophobicContact CD-CD2 4.09Å; F316-F502 HydrophobicContact CE2-CE2 4.42Å; F316-F502 HydrophobicContact CZ-CD2 4.43Å; F316-F502 AromaticContact CZ-CE2 3.74Å; F316-F502 HydrophobicContact CZ-CE2 3.74Å; F316-F502 HydrophobicContact CZ-CZ 4.49Å; D500-F502 PolarHBondContact O-N 3.08Å; F502-C520 PolarHBondContact O-SG 3.47Å; F502-N579 WeakPolarHBondContact CD1-O 3.36Å; F502-N579 VanDerWaalsContact CE1-O 3.31Å; F502-N579 WeakPolarHBondContact CE1-O 3.11Å; F502-L580 HydrophobicContact CE1-CD1 4.5Å; F502-L580 WeakPolarHBondContact CE1-O 3.31Å; F502-L580 HydrophobicContact CZ-CD1 4.28Å; F502-H582 AromaticContact CD1-NE2 3.53Å; F502-H582 PolarHBondContact O-CE1 2.92Å
503	C	88	Confident	77	Confident	19 Å²	19	46.9 Å²	46.9	13%	0.128	27%	0.271	C	S	.	.			trans	-134.6	146.5	166.2	-65.2	0	0	0	0	108.6	E507 C520	C503-E507 WeakPolarHBondContact CA-OE2 3.25Å; C503-E507 HydrophobicContact CB-CB 3.81Å; C503-C520 WeakPolarHBondContact CA-SG 3.38Å; C503-C520 HydrophobicContact CB-CB 3.9Å; C503-C520 WeakPolarHBondContact CB-SG 3.41Å; C503-C520 VanDerWaalsContact SG-CA 3.53Å; C503-C520 WeakPolarHBondContact SG-CB 3.03Å; C503-C520 CovalentContact SG-SG 2.04Å; C503-C520 PolarHBondContact SG-SG 3.22Å
504	G	86.3	Confident	77.6	Confident	2 Å²	2	46.8 Å²	46.8	2%	0.021	28%	0.276	C	S	.	.			trans	-64.1	164.4	176.9	0	0	0	0	0	112.2	H506 E507	G504-H506 PolarHBondContact O-N 3.28Å; G504-E507 PolarHBondContact N-OE2 2.04Å; G504-E507 PolarHBondContact O-N 3.32Å
505	S	85.7	Confident	78.4	Confident	68 Å²	68	46 Å²	46	48%	0.476	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.6	179.8	60.6	0	0	0	0	113.8	R523	S505-R523 PolarHBondContact O-NE 2.81Å
506	H	88.6	Confident	79.4	Confident	19 Å²	19	40.4 Å²	40.4	9%	0.088	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	0.1	177.9	76.1	-96.2	0	0	0	114.5	G504 R523 F526 T581 M583	G504-H506 PolarHBondContact O-N 3.28Å; H506-R523 WeakPolarHBondContact O-CB 3.39Å; H506-R523 WeakPolarHBondContact O-CG 3.27Å; H506-R523 PolarHBondContact O-N 2.85Å; H506-F526 HydrophobicContact CB-CB 4.09Å; H506-F526 HydrophobicContact CB-CD1 4.04Å; H506-F526 HydrophobicContact CB-CD2 3.55Å; H506-F526 HydrophobicContact CB-CE1 4.32Å; H506-F526 HydrophobicContact CB-CE2 3.86Å; H506-F526 HydrophobicContact CB-CG 3.63Å; H506-F526 HydrophobicContact CB-CZ 4.23Å; H506-F526 AromaticContact CD2-CD1 3.45Å; H506-F526 VanDerWaalsContact CD2-CD1 3.45Å; H506-F526 WeakPolarHBondContact CD2-CD1 3.41Å; H506-F526 AromaticContact CD2-CE1 3.21Å; H506-F526 WeakPolarHBondContact CD2-CE1 3.46Å; H506-F526 AromaticContact CD2-CG 3.99Å; H506-F526 AromaticContact CD2-CZ 3.55Å; H506-F526 AromaticContact CG-CE1 3.92Å; H506-F526 AromaticContact CG-CE2 3.96Å; H506-F526 AromaticContact CG-CZ 3.85Å; H506-F526 AromaticContact NE2-CE1 3.74Å; H506-F526 AromaticContact NE2-CZ 3.93Å; H506-T581 PolarHBondContact CE1-O 2.88Å; H506-T581 PolarHBondContact ND1-O 3.25Å; H506-M583 VanDerWaalsContact CE1-SD 3.56Å
507	E	92.3	Very high	80.5	Confident	1 Å²	1	45 Å²	45	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	164.8	-175.2	-63	176.9	150.4	0	0	111.1	C503 G504 C520 H521 R523 C554 H582	C503-E507 WeakPolarHBondContact CA-OE2 3.25Å; C503-E507 HydrophobicContact CB-CB 3.81Å; G504-E507 PolarHBondContact N-OE2 2.04Å; G504-E507 PolarHBondContact O-N 3.32Å; E507-C520 HydrophobicContact CB-CB 4.09Å; E507-C520 HydrophobicContact CG-CB 4.28Å; E507-C520 VanDerWaalsContact OE2-CB 3.25Å; E507-C520 WeakPolarHBondContact OE2-CB 3.39Å; E507-H521 CarbonylContact C-O 3.43Å; E507-H521 VanDerWaalsContact CA-O 3.22Å; E507-H521 WeakPolarHBondContact CA-O 3.35Å; E507-R523 PolarHBondContact O-NE 3.11Å; E507-R523 PolarHBondContact O-NH2 3.3Å; E507-C554 HydrophobicContact CG-CB 3.99Å; E507-C554 VanDerWaalsContact OE1-CB 3.31Å; E507-C554 WeakPolarHBondContact OE1-CB 3Å; E507-H582 IonicContact OE1-ND1 2.73Å; E507-H582 WeakPolarHBondContact OE2-CB 3.35Å; E507-H582 IonicContact OE2-CE1 2.67Å; E507-H582 IonicContact OE2-CG 2.75Å; E507-H582 IonicContact OE2-ND1 3.78Å; E507-H582 PolarHBondContact OE2-ND1 3.37Å
508	F	91.1	Very high	81.2	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	148.1	168	69.4	-80.6	0	0	0	109.7	R280 R281 A510 H521 R523	R280-F508 HydrophobicContact CB-CD1 4.16Å; R280-F508 HydrophobicContact CB-CD2 4.13Å; R280-F508 HydrophobicContact CB-CE1 3.98Å; R280-F508 HydrophobicContact CB-CE2 3.96Å; R280-F508 HydrophobicContact CB-CG 4.24Å; R280-F508 HydrophobicContact CB-CZ 3.9Å; R280-F508 HydrophobicContact CG-CD1 4.32Å; R280-F508 HydrophobicContact CG-CD2 3.82Å; R280-F508 HydrophobicContact CG-CE2 4.11Å; R280-F508 HydrophobicContact CG-CG 3.94Å; R280-F508 HydrophobicContact CG-CZ 4.5Å; R281-F508 HydrophobicContact CG-CE1 4.26Å; R281-F508 HydrophobicContact CG-CZ 3.66Å; F508-A510 HydrophobicContact CD2-CB 4.15Å; F508-A510 HydrophobicContact CE2-CB 3.74Å; F508-H521 HydrophobicContact CD1-CB 4.23Å; F508-H521 VanDerWaalsContact CD1-O 3.3Å; F508-H521 WeakPolarHBondContact CD1-O 3.01Å; F508-H521 HydrophobicContact CE1-CB 3.6Å; F508-H521 HydrophobicContact CE2-CB 4.16Å; F508-H521 HydrophobicContact CZ-CB 3.53Å; F508-H521 PolarHBondContact N-O 3.21Å; F508-H521 PolarHBondContact O-N 3.13Å; F508-R523 HydrophobicContact CD1-CG 3.93Å
509	C	88.7	Confident	81.6	Confident	1 Å²	1	45 Å²	45	1%	0.007	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	132.7	175.8	-175.9	0	0	0	0	111.7	Q306 C498	Q306-C509 VanDerWaalsContact OE1-N 3.12Å; C498-C509 WeakPolarHBondContact CA-SG 3.42Å; C498-C509 HydrophobicContact CB-CB 3.78Å; C498-C509 WeakPolarHBondContact CB-SG 3.15Å; C498-C509 VanDerWaalsContact SG-C 3.59Å; C498-C509 WeakPolarHBondContact SG-CB 3.39Å; C498-C509 CovalentContact SG-SG 2.03Å; C498-C509 PolarHBondContact SG-SG 2.79Å
510	A	86.1	Confident	82.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	173	167.5	0	0	0	0	0	111.5	D460 F508 A518 R519	D460-A510 HydrophobicContact CB-CB 3.78Å; D460-A510 WeakPolarHBondContact OD1-CB 3.24Å; F508-A510 HydrophobicContact CD2-CB 4.15Å; F508-A510 HydrophobicContact CE2-CB 3.74Å; A510-A518 WeakPolarHBondContact O-CA 3.16Å; A510-R519 PolarHBondContact N-O 3.38Å; A510-R519 VanDerWaalsContact N-O 3.17Å; A510-R519 PolarHBondContact O-N 2.91Å
511	V	79.4	Confident	82.7	Confident	23 Å²	23	37.7 Å²	37.7	14%	0.139	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	125.2	177.2	-169.1	0	0	0	0	109.9	T497 S513 G516	T497-V511 HydrophobicContact CG2-CG2 3.96Å; V511-S513 PolarHBondContact O-N 3.03Å; V511-G516 WeakPolarHBondContact CG1-O 3.11Å
512	D	76.1	Confident	83.1	Confident	20 Å²	20	35.3 Å²	35.3	11%	0.107	22%	0.224	C	C	.	.			trans	-71.8	128	173.1	-169.7	-76.8	0	0	0	110	S514 S515 G516 E517 R519 H521	D512-S514 PolarHBondContact O-N 2.92Å; D512-S514 WeakPolarHBondContact OD1-CA 3.04Å; D512-S514 WeakPolarHBondContact OD1-CB 3.31Å; D512-S514 PolarHBondContact OD1-N 3.34Å; D512-S514 PolarHBondContact OD1-OG 2.7Å; D512-S515 PolarHBondContact OD1-N 2.85Å; D512-G516 WeakPolarHBondContact O-CA 3.49Å; D512-G516 PolarHBondContact O-N 3.4Å; D512-E517 PolarHBondContact N-O 3.5Å; D512-R519 HydrophobicContact CB-CG 4.26Å; D512-R519 IonicContact OD2-CZ 3.33Å; D512-R519 IonicContact OD2-NE 3.72Å; D512-R519 PolarHBondContact OD2-NE 3.46Å; D512-R519 IonicContact OD2-NH2 2.95Å; D512-R519 PolarHBondContact OD2-NH2 2.83Å; D512-H521 IonicContact OD2-CE1 2.63Å
513	S	67.4	Low	83.4	Confident	90 Å²	90	33.5 Å²	33.5	63%	0.629	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-7.6	-174.1	-50.1	0	0	0	0	114.1	V511	V511-S513 PolarHBondContact O-N 3.03Å
514	S	68	Low	83.5	Confident	113 Å²	113	32.9 Å²	32.9	79%	0.79	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-36.1	178.9	72.8	0	0	0	0	113.5	D512	D512-S514 PolarHBondContact O-N 2.92Å; D512-S514 WeakPolarHBondContact OD1-CA 3.04Å; D512-S514 WeakPolarHBondContact OD1-CB 3.31Å; D512-S514 PolarHBondContact OD1-N 3.34Å; D512-S514 PolarHBondContact OD1-OG 2.7Å
515	S	71.2	Confident	83.4	Confident	69 Å²	69	34.3 Å²	34.3	48%	0.483	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-28	175.2	66	0	0	0	0	113.6	D512 E517	D512-S515 PolarHBondContact OD1-N 2.85Å; S515-E517 PolarHBondContact O-N 3.48Å; S515-E517 PolarHBondContact OG-N 2.89Å; S515-E517 VanDerWaalsContact OG-N 3.15Å
516	G	73.1	Confident	83.4	Confident	51 Å²	51	33.2 Å²	33.2	53%	0.526	21%	0.206	S	C	.	.	S	Bend	trans	76.5	3.6	-168.9	0	0	0	0	0	114	V511 D512	V511-G516 WeakPolarHBondContact CG1-O 3.11Å; D512-G516 WeakPolarHBondContact O-CA 3.49Å; D512-G516 PolarHBondContact O-N 3.4Å
517	E	78.5	Confident	83.3	Confident	138 Å²	138	32.6 Å²	32.6	65%	0.645	20%	0.204	S	C	*	.	S	Bend	trans	-98.4	158.5	177.7	-60.4	-178.3	153.7	0	0	110.7	D512 S515	D512-E517 PolarHBondContact N-O 3.5Å; S515-E517 PolarHBondContact O-N 3.48Å; S515-E517 PolarHBondContact OG-N 2.89Å; S515-E517 VanDerWaalsContact OG-N 3.15Å
518	A	81.3	Confident	82.8	Confident	24 Å²	24	34.1 Å²	34.1	20%	0.198	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	142.2	174.5	0	0	0	0	0	112	T497 M501 A510	T497-A518 VanDerWaalsContact C-CB 3.48Å; T497-A518 HydrophobicContact CG2-CB 3.82Å; T497-A518 WeakPolarHBondContact O-CB 3.41Å; M501-A518 HydrophobicContact SD-CB 4.23Å; A510-A518 WeakPolarHBondContact O-CA 3.16Å
519	R	86.3	Confident	82.2	Confident	42 Å²	42	39.6 Å²	39.6	16%	0.158	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	172.7	166	71.2	-176.9	-177.1	83.9	-0.2	112.6	M501 A510 D512 H521 E557 D558	M501-R519 HydrophobicContact CE-CB 4.46Å; A510-R519 PolarHBondContact N-O 3.38Å; A510-R519 VanDerWaalsContact N-O 3.17Å; A510-R519 PolarHBondContact O-N 2.91Å; D512-R519 HydrophobicContact CB-CG 4.26Å; D512-R519 IonicContact OD2-CZ 3.33Å; D512-R519 IonicContact OD2-NE 3.72Å; D512-R519 PolarHBondContact OD2-NE 3.46Å; D512-R519 IonicContact OD2-NH2 2.95Å; D512-R519 PolarHBondContact OD2-NH2 2.83Å; R519-H521 VanDerWaalsContact CZ-ND1 3.31Å; R519-H521 PolarHBondContact NE-CE1 2.73Å; R519-H521 PolarHBondContact NH1-ND1 2.6Å; R519-H521 PolarHBondContact NH2-CE1 3.26Å; R519-H521 PolarHBondContact NH2-ND1 2.78Å; R519-E557 VanDerWaalsContact NH1-CB 3.34Å; R519-E557 IonicContact NH1-OE2 3.08Å; R519-E557 PolarHBondContact NH1-OE2 3.18Å; R519-D558 IonicContact CZ-OD1 2.78Å; R519-D558 VanDerWaalsContact CZ-OD1 3.28Å; R519-D558 IonicContact NH1-OD1 3.59Å; R519-D558 PolarHBondContact NH1-OD1 3.49Å; R519-D558 IonicContact NH2-OD1 2.7Å; R519-D558 PolarHBondContact NH2-OD1 3.08Å
520	C	90	Very high	81.4	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.02	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	119.3	173.5	-63.3	0	0	0	0	109.3	M501 F502 C503 E507	M501-C520 HydrophobicContact CE-CB 4.44Å; M501-C520 VanDerWaalsContact CE-SG 3.53Å; F502-C520 PolarHBondContact O-SG 3.47Å; C503-C520 WeakPolarHBondContact CA-SG 3.38Å; C503-C520 HydrophobicContact CB-CB 3.9Å; C503-C520 WeakPolarHBondContact CB-SG 3.41Å; C503-C520 VanDerWaalsContact SG-CA 3.53Å; C503-C520 WeakPolarHBondContact SG-CB 3.03Å; C503-C520 CovalentContact SG-SG 2.04Å; C503-C520 PolarHBondContact SG-SG 3.22Å; E507-C520 HydrophobicContact CB-CB 4.09Å; E507-C520 HydrophobicContact CG-CB 4.28Å; E507-C520 VanDerWaalsContact OE2-CB 3.25Å; E507-C520 WeakPolarHBondContact OE2-CB 3.39Å
521	H	91	Very high	80.6	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	144.4	174.9	-66.1	-78.4	0	0	0	110	R281 E507 F508 D512 R519 R523 D558	R281-H521 PolarHBondContact NH1-ND1 2.86Å; R281-H521 PolarHBondContact NH2-CD2 3.5Å; R281-H521 PolarHBondContact NH2-CE1 3.43Å; R281-H521 VanDerWaalsContact NH2-CG 3.35Å; R281-H521 PolarHBondContact NH2-ND1 2.87Å; R281-H521 PolarHBondContact NH2-NE2 3.01Å; E507-H521 CarbonylContact C-O 3.43Å; E507-H521 VanDerWaalsContact CA-O 3.22Å; E507-H521 WeakPolarHBondContact CA-O 3.35Å; F508-H521 HydrophobicContact CD1-CB 4.23Å; F508-H521 VanDerWaalsContact CD1-O 3.3Å; F508-H521 WeakPolarHBondContact CD1-O 3.01Å; F508-H521 HydrophobicContact CE1-CB 3.6Å; F508-H521 HydrophobicContact CE2-CB 4.16Å; F508-H521 HydrophobicContact CZ-CB 3.53Å; F508-H521 PolarHBondContact N-O 3.21Å; F508-H521 PolarHBondContact O-N 3.13Å; D512-H521 IonicContact OD2-CE1 2.63Å; R519-H521 VanDerWaalsContact CZ-ND1 3.31Å; R519-H521 PolarHBondContact NE-CE1 2.73Å; R519-H521 PolarHBondContact NH1-ND1 2.6Å; R519-H521 PolarHBondContact NH2-CE1 3.26Å; R519-H521 PolarHBondContact NH2-ND1 2.78Å; H521-R523 PolarHBondContact O-N 3.02Å; H521-D558 IonicContact ND1-OD1 2.7Å; H521-D558 PolarHBondContact ND1-OD1 3.15Å
522	C	91.6	Very high	79.9	Confident	8 Å²	8	50.9 Å²	50.9	5%	0.054	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	137.4	176.2	-57.7	0	0	0	0	111	A527 C554 L555	C522-A527 HydrophobicContact CB-CB 4.03Å; C522-C554 WeakPolarHBondContact CA-SG 3.44Å; C522-C554 HydrophobicContact CB-CB 4.06Å; C522-C554 WeakPolarHBondContact CB-SG 3.45Å; C522-C554 WeakPolarHBondContact SG-CB 3.47Å; C522-C554 CovalentContact SG-SG 2.03Å; C522-C554 PolarHBondContact SG-SG 3.15Å; C522-L555 HydrophobicContact CB-CD2 4.31Å; C522-L555 WeakPolarHBondContact SG-CD2 3.08Å; C522-L555 WeakPolarHBondContact SG-CG 3.29Å; C522-L555 PolarHBondContact SG-N 3.06Å
523	R	91.5	Very high	79.1	Confident	11 Å²	11	54.6 Å²	54.6	4%	0.042	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-68.4	149.1	168.2	-63.6	-179	-168.3	-97.3	-0.5	111.3	E279 D289 S505 H506 E507 F508 H521 L525 F526 A527	E279-R523 HydrophobicContact CG-CB 4.16Å; E279-R523 PolarHBondContact O-NH1 3.29Å; E279-R523 VanDerWaalsContact OE1-CB 3.24Å; E279-R523 WeakPolarHBondContact OE1-CB 3.48Å; D289-R523 IonicContact OD1-CZ 3.15Å; D289-R523 IonicContact OD1-NH1 3.72Å; D289-R523 PolarHBondContact OD1-NH1 2.81Å; D289-R523 IonicContact OD1-NH2 3.43Å; D289-R523 PolarHBondContact OD1-NH2 3.08Å; D289-R523 IonicContact OD2-NH2 2.78Å; S505-R523 PolarHBondContact O-NE 2.81Å; H506-R523 WeakPolarHBondContact O-CB 3.39Å; H506-R523 WeakPolarHBondContact O-CG 3.27Å; H506-R523 PolarHBondContact O-N 2.85Å; E507-R523 PolarHBondContact O-NE 3.11Å; E507-R523 PolarHBondContact O-NH2 3.3Å; F508-R523 HydrophobicContact CD1-CG 3.93Å; H521-R523 PolarHBondContact O-N 3.02Å; R523-L525 PolarHBondContact O-N 2.93Å; R523-F526 PolarHBondContact O-N 2.98Å; R523-A527 WeakPolarHBondContact O-CB 3.39Å; R523-A527 PolarHBondContact O-N 3.18Å
524	A	88.9	Confident	78.9	Confident	7 Å²	7	55.4 Å²	55.4	6%	0.058	32%	0.318	C	S	.	.	H	α-helix	trans	-66.5	-33	-171.4	0	0	0	0	0	114.1	E279 R280 K283 S528	E279-A524 HydrophobicContact CG-CB 4.36Å; R280-A524 VanDerWaalsContact O-CB 3.24Å; R280-A524 WeakPolarHBondContact O-CB 3.35Å; R280-A524 PolarHBondContact O-N 2.8Å; K283-A524 HydrophobicContact CG-CB 3.73Å; A524-S528 WeakPolarHBondContact O-CB 2.89Å; A524-S528 PolarHBondContact O-N 3.15Å; A524-S528 PolarHBondContact O-OG 2.91Å
525	L	84.3	Confident	79	Confident	32 Å²	32	51.9 Å²	51.9	17%	0.168	29%	0.293	C	S	.	.	H	α-helix	trans	-66.6	-53.4	175.7	-66.9	169.4	0	0	0	110.2	E279 K283 Y403 R523 A527 S528	E279-L525 VanDerWaalsContact CD-CD1 3.44Å; E279-L525 HydrophobicContact CG-CD1 4.19Å; E279-L525 HydrophobicContact CG-CG 4Å; E279-L525 VanDerWaalsContact OE1-CB 3.3Å; E279-L525 WeakPolarHBondContact OE1-CB 3.46Å; E279-L525 WeakPolarHBondContact OE1-CD1 3.29Å; E279-L525 WeakPolarHBondContact OE1-CG 3.44Å; E279-L525 PolarHBondContact OE1-N 2.91Å; K283-L525 HydrophobicContact CB-CD2 4.18Å; K283-L525 HydrophobicContact CD-CD2 3.66Å; K283-L525 HydrophobicContact CD-CG 4.49Å; K283-L525 HydrophobicContact CG-CD2 3.82Å; K283-L525 HydrophobicContact CG-CG 4.26Å; Y403-L525 HydrophobicContact CD2-CD2 3.72Å; Y403-L525 HydrophobicContact CE2-CD2 4.09Å; Y403-L525 HydrophobicContact CG-CD2 4.31Å; R523-L525 PolarHBondContact O-N 2.93Å; L525-A527 PolarHBondContact O-N 2.03Å; L525-S528 WeakPolarHBondContact O-CB 3.38Å; L525-S528 PolarHBondContact O-N 2.77Å; L525-S528 PolarHBondContact O-OG 3.47Å
526	F	86.9	Confident	79.2	Confident	45 Å²	45	50.2 Å²	50.2	20%	0.197	28%	0.277	C	S	.	.	H	α-helix	trans	-55	-51.6	177.2	-180	-97.1	0	0	0	111.7	H506 R523 S528 K529 Y530 A552 L555 M583	H506-F526 HydrophobicContact CB-CB 4.09Å; H506-F526 HydrophobicContact CB-CD1 4.04Å; H506-F526 HydrophobicContact CB-CD2 3.55Å; H506-F526 HydrophobicContact CB-CE1 4.32Å; H506-F526 HydrophobicContact CB-CE2 3.86Å; H506-F526 HydrophobicContact CB-CG 3.63Å; H506-F526 HydrophobicContact CB-CZ 4.23Å; H506-F526 AromaticContact CD2-CD1 3.45Å; H506-F526 VanDerWaalsContact CD2-CD1 3.45Å; H506-F526 WeakPolarHBondContact CD2-CD1 3.41Å; H506-F526 AromaticContact CD2-CE1 3.21Å; H506-F526 WeakPolarHBondContact CD2-CE1 3.46Å; H506-F526 AromaticContact CD2-CG 3.99Å; H506-F526 AromaticContact CD2-CZ 3.55Å; H506-F526 AromaticContact CG-CE1 3.92Å; H506-F526 AromaticContact CG-CE2 3.96Å; H506-F526 AromaticContact CG-CZ 3.85Å; H506-F526 AromaticContact NE2-CE1 3.74Å; H506-F526 AromaticContact NE2-CZ 3.93Å; R523-F526 PolarHBondContact O-N 2.98Å; F526-S528 PolarHBondContact O-N 3.14Å; F526-K529 WeakPolarHBondContact O-CB 3.31Å; F526-K529 PolarHBondContact O-N 2.04Å; F526-Y530 HydrophobicContact CD1-CD2 4.43Å; F526-Y530 AromaticContact CD1-CE2 3.93Å; F526-Y530 HydrophobicContact CD1-CE2 3.93Å; F526-Y530 HydrophobicContact CD2-CE2 4.15Å; F526-Y530 HydrophobicContact CE1-CD2 4.26Å; F526-Y530 AromaticContact CE1-CE2 3.59Å; F526-Y530 HydrophobicContact CE1-CE2 3.59Å; F526-Y530 AromaticContact CE2-CE2 3.84Å; F526-Y530 HydrophobicContact CE2-CE2 3.84Å; F526-Y530 HydrophobicContact CG-CE2 4.21Å; F526-Y530 AromaticContact CZ-CE2 3.56Å; F526-Y530 HydrophobicContact CZ-CE2 3.56Å; F526-Y530 WeakPolarHBondContact O-CD2 3.44Å; F526-Y530 VanDerWaalsContact O-CE2 3.32Å; F526-Y530 WeakPolarHBondContact O-CE2 3.22Å; F526-A552 HydrophobicContact CE1-CB 3.55Å; F526-A552 HydrophobicContact CZ-CB 3.79Å; F526-L555 HydrophobicContact CE1-CD1 4.39Å; F526-M583 HydrophobicContact CZ-CE 4.42Å; F526-M583 HydrophobicContact CZ-SD 4.26Å
527	A	85	Confident	79.3	Confident	6 Å²	6	48.1 Å²	48.1	5%	0.05	26%	0.256	C	S	.	.	H	α-helix	trans	-61.1	-31.1	177.6	0	0	0	0	0	113	C522 R523 L525 K529 Y530 K531 L555	C522-A527 HydrophobicContact CB-CB 4.03Å; R523-A527 WeakPolarHBondContact O-CB 3.39Å; R523-A527 PolarHBondContact O-N 3.18Å; L525-A527 PolarHBondContact O-N 2.03Å; A527-K529 VanDerWaalsContact C-N 3.25Å; A527-K529 PolarHBondContact O-N 3.46Å; A527-Y530 PolarHBondContact O-N 3.1Å; A527-Y530 VanDerWaalsContact O-N 3.07Å; A527-K531 WeakPolarHBondContact O-CG 3.24Å; A527-K531 PolarHBondContact O-N 2.89Å; A527-L555 HydrophobicContact CB-CD2 4.09Å
528	S	82.1	Confident	79	Confident	32 Å²	32	44.9 Å²	44.9	22%	0.224	24%	0.241	C	C	.	.	H	α-helix	trans	-66.9	-22.4	-179.3	74.6	0	0	0	0	114.3	A524 L525 F526 Y530 P532	A524-S528 WeakPolarHBondContact O-CB 2.89Å; A524-S528 PolarHBondContact O-N 3.15Å; A524-S528 PolarHBondContact O-OG 2.91Å; L525-S528 WeakPolarHBondContact O-CB 3.38Å; L525-S528 PolarHBondContact O-N 2.77Å; L525-S528 PolarHBondContact O-OG 3.47Å; F526-S528 PolarHBondContact O-N 3.14Å; S528-Y530 PolarHBondContact O-N 2.82Å; S528-P532 WeakPolarHBondContact O-CD 3.49Å
529	K	78.4	Confident	78.3	Confident	115 Å²	115	46.8 Å²	46.8	50%	0.5	25%	0.251	S	S	.	.	H	α-helix	trans	-61.5	-33.2	170.2	179.5	177.1	167.1	-176	0	112.3	F526 A527 E538	F526-K529 WeakPolarHBondContact O-CB 3.31Å; F526-K529 PolarHBondContact O-N 2.04Å; A527-K529 VanDerWaalsContact C-N 3.25Å; A527-K529 PolarHBondContact O-N 3.46Å; K529-E538 IonicContact NZ-OE1 3.26Å; K529-E538 PolarHBondContact NZ-OE1 3.43Å; K529-E538 IonicContact NZ-OE2 2.59Å; K529-E538 PolarHBondContact NZ-OE2 2.97Å
530	Y	73.1	Confident	77.6	Confident	5 Å²	5	45.2 Å²	45.2	2%	0.02	25%	0.246	C	C	.	.	H	α-helix	trans	-104.8	-24.4	-169.8	-51.4	-71.1	0	0	0	113.9	F526 A527 S528 T533 N534 S535 G537 E538 L555	F526-Y530 HydrophobicContact CD1-CD2 4.43Å; F526-Y530 AromaticContact CD1-CE2 3.93Å; F526-Y530 HydrophobicContact CD1-CE2 3.93Å; F526-Y530 HydrophobicContact CD2-CE2 4.15Å; F526-Y530 HydrophobicContact CE1-CD2 4.26Å; F526-Y530 AromaticContact CE1-CE2 3.59Å; F526-Y530 HydrophobicContact CE1-CE2 3.59Å; F526-Y530 AromaticContact CE2-CE2 3.84Å; F526-Y530 HydrophobicContact CE2-CE2 3.84Å; F526-Y530 HydrophobicContact CG-CE2 4.21Å; F526-Y530 AromaticContact CZ-CE2 3.56Å; F526-Y530 HydrophobicContact CZ-CE2 3.56Å; F526-Y530 WeakPolarHBondContact O-CD2 3.44Å; F526-Y530 VanDerWaalsContact O-CE2 3.32Å; F526-Y530 WeakPolarHBondContact O-CE2 3.22Å; A527-Y530 PolarHBondContact O-N 3.1Å; A527-Y530 VanDerWaalsContact O-N 3.07Å; S528-Y530 PolarHBondContact O-N 2.82Å; Y530-T533 PolarHBondContact O-N 2.87Å; Y530-T533 PolarHBondContact O-OG1 3.04Å; Y530-N534 PolarHBondContact O-N 3.06Å; Y530-S535 WeakPolarHBondContact CA-OG 3.35Å; Y530-S535 WeakPolarHBondContact CB-O 3.18Å; Y530-S535 WeakPolarHBondContact CB-OG 3.06Å; Y530-S535 PolarHBondContact O-N 3.44Å; Y530-S535 VanDerWaalsContact O-N 3.08Å; Y530-S535 PolarHBondContact O-OG 3.35Å; Y530-G537 VanDerWaalsContact CD1-O 3.27Å; Y530-G537 WeakPolarHBondContact CD1-O 3.39Å; Y530-G537 WeakPolarHBondContact CE1-O 3.47Å; Y530-E538 PolarHBondContact OH-OE1 3.35Å; Y530-L555 HydrophobicContact CD2-CD1 3.55Å; Y530-L555 HydrophobicContact CE2-CD1 4.21Å; Y530-L555 HydrophobicContact CG-CD1 3.86Å
531	K	69.4	Low	77.1	Confident	142 Å²	142	49.4 Å²	49.4	62%	0.617	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-52.2	-46.3	177.3	-79.7	176.5	-177.4	-177.5	0	114.5	A527 T533 N534	A527-K531 WeakPolarHBondContact O-CG 3.24Å; A527-K531 PolarHBondContact O-N 2.89Å; K531-T533 VanDerWaalsContact C-N 3.27Å; K531-T533 PolarHBondContact O-N 3.45Å; K531-N534 PolarHBondContact O-N 3.47Å; K531-N534 VanDerWaalsContact O-N 3.14Å
532	P	64.3	Low	76.4	Confident	114 Å²	114	50.8 Å²	50.8	74%	0.74	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-64.4	-29.5	-176.3	-23.5	34.5	0	0	0	114.1	S528	S528-P532 WeakPolarHBondContact O-CD 3.49Å
533	T	59.6	Low	75.3	Confident	99 Å²	99	52.9 Å²	52.9	61%	0.607	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-98.4	-1.4	178.4	51.5	0	0	0	0	112.8	Y530 K531 S535	Y530-T533 PolarHBondContact O-N 2.87Å; Y530-T533 PolarHBondContact O-OG1 3.04Å; K531-T533 VanDerWaalsContact C-N 3.27Å; K531-T533 PolarHBondContact O-N 3.45Å; T533-S535 PolarHBondContact O-N 3.1Å; T533-S535 PolarHBondContact OG1-OG 3.26Å
534	N	62.1	Low	73.9	Confident	106 Å²	106	58.6 Å²	58.6	57%	0.567	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	41.8	-169.9	-169.8	70.3	0	0	0	112.1	Y530 K531	Y530-N534 PolarHBondContact O-N 3.06Å; K531-N534 PolarHBondContact O-N 3.47Å; K531-N534 VanDerWaalsContact O-N 3.14Å
535	S	70.8	Confident	72.7	Confident	40 Å²	40	64.9 Å²	64.9	28%	0.28	36%	0.355	S	S	.	.			trans	-93.3	165.4	179.6	54.1	0	0	0	0	111.7	Y530 T533	Y530-S535 WeakPolarHBondContact CA-OG 3.35Å; Y530-S535 WeakPolarHBondContact CB-O 3.18Å; Y530-S535 WeakPolarHBondContact CB-OG 3.06Å; Y530-S535 PolarHBondContact O-N 3.44Å; Y530-S535 VanDerWaalsContact O-N 3.08Å; Y530-S535 PolarHBondContact O-OG 3.35Å; T533-S535 PolarHBondContact O-N 3.1Å; T533-S535 PolarHBondContact OG1-OG 3.26Å
536	F	75.1	Confident	72.2	Confident	33 Å²	33	63.8 Å²	63.8	15%	0.145	35%	0.352	C	S	.	.	S	Bend	trans	-112.5	5	-176.3	-69.6	-81.7	0	0	0	113.6	L551 A552 L555 L556 K559 I561 M630	F536-L551 HydrophobicContact CB-CD1 4.48Å; F536-L551 HydrophobicContact CB-CD2 4.06Å; F536-L551 CarbonylContact O-C 3.58Å; F536-L551 WeakPolarHBondContact O-CA 3.46Å; F536-A552 PolarHBondContact O-N 3.35Å; F536-L555 HydrophobicContact CD1-CB 4.06Å; F536-L555 WeakPolarHBondContact CD1-O 3.33Å; F536-L555 WeakPolarHBondContact CE1-O 3.47Å; F536-L556 HydrophobicContact CB-CD2 4.16Å; F536-L556 HydrophobicContact CD1-CD2 3.64Å; F536-L556 HydrophobicContact CD1-CG 4.28Å; F536-L556 HydrophobicContact CE1-CD2 4.14Å; F536-L556 HydrophobicContact CG-CD2 3.93Å; F536-K559 HydrophobicContact CE1-CB 4.12Å; F536-K559 HydrophobicContact CE1-CG 3.57Å; F536-K559 HydrophobicContact CZ-CB 4.45Å; F536-K559 HydrophobicContact CZ-CG 3.9Å; F536-I561 HydrophobicContact CE1-CD1 4.21Å; F536-I561 HydrophobicContact CZ-CD1 4.06Å; F536-M630 HydrophobicContact CD2-CE 3.37Å; F536-M630 HydrophobicContact CD2-SD 3.94Å; F536-M630 HydrophobicContact CE2-CE 3.47Å; F536-M630 VanDerWaalsContact CE2-CE 3.47Å; F536-M630 HydrophobicContact CE2-SD 4.43Å; F536-M630 HydrophobicContact CG-CE 4.01Å; F536-M630 HydrophobicContact CZ-CE 4.17Å
537	G	75.9	Confident	71.9	Confident	7 Å²	7	61.7 Å²	61.7	7%	0.072	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	165.1	-160.8	-176.6	0	0	0	0	0	112.6	Y530	Y530-G537 VanDerWaalsContact CD1-O 3.27Å; Y530-G537 WeakPolarHBondContact CD1-O 3.39Å; Y530-G537 WeakPolarHBondContact CE1-O 3.47Å
538	E	72	Confident	71.9	Confident	71 Å²	71	63.5 Å²	63.5	33%	0.332	35%	0.354	S	S	.	.	S	Bend	trans	-67.7	155.9	-172.5	-66.4	-63.9	170	0	0	112.8	K529 Y530 T550	K529-E538 IonicContact NZ-OE1 3.26Å; K529-E538 PolarHBondContact NZ-OE1 3.43Å; K529-E538 IonicContact NZ-OE2 2.59Å; K529-E538 PolarHBondContact NZ-OE2 2.97Å; Y530-E538 PolarHBondContact OH-OE1 3.35Å; E538-T550 PolarHBondContact N-O 3.18Å
539	P	66.7	Low	72	Confident	64 Å²	64	62 Å²	62	42%	0.416	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-49.9	149.4	164.7	-27.3	36.9	0	0	0	112.2	V541 S658	P539-V541 PolarHBondContact O-N 3.13Å; P539-S658 WeakPolarHBondContact CB-OG 3.1Å
540	I	72	Confident	72.3	Confident	9 Å²	9	58.1 Å²	58.1	5%	0.046	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-61.4	130.1	175.5	-174.9	169.3	0	0	0	111.2	A547 V549 F632 I657 S658	I540-A547 HydrophobicContact CD1-CB 3.84Å; I540-A547 HydrophobicContact CG1-CB 4.18Å; I540-V549 HydrophobicContact CB-CG2 4.18Å; I540-V549 HydrophobicContact CD1-CG2 3.73Å; I540-V549 HydrophobicContact CG1-CG2 3.76Å; I540-F632 HydrophobicContact CD1-CB 4.19Å; I540-F632 HydrophobicContact CD1-CD2 3.27Å; I540-F632 HydrophobicContact CD1-CE2 3.86Å; I540-F632 HydrophobicContact CD1-CG 4.1Å; I540-I657 HydrophobicContact CB-CG2 4.03Å; I540-I657 HydrophobicContact CG2-CG2 4.13Å; I540-S658 WeakPolarHBondContact CG2-O 3.32Å
541	V	78.1	Confident	72.9	Confident	91 Å²	91	58.1 Å²	58.1	55%	0.552	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	121.8	173	-178.3	0	0	0	0	108.5	P539 A547 T548	P539-V541 PolarHBondContact O-N 3.13Å; V541-A547 CarbonylContact O-C 3.57Å; V541-A547 WeakPolarHBondContact O-CA 3.37Å; V541-T548 PolarHBondContact N-O 3.41Å; V541-T548 PolarHBondContact O-N 3.05Å
542	C	77.1	Confident	73.9	Confident	29 Å²	29	51.3 Å²	51.3	20%	0.196	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	122.9	177.6	-56.1	0	0	0	0	109.1	C634 W662	C542-C634 HydrophobicContact CB-CB 3.97Å; C542-C634 WeakPolarHBondContact CB-SG 3.38Å; C542-C634 WeakPolarHBondContact SG-CB 3.36Å; C542-C634 CovalentContact SG-SG 2.04Å; C542-C634 PolarHBondContact SG-SG 2.96Å; C542-W662 VanDerWaalsContact C-CH2 3.49Å; C542-W662 HydrophobicContact CB-CH2 4.27Å; C542-W662 HydrophobicContact CB-CZ2 3.44Å; C542-W662 VanDerWaalsContact CB-CZ2 3.44Å; C542-W662 WeakPolarHBondContact O-CH2 3.4Å
543	A	68.8	Low	75.2	Confident	52 Å²	52	46.3 Å²	46.3	43%	0.43	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	148.4	176.4	0	0	0	0	0	111.5	K545 G546 W662	A543-K545 CarbonylContact O-C 3.55Å; A543-K545 PolarHBondContact O-N 2.71Å; A543-G546 PolarHBondContact N-O 3Å; A543-G546 VanDerWaalsContact N-O 3.11Å; A543-G546 CarbonylContact O-C 3.49Å; A543-G546 WeakPolarHBondContact O-CA 3.43Å; A543-G546 PolarHBondContact O-N 3.2Å; A543-W662 VanDerWaalsContact CA-CH2 3.43Å; A543-W662 WeakPolarHBondContact O-CH2 3.46Å; A543-W662 WeakPolarHBondContact O-CZ2 3.33Å
544	D	60.7	Low	76.7	Confident	131 Å²	131	41.6 Å²	41.6	70%	0.701	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-43.3	-21.4	-151.4	-103.3	-4.9	0	0	0	119.6	Y636 W662	D544-Y636 PolarHBondContact O-OH 3.27Å; D544-W662 WeakPolarHBondContact OD1-CZ3 3.31Å
545	K	63.7	Low	77.8	Confident	139 Å²	139	37.5 Å²	37.5	60%	0.604	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-140.7	34.5	176.5	-57.5	-173.8	-180	-175.5	0	112.5	A543 S589 S590	A543-K545 CarbonylContact O-C 3.55Å; A543-K545 PolarHBondContact O-N 2.71Å; K545-S589 CarbonylContact O-C 3.27Å; K545-S589 VanDerWaalsContact O-C 3.26Å; K545-S589 WeakPolarHBondContact O-CA 3.37Å; K545-S590 PolarHBondContact O-N 3.21Å
546	G	74.9	Confident	78.3	Confident	10 Å²	10	35.6 Å²	35.6	10%	0.103	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.4	-177.1	-168.7	0	0	0	0	0	114.6	A543 F588	A543-G546 PolarHBondContact N-O 3Å; A543-G546 VanDerWaalsContact N-O 3.11Å; A543-G546 CarbonylContact O-C 3.49Å; A543-G546 WeakPolarHBondContact O-CA 3.43Å; A543-G546 PolarHBondContact O-N 3.2Å; G546-F588 CarbonylContact C-O 3.6Å; G546-F588 WeakPolarHBondContact CA-O 3.22Å
547	A	79.9	Confident	78.8	Confident	1 Å²	1	37 Å²	37	1%	0.008	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	153.5	175.8	0	0	0	0	0	111.5	I540 V541 S587 F588 C634	I540-A547 HydrophobicContact CD1-CB 3.84Å; I540-A547 HydrophobicContact CG1-CB 4.18Å; V541-A547 CarbonylContact O-C 3.57Å; V541-A547 WeakPolarHBondContact O-CA 3.37Å; A547-S587 WeakPolarHBondContact O-CA 3.05Å; A547-S587 WeakPolarHBondContact O-CB 3.44Å; A547-F588 HydrophobicContact CB-CD1 4.29Å; A547-F588 HydrophobicContact CB-CE1 3.66Å; A547-F588 HydrophobicContact CB-CE2 4.42Å; A547-F588 HydrophobicContact CB-CZ 3.71Å; A547-F588 PolarHBondContact N-O 3.45Å; A547-F588 PolarHBondContact O-N 3.49Å; A547-C634 WeakPolarHBondContact CB-SG 3.23Å
548	T	86.1	Confident	79.1	Confident	44 Å²	44	39.8 Å²	39.8	27%	0.27	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.8	-179.4	-56.6	0	0	0	0	109.3	V541 T585 F586	V541-T548 PolarHBondContact N-O 3.41Å; V541-T548 PolarHBondContact O-N 3.05Å; T548-T585 HydrophobicContact CG2-CG2 3.39Å; T548-F586 CarbonylContact C-O 3.48Å; T548-F586 WeakPolarHBondContact CA-O 3.48Å
549	V	83.4	Confident	79.2	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.3	174.2	179.8	0	0	0	0	107.8	I540 L551 T585 F586 I611 F632 I657	I540-V549 HydrophobicContact CB-CG2 4.18Å; I540-V549 HydrophobicContact CD1-CG2 3.73Å; I540-V549 HydrophobicContact CG1-CG2 3.76Å; V549-L551 HydrophobicContact CG1-CD2 3.8Å; V549-L551 HydrophobicContact CG1-CG 4.3Å; V549-T585 WeakPolarHBondContact O-CA 3.47Å; V549-F586 PolarHBondContact N-O 2.89Å; V549-F586 PolarHBondContact O-N 3.01Å; V549-I611 HydrophobicContact CB-CD1 4.41Å; V549-I611 HydrophobicContact CG1-CD1 3.93Å; V549-F632 HydrophobicContact CG2-CD1 4.13Å; V549-F632 HydrophobicContact CG2-CD2 3.77Å; V549-F632 HydrophobicContact CG2-CE1 4.15Å; V549-F632 HydrophobicContact CG2-CE2 3.7Å; V549-F632 HydrophobicContact CG2-CG 3.91Å; V549-F632 HydrophobicContact CG2-CZ 3.9Å; V549-I657 HydrophobicContact CG1-CD1 4.4Å
550	T	85.4	Confident	79.6	Confident	33 Å²	33	42.2 Å²	42.2	20%	0.202	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	112	-175.8	-61.4	0	0	0	0	109.9	E538 M583 V584 T585	E538-T550 PolarHBondContact N-O 3.18Å; T550-M583 HydrophobicContact CG2-CB 3.68Å; T550-M583 HydrophobicContact CG2-CE 3.84Å; T550-M583 HydrophobicContact CG2-CG 4.28Å; T550-V584 WeakPolarHBondContact CA-O 3.21Å; T550-T585 PolarHBondContact OG1-OG1 3.11Å
551	L	85.4	Confident	79.8	Confident	5 Å²	5	43 Å²	43	3%	0.026	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	148.7	-178	-52.1	-174	0	0	0	110.1	F536 V549 L556 M583 V584 F586 I611 M630	F536-L551 HydrophobicContact CB-CD1 4.48Å; F536-L551 HydrophobicContact CB-CD2 4.06Å; F536-L551 CarbonylContact O-C 3.58Å; F536-L551 WeakPolarHBondContact O-CA 3.46Å; V549-L551 HydrophobicContact CG1-CD2 3.8Å; V549-L551 HydrophobicContact CG1-CG 4.3Å; L551-L556 HydrophobicContact CB-CD1 4.19Å; L551-L556 HydrophobicContact CD1-CD1 4.24Å; L551-L556 HydrophobicContact CD1-CD2 4.2Å; L551-M583 CarbonylContact O-C 3.53Å; L551-M583 VanDerWaalsContact O-CA 3.32Å; L551-M583 WeakPolarHBondContact O-CA 3.43Å; L551-V584 PolarHBondContact N-O 2.07Å; L551-V584 PolarHBondContact O-N 3.26Å; L551-F586 HydrophobicContact CD1-CE2 4.14Å; L551-I611 HydrophobicContact CD1-CD1 3.85Å; L551-I611 HydrophobicContact CG-CD1 4.46Å; L551-M630 HydrophobicContact CD1-SD 4.29Å
552	A	89.9	Confident	80.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	127.8	171.8	0	0	0	0	0	109.9	F526 F536 C554 L555 L556 M583	F526-A552 HydrophobicContact CE1-CB 3.55Å; F526-A552 HydrophobicContact CZ-CB 3.79Å; F536-A552 PolarHBondContact O-N 3.35Å; A552-C554 PolarHBondContact O-N 2.82Å; A552-L555 HydrophobicContact CB-CB 4.39Å; A552-L555 HydrophobicContact CB-CD1 4.01Å; A552-L555 HydrophobicContact CB-CG 4.1Å; A552-L555 PolarHBondContact O-N 3.17Å; A552-L556 PolarHBondContact O-N 3.04Å; A552-M583 HydrophobicContact CB-CE 3.95Å; A552-M583 HydrophobicContact CB-SD 3.8Å
553	N	91.3	Very high	80.5	Confident	9 Å²	9	43.6 Å²	43.6	5%	0.048	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-44.3	-175.1	-173.4	57.7	0	0	0	111.9	L555 L556 E557 Y563 L577 H582 V584	N553-L555 PolarHBondContact O-N 3.2Å; N553-L555 VanDerWaalsContact O-N 3.12Å; N553-L556 WeakPolarHBondContact O-CB 3.05Å; N553-L556 PolarHBondContact O-N 3.24Å; N553-E557 PolarHBondContact ND2-OE1 3.37Å; N553-E557 PolarHBondContact O-N 3.05Å; N553-Y563 VanDerWaalsContact OD1-CD1 3.29Å; N553-Y563 WeakPolarHBondContact OD1-CD1 3.41Å; N553-L577 HydrophobicContact CB-CD1 4.03Å; N553-H582 VanDerWaalsContact CB-O 3.32Å; N553-H582 WeakPolarHBondContact CB-O 3.31Å; N553-H582 PolarHBondContact N-O 3Å; N553-H582 VanDerWaalsContact N-O 3.1Å; N553-V584 HydrophobicContact CB-CG2 4.06Å
554	C	91.3	Very high	81.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-57.5	-29.2	177.7	66.9	0	0	0	0	114.2	E507 C522 A552 D558	E507-C554 HydrophobicContact CG-CB 3.99Å; E507-C554 VanDerWaalsContact OE1-CB 3.31Å; E507-C554 WeakPolarHBondContact OE1-CB 3Å; C522-C554 WeakPolarHBondContact CA-SG 3.44Å; C522-C554 HydrophobicContact CB-CB 4.06Å; C522-C554 WeakPolarHBondContact CB-SG 3.45Å; C522-C554 WeakPolarHBondContact SG-CB 3.47Å; C522-C554 CovalentContact SG-SG 2.03Å; C522-C554 PolarHBondContact SG-SG 3.15Å; A552-C554 PolarHBondContact O-N 2.82Å; C554-D558 VanDerWaalsContact O-CB 3.3Å; C554-D558 WeakPolarHBondContact O-CB 3.03Å; C554-D558 VanDerWaalsContact O-CG 3.3Å; C554-D558 PolarHBondContact O-N 3.26Å
555	L	84.6	Confident	82.6	Confident	19 Å²	19	38.5 Å²	38.5	10%	0.099	21%	0.212	C	C	.	.	H	α-helix	trans	-75	-31	178.2	-71.4	177.6	0	0	0	111.6	C522 F526 A527 Y530 F536 A552 N553	C522-L555 HydrophobicContact CB-CD2 4.31Å; C522-L555 WeakPolarHBondContact SG-CD2 3.08Å; C522-L555 WeakPolarHBondContact SG-CG 3.29Å; C522-L555 PolarHBondContact SG-N 3.06Å; F526-L555 HydrophobicContact CE1-CD1 4.39Å; A527-L555 HydrophobicContact CB-CD2 4.09Å; Y530-L555 HydrophobicContact CD2-CD1 3.55Å; Y530-L555 HydrophobicContact CE2-CD1 4.21Å; Y530-L555 HydrophobicContact CG-CD1 3.86Å; F536-L555 HydrophobicContact CD1-CB 4.06Å; F536-L555 WeakPolarHBondContact CD1-O 3.33Å; F536-L555 WeakPolarHBondContact CE1-O 3.47Å; A552-L555 HydrophobicContact CB-CB 4.39Å; A552-L555 HydrophobicContact CB-CD1 4.01Å; A552-L555 HydrophobicContact CB-CG 4.1Å; A552-L555 PolarHBondContact O-N 3.17Å; N553-L555 PolarHBondContact O-N 3.2Å; N553-L555 VanDerWaalsContact O-N 3.12Å
556	L	82.3	Confident	83.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-71.3	-47.4	172.9	-63.8	170.4	0	0	0	109.9	F536 L551 A552 N553 D558 K559 G560 I561 L566 M630	F536-L556 HydrophobicContact CB-CD2 4.16Å; F536-L556 HydrophobicContact CD1-CD2 3.64Å; F536-L556 HydrophobicContact CD1-CG 4.28Å; F536-L556 HydrophobicContact CE1-CD2 4.14Å; F536-L556 HydrophobicContact CG-CD2 3.93Å; L551-L556 HydrophobicContact CB-CD1 4.19Å; L551-L556 HydrophobicContact CD1-CD1 4.24Å; L551-L556 HydrophobicContact CD1-CD2 4.2Å; A552-L556 PolarHBondContact O-N 3.04Å; N553-L556 WeakPolarHBondContact O-CB 3.05Å; N553-L556 PolarHBondContact O-N 3.24Å; L556-D558 PolarHBondContact O-N 2.82Å; L556-K559 CarbonylContact O-C 3.54Å; L556-K559 WeakPolarHBondContact O-CA 3.22Å; L556-K559 PolarHBondContact O-N 3.01Å; L556-G560 PolarHBondContact O-N 3.27Å; L556-I561 CarbonylContact C-O 3.5Å; L556-I561 HydrophobicContact CB-CB 4.1Å; L556-I561 HydrophobicContact CB-CG2 4.39Å; L556-I561 WeakPolarHBondContact CB-O 3.47Å; L556-I561 HydrophobicContact CD2-CB 4.39Å; L556-I561 HydrophobicContact CD2-CD1 4.33Å; L556-I561 HydrophobicContact CD2-CG2 4.18Å; L556-I561 WeakPolarHBondContact O-CB 3.49Å; L556-I561 PolarHBondContact O-N 3.39Å; L556-L566 HydrophobicContact CD1-CD1 4.26Å; L556-L566 HydrophobicContact CD2-CD1 4.5Å; L556-M630 HydrophobicContact CD2-CE 4.08Å
557	E	86.2	Confident	84.2	Confident	62 Å²	62	31.6 Å²	31.6	29%	0.29	18%	0.179	S	C	.	.	H	α-helix	trans	-63	-38.4	177.4	-68	-176	-177	0	0	113.2	R519 N553 K559 G560	R519-E557 VanDerWaalsContact NH1-CB 3.34Å; R519-E557 IonicContact NH1-OE2 3.08Å; R519-E557 PolarHBondContact NH1-OE2 3.18Å; N553-E557 PolarHBondContact ND2-OE1 3.37Å; N553-E557 PolarHBondContact O-N 3.05Å; E557-K559 PolarHBondContact O-N 3.03Å; E557-G560 PolarHBondContact O-N 2.9Å
558	D	80.5	Confident	84.6	Confident	66 Å²	66	31.6 Å²	31.6	35%	0.353	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-7.7	173.1	-80.6	-3	0	0	0	113.2	R519 H521 C554 L556	R519-D558 IonicContact CZ-OD1 2.78Å; R519-D558 VanDerWaalsContact CZ-OD1 3.28Å; R519-D558 IonicContact NH1-OD1 3.59Å; R519-D558 PolarHBondContact NH1-OD1 3.49Å; R519-D558 IonicContact NH2-OD1 2.7Å; R519-D558 PolarHBondContact NH2-OD1 3.08Å; H521-D558 IonicContact ND1-OD1 2.7Å; H521-D558 PolarHBondContact ND1-OD1 3.15Å; C554-D558 VanDerWaalsContact O-CB 3.3Å; C554-D558 WeakPolarHBondContact O-CB 3.03Å; C554-D558 VanDerWaalsContact O-CG 3.3Å; C554-D558 PolarHBondContact O-N 3.26Å; L556-D558 PolarHBondContact O-N 2.82Å
559	K	74.9	Confident	84.6	Confident	122 Å²	122	32.3 Å²	32.3	53%	0.53	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	7.1	168.1	-63.5	-59.7	-169.8	173.8	0	113.8	F536 L556 E557 I561	F536-K559 HydrophobicContact CE1-CB 4.12Å; F536-K559 HydrophobicContact CE1-CG 3.57Å; F536-K559 HydrophobicContact CZ-CB 4.45Å; F536-K559 HydrophobicContact CZ-CG 3.9Å; L556-K559 CarbonylContact O-C 3.54Å; L556-K559 WeakPolarHBondContact O-CA 3.22Å; L556-K559 PolarHBondContact O-N 3.01Å; E557-K559 PolarHBondContact O-N 3.03Å; K559-I561 VanDerWaalsContact C-N 3.31Å; K559-I561 HydrophobicContact CB-CD1 4.03Å; K559-I561 HydrophobicContact CB-CG1 4.17Å
560	G	74.8	Confident	84.8	Confident	65 Å²	65	35.3 Å²	35.3	67%	0.67	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.5	21.3	-177.3	0	0	0	0	0	114.4	L556 E557	L556-G560 PolarHBondContact O-N 3.27Å; E557-G560 PolarHBondContact O-N 2.9Å
561	I	76.8	Confident	84.8	Confident	24 Å²	24	39 Å²	39	12%	0.123	21%	0.212	C	C	.	.			trans	-97.5	110.2	179.9	-57	169.5	0	0	0	109	F536 L556 K559 L566 V628	F536-I561 HydrophobicContact CE1-CD1 4.21Å; F536-I561 HydrophobicContact CZ-CD1 4.06Å; L556-I561 CarbonylContact C-O 3.5Å; L556-I561 HydrophobicContact CB-CB 4.1Å; L556-I561 HydrophobicContact CB-CG2 4.39Å; L556-I561 WeakPolarHBondContact CB-O 3.47Å; L556-I561 HydrophobicContact CD2-CB 4.39Å; L556-I561 HydrophobicContact CD2-CD1 4.33Å; L556-I561 HydrophobicContact CD2-CG2 4.18Å; L556-I561 WeakPolarHBondContact O-CB 3.49Å; L556-I561 PolarHBondContact O-N 3.39Å; K559-I561 VanDerWaalsContact C-N 3.31Å; K559-I561 HydrophobicContact CB-CD1 4.03Å; K559-I561 HydrophobicContact CB-CG1 4.17Å; I561-L566 HydrophobicContact CG2-CD1 4.03Å; I561-L566 HydrophobicContact CG2-CD2 4.14Å; I561-L566 HydrophobicContact CG2-CG 4.34Å; I561-V628 HydrophobicContact CD1-CG2 3.79Å; I561-V628 HydrophobicContact CG1-CG2 3.9Å; I561-V628 HydrophobicContact CG2-CG2 3.97Å
562	D	83.4	Confident	85	Confident	68 Å²	68	43 Å²	43	36%	0.364	24%	0.241	S	C	.	.			trans	-71.2	127.3	165.5	173.1	15.7	0	0	0	109.7	S564 V565	D562-S564 VanDerWaalsContact C-N 3.26Å; D562-S564 VanDerWaalsContact CG-OG 3.3Å; D562-S564 PolarHBondContact O-N 2.89Å; D562-S564 VanDerWaalsContact OD1-CB 3.27Å; D562-S564 WeakPolarHBondContact OD1-CB 3.42Å; D562-S564 PolarHBondContact OD1-N 3.37Å; D562-S564 PolarHBondContact OD1-OG 3.45Å; D562-S564 WeakPolarHBondContact OD2-CB 3.47Å; D562-S564 PolarHBondContact OD2-OG 3.41Å; D562-V565 HydrophobicContact CB-CG2 4.39Å; D562-V565 WeakPolarHBondContact O-CG2 3.5Å
563	Y	87	Confident	85	Confident	65 Å²	65	43.7 Å²	43.7	26%	0.255	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-68.4	-24.8	177.4	83.6	-87.2	0	0	0	112.8	N553 V565 L566 L577 V584	N553-Y563 VanDerWaalsContact OD1-CD1 3.29Å; N553-Y563 WeakPolarHBondContact OD1-CD1 3.41Å; Y563-V565 PolarHBondContact O-N 2.66Å; Y563-L566 WeakPolarHBondContact O-CB 3.3Å; Y563-L566 PolarHBondContact O-N 2.91Å; Y563-L577 HydrophobicContact CD2-CB 4.49Å; Y563-L577 HydrophobicContact CE1-CB 4.34Å; Y563-L577 HydrophobicContact CE1-CD2 3.95Å; Y563-L577 HydrophobicContact CE2-CB 3.75Å; Y563-V584 HydrophobicContact CD1-CG2 4.36Å; Y563-V584 HydrophobicContact CD2-CG1 3.85Å; Y563-V584 HydrophobicContact CD2-CG2 3.97Å; Y563-V584 HydrophobicContact CG-CG1 4.28Å; Y563-V584 HydrophobicContact CG-CG2 3.77Å
564	S	88.8	Confident	85.1	Confident	48 Å²	48	49.1 Å²	49.1	34%	0.336	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-65.6	-26.2	-172.8	92	0	0	0	0	113.3	D562 R574	D562-S564 VanDerWaalsContact C-N 3.26Å; D562-S564 VanDerWaalsContact CG-OG 3.3Å; D562-S564 PolarHBondContact O-N 2.89Å; D562-S564 VanDerWaalsContact OD1-CB 3.27Å; D562-S564 WeakPolarHBondContact OD1-CB 3.42Å; D562-S564 PolarHBondContact OD1-N 3.37Å; D562-S564 PolarHBondContact OD1-OG 3.45Å; D562-S564 WeakPolarHBondContact OD2-CB 3.47Å; D562-S564 PolarHBondContact OD2-OG 3.41Å; S564-R574 PolarHBondContact O-NH1 2.81Å
565	V	83.4	Confident	85	Confident	29 Å²	29	49.7 Å²	49.7	18%	0.176	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-89	-3.3	177.9	-61.6	0	0	0	0	113.7	D562 Y563 T613 Q614	D562-V565 HydrophobicContact CB-CG2 4.39Å; D562-V565 WeakPolarHBondContact O-CG2 3.5Å; Y563-V565 PolarHBondContact O-N 2.66Å; V565-T613 HydrophobicContact CG2-CG2 4.11Å; V565-Q614 PolarHBondContact O-N 3.47Å
566	L	84	Confident	85.4	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	137.5	-179.7	-59.1	-178.4	0	0	0	112.1	L556 I561 Y563 F586 I611 M612 T613 V628	L556-L566 HydrophobicContact CD1-CD1 4.26Å; L556-L566 HydrophobicContact CD2-CD1 4.5Å; I561-L566 HydrophobicContact CG2-CD1 4.03Å; I561-L566 HydrophobicContact CG2-CD2 4.14Å; I561-L566 HydrophobicContact CG2-CG 4.34Å; Y563-L566 WeakPolarHBondContact O-CB 3.3Å; Y563-L566 PolarHBondContact O-N 2.91Å; L566-F586 HydrophobicContact CB-CE1 3.93Å; L566-F586 HydrophobicContact CB-CZ 3.64Å; L566-F586 HydrophobicContact CD1-CZ 4.14Å; L566-I611 HydrophobicContact CB-CG2 3.91Å; L566-I611 HydrophobicContact CD1-CG2 4.15Å; L566-I611 HydrophobicContact CD2-CG2 4.39Å; L566-I611 HydrophobicContact CG-CG2 4.39Å; L566-M612 WeakPolarHBondContact CA-O 3.49Å; L566-T613 HydrophobicContact CD2-CG2 3.85Å; L566-V628 HydrophobicContact CD2-CB 4.13Å; L566-V628 HydrophobicContact CD2-CG1 4.14Å; L566-V628 HydrophobicContact CD2-CG2 4.44Å
567	H	88.8	Confident	85.8	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.019	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	164.8	176.6	61.4	84.9	0	0	0	111.6	C573 R574 I611 M612 Q614	H567-C573 CarbonylContact C-O 3.57Å; H567-C573 WeakPolarHBondContact CA-O 3.42Å; H567-R574 HydrophobicContact CB-CG 4.29Å; H567-I611 CarbonylContact O-C 3.52Å; H567-I611 WeakPolarHBondContact O-CA 3.45Å; H567-M612 PolarHBondContact CD2-O 2.88Å; H567-M612 WeakPolarHBondContact CE1-CG 3.41Å; H567-M612 PolarHBondContact N-O 2.94Å; H567-M612 PolarHBondContact O-N 3.02Å; H567-Q614 WeakPolarHBondContact NE2-CA 3.42Å; H567-Q614 PolarHBondContact NE2-N 3.09Å
568	L	88.2	Confident	86	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	31%	0.314	C	S	.	.			trans	-76.1	-175.8	171	-65.6	-174.4	0	0	0	111.5	D570 C573 F586 S587 F588 C594 A610 I611 F632	L568-D570 CarbonylContact O-C 3.55Å; L568-D570 PolarHBondContact O-N 2.89Å; L568-C573 HydrophobicContact CB-CB 4.06Å; L568-C573 HydrophobicContact CD1-CB 4.21Å; L568-C573 HydrophobicContact CG-CB 4.31Å; L568-C573 PolarHBondContact N-O 3.09Å; L568-F586 HydrophobicContact CD2-CB 4.04Å; L568-F586 HydrophobicContact CD2-CD1 4.11Å; L568-F586 HydrophobicContact CD2-CG 4.42Å; L568-F586 HydrophobicContact CG-CB 4.42Å; L568-F586 HydrophobicContact CG-CD1 4.26Å; L568-S587 WeakPolarHBondContact CD1-O 3.22Å; L568-F588 HydrophobicContact CD1-CB 4.37Å; L568-C594 HydrophobicContact CB-CB 4.1Å; L568-C594 HydrophobicContact CD1-CB 3.62Å; L568-C594 HydrophobicContact CG-CB 4.49Å; L568-A610 CarbonylContact C-O 3.47Å; L568-A610 WeakPolarHBondContact CA-O 3.46Å; L568-I611 HydrophobicContact CD2-CG1 4.06Å; L568-F632 HydrophobicContact CD2-CE1 3.59Å; L568-F632 HydrophobicContact CD2-CZ 3.55Å
569	N	85.8	Confident	86.3	Confident	58 Å²	58	61 Å²	61	31%	0.31	33%	0.329	S	S	.	.	S	Bend	trans	-49.6	-32.9	174.6	-74.2	-12.7	0	0	0	113.2	G595 N609 A610 M612	N569-G595 VanDerWaalsContact CB-O 3.28Å; N569-G595 WeakPolarHBondContact CB-O 3.4Å; N569-G595 PolarHBondContact ND2-O 3.4Å; N569-N609 WeakPolarHBondContact CB-OD1 3Å; N569-N609 PolarHBondContact N-OD1 2.83Å; N569-N609 PolarHBondContact ND2-OD1 2.71Å; N569-A610 PolarHBondContact N-O 3.48Å; N569-M612 WeakPolarHBondContact OD1-CE 3.37Å
570	D	87.3	Confident	86.6	Confident	64 Å²	64	60.5 Å²	60.5	34%	0.342	33%	0.331	S	S	.	.	S	Bend	trans	-89.4	123.9	165.4	-168.7	-43.2	0	0	0	111.4	L568 S572 C573 C594	L568-D570 CarbonylContact O-C 3.55Å; L568-D570 PolarHBondContact O-N 2.89Å; D570-S572 VanDerWaalsContact CG-OG 3.3Å; D570-S572 PolarHBondContact O-N 2.9Å; D570-S572 VanDerWaalsContact OD1-CB 3.32Å; D570-S572 WeakPolarHBondContact OD1-CB 3.31Å; D570-S572 PolarHBondContact OD1-N 3.26Å; D570-S572 PolarHBondContact OD1-OG 3.3Å; D570-C573 PolarHBondContact O-N 2.03Å; D570-C573 VanDerWaalsContact O-N 3.07Å; D570-C594 VanDerWaalsContact CB-C 3.41Å; D570-C594 HydrophobicContact CB-CB 4.46Å; D570-C594 PolarHBondContact N-O 3.25Å; D570-C594 VanDerWaalsContact N-O 3.13Å
571	Q	86.5	Confident	87.1	Confident	110 Å²	110	60.2 Å²	60.2	51%	0.514	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.8	-178.5	-66.6	-174.4	-3.2	0	0	114.7	C573	Q571-C573 VanDerWaalsContact C-N 3.34Å
572	S	88.8	Confident	87.8	Confident	89 Å²	89	60.1 Å²	60.1	62%	0.622	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-25.5	174.3	67.3	0	0	0	0	112.4	D570 R574	D570-S572 VanDerWaalsContact CG-OG 3.3Å; D570-S572 PolarHBondContact O-N 2.9Å; D570-S572 VanDerWaalsContact OD1-CB 3.32Å; D570-S572 WeakPolarHBondContact OD1-CB 3.31Å; D570-S572 PolarHBondContact OD1-N 3.26Å; D570-S572 PolarHBondContact OD1-OG 3.3Å; S572-R574 PolarHBondContact O-N 2.73Å
573	C	91.3	Very high	88.1	Confident	14 Å²	14	58 Å²	58	10%	0.095	30%	0.303	C	S	.	.			trans	-88.2	83.8	179.8	-64.8	0	0	0	0	111.2	H567 L568 D570 Q571 C594	H567-C573 CarbonylContact C-O 3.57Å; H567-C573 WeakPolarHBondContact CA-O 3.42Å; L568-C573 HydrophobicContact CB-CB 4.06Å; L568-C573 HydrophobicContact CD1-CB 4.21Å; L568-C573 HydrophobicContact CG-CB 4.31Å; L568-C573 PolarHBondContact N-O 3.09Å; D570-C573 PolarHBondContact O-N 2.03Å; D570-C573 VanDerWaalsContact O-N 3.07Å; Q571-C573 VanDerWaalsContact C-N 3.34Å; C573-C594 HydrophobicContact CB-CB 3.53Å; C573-C594 WeakPolarHBondContact CB-SG 3.38Å; C573-C594 WeakPolarHBondContact SG-CA 3.21Å; C573-C594 WeakPolarHBondContact SG-CB 3.46Å; C573-C594 CovalentContact SG-SG 2.04Å; C573-C594 PolarHBondContact SG-SG 3.39Å
574	R	91.6	Very high	88.3	Confident	124 Å²	124	54.9 Å²	54.9	47%	0.468	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-88.6	161.6	175.4	-61.3	-164.3	-174	-153.2	11.6	112.9	S564 H567 S572 Q614	S564-R574 PolarHBondContact O-NH1 2.81Å; H567-R574 HydrophobicContact CB-CG 4.29Å; S572-R574 PolarHBondContact O-N 2.73Å; R574-Q614 VanDerWaalsContact NH2-NE2 3.14Å
575	G	89.4	Confident	88.4	Confident	11 Å²	11	54.7 Å²	54.7	11%	0.113	29%	0.288	C	S	.	.			trans	-67.5	139.1	172.8	0	0	0	0	0	112
576	Q	93.2	Very high	88.7	Confident	152 Å²	152	53.4 Å²	53.4	71%	0.71	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	118.7	175.7	-64.1	-175.5	-6.1	0	0	109.5	V584 T585	Q576-V584 CarbonylContact O-C 3.54Å; Q576-V584 WeakPolarHBondContact O-CA 3.36Å; Q576-T585 PolarHBondContact N-O 3.33Å; Q576-T585 PolarHBondContact O-N 3.49Å
577	L	92.3	Very high	88.9	Confident	44 Å²	44	56.6 Å²	56.6	23%	0.23	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	127.3	172.8	179.9	69.1	0	0	0	109.9	N553 Y563 V584	N553-L577 HydrophobicContact CB-CD1 4.03Å; Y563-L577 HydrophobicContact CD2-CB 4.49Å; Y563-L577 HydrophobicContact CE1-CB 4.34Å; Y563-L577 HydrophobicContact CE1-CD2 3.95Å; Y563-L577 HydrophobicContact CE2-CB 3.75Å; L577-V584 HydrophobicContact CB-CG2 4.48Å; L577-V584 HydrophobicContact CD1-CG2 3.77Å
578	D	89.9	Confident	88.9	Confident	68 Å²	68	57.1 Å²	57.1	36%	0.364	30%	0.304	S	S	.	.			trans	-83.8	112.5	165	175.9	-11.4	0	0	0	109.2	L580 T581 H582 M583	D578-L580 PolarHBondContact O-N 2.93Å; D578-L580 WeakPolarHBondContact OD1-CA 3.02Å; D578-L580 WeakPolarHBondContact OD1-CB 3.34Å; D578-L580 PolarHBondContact OD1-N 2.65Å; D578-T581 VanDerWaalsContact CB-OG1 3.3Å; D578-T581 WeakPolarHBondContact CB-OG1 3.26Å; D578-T581 PolarHBondContact OD1-N 3.06Å; D578-T581 VanDerWaalsContact OD1-N 3.14Å; D578-T581 WeakPolarHBondContact OD2-CB 3.39Å; D578-T581 VanDerWaalsContact OD2-CG2 3.23Å; D578-T581 WeakPolarHBondContact OD2-CG2 3.17Å; D578-T581 PolarHBondContact OD2-OG1 3.28Å; D578-H582 VanDerWaalsContact O-CA 3.23Å; D578-H582 WeakPolarHBondContact O-CA 3.02Å; D578-H582 PolarHBondContact O-N 2.87Å; D578-M583 PolarHBondContact N-O 3.32Å
579	N	85.8	Confident	88.7	Confident	122 Å²	122	59.1 Å²	59.1	65%	0.652	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-6.9	-178.6	-66.6	-18.7	0	0	0	114.3	F502	F502-N579 WeakPolarHBondContact CD1-O 3.36Å; F502-N579 VanDerWaalsContact CE1-O 3.31Å; F502-N579 WeakPolarHBondContact CE1-O 3.11Å
580	L	82.8	Confident	88.1	Confident	110 Å²	110	58 Å²	58	58%	0.576	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-43	175.9	-168.5	78.2	0	0	0	111.9	F502 D578	F502-L580 HydrophobicContact CE1-CD1 4.5Å; F502-L580 WeakPolarHBondContact CE1-O 3.31Å; F502-L580 HydrophobicContact CZ-CD1 4.28Å; D578-L580 PolarHBondContact O-N 2.93Å; D578-L580 WeakPolarHBondContact OD1-CA 3.02Å; D578-L580 WeakPolarHBondContact OD1-CB 3.34Å; D578-L580 PolarHBondContact OD1-N 2.65Å
581	T	85.3	Confident	87.6	Confident	59 Å²	59	64 Å²	64	36%	0.362	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-16.5	179.6	64.9	0	0	0	0	113.6	H506 D578 M583	H506-T581 PolarHBondContact CE1-O 2.88Å; H506-T581 PolarHBondContact ND1-O 3.25Å; D578-T581 VanDerWaalsContact CB-OG1 3.3Å; D578-T581 WeakPolarHBondContact CB-OG1 3.26Å; D578-T581 PolarHBondContact OD1-N 3.06Å; D578-T581 VanDerWaalsContact OD1-N 3.14Å; D578-T581 WeakPolarHBondContact OD2-CB 3.39Å; D578-T581 VanDerWaalsContact OD2-CG2 3.23Å; D578-T581 WeakPolarHBondContact OD2-CG2 3.17Å; D578-T581 PolarHBondContact OD2-OG1 3.28Å; T581-M583 PolarHBondContact O-N 2.98Å
582	H	90.3	Very high	87.5	Confident	23 Å²	23	63 Å²	63	11%	0.106	34%	0.339	C	S	.	.			trans	58.7	26.4	-172.5	-79.8	-153.4	0	0	0	114.2	F502 E507 N553 D578	F502-H582 AromaticContact CD1-NE2 3.53Å; F502-H582 PolarHBondContact O-CE1 2.92Å; E507-H582 IonicContact OE1-ND1 2.73Å; E507-H582 WeakPolarHBondContact OE2-CB 3.35Å; E507-H582 IonicContact OE2-CE1 2.67Å; E507-H582 IonicContact OE2-CG 2.75Å; E507-H582 IonicContact OE2-ND1 3.78Å; E507-H582 PolarHBondContact OE2-ND1 3.37Å; N553-H582 VanDerWaalsContact CB-O 3.32Å; N553-H582 WeakPolarHBondContact CB-O 3.31Å; N553-H582 PolarHBondContact N-O 3Å; N553-H582 VanDerWaalsContact N-O 3.1Å; D578-H582 VanDerWaalsContact O-CA 3.23Å; D578-H582 WeakPolarHBondContact O-CA 3.02Å; D578-H582 PolarHBondContact O-N 2.87Å
583	M	89	Confident	87.2	Confident	22 Å²	22	61.1 Å²	61.1	11%	0.108	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	139	173.7	-54.8	-62.7	-69.9	0	0	110.6	H506 F526 T550 L551 A552 D578 T581	H506-M583 VanDerWaalsContact CE1-SD 3.56Å; F526-M583 HydrophobicContact CZ-CE 4.42Å; F526-M583 HydrophobicContact CZ-SD 4.26Å; T550-M583 HydrophobicContact CG2-CB 3.68Å; T550-M583 HydrophobicContact CG2-CE 3.84Å; T550-M583 HydrophobicContact CG2-CG 4.28Å; L551-M583 CarbonylContact O-C 3.53Å; L551-M583 VanDerWaalsContact O-CA 3.32Å; L551-M583 WeakPolarHBondContact O-CA 3.43Å; A552-M583 HydrophobicContact CB-CE 3.95Å; A552-M583 HydrophobicContact CB-SD 3.8Å; D578-M583 PolarHBondContact N-O 3.32Å; T581-M583 PolarHBondContact O-N 2.98Å
584	V	91.5	Very high	87.1	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	118.2	174.8	-174.2	0	0	0	0	109.1	T550 L551 N553 Y563 Q576 L577 F586	T550-V584 WeakPolarHBondContact CA-O 3.21Å; L551-V584 PolarHBondContact N-O 2.07Å; L551-V584 PolarHBondContact O-N 3.26Å; N553-V584 HydrophobicContact CB-CG2 4.06Å; Y563-V584 HydrophobicContact CD1-CG2 4.36Å; Y563-V584 HydrophobicContact CD2-CG1 3.85Å; Y563-V584 HydrophobicContact CD2-CG2 3.97Å; Y563-V584 HydrophobicContact CG-CG1 4.28Å; Y563-V584 HydrophobicContact CG-CG2 3.77Å; Q576-V584 CarbonylContact O-C 3.54Å; Q576-V584 WeakPolarHBondContact O-CA 3.36Å; L577-V584 HydrophobicContact CB-CG2 4.48Å; L577-V584 HydrophobicContact CD1-CG2 3.77Å; V584-F586 HydrophobicContact CB-CE2 4.48Å; V584-F586 HydrophobicContact CG1-CD2 4.36Å; V584-F586 HydrophobicContact CG1-CE2 3.62Å; V584-F586 HydrophobicContact CG1-CZ 4.06Å
585	T	90.9	Very high	86.8	Confident	44 Å²	44	56 Å²	56	27%	0.27	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	132.4	-178.6	-63.4	0	0	0	0	111.8	T548 V549 T550 Q576	T548-T585 HydrophobicContact CG2-CG2 3.39Å; V549-T585 WeakPolarHBondContact O-CA 3.47Å; T550-T585 PolarHBondContact OG1-OG1 3.11Å; Q576-T585 PolarHBondContact N-O 3.33Å; Q576-T585 PolarHBondContact O-N 3.49Å
586	F	90.3	Very high	86.5	Confident	2 Å²	2	56 Å²	56	1%	0.009	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	136.3	169.2	-60.5	-102.3	0	0	0	108.2	T548 V549 L551 L566 L568 V584 I611	T548-F586 CarbonylContact C-O 3.48Å; T548-F586 WeakPolarHBondContact CA-O 3.48Å; V549-F586 PolarHBondContact N-O 2.89Å; V549-F586 PolarHBondContact O-N 3.01Å; L551-F586 HydrophobicContact CD1-CE2 4.14Å; L566-F586 HydrophobicContact CB-CE1 3.93Å; L566-F586 HydrophobicContact CB-CZ 3.64Å; L566-F586 HydrophobicContact CD1-CZ 4.14Å; L568-F586 HydrophobicContact CD2-CB 4.04Å; L568-F586 HydrophobicContact CD2-CD1 4.11Å; L568-F586 HydrophobicContact CD2-CG 4.42Å; L568-F586 HydrophobicContact CG-CB 4.42Å; L568-F586 HydrophobicContact CG-CD1 4.26Å; V584-F586 HydrophobicContact CB-CE2 4.48Å; V584-F586 HydrophobicContact CG1-CD2 4.36Å; V584-F586 HydrophobicContact CG1-CE2 3.62Å; V584-F586 HydrophobicContact CG1-CZ 4.06Å; F586-I611 HydrophobicContact CB-CD1 4.46Å; F586-I611 HydrophobicContact CD1-CD1 4.45Å; F586-I611 HydrophobicContact CD1-CG1 4.37Å; F586-I611 HydrophobicContact CD1-CG2 4.34Å; F586-I611 HydrophobicContact CD2-CD1 3.62Å; F586-I611 HydrophobicContact CD2-CG1 4.39Å; F586-I611 HydrophobicContact CE1-CG2 3.8Å; F586-I611 HydrophobicContact CE2-CD1 3.91Å; F586-I611 HydrophobicContact CE2-CG2 4.25Å; F586-I611 HydrophobicContact CG-CD1 3.94Å; F586-I611 HydrophobicContact CG-CG1 4.25Å; F586-I611 HydrophobicContact CZ-CD1 4.43Å; F586-I611 HydrophobicContact CZ-CG2 3.76Å
587	S	89.1	Confident	85.7	Confident	67 Å²	67	52 Å²	52	47%	0.469	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	157	175.1	64.3	0	0	0	0	112.8	A547 L568	A547-S587 WeakPolarHBondContact O-CA 3.05Å; A547-S587 WeakPolarHBondContact O-CB 3.44Å; L568-S587 WeakPolarHBondContact CD1-O 3.22Å
588	F	87.6	Confident	84.7	Confident	15 Å²	15	51.1 Å²	51.1	7%	0.066	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	158.2	167.8	71.7	-104.1	0	0	0	109.8	G546 A547 L568 C594 T596 N609 F632	G546-F588 CarbonylContact C-O 3.6Å; G546-F588 WeakPolarHBondContact CA-O 3.22Å; A547-F588 HydrophobicContact CB-CD1 4.29Å; A547-F588 HydrophobicContact CB-CE1 3.66Å; A547-F588 HydrophobicContact CB-CE2 4.42Å; A547-F588 HydrophobicContact CB-CZ 3.71Å; A547-F588 PolarHBondContact N-O 3.45Å; A547-F588 PolarHBondContact O-N 3.49Å; L568-F588 HydrophobicContact CD1-CB 4.37Å; F588-C594 HydrophobicContact CB-CB 3.89Å; F588-T596 WeakPolarHBondContact CD1-OG1 3.49Å; F588-T596 HydrophobicContact CD2-CG2 4.24Å; F588-T596 VanDerWaalsContact CD2-OG1 3.28Å; F588-T596 WeakPolarHBondContact CD2-OG1 3.38Å; F588-T596 HydrophobicContact CE1-CG2 4.22Å; F588-T596 WeakPolarHBondContact CE1-OG1 3.43Å; F588-T596 HydrophobicContact CE2-CG2 3.72Å; F588-T596 WeakPolarHBondContact CE2-OG1 3.49Å; F588-T596 WeakPolarHBondContact CG-OG1 3.32Å; F588-T596 HydrophobicContact CZ-CG2 3.71Å; F588-N609 HydrophobicContact CD1-CB 4.17Å; F588-N609 HydrophobicContact CE1-CB 4.02Å; F588-F632 HydrophobicContact CD1-CE2 4.15Å; F588-F632 HydrophobicContact CD1-CZ 4.48Å; F588-F632 AromaticContact CE1-CE2 3.78Å; F588-F632 HydrophobicContact CE1-CE2 3.78Å; F588-F632 HydrophobicContact CE1-CZ 4.5Å
589	S	84.1	Confident	83.5	Confident	43 Å²	43	52.5 Å²	52.5	30%	0.301	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	175.7	175.3	64.3	0	0	0	0	111.7	K545 Q591 N592 T593	K545-S589 CarbonylContact O-C 3.27Å; K545-S589 VanDerWaalsContact O-C 3.26Å; K545-S589 WeakPolarHBondContact O-CA 3.37Å; S589-Q591 PolarHBondContact O-N 2.83Å; S589-Q591 PolarHBondContact OG-N 2.48Å; S589-N592 PolarHBondContact N-O 3.02Å; S589-N592 CarbonylContact O-C 3.51Å; S589-N592 PolarHBondContact O-N 3.42Å; S589-N592 PolarHBondContact OG-N 3.48Å; S589-N592 VanDerWaalsContact OG-N 3.09Å; S589-T593 VanDerWaalsContact O-CA 3.3Å; S589-T593 WeakPolarHBondContact O-CA 3.38Å; S589-T593 PolarHBondContact O-N 3.37Å
590	S	73	Confident	82.1	Confident	36 Å²	36	48.4 Å²	48.4	25%	0.252	28%	0.28	S	S	.	.	S	Bend	trans	-57.1	-36.2	168.6	49.1	0	0	0	0	113	K545 E702	K545-S590 PolarHBondContact O-N 3.21Å; S590-E702 WeakPolarHBondContact CB-OE1 3.23Å
591	Q	77.6	Confident	80.7	Confident	188 Å²	188	46.4 Å²	46.4	88%	0.879	27%	0.27	S	S	*	.	S	Bend	trans	-76.7	-38.1	179.8	-63.5	-179.7	0.5	0	0	112.4	S589	S589-Q591 PolarHBondContact O-N 2.83Å; S589-Q591 PolarHBondContact OG-N 2.48Å
592	N	83.7	Confident	79	Confident	89 Å²	89	49.6 Å²	49.6	48%	0.476	28%	0.284	S	S	.	.	S	Bend	trans	-127.6	97.1	174	-173.6	7.2	0	0	0	110.3	S589 C594	S589-N592 PolarHBondContact N-O 3.02Å; S589-N592 CarbonylContact O-C 3.51Å; S589-N592 PolarHBondContact O-N 3.42Å; S589-N592 PolarHBondContact OG-N 3.48Å; S589-N592 VanDerWaalsContact OG-N 3.09Å; N592-C594 VanDerWaalsContact C-N 3.34Å; N592-C594 PolarHBondContact O-N 3.12Å
593	T	82.7	Confident	77.4	Confident	50 Å²	50	49.2 Å²	49.2	31%	0.307	29%	0.285	S	S	.	.			trans	-79.7	-16.8	-163.7	76.2	0	0	0	0	113.7	S589 G595 T596	S589-T593 VanDerWaalsContact O-CA 3.3Å; S589-T593 WeakPolarHBondContact O-CA 3.38Å; S589-T593 PolarHBondContact O-N 3.37Å; T593-G595 PolarHBondContact O-N 3.14Å; T593-T596 VanDerWaalsContact O-CB 3.29Å; T593-T596 WeakPolarHBondContact O-CB 3.23Å; T593-T596 PolarHBondContact O-N 3.15Å; T593-T596 PolarHBondContact O-OG1 3.1Å; T593-T596 VanDerWaalsContact O-OG1 3.04Å
594	C	89.1	Confident	76	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.014	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.2	35	177.6	-62.4	0	0	0	0	115.5	L568 D570 C573 F588 N592 T596 N609	L568-C594 HydrophobicContact CB-CB 4.1Å; L568-C594 HydrophobicContact CD1-CB 3.62Å; L568-C594 HydrophobicContact CG-CB 4.49Å; D570-C594 VanDerWaalsContact CB-C 3.41Å; D570-C594 HydrophobicContact CB-CB 4.46Å; D570-C594 PolarHBondContact N-O 3.25Å; D570-C594 VanDerWaalsContact N-O 3.13Å; C573-C594 HydrophobicContact CB-CB 3.53Å; C573-C594 WeakPolarHBondContact CB-SG 3.38Å; C573-C594 WeakPolarHBondContact SG-CA 3.21Å; C573-C594 WeakPolarHBondContact SG-CB 3.46Å; C573-C594 CovalentContact SG-SG 2.04Å; C573-C594 PolarHBondContact SG-SG 3.39Å; F588-C594 HydrophobicContact CB-CB 3.89Å; N592-C594 VanDerWaalsContact C-N 3.34Å; N592-C594 PolarHBondContact O-N 3.12Å; C594-T596 VanDerWaalsContact C-N 3.32Å; C594-T596 PolarHBondContact O-N 2.92Å; C594-N609 PolarHBondContact O-ND2 3.24Å
595	G	85.1	Confident	74.7	Confident	29 Å²	29	50.1 Å²	50.1	30%	0.299	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	18.1	-178.6	0	0	0	0	0	115.1	N569 T593 V597	N569-G595 VanDerWaalsContact CB-O 3.28Å; N569-G595 WeakPolarHBondContact CB-O 3.4Å; N569-G595 PolarHBondContact ND2-O 3.4Å; T593-G595 PolarHBondContact O-N 3.14Å; G595-V597 PolarHBondContact O-N 3.07Å
596	T	83.3	Confident	73.6	Confident	11 Å²	11	49.3 Å²	49.3	7%	0.067	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-58.9	124.7	176.4	-69	0	0	0	0	111.2	F588 T593 C594 Y607 N609	F588-T596 WeakPolarHBondContact CD1-OG1 3.49Å; F588-T596 HydrophobicContact CD2-CG2 4.24Å; F588-T596 VanDerWaalsContact CD2-OG1 3.28Å; F588-T596 WeakPolarHBondContact CD2-OG1 3.38Å; F588-T596 HydrophobicContact CE1-CG2 4.22Å; F588-T596 WeakPolarHBondContact CE1-OG1 3.43Å; F588-T596 HydrophobicContact CE2-CG2 3.72Å; F588-T596 WeakPolarHBondContact CE2-OG1 3.49Å; F588-T596 WeakPolarHBondContact CG-OG1 3.32Å; F588-T596 HydrophobicContact CZ-CG2 3.71Å; T593-T596 VanDerWaalsContact O-CB 3.29Å; T593-T596 WeakPolarHBondContact O-CB 3.23Å; T593-T596 PolarHBondContact O-N 3.15Å; T593-T596 PolarHBondContact O-OG1 3.1Å; T593-T596 VanDerWaalsContact O-OG1 3.04Å; C594-T596 VanDerWaalsContact C-N 3.32Å; C594-T596 PolarHBondContact O-N 2.92Å; T596-Y607 HydrophobicContact CG2-CD1 4.14Å; T596-N609 PolarHBondContact N-ND2 3.02Å; T596-N609 PolarHBondContact OG1-ND2 3.21Å
597	V	77.6	Confident	72.9	Confident	68 Å²	68	50.2 Å²	50.2	41%	0.412	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	123.5	177.7	-176.1	0	0	0	0	108.8	G595 Q599 K608	G595-V597 PolarHBondContact O-N 3.07Å; V597-Q599 HydrophobicContact CG1-CG 3.96Å; V597-K608 PolarHBondContact N-O 3.02Å; V597-K608 PolarHBondContact O-N 2.84Å
598	V	70.8	Confident	72.2	Confident	25 Å²	25	49.3 Å²	49.3	15%	0.152	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	120.2	171.6	-173.9	0	0	0	0	108.6	I605 Y607	V598-I605 HydrophobicContact CG1-CG2 3.85Å; V598-Y607 HydrophobicContact CG2-CD1 3.74Å; V598-Y607 HydrophobicContact CG2-CE1 3.65Å
599	Q	64.6	Low	71.9	Confident	97 Å²	97	48.6 Å²	48.6	45%	0.453	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	153.4	175.3	-63.7	-169.6	-11.8	0	0	110.4	V597 I606	V597-Q599 HydrophobicContact CG1-CG 3.96Å; Q599-I606 PolarHBondContact N-O 2.9Å; Q599-I606 PolarHBondContact O-N 2.89Å
600	A	57.1	Low	71.5	Confident	36 Å²	36	46.6 Å²	46.6	30%	0.298	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	115.4	179.5	0	0	0	0	0	108.4	I605 V779 I811	A600-I605 HydrophobicContact CB-CD1 4.22Å; A600-V779 HydrophobicContact CB-CG2 3.92Å; A600-I811 HydrophobicContact CB-CD1 3.89Å; A600-I811 HydrophobicContact CB-CG1 3.71Å
601	N	53.2	Low	71.9	Confident	69 Å²	69	44.9 Å²	44.9	37%	0.369	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	157.3	167.4	-166.8	-7.6	0	0	0	108	S603 Q604 I606 I811	N601-S603 PolarHBondContact O-N 3.08Å; N601-Q604 PolarHBondContact N-O 3.14Å; N601-Q604 PolarHBondContact O-N 2.94Å; N601-Q604 VanDerWaalsContact O-O 3.09Å; N601-I606 HydrophobicContact CB-CD1 3.97Å; N601-I811 WeakPolarHBondContact O-CD1 3.34Å; N601-I811 WeakPolarHBondContact O-CG1 3.14Å
602	N	49.1	Very low	71.9	Confident	125 Å²	125	38 Å²	38	67%	0.668	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-5.6	-168.4	-63.6	-18.1	0	0	0	116.1
603	S	56	Low	71.3	Confident	16 Å²	16	35 Å²	35	11%	0.112	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-137.2	1.1	174.7	57.9	0	0	0	0	115.3	N601	N601-S603 PolarHBondContact O-N 3.08Å
604	Q	59.7	Low	70.4	Confident	41 Å²	41	35.8 Å²	35.8	19%	0.192	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	136.9	-170.3	-70.3	175.2	-27.3	0	0	112.3	N601 I606 Y635 Y636	N601-Q604 PolarHBondContact N-O 3.14Å; N601-Q604 PolarHBondContact O-N 2.94Å; N601-Q604 VanDerWaalsContact O-O 3.09Å; Q604-I606 HydrophobicContact CB-CD1 4.46Å; Q604-I606 HydrophobicContact CB-CG1 4.04Å; Q604-Y635 HydrophobicContact CG-CD2 4.08Å; Q604-Y636 WeakPolarHBondContact CA-O 3.46Å
605	I	64.5	Low	68.6	Low	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	124.6	161.8	-60.6	-71.3	0	0	0	107.6	V598 A600 Y607 Y635 Y636 L777 I811	V598-I605 HydrophobicContact CG1-CG2 3.85Å; A600-I605 HydrophobicContact CB-CD1 4.22Å; I605-Y607 HydrophobicContact CG2-CD2 4.29Å; I605-Y607 HydrophobicContact CG2-CE2 3.75Å; I605-Y635 CarbonylContact O-C 3.51Å; I605-Y635 VanDerWaalsContact O-CA 3.31Å; I605-Y635 WeakPolarHBondContact O-CA 3.39Å; I605-Y636 PolarHBondContact N-O 3.35Å; I605-Y636 PolarHBondContact O-N 3.3Å; I605-L777 HydrophobicContact CD1-CB 4.19Å; I605-L777 HydrophobicContact CD1-CD1 4.22Å; I605-L777 HydrophobicContact CG1-CD1 3.88Å; I605-I811 HydrophobicContact CD1-CD1 3.52Å; I605-I811 HydrophobicContact CG1-CD1 4.07Å
606	I	67.6	Low	66.7	Low	27 Å²	27	43.5 Å²	43.5	14%	0.138	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	115	-170.6	-53.3	177.8	0	0	0	108.6	Q599 N601 Q604	Q599-I606 PolarHBondContact N-O 2.9Å; Q599-I606 PolarHBondContact O-N 2.89Å; N601-I606 HydrophobicContact CB-CD1 3.97Å; Q604-I606 HydrophobicContact CB-CD1 4.46Å; Q604-I606 HydrophobicContact CB-CG1 4.04Å
607	Y	75.9	Confident	64.7	Low	20 Å²	20	47.5 Å²	47.5	8%	0.078	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	109.4	170.5	-68.6	-102.3	0	0	0	107.5	T596 V598 I605 S633 C634 Y636	T596-Y607 HydrophobicContact CG2-CD1 4.14Å; V598-Y607 HydrophobicContact CG2-CD1 3.74Å; V598-Y607 HydrophobicContact CG2-CE1 3.65Å; I605-Y607 HydrophobicContact CG2-CD2 4.29Å; I605-Y607 HydrophobicContact CG2-CE2 3.75Å; Y607-S633 WeakPolarHBondContact O-CA 3.31Å; Y607-S633 WeakPolarHBondContact O-CB 3.4Å; Y607-C634 PolarHBondContact N-O 2.9Å; Y607-C634 PolarHBondContact O-N 2.99Å; Y607-Y636 AromaticContact CD2-CD2 3.79Å; Y607-Y636 HydrophobicContact CD2-CD2 3.79Å; Y607-Y636 AromaticContact CD2-CE2 3.67Å; Y607-Y636 HydrophobicContact CD2-CE2 3.67Å; Y607-Y636 AromaticContact CE2-CD2 3.46Å; Y607-Y636 HydrophobicContact CE2-CD2 3.46Å; Y607-Y636 VanDerWaalsContact CE2-CD2 3.46Å; Y607-Y636 AromaticContact CE2-CE2 3.26Å; Y607-Y636 HydrophobicContact CE2-CE2 3.26Å
608	K	74.6	Confident	62.9	Low	48 Å²	48	52.5 Å²	52.5	21%	0.209	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.4	-176.3	-166.6	-175.3	-178.4	-162.4	0	111.3	V597 D631 F632	V597-K608 PolarHBondContact N-O 3.02Å; V597-K608 PolarHBondContact O-N 2.84Å; K608-D631 WeakPolarHBondContact CE-OD1 3.31Å; K608-D631 WeakPolarHBondContact CE-OD2 3.39Å; K608-D631 IonicContact NZ-OD1 2.83Å; K608-D631 PolarHBondContact NZ-OD1 2.91Å; K608-D631 IonicContact NZ-OD2 3.18Å; K608-D631 PolarHBondContact NZ-OD2 3.44Å; K608-F632 WeakPolarHBondContact CA-O 3.41Å; K608-F632 WeakPolarHBondContact CG-O 3.21Å
609	N	81.3	Confident	61.4	Low	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	171	168.1	-154.3	-41.3	0	0	0	108.4	N569 F588 C594 T596 F632	N569-N609 WeakPolarHBondContact CB-OD1 3Å; N569-N609 PolarHBondContact N-OD1 2.83Å; N569-N609 PolarHBondContact ND2-OD1 2.71Å; F588-N609 HydrophobicContact CD1-CB 4.17Å; F588-N609 HydrophobicContact CE1-CB 4.02Å; C594-N609 PolarHBondContact O-ND2 3.24Å; T596-N609 PolarHBondContact N-ND2 3.02Å; T596-N609 PolarHBondContact OG1-ND2 3.21Å; N609-F632 HydrophobicContact CB-CD2 4.45Å; N609-F632 HydrophobicContact CB-CE1 4.13Å; N609-F632 HydrophobicContact CB-CE2 3.88Å; N609-F632 HydrophobicContact CB-CZ 3.7Å; N609-F632 PolarHBondContact N-O 3.04Å; N609-F632 WeakPolarHBondContact O-CD1 3.29Å; N609-F632 PolarHBondContact O-N 3.28Å
610	A	76.1	Confident	60	Low	2 Å²	2	58.3 Å²	58.3	2%	0.017	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	137	-179.9	0	0	0	0	0	110.9	L568 N569 M612 M630	L568-A610 CarbonylContact C-O 3.47Å; L568-A610 WeakPolarHBondContact CA-O 3.46Å; N569-A610 PolarHBondContact N-O 3.48Å; A610-M612 HydrophobicContact CB-CE 3.9Å; A610-M630 CarbonylContact C-O 3.59Å; A610-M630 VanDerWaalsContact CA-O 3.25Å; A610-M630 WeakPolarHBondContact CA-O 3.22Å
611	I	80.3	Confident	58.9	Low	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	125.4	168.5	-51.5	177.1	0	0	0	107.4	V549 L551 L566 H567 L568 F586 H629 M630 F632	V549-I611 HydrophobicContact CB-CD1 4.41Å; V549-I611 HydrophobicContact CG1-CD1 3.93Å; L551-I611 HydrophobicContact CD1-CD1 3.85Å; L551-I611 HydrophobicContact CG-CD1 4.46Å; L566-I611 HydrophobicContact CB-CG2 3.91Å; L566-I611 HydrophobicContact CD1-CG2 4.15Å; L566-I611 HydrophobicContact CD2-CG2 4.39Å; L566-I611 HydrophobicContact CG-CG2 4.39Å; H567-I611 CarbonylContact O-C 3.52Å; H567-I611 WeakPolarHBondContact O-CA 3.45Å; L568-I611 HydrophobicContact CD2-CG1 4.06Å; F586-I611 HydrophobicContact CB-CD1 4.46Å; F586-I611 HydrophobicContact CD1-CD1 4.45Å; F586-I611 HydrophobicContact CD1-CG1 4.37Å; F586-I611 HydrophobicContact CD1-CG2 4.34Å; F586-I611 HydrophobicContact CD2-CD1 3.62Å; F586-I611 HydrophobicContact CD2-CG1 4.39Å; F586-I611 HydrophobicContact CE1-CG2 3.8Å; F586-I611 HydrophobicContact CE2-CD1 3.91Å; F586-I611 HydrophobicContact CE2-CG2 4.25Å; F586-I611 HydrophobicContact CG-CD1 3.94Å; F586-I611 HydrophobicContact CG-CG1 4.25Å; F586-I611 HydrophobicContact CZ-CD1 4.43Å; F586-I611 HydrophobicContact CZ-CG2 3.76Å; I611-H629 CarbonylContact O-C 3.26Å; I611-H629 WeakPolarHBondContact O-CA 3.08Å; I611-M630 HydrophobicContact CB-CB 4.27Å; I611-M630 PolarHBondContact N-O 3.39Å; I611-M630 PolarHBondContact O-N 2.92Å; I611-F632 HydrophobicContact CD1-CE1 4.43Å; I611-F632 HydrophobicContact CG1-CD1 4.13Å; I611-F632 HydrophobicContact CG1-CE1 3.68Å
612	M	77.3	Confident	57.9	Low	42 Å²	42	67.4 Å²	67.4	21%	0.207	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	156.7	-178.9	67.5	-170.5	76.9	0	0	113	L566 H567 N569 A610 V628	L566-M612 WeakPolarHBondContact CA-O 3.49Å; H567-M612 PolarHBondContact CD2-O 2.88Å; H567-M612 WeakPolarHBondContact CE1-CG 3.41Å; H567-M612 PolarHBondContact N-O 2.94Å; H567-M612 PolarHBondContact O-N 3.02Å; N569-M612 WeakPolarHBondContact OD1-CE 3.37Å; A610-M612 HydrophobicContact CB-CE 3.9Å; M612-V628 VanDerWaalsContact CA-O 3.29Å; M612-V628 WeakPolarHBondContact CA-O 3.49Å
613	T	71.3	Confident	57.5	Low	26 Å²	26	65.7 Å²	65.7	16%	0.16	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	147.8	169.4	42	0	0	0	0	111.9	V565 L566 N615 V628	V565-T613 HydrophobicContact CG2-CG2 4.11Å; L566-T613 HydrophobicContact CD2-CG2 3.85Å; T613-N615 PolarHBondContact O-N 2.95Å; T613-V628 HydrophobicContact CG2-CB 3.9Å; T613-V628 HydrophobicContact CG2-CG2 3.92Å; T613-V628 PolarHBondContact N-O 2.88Å; T613-V628 PolarHBondContact OG1-N 3.19Å
614	Q	64.2	Low	56.8	Low	67 Å²	67	74.5 Å²	74.5	31%	0.313	38%	0.383	S	S	.	.			trans	-53.3	127.8	173.7	-68.1	-165	-31	0	0	112.8	V565 H567 R574 I616	V565-Q614 PolarHBondContact O-N 3.47Å; H567-Q614 WeakPolarHBondContact NE2-CA 3.42Å; H567-Q614 PolarHBondContact NE2-N 3.09Å; R574-Q614 VanDerWaalsContact NH2-NE2 3.14Å; Q614-I616 PolarHBondContact O-N 2.95Å; Q614-I616 VanDerWaalsContact O-N 3.07Å
615	N	50.8	Low	55.9	Low	120 Å²	120	77.5 Å²	77.5	64%	0.642	40%	0.396	S	S	*	.			trans	-75.1	96.1	167.6	-166.7	3.6	0	0	0	108.4	T613 S617	T613-N615 PolarHBondContact O-N 2.95Å; N615-S617 PolarHBondContact O-N 2.84Å
616	I	45.5	Very low	54.8	Low	73 Å²	73	84.1 Å²	84.1	37%	0.374	43%	0.432	S	S	.	.			trans	-73.2	71.7	-179	-51.2	174.4	0	0	0	109.6	Q614	Q614-I616 PolarHBondContact O-N 2.95Å; Q614-I616 VanDerWaalsContact O-N 3.07Å
617	S	40.6	Very low	54	Low	95 Å²	95	91.6 Å²	91.6	66%	0.664	46%	0.463	S	S	*	.			trans	-98.8	-0.5	175.3	58.2	0	0	0	0	113.5	N615	N615-S617 PolarHBondContact O-N 2.84Å
618	M	40.4	Very low	53.2	Low	173 Å²	173	91.4 Å²	91.4	85%	0.852	46%	0.464	S	S	*	.	S	Bend	trans	-94.4	-10.6	176.7	-69.7	-163.4	-176.5	0	0	115.3
619	F	38.8	Very low	52.7	Low	198 Å²	198	94.6 Å²	94.6	87%	0.868	48%	0.48	S	S	*	.	S	Bend	trans	-135.7	20.6	-179.3	-72.4	-69.2	0	0	0	115.9
620	G	36.1	Very low	52	Low	46 Å²	46	96 Å²	96	47%	0.474	49%	0.486	S	S	.	.			trans	107.7	178.5	161.3	0	0	0	0	0	117.4	I622	G620-I622 PolarHBondContact O-N 2.83Å
621	L	34.1	Very low	51.5	Low	187 Å²	187	98.1 Å²	98.1	98%	0.979	50%	0.497	S	S	*	.	S	Bend	trans	-63.6	11.3	-160	-78.8	140.3	0	0	0	118.2
622	I	32.4	Very low	51	Low	109 Å²	109	98.3 Å²	98.3	56%	0.559	50%	0.498	S	S	*	.			trans	-126.6	101.2	-170.3	-51.5	178.5	0	0	0	111.2	G620 R624	G620-I622 PolarHBondContact O-N 2.83Å; I622-R624 HydrophobicContact CG2-CG 3.9Å
623	T	39.3	Very low	50.7	Low	89 Å²	89	97 Å²	97	55%	0.546	49%	0.494	S	S	.	.			trans	-81.1	117.2	164.4	49.4	0	0	0	0	109.7
624	R	41.2	Very low	50.9	Low	202 Å²	202	95.9 Å²	95.9	76%	0.762	49%	0.487	S	S	*	.			trans	-97.7	-3.6	-179.4	-64.5	-176	179.7	-95.3	1.1	114.8	I622	I622-R624 HydrophobicContact CG2-CG 3.9Å
625	H	41.5	Very low	51	Low	103 Å²	103	95 Å²	95	48%	0.477	48%	0.481	S	S	.	.	S	Bend	trans	-122.6	149	179.9	-56.6	99.4	0	0	0	109.3
626	D	41.5	Very low	51.6	Low	140 Å²	140	89.6 Å²	89.6	75%	0.749	45%	0.451	S	S	*	.			trans	-64.3	146.5	176.1	-76.5	-39.8	0	0	0	111.6	V628	D626-V628 PolarHBondContact O-N 2.91Å
627	K	51	Low	52	Low	183 Å²	183	86.4 Å²	86.4	80%	0.796	44%	0.436	S	S	*	.			trans	-74.7	90.4	179.2	-71.5	-176.5	177.5	179.2	0	110.3
628	V	58.2	Low	52.5	Low	17 Å²	17	83.4 Å²	83.4	10%	0.103	41%	0.411	C	S	.	.			trans	-75	129.2	170.9	-174.1	0	0	0	0	109.1	I561 L566 M612 T613 D626 M630	I561-V628 HydrophobicContact CD1-CG2 3.79Å; I561-V628 HydrophobicContact CG1-CG2 3.9Å; I561-V628 HydrophobicContact CG2-CG2 3.97Å; L566-V628 HydrophobicContact CD2-CB 4.13Å; L566-V628 HydrophobicContact CD2-CG1 4.14Å; L566-V628 HydrophobicContact CD2-CG2 4.44Å; M612-V628 VanDerWaalsContact CA-O 3.29Å; M612-V628 WeakPolarHBondContact CA-O 3.49Å; T613-V628 HydrophobicContact CG2-CB 3.9Å; T613-V628 HydrophobicContact CG2-CG2 3.92Å; T613-V628 PolarHBondContact N-O 2.88Å; T613-V628 PolarHBondContact OG1-N 3.19Å; D626-V628 PolarHBondContact O-N 2.91Å; V628-M630 HydrophobicContact CG1-CE 3.61Å; V628-M630 HydrophobicContact CG1-CG 4.06Å
629	H	64.6	Low	52.7	Low	115 Å²	115	75.4 Å²	75.4	53%	0.532	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	107.8	171.1	-171.4	75.3	0	0	0	109	I611 D631	I611-H629 CarbonylContact O-C 3.26Å; I611-H629 WeakPolarHBondContact O-CA 3.08Å; H629-D631 IonicContact NE2-OD1 2.67Å
630	M	66.9	Low	52.6	Low	28 Å²	28	70.4 Å²	70.4	14%	0.138	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	101.5	-179.2	-54.4	-175	-169.2	0	0	109.2	F536 L551 L556 A610 I611 V628	F536-M630 HydrophobicContact CD2-CE 3.37Å; F536-M630 HydrophobicContact CD2-SD 3.94Å; F536-M630 HydrophobicContact CE2-CE 3.47Å; F536-M630 VanDerWaalsContact CE2-CE 3.47Å; F536-M630 HydrophobicContact CE2-SD 4.43Å; F536-M630 HydrophobicContact CG-CE 4.01Å; F536-M630 HydrophobicContact CZ-CE 4.17Å; L551-M630 HydrophobicContact CD1-SD 4.29Å; L556-M630 HydrophobicContact CD2-CE 4.08Å; A610-M630 CarbonylContact C-O 3.59Å; A610-M630 VanDerWaalsContact CA-O 3.25Å; A610-M630 WeakPolarHBondContact CA-O 3.22Å; I611-M630 HydrophobicContact CB-CB 4.27Å; I611-M630 PolarHBondContact N-O 3.39Å; I611-M630 PolarHBondContact O-N 2.92Å; V628-M630 HydrophobicContact CG1-CE 3.61Å; V628-M630 HydrophobicContact CG1-CG 4.06Å
631	D	65.6	Low	52.7	Low	47 Å²	47	69.5 Å²	69.5	25%	0.251	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	134.1	175.4	-96.4	-28	0	0	0	111.3	K608 H629	K608-D631 WeakPolarHBondContact CE-OD1 3.31Å; K608-D631 WeakPolarHBondContact CE-OD2 3.39Å; K608-D631 IonicContact NZ-OD1 2.83Å; K608-D631 PolarHBondContact NZ-OD1 2.91Å; K608-D631 IonicContact NZ-OD2 3.18Å; K608-D631 PolarHBondContact NZ-OD2 3.44Å; H629-D631 IonicContact NE2-OD1 2.67Å
632	F	70.5	Confident	52.6	Low	4 Å²	4	70.3 Å²	70.3	2%	0.018	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	152.6	172.7	67.4	-94.9	0	0	0	112.9	I540 V549 L568 F588 K608 N609 I611 I657	I540-F632 HydrophobicContact CD1-CB 4.19Å; I540-F632 HydrophobicContact CD1-CD2 3.27Å; I540-F632 HydrophobicContact CD1-CE2 3.86Å; I540-F632 HydrophobicContact CD1-CG 4.1Å; V549-F632 HydrophobicContact CG2-CD1 4.13Å; V549-F632 HydrophobicContact CG2-CD2 3.77Å; V549-F632 HydrophobicContact CG2-CE1 4.15Å; V549-F632 HydrophobicContact CG2-CE2 3.7Å; V549-F632 HydrophobicContact CG2-CG 3.91Å; V549-F632 HydrophobicContact CG2-CZ 3.9Å; L568-F632 HydrophobicContact CD2-CE1 3.59Å; L568-F632 HydrophobicContact CD2-CZ 3.55Å; F588-F632 HydrophobicContact CD1-CE2 4.15Å; F588-F632 HydrophobicContact CD1-CZ 4.48Å; F588-F632 AromaticContact CE1-CE2 3.78Å; F588-F632 HydrophobicContact CE1-CE2 3.78Å; F588-F632 HydrophobicContact CE1-CZ 4.5Å; K608-F632 WeakPolarHBondContact CA-O 3.41Å; K608-F632 WeakPolarHBondContact CG-O 3.21Å; N609-F632 HydrophobicContact CB-CD2 4.45Å; N609-F632 HydrophobicContact CB-CE1 4.13Å; N609-F632 HydrophobicContact CB-CE2 3.88Å; N609-F632 HydrophobicContact CB-CZ 3.7Å; N609-F632 PolarHBondContact N-O 3.04Å; N609-F632 WeakPolarHBondContact O-CD1 3.29Å; N609-F632 PolarHBondContact O-N 3.28Å; I611-F632 HydrophobicContact CD1-CE1 4.43Å; I611-F632 HydrophobicContact CG1-CD1 4.13Å; I611-F632 HydrophobicContact CG1-CE1 3.68Å; F632-I657 HydrophobicContact CB-CB 4.32Å; F632-I657 HydrophobicContact CB-CD1 4.05Å; F632-I657 HydrophobicContact CB-CG1 4.5Å
633	S	71.2	Confident	52.7	Low	16 Å²	16	68.6 Å²	68.6	11%	0.112	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	148.5	177.9	55.9	0	0	0	0	112.7	Y607 S659	Y607-S633 WeakPolarHBondContact O-CA 3.31Å; Y607-S633 WeakPolarHBondContact O-CB 3.4Å; S633-S659 PolarHBondContact O-OG 3.4Å; S633-S659 PolarHBondContact OG-OG 2.86Å; S633-S659 VanDerWaalsContact OG-OG 3.1Å
634	C	73.8	Confident	52.4	Low	2 Å²	2	68.6 Å²	68.6	1%	0.014	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	139.3	157.7	-69.6	0	0	0	0	107.9	C542 A547 Y607	C542-C634 HydrophobicContact CB-CB 3.97Å; C542-C634 WeakPolarHBondContact CB-SG 3.38Å; C542-C634 WeakPolarHBondContact SG-CB 3.36Å; C542-C634 CovalentContact SG-SG 2.04Å; C542-C634 PolarHBondContact SG-SG 2.96Å; A547-C634 WeakPolarHBondContact CB-SG 3.23Å; Y607-C634 PolarHBondContact N-O 2.9Å; Y607-C634 PolarHBondContact O-N 2.99Å
635	Y	67.1	Low	51.8	Low	47 Å²	47	59.3 Å²	59.3	18%	0.184	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	138.7	178.4	64.7	-87.6	0	0	0	112.5	Q604 I605 S637 S659 G660 E661 W662	Q604-Y635 HydrophobicContact CG-CD2 4.08Å; I605-Y635 CarbonylContact O-C 3.51Å; I605-Y635 VanDerWaalsContact O-CA 3.31Å; I605-Y635 WeakPolarHBondContact O-CA 3.39Å; Y635-S637 WeakPolarHBondContact CE2-OG 3.2Å; Y635-S637 PolarHBondContact O-N 3.24Å; Y635-S659 VanDerWaalsContact CD1-OG 3.27Å; Y635-S659 WeakPolarHBondContact CD1-OG 3.46Å; Y635-S659 VanDerWaalsContact CE1-O 3.31Å; Y635-S659 WeakPolarHBondContact CE1-O 2.97Å; Y635-G660 PolarHBondContact N-O 2.94Å; Y635-E661 HydrophobicContact CE2-CB 4.22Å; Y635-E661 HydrophobicContact CE2-CG 4.17Å; Y635-W662 WeakPolarHBondContact O-CB 3.37Å; Y635-W662 PolarHBondContact O-N 2.99Å
636	Y	62.6	Low	51.3	Low	7 Å²	7	56.8 Å²	56.8	3%	0.027	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	98	166.1	-73	-98.8	0	0	0	108.2	D544 Q604 I605 Y607 W662 Y664 G700 L701	D544-Y636 PolarHBondContact O-OH 3.27Å; Q604-Y636 WeakPolarHBondContact CA-O 3.46Å; I605-Y636 PolarHBondContact N-O 3.35Å; I605-Y636 PolarHBondContact O-N 3.3Å; Y607-Y636 AromaticContact CD2-CD2 3.79Å; Y607-Y636 HydrophobicContact CD2-CD2 3.79Å; Y607-Y636 AromaticContact CD2-CE2 3.67Å; Y607-Y636 HydrophobicContact CD2-CE2 3.67Å; Y607-Y636 AromaticContact CE2-CD2 3.46Å; Y607-Y636 HydrophobicContact CE2-CD2 3.46Å; Y607-Y636 VanDerWaalsContact CE2-CD2 3.46Å; Y607-Y636 AromaticContact CE2-CE2 3.26Å; Y607-Y636 HydrophobicContact CE2-CE2 3.26Å; Y636-W662 HydrophobicContact CD1-CB 3.37Å; Y636-W662 HydrophobicContact CD1-CD2 4.44Å; Y636-W662 AromaticContact CD1-CG 3.86Å; Y636-W662 HydrophobicContact CD1-CG 3.86Å; Y636-W662 HydrophobicContact CD2-CB 3.82Å; Y636-W662 AromaticContact CD2-CD1 3.63Å; Y636-W662 AromaticContact CD2-CG 3.72Å; Y636-W662 HydrophobicContact CD2-CG 3.72Å; Y636-W662 HydrophobicContact CE1-CB 3.62Å; Y636-W662 AromaticContact CE1-CD2 3.79Å; Y636-W662 HydrophobicContact CE1-CD2 3.79Å; Y636-W662 AromaticContact CE1-CE3 3.95Å; Y636-W662 HydrophobicContact CE1-CE3 3.95Å; Y636-W662 AromaticContact CE1-CG 3.66Å; Y636-W662 HydrophobicContact CE1-CG 3.66Å; Y636-W662 HydrophobicContact CE2-CB 4.03Å; Y636-W662 AromaticContact CE2-CD1 3.39Å; Y636-W662 AromaticContact CE2-CD2 3.92Å; Y636-W662 HydrophobicContact CE2-CD2 3.92Å; Y636-W662 AromaticContact CE2-CG 3.5Å; Y636-W662 HydrophobicContact CE2-CG 3.5Å; Y636-W662 VanDerWaalsContact CE2-CG 3.5Å; Y636-W662 AromaticContact CE2-NE1 3.71Å; Y636-W662 HydrophobicContact CG-CB 3.49Å; Y636-W662 VanDerWaalsContact CG-CB 3.49Å; Y636-W662 AromaticContact CG-CG 3.9Å; Y636-W662 HydrophobicContact CG-CG 3.9Å; Y636-W662 AromaticContact CZ-CD1 3.83Å; Y636-W662 AromaticContact CZ-CD2 3.49Å; Y636-W662 VanDerWaalsContact CZ-CD2 3.49Å; Y636-W662 AromaticContact CZ-CE2 3.98Å; Y636-W662 AromaticContact CZ-CE3 3.97Å; Y636-W662 AromaticContact CZ-CG 3.48Å; Y636-W662 VanDerWaalsContact CZ-CG 3.48Å; Y636-Y664 AromaticContact CD1-CD1 3.97Å; Y636-Y664 HydrophobicContact CD1-CD1 3.97Å; Y636-Y664 HydrophobicContact CD1-CG 4.34Å; Y636-Y664 HydrophobicContact CG-CD1 4.3Å; Y636-G700 WeakPolarHBondContact CE1-O 3.14Å; Y636-L701 HydrophobicContact CD1-CD2 4.03Å; Y636-L701 HydrophobicContact CE1-CD2 4.4Å; Y636-L701 HydrophobicContact CG-CD2 4.21Å
637	S	53.8	Low	50.6	Low	6 Å²	6	54.3 Å²	54.3	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	145.3	160.1	-95.3	0	0	0	0	108.9	Y635 E661 W662 Y664	Y635-S637 WeakPolarHBondContact CE2-OG 3.2Å; Y635-S637 PolarHBondContact O-N 3.24Å; S637-E661 WeakPolarHBondContact CB-OE1 3.41Å; S637-E661 PolarHBondContact OG-OE1 3.49Å; S637-W662 PolarHBondContact N-O 2.63Å; S637-Y664 VanDerWaalsContact O-CD1 3.22Å; S637-Y664 WeakPolarHBondContact O-CD1 3.23Å; S637-Y664 WeakPolarHBondContact O-CE1 3.19Å
638	Q	52	Low	49.5	Very low	33 Å²	33	53.3 Å²	53.3	15%	0.154	26%	0.26	C	S	.	.			trans	-47.9	137.8	164.9	-71.2	173.5	-4.8	0	0	110.2
639	P	45.4	Very low	47.9	Very low	5 Å²	5	60 Å²	60	3%	0.032	28%	0.283	C	S	.	.			trans	-45.3	156	175.2	-9.9	-2.2	0	0	0	113.7	V641 R647 Y664 L666	P639-V641 HydrophobicContact CB-CG2 3.93Å; P639-V641 HydrophobicContact CG-CG2 4.07Å; P639-V641 PolarHBondContact O-N 2.88Å; P639-R647 PolarHBondContact O-NH2 3.19Å; P639-Y664 WeakPolarHBondContact CA-O 3.41Å; P639-Y664 WeakPolarHBondContact CB-O 3.45Å; P639-Y664 VanDerWaalsContact CD-CZ 3.44Å; P639-Y664 WeakPolarHBondContact CD-O 3.46Å; P639-Y664 HydrophobicContact CG-CD2 4.2Å; P639-Y664 HydrophobicContact CG-CE2 4.14Å; P639-Y664 WeakPolarHBondContact CG-O 3.48Å; P639-L666 HydrophobicContact CG-CB 4.34Å
640	D	36.6	Very low	46	Very low	93 Å²	93	61.3 Å²	61.3	50%	0.497	29%	0.29	S	S	.	.			trans	-67	86.4	148.5	-77.5	-46.6	0	0	0	108.4	K642 R647 K663	D640-K642 PolarHBondContact O-N 2.91Å; D640-R647 IonicContact OD1-CZ 2.86Å; D640-R647 IonicContact OD1-NH1 3.05Å; D640-R647 PolarHBondContact OD1-NH1 2.96Å; D640-R647 IonicContact OD1-NH2 3.68Å; D640-R647 PolarHBondContact OD1-NH2 3.07Å; D640-K663 IonicContact OD2-NZ 2.89Å; D640-K663 PolarHBondContact OD2-NZ 2.92Å
641	V	38.3	Very low	44.1	Very low	27 Å²	27	64.5 Å²	64.5	16%	0.164	32%	0.315	C	S	.	.			trans	-63.8	118.3	-176.6	173.2	0	0	0	0	109.4	P639 T643 W815	P639-V641 HydrophobicContact CB-CG2 3.93Å; P639-V641 HydrophobicContact CG-CG2 4.07Å; P639-V641 PolarHBondContact O-N 2.88Å; V641-T643 HydrophobicContact CG1-CG2 4.06Å; V641-T643 PolarHBondContact O-N 2.87Å; V641-W815 HydrophobicContact CB-CH2 3.92Å; V641-W815 HydrophobicContact CB-CZ3 4.41Å; V641-W815 HydrophobicContact CG1-CH2 3.86Å; V641-W815 HydrophobicContact CG1-CZ3 4.02Å; V641-W815 HydrophobicContact CG2-CH2 3.49Å; V641-W815 VanDerWaalsContact CG2-CH2 3.49Å; V641-W815 HydrophobicContact CG2-CZ2 3.87Å; V641-W815 HydrophobicContact CG2-CZ3 4.43Å
642	K	31.9	Very low	42.1	Very low	204 Å²	204	67.7 Å²	67.7	89%	0.887	34%	0.341	S	S	*	.			trans	-63.7	112.1	156.3	-104.7	-161.7	176.8	-171.3	0	107.1	D640	D640-K642 PolarHBondContact O-N 2.91Å
643	T	33.6	Very low	40	Very low	73 Å²	73	73.8 Å²	73.8	45%	0.448	38%	0.378	S	S	.	.			trans	-88.7	118.3	-168.3	46.5	0	0	0	0	113.7	V641 S645 V646	V641-T643 HydrophobicContact CG1-CG2 4.06Å; V641-T643 PolarHBondContact O-N 2.87Å; T643-S645 WeakPolarHBondContact CB-OG 3.45Å; T643-S645 PolarHBondContact OG1-OG 2.95Å; T643-V646 HydrophobicContact CG2-CG1 4.19Å
644	L	33.2	Very low	37.8	Very low	88 Å²	88	77.5 Å²	77.5	46%	0.461	40%	0.396	S	S	.	.	S	Bend		-76	136.2	99.8	-98.1	75.8	0	0	0	106.5	F770 L771	L644-F770 HydrophobicContact CD2-CB 4.09Å; L644-F770 HydrophobicContact CD2-CD1 4.08Å; L644-L771 WeakPolarHBondContact CD2-O 3.08Å
645	S	29.6	Very low	35.7	Very low	7 Å²	7	86.3 Å²	86.3	5%	0.049	44%	0.437	C	S	.	.	S	Bend	trans	-108.5	160.8	-137.5	-94.5	0	0	0	0	115.2	T643 T816 Y817	T643-S645 WeakPolarHBondContact CB-OG 3.45Å; T643-S645 PolarHBondContact OG1-OG 2.95Å; S645-T816 CarbonylContact C-O 3.57Å; S645-T816 CarbonylContact O-C 3.59Å; S645-Y817 VanDerWaalsContact CB-CG 3.47Å; S645-Y817 VanDerWaalsContact CB-CZ 3.46Å; S645-Y817 PolarHBondContact O-N 2.94Å; S645-Y817 VanDerWaalsContact O-N 3.1Å; S645-Y817 WeakPolarHBondContact OG-CE2 3.18Å; S645-Y817 PolarHBondContact OG-OH 3.23Å
646	V	30.1	Very low	33.9	Very low	50 Å²	50	89 Å²	89	30%	0.303	45%	0.451	S	S	.	.			cis	-143	-165.6	-21	-150	0	0	0	0	110.9	T643 W815 T816 Y817	T643-V646 HydrophobicContact CG2-CG1 4.19Å; V646-W815 WeakPolarHBondContact O-CZ3 3.38Å; V646-T816 PolarHBondContact N-O 2.67Å; V646-Y817 HydrophobicContact CG2-CD1 4.44Å; V646-Y817 HydrophobicContact CG2-CE1 4.36Å
647	R	26.6	Very low	32.3	Very low	88 Å²	88	90.6 Å²	90.6	33%	0.332	46%	0.459	S	S	.	.			trans	-94.6	176.4	-157	-68.6	163	135.2	170.9	-13.6	115.9	P639 D640 W815	P639-R647 PolarHBondContact O-NH2 3.19Å; D640-R647 IonicContact OD1-CZ 2.86Å; D640-R647 IonicContact OD1-NH1 3.05Å; D640-R647 PolarHBondContact OD1-NH1 2.96Å; D640-R647 IonicContact OD1-NH2 3.68Å; D640-R647 PolarHBondContact OD1-NH2 3.07Å; R647-W815 HydrophobicContact CG-CH2 4.18Å; R647-W815 HydrophobicContact CG-CZ3 4.44Å
648	F	27.5	Very low	31.2	Very low	162 Å²	162	93.7 Å²	93.7	71%	0.711	48%	0.481	S	S	*	.				-177.9	-155.8	83.7	-85	-66.1	0	0	0	116.4
649	R	24.6	Very low	30.5	Very low	158 Å²	158	93.3 Å²	93.3	60%	0.596	48%	0.482	S	S	*	.			trans	-105.3	-175.8	-164.6	-66	-176.2	168.3	-177.8	-4.9	114.2
650	Q	24.6	Very low	30.2	Very low	142 Å²	142	94 Å²	94	66%	0.664	49%	0.49	S	S	*	.			cis	-156.8	-137.1	27.4	-150.5	149.8	-79.8	0	0	117.5
651	S	28.1	Very low	30.5	Very low	96 Å²	96	94.3 Å²	94.3	67%	0.671	49%	0.488	S	S	*	.			trans	-144.5	168.5	-137.4	67.2	0	0	0	0	120.2
652	S	23.3	Very low	30.7	Very low	114 Å²	114	94.3 Å²	94.3	80%	0.797	49%	0.485	S	S	*	.			trans	-147.5	167.1	161.8	56.4	0	0	0	0	113.8
653	V	25.4	Very low	31.2	Very low	132 Å²	132	90.7 Å²	90.7	80%	0.8	47%	0.47	S	S	*	.			trans	-109.4	142	-141.9	177.9	0	0	0	0	116.6
654	I	26	Very low	32	Very low	94 Å²	94	88.1 Å²	88.1	48%	0.482	45%	0.452	S	S	.	.			trans	-118.8	162	166.9	-68.4	167.8	0	0	0	108.2	H656	I654-H656 PolarHBondContact O-CD2 2.91Å; I654-H656 PolarHBondContact O-N 3.16Å
655	Q	29.6	Very low	32.9	Very low	187 Å²	187	87.3 Å²	87.3	87%	0.874	45%	0.448	S	S	*	.			trans	-80	108.3	168.2	-147.5	177	25.3	0	0	109.5
656	H	29.6	Very low	34	Very low	104 Å²	104	89 Å²	89	48%	0.481	46%	0.456	S	S	.	.			trans	-96.7	132.2	-165.2	-73.8	-81.3	0	0	0	112.9	I654 S658	I654-H656 PolarHBondContact O-CD2 2.91Å; I654-H656 PolarHBondContact O-N 3.16Å; H656-S658 PolarHBondContact O-N 3.19Å
657	I	28.7	Very low	35.4	Very low	39 Å²	39	87.8 Å²	87.8	20%	0.2	45%	0.449	C	S	.	.	S	Bend	trans	-59.9	125	138.7	-61.1	-171.4	0	0	0	105.9	I540 V549 F632 S659	I540-I657 HydrophobicContact CB-CG2 4.03Å; I540-I657 HydrophobicContact CG2-CG2 4.13Å; V549-I657 HydrophobicContact CG1-CD1 4.4Å; F632-I657 HydrophobicContact CB-CB 4.32Å; F632-I657 HydrophobicContact CB-CD1 4.05Å; F632-I657 HydrophobicContact CB-CG1 4.5Å; I657-S659 WeakPolarHBondContact O-CA 3.34Å; I657-S659 PolarHBondContact O-N 2.58Å
658	S	30.5	Very low	37.2	Very low	71 Å²	71	87 Å²	87	50%	0.497	45%	0.45	S	S	.	.			trans	-53.1	105.1	-170	33.7	0	0	0	0	111	P539 I540 H656 G660	P539-S658 WeakPolarHBondContact CB-OG 3.1Å; I540-S658 WeakPolarHBondContact CG2-O 3.32Å; H656-S658 PolarHBondContact O-N 3.19Å; S658-G660 PolarHBondContact O-N 3.48Å
659	S	36.7	Very low	39.2	Very low	26 Å²	26	81.8 Å²	81.8	18%	0.182	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-75.9	123.5	-160.5	-165	0	0	0	0	110.4	S633 Y635 I657	S633-S659 PolarHBondContact O-OG 3.4Å; S633-S659 PolarHBondContact OG-OG 2.86Å; S633-S659 VanDerWaalsContact OG-OG 3.1Å; Y635-S659 VanDerWaalsContact CD1-OG 3.27Å; Y635-S659 WeakPolarHBondContact CD1-OG 3.46Å; Y635-S659 VanDerWaalsContact CE1-O 3.31Å; Y635-S659 WeakPolarHBondContact CE1-O 2.97Å; I657-S659 WeakPolarHBondContact O-CA 3.34Å; I657-S659 PolarHBondContact O-N 2.58Å
660	G	38.8	Very low	41.4	Very low	18 Å²	18	75.5 Å²	75.5	19%	0.186	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	138.8	-175.7	0	0	0	0	0	112.7	Y635 S658	Y635-G660 PolarHBondContact N-O 2.94Å; S658-G660 PolarHBondContact O-N 3.48Å
661	E	44.1	Very low	44.1	Very low	101 Å²	101	69.5 Å²	69.5	47%	0.472	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	122.6	-179.4	-178.6	167.3	-124.3	0	0	111.8	Y635 S637	Y635-E661 HydrophobicContact CE2-CB 4.22Å; Y635-E661 HydrophobicContact CE2-CG 4.17Å; S637-E661 WeakPolarHBondContact CB-OE1 3.41Å; S637-E661 PolarHBondContact OG-OE1 3.49Å
662	W	43	Very low	46.5	Very low	26 Å²	26	68.4 Å²	68.4	10%	0.098	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	149.9	163.8	-77.7	105.5	0	0	0	111.9	C542 A543 D544 Y635 Y636 S637	C542-W662 VanDerWaalsContact C-CH2 3.49Å; C542-W662 HydrophobicContact CB-CH2 4.27Å; C542-W662 HydrophobicContact CB-CZ2 3.44Å; C542-W662 VanDerWaalsContact CB-CZ2 3.44Å; C542-W662 WeakPolarHBondContact O-CH2 3.4Å; A543-W662 VanDerWaalsContact CA-CH2 3.43Å; A543-W662 WeakPolarHBondContact O-CH2 3.46Å; A543-W662 WeakPolarHBondContact O-CZ2 3.33Å; D544-W662 WeakPolarHBondContact OD1-CZ3 3.31Å; Y635-W662 WeakPolarHBondContact O-CB 3.37Å; Y635-W662 PolarHBondContact O-N 2.99Å; Y636-W662 HydrophobicContact CD1-CB 3.37Å; Y636-W662 HydrophobicContact CD1-CD2 4.44Å; Y636-W662 AromaticContact CD1-CG 3.86Å; Y636-W662 HydrophobicContact CD1-CG 3.86Å; Y636-W662 HydrophobicContact CD2-CB 3.82Å; Y636-W662 AromaticContact CD2-CD1 3.63Å; Y636-W662 AromaticContact CD2-CG 3.72Å; Y636-W662 HydrophobicContact CD2-CG 3.72Å; Y636-W662 HydrophobicContact CE1-CB 3.62Å; Y636-W662 AromaticContact CE1-CD2 3.79Å; Y636-W662 HydrophobicContact CE1-CD2 3.79Å; Y636-W662 AromaticContact CE1-CE3 3.95Å; Y636-W662 HydrophobicContact CE1-CE3 3.95Å; Y636-W662 AromaticContact CE1-CG 3.66Å; Y636-W662 HydrophobicContact CE1-CG 3.66Å; Y636-W662 HydrophobicContact CE2-CB 4.03Å; Y636-W662 AromaticContact CE2-CD1 3.39Å; Y636-W662 AromaticContact CE2-CD2 3.92Å; Y636-W662 HydrophobicContact CE2-CD2 3.92Å; Y636-W662 AromaticContact CE2-CG 3.5Å; Y636-W662 HydrophobicContact CE2-CG 3.5Å; Y636-W662 VanDerWaalsContact CE2-CG 3.5Å; Y636-W662 AromaticContact CE2-NE1 3.71Å; Y636-W662 HydrophobicContact CG-CB 3.49Å; Y636-W662 VanDerWaalsContact CG-CB 3.49Å; Y636-W662 AromaticContact CG-CG 3.9Å; Y636-W662 HydrophobicContact CG-CG 3.9Å; Y636-W662 AromaticContact CZ-CD1 3.83Å; Y636-W662 AromaticContact CZ-CD2 3.49Å; Y636-W662 VanDerWaalsContact CZ-CD2 3.49Å; Y636-W662 AromaticContact CZ-CE2 3.98Å; Y636-W662 AromaticContact CZ-CE3 3.97Å; Y636-W662 AromaticContact CZ-CG 3.48Å; Y636-W662 VanDerWaalsContact CZ-CG 3.48Å; S637-W662 PolarHBondContact N-O 2.63Å
663	K	42.1	Very low	49.2	Very low	129 Å²	129	64.5 Å²	64.5	56%	0.561	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	114.2	163	-61.6	-169.5	-179.1	-169.3	0	110.1	D640	D640-K663 IonicContact OD2-NZ 2.89Å; D640-K663 PolarHBondContact OD2-NZ 2.92Å
664	Y	49.8	Very low	52	Low	18 Å²	18	66 Å²	66	7%	0.071	34%	0.335	C	S	.	.			trans	-90.8	163.5	158	67.4	-72.7	0	0	0	108.8	Y636 S637 P639 T698 Y699 L701 L777	Y636-Y664 AromaticContact CD1-CD1 3.97Å; Y636-Y664 HydrophobicContact CD1-CD1 3.97Å; Y636-Y664 HydrophobicContact CD1-CG 4.34Å; Y636-Y664 HydrophobicContact CG-CD1 4.3Å; S637-Y664 VanDerWaalsContact O-CD1 3.22Å; S637-Y664 WeakPolarHBondContact O-CD1 3.23Å; S637-Y664 WeakPolarHBondContact O-CE1 3.19Å; P639-Y664 WeakPolarHBondContact CA-O 3.41Å; P639-Y664 WeakPolarHBondContact CB-O 3.45Å; P639-Y664 VanDerWaalsContact CD-CZ 3.44Å; P639-Y664 WeakPolarHBondContact CD-O 3.46Å; P639-Y664 HydrophobicContact CG-CD2 4.2Å; P639-Y664 HydrophobicContact CG-CE2 4.14Å; P639-Y664 WeakPolarHBondContact CG-O 3.48Å; Y664-T698 HydrophobicContact CD2-CG2 4.29Å; Y664-T698 HydrophobicContact CE2-CG2 4.43Å; Y664-Y699 VanDerWaalsContact CA-O 3.3Å; Y664-Y699 WeakPolarHBondContact CA-O 3.15Å; Y664-Y699 VanDerWaalsContact CB-O 3.25Å; Y664-Y699 WeakPolarHBondContact CB-O 3.24Å; Y664-L701 HydrophobicContact CD1-CD2 4.49Å; Y664-L701 HydrophobicContact CD2-CD1 3.86Å; Y664-L701 HydrophobicContact CD2-CD2 4.42Å; Y664-L701 HydrophobicContact CD2-CG 4.1Å; Y664-L701 HydrophobicContact CE2-CD1 4.12Å; Y664-L701 HydrophobicContact CG-CD1 4.39Å; Y664-L701 HydrophobicContact CG-CD2 4.13Å; Y664-L701 HydrophobicContact CG-CG 4.2Å; Y664-L777 HydrophobicContact CE2-CD1 4.09Å
665	N	52	Low	54.6	Low	71 Å²	71	66.4 Å²	66.4	38%	0.38	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	138.6	174.2	-160.8	7.5	0	0	0	111	T698 Y699	N665-T698 CarbonylContact O-C 3.59Å; N665-T698 VanDerWaalsContact O-CA 3.27Å; N665-T698 WeakPolarHBondContact O-CA 3.23Å; N665-Y699 PolarHBondContact N-O 2.84Å; N665-Y699 PolarHBondContact O-N 2.91Å
666	L	52.8	Low	57.2	Low	42 Å²	42	60.8 Å²	60.8	22%	0.22	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	115.3	173.1	172	66.1	0	0	0	107.7	P639 K697 T698	P639-L666 HydrophobicContact CG-CB 4.34Å; L666-K697 WeakPolarHBondContact CA-O 3.49Å; L666-T698 HydrophobicContact CB-CG2 4.22Å; L666-T698 HydrophobicContact CD1-CG2 3.69Å
667	T	59.5	Low	59.4	Low	25 Å²	25	60.8 Å²	60.8	15%	0.153	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	139.3	172.7	62.8	0	0	0	0	110.2	E669 L696 K697 Y699	T667-E669 PolarHBondContact OG1-OE2 2.64Å; T667-L696 WeakPolarHBondContact O-CA 3.28Å; T667-K697 PolarHBondContact N-O 2.93Å; T667-K697 PolarHBondContact O-N 2.85Å; T667-Y699 HydrophobicContact CG2-CD2 4.28Å; T667-Y699 HydrophobicContact CG2-CE2 3.84Å
668	M	64.3	Low	61.6	Low	71 Å²	71	65.1 Å²	65.1	35%	0.35	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	104.2	161.3	-179.3	174.9	66.6	0	0	106.3	V694 E695 L696 L771	M668-V694 HydrophobicContact CG-CG1 3.66Å; M668-V694 HydrophobicContact SD-CG1 4.25Å; M668-E695 WeakPolarHBondContact CA-O 3.45Å; M668-L696 HydrophobicContact CB-CD2 3.71Å; M668-L696 HydrophobicContact CG-CD2 3.6Å; M668-L696 HydrophobicContact SD-CD2 3.96Å; M668-L771 HydrophobicContact CE-CB 3.9Å; M668-L771 HydrophobicContact SD-CB 4.22Å
669	E	69.1	Low	63.6	Low	53 Å²	53	64.1 Å²	64.1	25%	0.248	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	130.2	-175.7	-74.4	164	138.9	0	0	109.2	T667 Y671 P679 V694 E695	T667-E669 PolarHBondContact OG1-OE2 2.64Å; E669-Y671 HydrophobicContact CB-CD2 4.47Å; E669-Y671 HydrophobicContact CB-CE2 3.53Å; E669-Y671 WeakPolarHBondContact O-CD2 3.35Å; E669-Y671 WeakPolarHBondContact O-CE2 3.31Å; E669-P679 HydrophobicContact CB-CB 4.38Å; E669-V694 WeakPolarHBondContact O-CA 3.44Å; E669-E695 PolarHBondContact N-O 2.78Å; E669-E695 PolarHBondContact O-N 2.85Å
670	A	72.3	Confident	65	Low	26 Å²	26	64.9 Å²	64.9	22%	0.215	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	144.4	176.8	0	0	0	0	0	110.1	P679 I680 W693 V694	A670-P679 CarbonylContact O-C 3.43Å; A670-P679 WeakPolarHBondContact O-CA 3.3Å; A670-I680 HydrophobicContact CB-CD1 4.04Å; A670-I680 WeakPolarHBondContact O-CG1 3.48Å; A670-I680 PolarHBondContact O-N 2.81Å; A670-W693 CarbonylContact C-O 3.6Å; A670-W693 WeakPolarHBondContact CA-O 3.44Å; A670-V694 HydrophobicContact CB-CG2 4.37Å
671	Y	79.9	Confident	65.9	Low	17 Å²	17	68.7 Å²	68.7	7%	0.067	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	140.9	-173.3	-61.2	-94.5	0	0	0	109.9	E669 S673 R676 K678 P679 L692 W693 E695	E669-Y671 HydrophobicContact CB-CD2 4.47Å; E669-Y671 HydrophobicContact CB-CE2 3.53Å; E669-Y671 WeakPolarHBondContact O-CD2 3.35Å; E669-Y671 WeakPolarHBondContact O-CE2 3.31Å; Y671-S673 VanDerWaalsContact C-N 3.26Å; Y671-R676 VanDerWaalsContact CD1-C 3.45Å; Y671-R676 HydrophobicContact CD1-CB 3.8Å; Y671-R676 HydrophobicContact CD1-CG 4.36Å; Y671-R676 HydrophobicContact CD2-CB 4.04Å; Y671-R676 HydrophobicContact CD2-CG 3.91Å; Y671-R676 VanDerWaalsContact CE1-C 3.46Å; Y671-R676 HydrophobicContact CE1-CB 3.89Å; Y671-R676 WeakPolarHBondContact CE1-O 3.49Å; Y671-R676 HydrophobicContact CE2-CB 4.14Å; Y671-R676 HydrophobicContact CE2-CG 4.34Å; Y671-R676 HydrophobicContact CG-CB 3.88Å; Y671-R676 HydrophobicContact CG-CG 3.92Å; Y671-K678 VanDerWaalsContact CD1-C 3.46Å; Y671-K678 VanDerWaalsContact CD1-O 3.24Å; Y671-K678 WeakPolarHBondContact CD1-O 3.46Å; Y671-P679 HydrophobicContact CD1-CB 4.4Å; Y671-P679 HydrophobicContact CE1-CB 3.89Å; Y671-L692 WeakPolarHBondContact O-CA 3.34Å; Y671-W693 PolarHBondContact N-O 3.11Å; Y671-W693 PolarHBondContact O-N 3.43Å; Y671-E695 HydrophobicContact CE2-CB 4.05Å
672	T	78.5	Confident	66.2	Low	72 Å²	72	69.5 Å²	69.5	44%	0.442	36%	0.359	S	S	.	.	S	Bend	trans	-83.6	-1.3	173.8	52.5	0	0	0	0	113.2	I680 L692 W693	T672-I680 HydrophobicContact CG2-CD1 3.69Å; T672-I680 HydrophobicContact CG2-CG1 3.92Å; T672-L692 HydrophobicContact CG2-CD2 4.29Å; T672-W693 WeakPolarHBondContact O-CZ3 3.05Å
673	S	81.1	Confident	66.8	Low	33 Å²	33	75.3 Å²	75.3	23%	0.231	39%	0.392	C	S	.	.	S	Bend	trans	-139.5	148.4	-174.2	69.5	0	0	0	0	112.2	Y671 D675 R676	Y671-S673 VanDerWaalsContact C-N 3.26Å; S673-D675 VanDerWaalsContact C-N 3.32Å; S673-D675 WeakPolarHBondContact CB-OD1 3.38Å; S673-D675 PolarHBondContact O-N 2.86Å; S673-D675 PolarHBondContact OG-OD1 2.97Å; S673-R676 PolarHBondContact O-N 2.69Å
674	R	83	Confident	67.5	Low	164 Å²	164	71.4 Å²	71.4	62%	0.619	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-27.2	-174.1	-172.4	170.5	-169.9	-152.1	0.2	114	R676 W693 E745	R674-R676 PolarHBondContact O-N 2.89Å; R674-R676 PolarHBondContact O-NH1 2.81Å; R674-R676 VanDerWaalsContact O-NH1 3.1Å; R674-W693 HydrophobicContact CB-CD2 4.27Å; R674-W693 HydrophobicContact CB-CH2 4.41Å; R674-W693 HydrophobicContact CB-CZ2 3.73Å; R674-W693 HydrophobicContact CG-CZ2 4.3Å; R674-E745 IonicContact CZ-OE1 2.73Å; R674-E745 VanDerWaalsContact CZ-OE1 3.25Å; R674-E745 IonicContact NE-OE1 3.01Å; R674-E745 PolarHBondContact NE-OE1 3.16Å; R674-E745 IonicContact NH2-OE1 3.28Å; R674-E745 PolarHBondContact NH2-OE1 2.83Å
675	D	82	Confident	67.8	Low	101 Å²	101	78.7 Å²	78.7	54%	0.54	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-11.8	176.7	64.2	-36.9	0	0	0	113.3	S673 T677	S673-D675 VanDerWaalsContact C-N 3.32Å; S673-D675 WeakPolarHBondContact CB-OD1 3.38Å; S673-D675 PolarHBondContact O-N 2.86Å; S673-D675 PolarHBondContact OG-OD1 2.97Å; D675-T677 VanDerWaalsContact C-N 3.29Å; D675-T677 HydrophobicContact CB-CG2 4.17Å; D675-T677 PolarHBondContact O-N 3.25Å; D675-T677 WeakPolarHBondContact OD2-CB 3.4Å; D675-T677 WeakPolarHBondContact OD2-CG2 3.17Å; D675-T677 PolarHBondContact OD2-OG1 3.31Å
676	R	84.2	Confident	68.4	Low	70 Å²	70	78.7 Å²	78.7	26%	0.264	42%	0.423	S	S	.	.			trans	55.1	40.3	173	-59.5	178.5	-65.6	-90.5	8.5	113.6	Y671 S673 R674 W693 E695 E745	Y671-R676 VanDerWaalsContact CD1-C 3.45Å; Y671-R676 HydrophobicContact CD1-CB 3.8Å; Y671-R676 HydrophobicContact CD1-CG 4.36Å; Y671-R676 HydrophobicContact CD2-CB 4.04Å; Y671-R676 HydrophobicContact CD2-CG 3.91Å; Y671-R676 VanDerWaalsContact CE1-C 3.46Å; Y671-R676 HydrophobicContact CE1-CB 3.89Å; Y671-R676 WeakPolarHBondContact CE1-O 3.49Å; Y671-R676 HydrophobicContact CE2-CB 4.14Å; Y671-R676 HydrophobicContact CE2-CG 4.34Å; Y671-R676 HydrophobicContact CG-CB 3.88Å; Y671-R676 HydrophobicContact CG-CG 3.92Å; S673-R676 PolarHBondContact O-N 2.69Å; R674-R676 PolarHBondContact O-N 2.89Å; R674-R676 PolarHBondContact O-NH1 2.81Å; R674-R676 VanDerWaalsContact O-NH1 3.1Å; R676-W693 HydrophobicContact CG-CB 4.47Å; R676-E695 VanDerWaalsContact CD-OE2 3.29Å; R676-E695 WeakPolarHBondContact CD-OE2 3.35Å; R676-E695 IonicContact NE-OE2 2.76Å; R676-E695 PolarHBondContact NE-OE2 2.92Å; R676-E745 IonicContact CZ-OE2 2.95Å; R676-E745 IonicContact NH1-OE2 2.8Å; R676-E745 PolarHBondContact NH1-OE2 2.8Å
677	T	75	Confident	69.1	Low	104 Å²	104	82.6 Å²	82.6	64%	0.638	45%	0.445	S	S	*	.			trans	-86.3	-29.6	-173.3	42.7	0	0	0	0	114.8	D675	D675-T677 VanDerWaalsContact C-N 3.29Å; D675-T677 HydrophobicContact CB-CG2 4.17Å; D675-T677 PolarHBondContact O-N 3.25Å; D675-T677 WeakPolarHBondContact OD2-CB 3.4Å; D675-T677 WeakPolarHBondContact OD2-CG2 3.17Å; D675-T677 PolarHBondContact OD2-OG1 3.31Å
678	K	74.8	Confident	69.5	Low	129 Å²	129	86.8 Å²	86.8	56%	0.561	47%	0.465	S	S	*	.	S	Bend	trans	-132.2	120.4	171.1	-166.9	-160	166.4	-162.8	0	110.7	Y671 D681	Y671-K678 VanDerWaalsContact CD1-C 3.46Å; Y671-K678 VanDerWaalsContact CD1-O 3.24Å; Y671-K678 WeakPolarHBondContact CD1-O 3.46Å; K678-D681 IonicContact NZ-OD2 2.84Å; K678-D681 PolarHBondContact NZ-OD2 3.38Å
679	P	72.1	Confident	69.9	Low	50 Å²	50	88.8 Å²	88.8	33%	0.325	48%	0.478	S	S	.	.	B	Isolated β-bridge	trans	-68.4	156.3	173.2	30.3	-34.6	0	0	0	111.1	E669 A670 Y671	E669-P679 HydrophobicContact CB-CB 4.38Å; A670-P679 CarbonylContact O-C 3.43Å; A670-P679 WeakPolarHBondContact O-CA 3.3Å; Y671-P679 HydrophobicContact CD1-CB 4.4Å; Y671-P679 HydrophobicContact CE1-CB 3.89Å
680	I	66.4	Low	70.2	Confident	43 Å²	43	89.1 Å²	89.1	22%	0.221	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-74.9	130.9	176.6	-64.5	170.1	0	0	0	109.2	A670 T672 A684 I686 L692	A670-I680 HydrophobicContact CB-CD1 4.04Å; A670-I680 WeakPolarHBondContact O-CG1 3.48Å; A670-I680 PolarHBondContact O-N 2.81Å; T672-I680 HydrophobicContact CG2-CD1 3.69Å; T672-I680 HydrophobicContact CG2-CG1 3.92Å; I680-A684 HydrophobicContact CG2-CB 3.83Å; I680-I686 HydrophobicContact CD1-CD1 4.18Å; I680-I686 HydrophobicContact CG2-CD1 4.22Å; I680-L692 HydrophobicContact CD1-CD2 3.59Å
681	D	58.6	Low	70.8	Confident	98 Å²	98	92.1 Å²	92.1	52%	0.524	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-68.2	145.5	175.9	-64.1	-63.5	0	0	0	110.2	K678 D683 A684	K678-D681 IonicContact NZ-OD2 2.84Å; K678-D681 PolarHBondContact NZ-OD2 3.38Å; D681-D683 PolarHBondContact O-N 2.89Å; D681-A684 WeakPolarHBondContact O-CB 3.32Å; D681-A684 PolarHBondContact O-N 2.89Å; D681-A684 VanDerWaalsContact O-N 3.13Å
682	S	50.5	Low	70.8	Confident	117 Å²	117	91.7 Å²	91.7	82%	0.818	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-17.9	-168.9	58	0	0	0	0	115.7
683	D	53.8	Low	71.1	Confident	148 Å²	148	90 Å²	90	79%	0.791	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	15.1	-173.3	-50	-14.2	0	0	0	111.5	D681	D681-D683 PolarHBondContact O-N 2.89Å
684	A	56.9	Low	71	Confident	47 Å²	47	88.4 Å²	88.4	39%	0.388	46%	0.458	S	S	.	.			trans	-81.2	130.3	-177.7	0	0	0	0	0	112.6	I680 D681	I680-A684 HydrophobicContact CG2-CB 3.83Å; D681-A684 WeakPolarHBondContact O-CB 3.32Å; D681-A684 PolarHBondContact O-N 2.89Å; D681-A684 VanDerWaalsContact O-N 3.13Å
685	D	57.1	Low	70.9	Confident	172 Å²	172	81.5 Å²	81.5	92%	0.92	43%	0.433	S	S	*	.			trans	-66.7	133.3	168.6	-71.3	-47.5	0	0	0	110.6
686	I	65.5	Low	70.5	Confident	70 Å²	70	76.9 Å²	76.9	36%	0.359	41%	0.408	S	S	.	.			trans	-122.1	126.8	-179	-53.9	176.6	0	0	0	108.9	I680 Q690 L692 T759	I680-I686 HydrophobicContact CD1-CD1 4.18Å; I680-I686 HydrophobicContact CG2-CD1 4.22Å; I686-Q690 HydrophobicContact CG2-CB 4.47Å; I686-L692 HydrophobicContact CD1-CD1 4.09Å; I686-L692 HydrophobicContact CG2-CD1 4.38Å; I686-L692 HydrophobicContact CG2-CD2 4.12Å; I686-T759 HydrophobicContact CG2-CG2 3.52Å
687	D	66.7	Low	70	Confident	125 Å²	125	76.6 Å²	76.6	67%	0.668	41%	0.409	S	S	*	.			trans	-66.1	150.8	-179.5	-78.5	-44.8	0	0	0	111.8	Q690 T759	D687-Q690 HydrophobicContact CB-CB 4.26Å; D687-Q690 VanDerWaalsContact N-OE1 3.16Å; D687-Q690 VanDerWaalsContact O-CB 3.25Å; D687-Q690 WeakPolarHBondContact O-CB 3.48Å; D687-Q690 PolarHBondContact O-N 3.28Å; D687-T759 PolarHBondContact O-OG1 2.85Å
688	L	67.5	Low	69.6	Low	112 Å²	112	72 Å²	72	59%	0.586	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	144.3	173	-72.6	174.6	0	0	0	111.8	Q690 Q761	L688-Q690 PolarHBondContact O-N 2.88Å; L688-Q761 HydrophobicContact CD2-CB 3.88Å
689	N	72.1	Confident	69	Low	114 Å²	114	70.8 Å²	70.8	61%	0.61	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	14.3	-175.8	-167.5	48.3	0	0	0	114.5	N758 T759	N689-N758 PolarHBondContact O-ND2 2.6Å; N689-N758 PolarHBondContact OD1-ND2 2.87Å; N689-T759 WeakPolarHBondContact CA-O 3.29Å; N689-T759 PolarHBondContact N-O 3.14Å; N689-T759 PolarHBondContact N-OG1 3.25Å
690	Q	77	Confident	68.5	Low	60 Å²	60	70.7 Å²	70.7	28%	0.28	38%	0.381	S	S	.	.			trans	-73.6	134.9	168.9	-174.9	176.6	2.2	0	0	109.7	I686 D687 L688 N758 T759	I686-Q690 HydrophobicContact CG2-CB 4.47Å; D687-Q690 HydrophobicContact CB-CB 4.26Å; D687-Q690 VanDerWaalsContact N-OE1 3.16Å; D687-Q690 VanDerWaalsContact O-CB 3.25Å; D687-Q690 WeakPolarHBondContact O-CB 3.48Å; D687-Q690 PolarHBondContact O-N 3.28Å; L688-Q690 PolarHBondContact O-N 2.88Å; Q690-N758 CarbonylContact O-C 3.53Å; Q690-N758 WeakPolarHBondContact O-CA 3.44Å; Q690-T759 PolarHBondContact N-OG1 3.46Å; Q690-T759 WeakPolarHBondContact O-CG2 3.49Å; Q690-T759 PolarHBondContact O-N 3.46Å; Q690-T759 PolarHBondContact O-OG1 2.99Å
691	R	83.6	Confident	68.5	Low	89 Å²	89	69.6 Å²	69.6	34%	0.336	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	125.9	176.8	-166	174.3	-169.9	109.1	14.1	110.4	W693 T741 S756 F757	R691-W693 HydrophobicContact CB-CH2 4.11Å; R691-W693 HydrophobicContact CB-CZ3 4.17Å; R691-W693 HydrophobicContact CG-CH2 3.92Å; R691-W693 HydrophobicContact CG-CZ2 4.14Å; R691-W693 HydrophobicContact CG-CZ3 4.15Å; R691-W693 WeakPolarHBondContact O-CZ3 3.3Å; R691-T741 PolarHBondContact NH2-O 2.83Å; R691-S756 PolarHBondContact NE-OG 3.48Å; R691-S756 PolarHBondContact NH2-OG 2.67Å; R691-F757 WeakPolarHBondContact CA-O 3.48Å
692	L	80.3	Confident	69.1	Low	8 Å²	8	66.6 Å²	66.6	4%	0.042	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	149.1	171	-63.1	-175.4	0	0	0	110.7	Y671 T672 I680 I686 S756 F757 T759	Y671-L692 WeakPolarHBondContact O-CA 3.34Å; T672-L692 HydrophobicContact CG2-CD2 4.29Å; I680-L692 HydrophobicContact CD1-CD2 3.59Å; I686-L692 HydrophobicContact CD1-CD1 4.09Å; I686-L692 HydrophobicContact CG2-CD1 4.38Å; I686-L692 HydrophobicContact CG2-CD2 4.12Å; L692-S756 CarbonylContact O-C 3.58Å; L692-S756 WeakPolarHBondContact O-CA 3.28Å; L692-S756 WeakPolarHBondContact O-CB 3.14Å; L692-F757 HydrophobicContact CB-CE1 4.32Å; L692-F757 HydrophobicContact CD1-CZ 4.27Å; L692-F757 PolarHBondContact N-O 2.89Å; L692-F757 PolarHBondContact O-N 3.06Å; L692-F757 VanDerWaalsContact O-N 3.1Å; L692-T759 HydrophobicContact CD1-CG2 3.47Å; L692-T759 VanDerWaalsContact CD1-CG2 3.47Å; L692-T759 HydrophobicContact CD2-CG2 4.4Å; L692-T759 HydrophobicContact CG-CG2 3.59Å
693	W	84.8	Confident	70.1	Confident	35 Å²	35	66.8 Å²	66.8	13%	0.133	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.5	165.3	-68.7	-101.4	0	0	0	108.3	A670 Y671 T672 R674 R676 R691 F755	A670-W693 CarbonylContact C-O 3.6Å; A670-W693 WeakPolarHBondContact CA-O 3.44Å; Y671-W693 PolarHBondContact N-O 3.11Å; Y671-W693 PolarHBondContact O-N 3.43Å; T672-W693 WeakPolarHBondContact O-CZ3 3.05Å; R674-W693 HydrophobicContact CB-CD2 4.27Å; R674-W693 HydrophobicContact CB-CH2 4.41Å; R674-W693 HydrophobicContact CB-CZ2 3.73Å; R674-W693 HydrophobicContact CG-CZ2 4.3Å; R676-W693 HydrophobicContact CG-CB 4.47Å; R691-W693 HydrophobicContact CB-CH2 4.11Å; R691-W693 HydrophobicContact CB-CZ3 4.17Å; R691-W693 HydrophobicContact CG-CH2 3.92Å; R691-W693 HydrophobicContact CG-CZ2 4.14Å; R691-W693 HydrophobicContact CG-CZ3 4.15Å; R691-W693 WeakPolarHBondContact O-CZ3 3.3Å; W693-F755 CarbonylContact C-O 3.57Å; W693-F755 WeakPolarHBondContact CA-O 3.49Å
694	V	79.9	Confident	71	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	121.1	176.7	-179.2	0	0	0	0	107.8	M668 E669 A670 V754 F755 F757 L771	M668-V694 HydrophobicContact CG-CG1 3.66Å; M668-V694 HydrophobicContact SD-CG1 4.25Å; E669-V694 WeakPolarHBondContact O-CA 3.44Å; A670-V694 HydrophobicContact CB-CG2 4.37Å; V694-V754 WeakPolarHBondContact O-CA 3.41Å; V694-F755 HydrophobicContact CB-CD1 4.08Å; V694-F755 HydrophobicContact CB-CD2 4.45Å; V694-F755 HydrophobicContact CB-CE1 3.65Å; V694-F755 HydrophobicContact CB-CE2 4.05Å; V694-F755 HydrophobicContact CB-CG 4.47Å; V694-F755 HydrophobicContact CB-CZ 3.63Å; V694-F755 HydrophobicContact CG1-CD1 4.39Å; V694-F755 HydrophobicContact CG1-CE1 3.61Å; V694-F755 HydrophobicContact CG1-CZ 3.76Å; V694-F755 HydrophobicContact CG2-CE1 4.47Å; V694-F755 HydrophobicContact CG2-CE2 4.1Å; V694-F755 HydrophobicContact CG2-CZ 3.95Å; V694-F755 PolarHBondContact N-O 2.78Å; V694-F755 PolarHBondContact O-N 3.05Å; V694-F757 HydrophobicContact CG2-CE1 3.9Å; V694-L771 HydrophobicContact CG2-CD1 4.03Å
695	E	80.4	Confident	71.6	Confident	19 Å²	19	64.6 Å²	64.6	9%	0.089	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.9	172.3	-178.7	160.4	-169.4	0	0	109.4	M668 E669 Y671 R676 K697 S752 V754	M668-E695 WeakPolarHBondContact CA-O 3.45Å; E669-E695 PolarHBondContact N-O 2.78Å; E669-E695 PolarHBondContact O-N 2.85Å; Y671-E695 HydrophobicContact CE2-CB 4.05Å; R676-E695 VanDerWaalsContact CD-OE2 3.29Å; R676-E695 WeakPolarHBondContact CD-OE2 3.35Å; R676-E695 IonicContact NE-OE2 2.76Å; R676-E695 PolarHBondContact NE-OE2 2.92Å; E695-K697 HydrophobicContact CG-CB 4.04Å; E695-S752 PolarHBondContact OE1-OG 3.15Å; E695-V754 HydrophobicContact CB-CG2 4.03Å; E695-V754 HydrophobicContact CG-CG2 3.86Å
696	L	74	Confident	72.1	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.021	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	111.1	168.2	-65.4	167.3	0	0	0	106.7	T667 M668 T710 S752 T753 F755 C773 V775	T667-L696 WeakPolarHBondContact O-CA 3.28Å; M668-L696 HydrophobicContact CB-CD2 3.71Å; M668-L696 HydrophobicContact CG-CD2 3.6Å; M668-L696 HydrophobicContact SD-CD2 3.96Å; L696-T710 HydrophobicContact CD1-CG2 3.95Å; L696-T710 VanDerWaalsContact CD1-OG1 3.28Å; L696-T710 WeakPolarHBondContact CD1-OG1 3.3Å; L696-S752 CarbonylContact O-C 3.23Å; L696-S752 WeakPolarHBondContact O-CA 3.45Å; L696-S752 VanDerWaalsContact O-CB 3.31Å; L696-S752 WeakPolarHBondContact O-CB 3.3Å; L696-T753 PolarHBondContact N-O 3.35Å; L696-T753 PolarHBondContact O-N 3.01Å; L696-F755 HydrophobicContact CD1-CE1 4.29Å; L696-C773 HydrophobicContact CD1-CB 3.97Å; L696-C773 HydrophobicContact CD2-CB 4.19Å; L696-V775 HydrophobicContact CD1-CG2 4.28Å
697	K	72.6	Confident	72.8	Confident	64 Å²	64	53.1 Å²	53.1	28%	0.278	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	135.5	-172.8	-178.8	169.6	-176.9	176.4	0	112.9	L666 T667 E695 Y699	L666-K697 WeakPolarHBondContact CA-O 3.49Å; T667-K697 PolarHBondContact N-O 2.93Å; T667-K697 PolarHBondContact O-N 2.85Å; E695-K697 HydrophobicContact CG-CB 4.04Å; K697-Y699 HydrophobicContact CD-CE1 4.24Å; K697-Y699 HydrophobicContact CD-CE2 4.33Å; K697-Y699 HydrophobicContact CG-CE2 4.2Å
698	T	67.2	Low	73.2	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.043	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	135	172.7	51.7	0	0	0	0	112.1	Y664 N665 L666 L701 V708 T751	Y664-T698 HydrophobicContact CD2-CG2 4.29Å; Y664-T698 HydrophobicContact CE2-CG2 4.43Å; N665-T698 CarbonylContact O-C 3.59Å; N665-T698 VanDerWaalsContact O-CA 3.27Å; N665-T698 WeakPolarHBondContact O-CA 3.23Å; L666-T698 HydrophobicContact CB-CG2 4.22Å; L666-T698 HydrophobicContact CD1-CG2 3.69Å; T698-L701 HydrophobicContact CG2-CD1 4.09Å; T698-V708 HydrophobicContact CG2-CG2 3.74Å; T698-V708 WeakPolarHBondContact OG1-CG2 3.37Å; T698-T751 PolarHBondContact N-O 3.03Å; T698-T751 VanDerWaalsContact OG1-CB 3.27Å; T698-T751 WeakPolarHBondContact OG1-CB 3.33Å; T698-T751 PolarHBondContact OG1-O 3.08Å
699	Y	62	Low	73.8	Confident	104 Å²	104	42 Å²	42	41%	0.408	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.2	173.7	-63.5	-84.6	0	0	0	109.3	Y664 N665 T667 K697	Y664-Y699 VanDerWaalsContact CA-O 3.3Å; Y664-Y699 WeakPolarHBondContact CA-O 3.15Å; Y664-Y699 VanDerWaalsContact CB-O 3.25Å; Y664-Y699 WeakPolarHBondContact CB-O 3.24Å; N665-Y699 PolarHBondContact N-O 2.84Å; N665-Y699 PolarHBondContact O-N 2.91Å; T667-Y699 HydrophobicContact CG2-CD2 4.28Å; T667-Y699 HydrophobicContact CG2-CE2 3.84Å; K697-Y699 HydrophobicContact CD-CE1 4.24Å; K697-Y699 HydrophobicContact CD-CE2 4.33Å; K697-Y699 HydrophobicContact CG-CE2 4.2Å
700	G	61	Low	74.2	Confident	48 Å²	48	36.6 Å²	36.6	50%	0.495	18%	0.177	S	C	.	.	S	Bend	trans	95.2	7.4	179.6	0	0	0	0	0	115.8	Y636	Y636-G700 WeakPolarHBondContact CE1-O 3.14Å
701	L	66.9	Low	74.2	Confident	20 Å²	20	35.6 Å²	35.6	11%	0.105	17%	0.173	C	C	.	.	S	Bend	trans	-108.3	156.3	172.3	-61.4	-178.4	0	0	0	111.1	Y636 Y664 T698 V706 T751 L777	Y636-L701 HydrophobicContact CD1-CD2 4.03Å; Y636-L701 HydrophobicContact CE1-CD2 4.4Å; Y636-L701 HydrophobicContact CG-CD2 4.21Å; Y664-L701 HydrophobicContact CD1-CD2 4.49Å; Y664-L701 HydrophobicContact CD2-CD1 3.86Å; Y664-L701 HydrophobicContact CD2-CD2 4.42Å; Y664-L701 HydrophobicContact CD2-CG 4.1Å; Y664-L701 HydrophobicContact CE2-CD1 4.12Å; Y664-L701 HydrophobicContact CG-CD1 4.39Å; Y664-L701 HydrophobicContact CG-CD2 4.13Å; Y664-L701 HydrophobicContact CG-CG 4.2Å; T698-L701 HydrophobicContact CG2-CD1 4.09Å; L701-V706 HydrophobicContact CD1-CG1 4.32Å; L701-T751 HydrophobicContact CB-CG2 4.04Å; L701-L777 HydrophobicContact CD1-CD1 4.06Å; L701-L777 HydrophobicContact CD1-CD2 4.04Å
702	E	70.4	Confident	74.2	Confident	36 Å²	36	32.1 Å²	32.1	17%	0.168	16%	0.163	C	C	.	.			trans	-90.6	119.9	-179	-128.2	-176.6	178.2	0	0	111.9	S590 D704 R705 V706	S590-E702 WeakPolarHBondContact CB-OE1 3.23Å; E702-D704 VanDerWaalsContact C-N 3.3Å; E702-D704 WeakPolarHBondContact CB-OD1 3.49Å; E702-D704 WeakPolarHBondContact CG-OD1 3.38Å; E702-D704 PolarHBondContact O-N 2.96Å; E702-R705 HydrophobicContact CB-CB 4.26Å; E702-R705 HydrophobicContact CB-CG 4.28Å; E702-R705 PolarHBondContact O-N 3.49Å; E702-R705 WeakPolarHBondContact OE2-CD 3.26Å; E702-R705 IonicContact OE2-CZ 3.25Å; E702-R705 IonicContact OE2-NE 3.86Å; E702-R705 PolarHBondContact OE2-NE 3.06Å; E702-V706 PolarHBondContact O-N 2.81Å
703	E	72.3	Confident	74.3	Confident	121 Å²	121	31.8 Å²	31.8	57%	0.565	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-28.3	-173.9	-77.8	175.9	-151.8	0	0	114.7	T751 R780	E703-T751 HydrophobicContact CB-CG2 4.32Å; E703-T751 HydrophobicContact CG-CG2 3.44Å; E703-T751 VanDerWaalsContact CG-CG2 3.44Å; E703-T751 WeakPolarHBondContact CG-OG1 3.1Å; E703-T751 PolarHBondContact OE1-OG1 2.86Å; E703-T751 VanDerWaalsContact OE1-OG1 3.08Å; E703-R780 VanDerWaalsContact O-CD 3.24Å; E703-R780 WeakPolarHBondContact O-CD 3.18Å; E703-R780 PolarHBondContact O-NH1 3.25Å
704	D	73.4	Confident	74.3	Confident	96 Å²	96	30.9 Å²	30.9	51%	0.513	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-26.1	177.7	67.1	-42	0	0	0	112.8	E702 R780	E702-D704 VanDerWaalsContact C-N 3.3Å; E702-D704 WeakPolarHBondContact CB-OD1 3.49Å; E702-D704 WeakPolarHBondContact CG-OD1 3.38Å; E702-D704 PolarHBondContact O-N 2.96Å; D704-R780 WeakPolarHBondContact O-CB 3.37Å; D704-R780 WeakPolarHBondContact O-CD 3.45Å
705	R	67.9	Low	74.4	Confident	52 Å²	52	30.9 Å²	30.9	20%	0.196	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-32.8	-178.6	-59.3	-168.8	-169.4	-112.2	-19.7	115.1	E702 R780	E702-R705 HydrophobicContact CB-CB 4.26Å; E702-R705 HydrophobicContact CB-CG 4.28Å; E702-R705 PolarHBondContact O-N 3.49Å; E702-R705 WeakPolarHBondContact OE2-CD 3.26Å; E702-R705 IonicContact OE2-CZ 3.25Å; E702-R705 IonicContact OE2-NE 3.86Å; E702-R705 PolarHBondContact OE2-NE 3.06Å; R705-R780 PolarHBondContact O-N 2.68Å
706	V	69.1	Low	74	Confident	1 Å²	1	30 Å²	30	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	124.5	-174.6	-175.6	0	0	0	0	109.5	L701 E702 L777 C778	L701-V706 HydrophobicContact CD1-CG1 4.32Å; E702-V706 PolarHBondContact O-N 2.81Å; V706-L777 HydrophobicContact CG1-CB 4.19Å; V706-L777 HydrophobicContact CG1-CD2 4.19Å; V706-C778 WeakPolarHBondContact CA-O 3.2Å
707	A	78.7	Confident	73.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	140.1	172.7	0	0	0	0	0	110.6	G748 G750 C778 R780 C785	A707-G748 WeakPolarHBondContact CB-O 3.23Å; A707-G750 CarbonylContact C-O 3.56Å; A707-G750 WeakPolarHBondContact CA-O 3.37Å; A707-C778 PolarHBondContact N-O 2.04Å; A707-C778 PolarHBondContact O-N 2.79Å; A707-R780 HydrophobicContact CB-CG 3.79Å; A707-C785 HydrophobicContact CB-CB 3.69Å
708	V	75.1	Confident	73.6	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.006	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	114.8	167.8	175.1	0	0	0	0	107.9	T698 G748 G750 T751 T753 V775 L777	T698-V708 HydrophobicContact CG2-CG2 3.74Å; T698-V708 WeakPolarHBondContact OG1-CG2 3.37Å; V708-G748 WeakPolarHBondContact O-CA 3.36Å; V708-G748 PolarHBondContact O-N 2.84Å; V708-G750 PolarHBondContact N-O 3.35Å; V708-T751 WeakPolarHBondContact CG2-O 3.42Å; V708-T753 PolarHBondContact O-OG1 2.99Å; V708-V775 HydrophobicContact CG1-CG1 3.37Å; V708-L777 HydrophobicContact CG2-CD2 3.87Å
709	V	80.6	Confident	73.3	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.024	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	112.5	179.1	-178.3	0	0	0	0	108.7	D711 N747 V775 E776 C778 C785 Q787	V709-D711 PolarHBondContact O-N 2.79Å; V709-N747 WeakPolarHBondContact CA-OD1 3.41Å; V709-V775 CarbonylContact O-C 3.54Å; V709-V775 WeakPolarHBondContact O-CA 2.91Å; V709-E776 HydrophobicContact CB-CB 4.46Å; V709-E776 PolarHBondContact N-O 3.29Å; V709-E776 PolarHBondContact O-N 3.17Å; V709-C778 HydrophobicContact CG2-CB 3.58Å; V709-C785 HydrophobicContact CG2-CB 3.95Å; V709-C785 WeakPolarHBondContact CG2-O 3.35Å; V709-Q787 HydrophobicContact CG1-CG 3.82Å
710	T	81.8	Confident	73.3	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	114.3	174.5	-59.9	0	0	0	0	109.1	L696 C713 I730 G733 N747 T753	L696-T710 HydrophobicContact CD1-CG2 3.95Å; L696-T710 VanDerWaalsContact CD1-OG1 3.28Å; L696-T710 WeakPolarHBondContact CD1-OG1 3.3Å; T710-C713 WeakPolarHBondContact CG2-SG 3.27Å; T710-I730 HydrophobicContact CG2-CD1 3.96Å; T710-I730 HydrophobicContact CG2-CG2 4.49Å; T710-G733 VanDerWaalsContact O-CA 3.25Å; T710-G733 WeakPolarHBondContact O-CA 3.21Å; T710-N747 PolarHBondContact N-OD1 3.05Å; T710-N747 PolarHBondContact O-ND2 2.8Å; T710-T753 WeakPolarHBondContact OG1-CB 3.44Å; T710-T753 VanDerWaalsContact OG1-CG2 3.31Å; T710-T753 WeakPolarHBondContact OG1-CG2 3.3Å; T710-T753 PolarHBondContact OG1-OG1 2.98Å
711	D	76.9	Confident	73.3	Confident	38 Å²	38	32 Å²	32	20%	0.203	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-47.7	179.7	160.5	67	0	0	0	111.3	V709 N732 G733 K774 E776	V709-D711 PolarHBondContact O-N 2.79Å; D711-N732 CarbonylContact O-C 3.51Å; D711-N732 WeakPolarHBondContact O-CA 3.29Å; D711-N732 PolarHBondContact O-N 3.29Å; D711-G733 PolarHBondContact O-N 2.88Å; D711-K774 HydrophobicContact CB-CG 4.23Å; D711-K774 VanDerWaalsContact CG-NZ 3.28Å; D711-K774 PolarHBondContact N-O 3.5Å; D711-K774 IonicContact OD1-NZ 3.17Å; D711-K774 VanDerWaalsContact OD2-CD 3.29Å; D711-K774 WeakPolarHBondContact OD2-CD 3.31Å; D711-K774 IonicContact OD2-NZ 3.87Å; D711-K774 PolarHBondContact OD2-NZ 2.98Å; D711-E776 HydrophobicContact CB-CG 4.13Å
712	S	82	Confident	73.2	Confident	17 Å²	17	35.3 Å²	35.3	12%	0.119	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	143.6	177.9	46.2	0	0	0	0	111.3	I730 C773 K774	S712-I730 WeakPolarHBondContact CA-O 3.16Å; S712-I730 WeakPolarHBondContact CB-O 3.26Å; S712-C773 CarbonylContact O-C 3.23Å; S712-C773 WeakPolarHBondContact O-CA 3.43Å; S712-K774 PolarHBondContact N-O 2.93Å; S712-K774 PolarHBondContact O-N 2.89Å
713	C	82.9	Confident	72.7	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.007	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.9	172.6	-69.3	0	0	0	0	108.7	T710 L729 I730 F755 H772 C773	T710-C713 WeakPolarHBondContact CG2-SG 3.27Å; C713-L729 PolarHBondContact O-N 3.31Å; C713-I730 HydrophobicContact CB-CB 4.05Å; C713-I730 HydrophobicContact CB-CD1 4.17Å; C713-I730 HydrophobicContact CB-CG1 4.18Å; C713-I730 PolarHBondContact N-O 2.97Å; C713-I730 VanDerWaalsContact N-O 3.15Å; C713-I730 PolarHBondContact O-N 3.24Å; C713-F755 HydrophobicContact CB-CE1 4.37Å; C713-F755 HydrophobicContact CB-CZ 4.06Å; C713-H772 CarbonylContact C-O 3.39Å; C713-H772 WeakPolarHBondContact CA-O 3.23Å; C713-C773 HydrophobicContact CB-CB 4.21Å; C713-C773 WeakPolarHBondContact CB-SG 3.32Å; C713-C773 WeakPolarHBondContact SG-CB 3.16Å; C713-C773 CovalentContact SG-SG 2.04Å; C713-C773 PolarHBondContact SG-SG 2.92Å
714	W	85.5	Confident	72.5	Confident	15 Å²	15	31.8 Å²	31.8	6%	0.057	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	156	-179.4	63.5	95.7	0	0	0	110.7	P721 R726 Y727 N728 H772 K774	W714-P721 HydrophobicContact CZ2-CB 3.39Å; W714-P721 HydrophobicContact CZ2-CG 4.39Å; W714-P721 PolarHBondContact NE1-O 2.01Å; W714-P721 VanDerWaalsContact NE1-O 3.16Å; W714-R726 HydrophobicContact CB-CG 4.27Å; W714-R726 VanDerWaalsContact CD2-CZ 3.45Å; W714-R726 HydrophobicContact CG-CG 4.24Å; W714-R726 VanDerWaalsContact CG-CZ 3.47Å; W714-Y727 CarbonylContact C-O 3.49Å; W714-Y727 WeakPolarHBondContact CA-O 3.49Å; W714-Y727 VanDerWaalsContact CB-O 3.28Å; W714-Y727 WeakPolarHBondContact CB-O 3.24Å; W714-N728 HydrophobicContact CB-CB 4.49Å; W714-N728 WeakPolarHBondContact CB-OD1 3.24Å; W714-H772 HydrophobicContact CD2-CB 3.92Å; W714-H772 VanDerWaalsContact CE2-CB 3.48Å; W714-H772 HydrophobicContact CG-CB 4.3Å; W714-H772 HydrophobicContact CH2-CB 4.34Å; W714-H772 HydrophobicContact CZ2-CB 3.73Å; W714-H772 PolarHBondContact N-O 2.96Å; W714-H772 AromaticContact NE1-CD2 3.8Å; W714-H772 AromaticContact NE1-CG 3.87Å; W714-H772 PolarHBondContact O-N 3.42Å; W714-K774 HydrophobicContact CH2-CB 4.12Å; W714-K774 HydrophobicContact CZ3-CB 3.94Å
715	A	80.8	Confident	72.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	154.4	172.3	0	0	0	0	0	111.2	R726 Y727 F760 F762 V769 F770 L771	A715-R726 WeakPolarHBondContact O-CA 3.27Å; A715-Y727 PolarHBondContact N-O 3.25Å; A715-Y727 PolarHBondContact O-N 2.99Å; A715-F760 HydrophobicContact CB-CE2 4.24Å; A715-F760 HydrophobicContact CB-CZ 3.61Å; A715-F762 HydrophobicContact CB-CE2 4.18Å; A715-F762 HydrophobicContact CB-CZ 4.3Å; A715-F762 WeakPolarHBondContact O-CZ 2.96Å; A715-V769 HydrophobicContact CB-CG1 3.59Å; A715-F770 CarbonylContact C-O 3.5Å; A715-F770 WeakPolarHBondContact CA-O 3.35Å; A715-L771 HydrophobicContact CB-CD2 4.06Å
716	T	72.6	Confident	73.2	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	160.2	173.7	52	0	0	0	0	113.2	R718 S720 L725 R726 V769 F770 H772	T716-R718 VanDerWaalsContact C-N 3.25Å; T716-R718 PolarHBondContact O-N 3.14Å; T716-R718 PolarHBondContact OG1-O 3.5Å; T716-S720 WeakPolarHBondContact CB-O 3.46Å; T716-S720 WeakPolarHBondContact CG2-O 3.38Å; T716-S720 PolarHBondContact OG1-O 3.29Å; T716-L725 VanDerWaalsContact CA-O 3.24Å; T716-L725 WeakPolarHBondContact CA-O 2.94Å; T716-R726 HydrophobicContact CG2-CB 4.17Å; T716-R726 HydrophobicContact CG2-CG 4.39Å; T716-V769 WeakPolarHBondContact O-CA 3.4Å; T716-F770 PolarHBondContact N-O 3.43Å; T716-F770 PolarHBondContact O-N 3.36Å; T716-H772 PolarHBondContact OG1-CD2 2.76Å; T716-H772 PolarHBondContact OG1-NE2 2.9Å
717	D	70.3	Confident	73.9	Confident	22 Å²	22	37.2 Å²	37.2	12%	0.118	21%	0.21	C	C	.	.	S	Bend	trans	-75.9	-10	175.3	69.7	-50.3	0	0	0	114.3	G724 L725 F762	D717-G724 PolarHBondContact OD1-N 3.08Å; D717-L725 HydrophobicContact CB-CB 4.05Å; D717-L725 HydrophobicContact CB-CD1 4.36Å; D717-L725 PolarHBondContact N-O 3.34Å; D717-L725 PolarHBondContact OD1-N 2.98Å; D717-F762 HydrophobicContact CB-CB 4.32Å; D717-F762 HydrophobicContact CB-CD2 4.11Å; D717-F762 HydrophobicContact CB-CG 4.33Å
718	R	67.4	Low	74.2	Confident	159 Å²	159	39.8 Å²	39.8	60%	0.6	22%	0.224	S	C	*	.	S	Bend	trans	-133.6	160.8	-177.8	-66.1	-177	-174.8	-148.2	-4.5	110.3	T716 S720 F770	T716-R718 VanDerWaalsContact C-N 3.25Å; T716-R718 PolarHBondContact O-N 3.14Å; T716-R718 PolarHBondContact OG1-O 3.5Å; R718-S720 PolarHBondContact O-N 3.19Å; R718-F770 WeakPolarHBondContact O-CB 3.19Å; R718-F770 VanDerWaalsContact O-CD2 3.27Å; R718-F770 WeakPolarHBondContact O-CD2 3.38Å; R718-F770 WeakPolarHBondContact O-CG 3.29Å
719	P	62.2	Low	74.7	Confident	54 Å²	54	39.7 Å²	39.7	35%	0.351	22%	0.224	S	C	.	.	S	Bend	trans	-53.4	-23.8	173.2	-24.6	32.3	0	0	0	113.7	F770 H772 Y817	P719-F770 HydrophobicContact CB-CD1 4.19Å; P719-F770 HydrophobicContact CB-CE1 4.15Å; P719-F770 HydrophobicContact CG-CD1 4.2Å; P719-F770 HydrophobicContact CG-CE1 3.69Å; P719-F770 HydrophobicContact CG-CE2 4.15Å; P719-F770 HydrophobicContact CG-CZ 3.66Å; P719-H772 PolarHBondContact O-CE1 2.94Å; P719-Y817 HydrophobicContact CB-CD2 3.21Å; P719-Y817 HydrophobicContact CB-CE2 3.42Å; P719-Y817 VanDerWaalsContact CB-CE2 3.42Å; P719-Y817 HydrophobicContact CB-CG 4.15Å; P719-Y817 HydrophobicContact CG-CE2 4.47Å; P719-Y817 WeakPolarHBondContact O-CB 3.21Å; P719-Y817 VanDerWaalsContact O-CD2 3.31Å; P719-Y817 WeakPolarHBondContact O-CD2 3.42Å
720	S	61.1	Low	74.9	Confident	32 Å²	32	39.5 Å²	39.5	22%	0.224	22%	0.223	C	C	.	.	S	Bend	trans	-76.1	129.6	174.2	-177.2	0	0	0	0	114.2	T716 R718 A722 G723 Y817	T716-S720 WeakPolarHBondContact CB-O 3.46Å; T716-S720 WeakPolarHBondContact CG2-O 3.38Å; T716-S720 PolarHBondContact OG1-O 3.29Å; R718-S720 PolarHBondContact O-N 3.19Å; S720-A722 PolarHBondContact O-N 3.32Å; S720-A722 PolarHBondContact OG-N 2.96Å; S720-G723 WeakPolarHBondContact O-CA 3.47Å; S720-G723 PolarHBondContact O-N 2.82Å; S720-Y817 WeakPolarHBondContact CA-O 3.35Å; S720-Y817 WeakPolarHBondContact CB-O 3.34Å; S720-Y817 PolarHBondContact OG-O 2.64Å
721	P	61.6	Low	75	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.026	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.2	164.8	23.9	-35.1	0	0	0	115.3	W714 G723 H772 T816 Y817	W714-P721 HydrophobicContact CZ2-CB 3.39Å; W714-P721 HydrophobicContact CZ2-CG 4.39Å; W714-P721 PolarHBondContact NE1-O 2.01Å; W714-P721 VanDerWaalsContact NE1-O 3.16Å; P721-G723 VanDerWaalsContact C-N 3.3Å; P721-H772 HydrophobicContact CB-CB 4.18Å; P721-T816 HydrophobicContact CG-CG2 4.16Å; P721-Y817 VanDerWaalsContact CD-N 3.28Å; P721-Y817 WeakPolarHBondContact CD-O 3.46Å
722	A	64.4	Low	75.2	Confident	88 Å²	88	46.4 Å²	46.4	73%	0.727	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	15.2	169.9	0	0	0	0	0	111.8	S720	S720-A722 PolarHBondContact O-N 3.32Å; S720-A722 PolarHBondContact OG-N 2.96Å
723	G	60.3	Low	75	Confident	12 Å²	12	45.7 Å²	45.7	12%	0.124	25%	0.254	C	S	.	.			trans	-51.3	151.8	173.8	0	0	0	0	0	112.8	S720 P721 L725	S720-G723 WeakPolarHBondContact O-CA 3.47Å; S720-G723 PolarHBondContact O-N 2.82Å; P721-G723 VanDerWaalsContact C-N 3.3Å; G723-L725 PolarHBondContact O-N 3.15Å; G723-L725 VanDerWaalsContact O-N 3.16Å
724	G	67.5	Low	75.3	Confident	71 Å²	71	47.1 Å²	47.1	73%	0.732	26%	0.264	S	S	*	.	S	Bend	trans	-62.9	-26.1	-169.7	0	0	0	0	0	113.6	D717	D717-G724 PolarHBondContact OD1-N 3.08Å
725	L	73.5	Confident	75.4	Confident	64 Å²	64	48.5 Å²	48.5	34%	0.335	28%	0.275	S	S	.	.	S	Bend	trans	-117.1	125.6	172.1	-56.6	173.5	0	0	0	109	T716 D717 G723 F762	T716-L725 VanDerWaalsContact CA-O 3.24Å; T716-L725 WeakPolarHBondContact CA-O 2.94Å; D717-L725 HydrophobicContact CB-CB 4.05Å; D717-L725 HydrophobicContact CB-CD1 4.36Å; D717-L725 PolarHBondContact N-O 3.34Å; D717-L725 PolarHBondContact OD1-N 2.98Å; G723-L725 PolarHBondContact O-N 3.15Å; G723-L725 VanDerWaalsContact O-N 3.16Å; L725-F762 HydrophobicContact CB-CB 4.27Å; L725-F762 HydrophobicContact CB-CD1 3.55Å; L725-F762 HydrophobicContact CB-CE1 3.98Å; L725-F762 HydrophobicContact CB-CG 3.92Å; L725-F762 HydrophobicContact CD1-CB 3.81Å; L725-F762 HydrophobicContact CD1-CD1 4.43Å; L725-F762 HydrophobicContact CD1-CG 4.39Å
726	R	83.6	Confident	75.7	Confident	120 Å²	120	49.1 Å²	49.1	45%	0.453	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	137	-177.1	173.2	172.8	169.9	152	2.6	111.3	W714 A715 T716 N728	W714-R726 HydrophobicContact CB-CG 4.27Å; W714-R726 VanDerWaalsContact CD2-CZ 3.45Å; W714-R726 HydrophobicContact CG-CG 4.24Å; W714-R726 VanDerWaalsContact CG-CZ 3.47Å; A715-R726 WeakPolarHBondContact O-CA 3.27Å; T716-R726 HydrophobicContact CG2-CB 4.17Å; T716-R726 HydrophobicContact CG2-CG 4.39Å; R726-N728 PolarHBondContact NE-OD1 3.04Å; R726-N728 PolarHBondContact NH2-OD1 2.7Å
727	Y	84.1	Confident	76.3	Confident	79 Å²	79	54.8 Å²	54.8	31%	0.31	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	118.2	175	-166.2	-94.4	0	0	0	110.7	W714 A715 L729 D739 F760	W714-Y727 CarbonylContact C-O 3.49Å; W714-Y727 WeakPolarHBondContact CA-O 3.49Å; W714-Y727 VanDerWaalsContact CB-O 3.28Å; W714-Y727 WeakPolarHBondContact CB-O 3.24Å; A715-Y727 PolarHBondContact N-O 3.25Å; A715-Y727 PolarHBondContact O-N 2.99Å; Y727-L729 HydrophobicContact CD1-CD2 3.97Å; Y727-L729 HydrophobicContact CE1-CD2 4.11Å; Y727-D739 HydrophobicContact CE1-CB 4.4Å; Y727-F760 HydrophobicContact CD1-CE1 4.1Å; Y727-F760 HydrophobicContact CD1-CE2 4.23Å; Y727-F760 AromaticContact CD1-CZ 3.71Å; Y727-F760 HydrophobicContact CD1-CZ 3.71Å; Y727-F760 HydrophobicContact CG-CE2 4.07Å; Y727-F760 AromaticContact CG-CZ 3.97Å; Y727-F760 HydrophobicContact CG-CZ 3.97Å
728	N	84.5	Confident	77.1	Confident	54 Å²	54	62.4 Å²	62.4	29%	0.289	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	128.9	179.9	-60.9	-41.4	0	0	0	110.6	W714 R726 I731 N736	W714-N728 HydrophobicContact CB-CB 4.49Å; W714-N728 WeakPolarHBondContact CB-OD1 3.24Å; R726-N728 PolarHBondContact NE-OD1 3.04Å; R726-N728 PolarHBondContact NH2-OD1 2.7Å; N728-I731 HydrophobicContact CB-CD1 4.1Å; N728-I731 HydrophobicContact CB-CG1 3.85Å; N728-N736 WeakPolarHBondContact O-CB 3.49Å; N728-N736 PolarHBondContact O-ND2 2.03Å
729	L	84.9	Confident	77.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-45.7	174.7	-62.4	171.9	0	0	0	110.5	C713 Y727 N736 V742 F755 F757 F760 L771	C713-L729 PolarHBondContact O-N 3.31Å; Y727-L729 HydrophobicContact CD1-CD2 3.97Å; Y727-L729 HydrophobicContact CE1-CD2 4.11Å; L729-N736 VanDerWaalsContact O-CB 3.31Å; L729-N736 WeakPolarHBondContact O-CB 3.38Å; L729-N736 PolarHBondContact O-N 3.1Å; L729-V742 HydrophobicContact CB-CG2 4.39Å; L729-V742 HydrophobicContact CD2-CG2 3.86Å; L729-V742 WeakPolarHBondContact O-CG1 3.32Å; L729-F755 HydrophobicContact CD1-CE2 4.12Å; L729-F757 HydrophobicContact CD1-CD1 3.97Å; L729-F757 HydrophobicContact CD1-CD2 4.01Å; L729-F757 HydrophobicContact CD1-CE1 4.03Å; L729-F757 HydrophobicContact CD1-CE2 4.07Å; L729-F757 HydrophobicContact CD1-CG 3.98Å; L729-F757 HydrophobicContact CD1-CZ 4.09Å; L729-F757 HydrophobicContact CD2-CB 4.06Å; L729-F757 HydrophobicContact CD2-CD2 3.84Å; L729-F757 HydrophobicContact CD2-CG 3.98Å; L729-F760 HydrophobicContact CD2-CE1 4.05Å; L729-L771 HydrophobicContact CD1-CD2 3.82Å
730	I	85.6	Confident	79	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.1	175.8	-60.7	175.8	0	0	0	109	T710 S712 C713 C734 V744 F755	T710-I730 HydrophobicContact CG2-CD1 3.96Å; T710-I730 HydrophobicContact CG2-CG2 4.49Å; S712-I730 WeakPolarHBondContact CA-O 3.16Å; S712-I730 WeakPolarHBondContact CB-O 3.26Å; C713-I730 HydrophobicContact CB-CB 4.05Å; C713-I730 HydrophobicContact CB-CD1 4.17Å; C713-I730 HydrophobicContact CB-CG1 4.18Å; C713-I730 PolarHBondContact N-O 2.97Å; C713-I730 VanDerWaalsContact N-O 3.15Å; C713-I730 PolarHBondContact O-N 3.24Å; I730-C734 CarbonylContact C-O 3.56Å; I730-C734 WeakPolarHBondContact CA-O 3.14Å; I730-C734 WeakPolarHBondContact CG2-O 3.43Å; I730-V744 HydrophobicContact CD1-CG2 3.69Å; I730-V744 HydrophobicContact CG1-CG2 3.98Å; I730-F755 HydrophobicContact CD1-CB 3.87Å; I730-F755 HydrophobicContact CD1-CD1 3.79Å; I730-F755 HydrophobicContact CD1-CD2 4.22Å; I730-F755 HydrophobicContact CD1-CE1 4.34Å; I730-F755 HydrophobicContact CD1-CG 3.72Å
731	I	83.1	Confident	80.3	Confident	61 Å²	61	59 Å²	59	31%	0.313	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	119.5	-179.3	-55.5	174.5	0	0	0	107.8	N728 G733 C734 N736	N728-I731 HydrophobicContact CB-CD1 4.1Å; N728-I731 HydrophobicContact CB-CG1 3.85Å; I731-G733 VanDerWaalsContact C-N 3.29Å; I731-G733 PolarHBondContact O-N 2.85Å; I731-C734 PolarHBondContact N-O 2.82Å; I731-C734 PolarHBondContact O-N 2.93Å; I731-C734 VanDerWaalsContact O-N 3.07Å; I731-N736 HydrophobicContact CD1-CB 4.13Å; I731-N736 HydrophobicContact CG1-CB 4.48Å
732	N	80.8	Confident	81.5	Confident	122 Å²	122	59.4 Å²	59.4	65%	0.652	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	47.7	-179.9	-53.2	-10.4	0	0	0	112.6	D711 C734	D711-N732 CarbonylContact O-C 3.51Å; D711-N732 WeakPolarHBondContact O-CA 3.29Å; D711-N732 PolarHBondContact O-N 3.29Å; N732-C734 VanDerWaalsContact C-N 3.27Å; N732-C734 PolarHBondContact O-N 3.39Å
733	G	79	Confident	82.7	Confident	2 Å²	2	57 Å²	57	2%	0.021	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	-1	179.9	0	0	0	0	0	116.7	T710 D711 I731 N747	T710-G733 VanDerWaalsContact O-CA 3.25Å; T710-G733 WeakPolarHBondContact O-CA 3.21Å; D711-G733 PolarHBondContact O-N 2.88Å; I731-G733 VanDerWaalsContact C-N 3.29Å; I731-G733 PolarHBondContact O-N 2.85Å; G733-N747 VanDerWaalsContact CA-ND2 3.33Å; G733-N747 WeakPolarHBondContact CA-ND2 3.33Å; G733-N747 PolarHBondContact O-ND2 2.77Å
734	C	87.7	Confident	84	Confident	31 Å²	31	58.1 Å²	58.1	21%	0.209	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	153.2	-175	-64.6	0	0	0	0	113.2	I730 I731 N732 C789	I730-C734 CarbonylContact C-O 3.56Å; I730-C734 WeakPolarHBondContact CA-O 3.14Å; I730-C734 WeakPolarHBondContact CG2-O 3.43Å; I731-C734 PolarHBondContact N-O 2.82Å; I731-C734 PolarHBondContact O-N 2.93Å; I731-C734 VanDerWaalsContact O-N 3.07Å; N732-C734 VanDerWaalsContact C-N 3.27Å; N732-C734 PolarHBondContact O-N 3.39Å; C734-C789 WeakPolarHBondContact CA-SG 3.47Å; C734-C789 HydrophobicContact CB-CB 3.96Å; C734-C789 WeakPolarHBondContact CB-SG 3.44Å; C734-C789 WeakPolarHBondContact SG-CA 3.45Å; C734-C789 WeakPolarHBondContact SG-CB 3.36Å; C734-C789 CovalentContact SG-SG 2.03Å; C734-C789 PolarHBondContact SG-SG 2.78Å
735	P	87.6	Confident	84.8	Confident	44 Å²	44	58.4 Å²	58.4	29%	0.286	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	141.8	172.1	-22.9	31.4	0	0	0	112.2	P737 V742 V744	P735-P737 WeakPolarHBondContact O-CD 3.35Å; P735-V742 HydrophobicContact CB-CB 4.25Å; P735-V742 HydrophobicContact CB-CG1 4.06Å; P735-V744 HydrophobicContact CG-CB 4.35Å; P735-V744 HydrophobicContact CG-CG2 3.99Å
736	N	88.3	Confident	85.1	Confident	13 Å²	13	56.3 Å²	56.3	7%	0.07	31%	0.306	C	S	.	.			trans	-60.2	116.2	174.5	173.8	5.1	0	0	0	110	N728 L729 I731 K738 D739	N728-N736 WeakPolarHBondContact O-CB 3.49Å; N728-N736 PolarHBondContact O-ND2 2.03Å; L729-N736 VanDerWaalsContact O-CB 3.31Å; L729-N736 WeakPolarHBondContact O-CB 3.38Å; L729-N736 PolarHBondContact O-N 3.1Å; I731-N736 HydrophobicContact CD1-CB 4.13Å; I731-N736 HydrophobicContact CG1-CB 4.48Å; N736-K738 PolarHBondContact O-N 2.82Å; N736-K738 WeakPolarHBondContact OD1-CB 3.22Å; N736-K738 PolarHBondContact OD1-N 2.81Å; N736-D739 HydrophobicContact CB-CB 4.44Å; N736-D739 PolarHBondContact O-N 2.97Å
737	P	85.4	Confident	85.1	Confident	119 Å²	119	51 Å²	51	77%	0.773	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-4.6	-175.5	29.6	-37.1	0	0	0	114.1	P735	P735-P737 WeakPolarHBondContact O-CD 3.35Å
738	K	85.7	Confident	84.9	Confident	182 Å²	182	47.2 Å²	47.2	79%	0.791	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-11.2	172.7	-57.8	-175.7	179.9	-179.8	0	113.4	N736	N736-K738 PolarHBondContact O-N 2.82Å; N736-K738 WeakPolarHBondContact OD1-CB 3.22Å; N736-K738 PolarHBondContact OD1-N 2.81Å
739	D	85.1	Confident	84.8	Confident	17 Å²	17	49.1 Å²	49.1	9%	0.091	28%	0.282	C	S	.	.			trans	-120.2	101	-178.6	-170.4	-17.9	0	0	0	110.1	Y727 N736 T741 V742	Y727-D739 HydrophobicContact CE1-CB 4.4Å; N736-D739 HydrophobicContact CB-CB 4.44Å; N736-D739 PolarHBondContact O-N 2.97Å; D739-T741 PolarHBondContact O-N 2.91Å; D739-T741 WeakPolarHBondContact OD1-CA 3.38Å; D739-T741 VanDerWaalsContact OD1-CB 3.28Å; D739-T741 WeakPolarHBondContact OD1-CB 3.45Å; D739-T741 WeakPolarHBondContact OD1-CG2 3.37Å; D739-T741 PolarHBondContact OD1-N 2.83Å; D739-T741 PolarHBondContact OD1-OG1 3.06Å; D739-T741 PolarHBondContact OD2-OG1 2.96Å; D739-V742 HydrophobicContact CB-CG2 3.87Å; D739-V742 PolarHBondContact O-N 2.79Å; D739-V742 WeakPolarHBondContact OD2-CG2 3.01Å
740	P	85.5	Confident	84.8	Confident	128 Å²	128	49.6 Å²	49.6	83%	0.831	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-6.6	179.7	32.2	-36.1	0	0	0	113.1
741	T	87.3	Confident	84.5	Confident	29 Å²	29	49.9 Å²	49.9	18%	0.178	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-25.6	177.3	78.2	0	0	0	0	111.8	R691 D739 N758	R691-T741 PolarHBondContact NH2-O 2.83Å; D739-T741 PolarHBondContact O-N 2.91Å; D739-T741 WeakPolarHBondContact OD1-CA 3.38Å; D739-T741 VanDerWaalsContact OD1-CB 3.28Å; D739-T741 WeakPolarHBondContact OD1-CB 3.45Å; D739-T741 WeakPolarHBondContact OD1-CG2 3.37Å; D739-T741 PolarHBondContact OD1-N 2.83Å; D739-T741 PolarHBondContact OD1-OG1 3.06Å; D739-T741 PolarHBondContact OD2-OG1 2.96Å; T741-N758 HydrophobicContact CG2-CB 3.88Å; T741-N758 PolarHBondContact OG1-N 3.35Å; T741-N758 VanDerWaalsContact OG1-N 3.13Å
742	V	88.3	Confident	84.5	Confident	11 Å²	11	48.9 Å²	48.9	7%	0.067	29%	0.287	C	S	.	.			trans	-75.7	128.3	-178.5	-170.5	0	0	0	0	111.7	L729 P735 D739 S756 F757	L729-V742 HydrophobicContact CB-CG2 4.39Å; L729-V742 HydrophobicContact CD2-CG2 3.86Å; L729-V742 WeakPolarHBondContact O-CG1 3.32Å; P735-V742 HydrophobicContact CB-CB 4.25Å; P735-V742 HydrophobicContact CB-CG1 4.06Å; D739-V742 HydrophobicContact CB-CG2 3.87Å; D739-V742 PolarHBondContact O-N 2.79Å; D739-V742 WeakPolarHBondContact OD2-CG2 3.01Å; V742-S756 CarbonylContact C-O 3.56Å; V742-S756 WeakPolarHBondContact CA-O 3.28Å; V742-F757 HydrophobicContact CG2-CB 3.88Å
743	A	89.3	Confident	84.7	Confident	39 Å²	39	43.1 Å²	43.1	32%	0.322	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	140.4	170.8	0	0	0	0	0	110.9	F755 S756	A743-F755 CarbonylContact O-C 3.43Å; A743-F755 WeakPolarHBondContact O-CA 3.17Å; A743-F755 WeakPolarHBondContact O-CB 3.18Å; A743-S756 PolarHBondContact N-O 2.81Å; A743-S756 PolarHBondContact O-N 2.84Å
744	V	88	Confident	85.1	Confident	35 Å²	35	43.5 Å²	43.5	21%	0.212	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.9	175.4	176.2	0	0	0	0	107.6	I730 P735 N747 T753 F755	I730-V744 HydrophobicContact CD1-CG2 3.69Å; I730-V744 HydrophobicContact CG1-CG2 3.98Å; P735-V744 HydrophobicContact CG-CB 4.35Å; P735-V744 HydrophobicContact CG-CG2 3.99Å; V744-N747 HydrophobicContact CG1-CB 4.13Å; V744-T753 HydrophobicContact CG1-CG2 4.46Å; V744-F755 HydrophobicContact CG2-CB 3.94Å
745	E	84.4	Confident	85.2	Confident	77 Å²	77	42 Å²	42	36%	0.36	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	-22.9	-177.1	-58.6	-158.6	128.4	0	0	112.3	R674 R676 V754	R674-E745 IonicContact CZ-OE1 2.73Å; R674-E745 VanDerWaalsContact CZ-OE1 3.25Å; R674-E745 IonicContact NE-OE1 3.01Å; R674-E745 PolarHBondContact NE-OE1 3.16Å; R674-E745 IonicContact NH2-OE1 3.28Å; R674-E745 PolarHBondContact NH2-OE1 2.83Å; R676-E745 IonicContact CZ-OE2 2.95Å; R676-E745 IonicContact NH1-OE2 2.8Å; R676-E745 PolarHBondContact NH1-OE2 2.8Å; E745-V754 HydrophobicContact CB-CB 4.33Å; E745-V754 HydrophobicContact CG-CB 4.5Å; E745-V754 HydrophobicContact CG-CG1 4.29Å; E745-V754 PolarHBondContact N-O 2.74Å
746	G	78.7	Confident	85.3	Confident	20 Å²	20	40.1 Å²	40.1	21%	0.206	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.8	147.6	173.1	0	0	0	0	0	111.3	T753	G746-T753 WeakPolarHBondContact O-CG2 3.35Å
747	N	83.3	Confident	85.3	Confident	7 Å²	7	39.9 Å²	39.9	4%	0.037	23%	0.234	C	C	.	.	S	Bend	trans	-139.7	123.1	-173.7	-171.9	0.7	0	0	0	110.4	V709 T710 G733 V744 T753 Q787	V709-N747 WeakPolarHBondContact CA-OD1 3.41Å; T710-N747 PolarHBondContact N-OD1 3.05Å; T710-N747 PolarHBondContact O-ND2 2.8Å; G733-N747 VanDerWaalsContact CA-ND2 3.33Å; G733-N747 WeakPolarHBondContact CA-ND2 3.33Å; G733-N747 PolarHBondContact O-ND2 2.77Å; V744-N747 HydrophobicContact CG1-CB 4.13Å; N747-T753 HydrophobicContact CB-CG2 4.48Å; N747-Q787 HydrophobicContact CB-CB 4.33Å; N747-Q787 PolarHBondContact O-N 2.9Å
748	G	80.1	Confident	85.2	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.205	C	C	.	.	S	Bend	trans	76.3	19.4	-176.2	0	0	0	0	0	115.7	A707 V708	A707-G748 WeakPolarHBondContact CB-O 3.23Å; V708-G748 WeakPolarHBondContact O-CA 3.36Å; V708-G748 PolarHBondContact O-N 2.84Å
749	L	83.3	Confident	84.7	Confident	95 Å²	95	28 Å²	28	50%	0.497	17%	0.173	S	C	.	.	S	Bend	trans	-89.9	-19.7	-177.9	-66.1	175.6	0	0	0	114.5	R780 I786	L749-R780 PolarHBondContact O-NH1 2.79Å; L749-I786 HydrophobicContact CD2-CD1 3.79Å; L749-I786 HydrophobicContact CD2-CG1 4.03Å; L749-I786 HydrophobicContact CD2-CG2 4.09Å
750	G	83.9	Confident	84.3	Confident	9 Å²	9	29.4 Å²	29.4	9%	0.093	18%	0.179	C	C	.	.	S	Bend	trans	-178	-156	-175.7	0	0	0	0	0	111.4	A707 V708 S752	A707-G750 CarbonylContact C-O 3.56Å; A707-G750 WeakPolarHBondContact CA-O 3.37Å; V708-G750 PolarHBondContact N-O 3.35Å; G750-S752 VanDerWaalsContact C-N 3.26Å; G750-S752 PolarHBondContact O-N 2.93Å
751	T	80.8	Confident	83.6	Confident	6 Å²	6	27.9 Å²	27.9	4%	0.037	16%	0.16	C	C	.	.	S	Bend	trans	-78.2	1.1	-178.4	51.2	0	0	0	0	114.9	T698 L701 E703 V708	T698-T751 PolarHBondContact N-O 3.03Å; T698-T751 VanDerWaalsContact OG1-CB 3.27Å; T698-T751 WeakPolarHBondContact OG1-CB 3.33Å; T698-T751 PolarHBondContact OG1-O 3.08Å; L701-T751 HydrophobicContact CB-CG2 4.04Å; E703-T751 HydrophobicContact CB-CG2 4.32Å; E703-T751 HydrophobicContact CG-CG2 3.44Å; E703-T751 VanDerWaalsContact CG-CG2 3.44Å; E703-T751 WeakPolarHBondContact CG-OG1 3.1Å; E703-T751 PolarHBondContact OE1-OG1 2.86Å; E703-T751 VanDerWaalsContact OE1-OG1 3.08Å; V708-T751 WeakPolarHBondContact CG2-O 3.42Å
752	S	82.9	Confident	82.8	Confident	41 Å²	41	27.5 Å²	27.5	29%	0.287	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	155.5	171.2	72.6	0	0	0	0	114.2	E695 L696 G750	E695-S752 PolarHBondContact OE1-OG 3.15Å; L696-S752 CarbonylContact O-C 3.23Å; L696-S752 WeakPolarHBondContact O-CA 3.45Å; L696-S752 VanDerWaalsContact O-CB 3.31Å; L696-S752 WeakPolarHBondContact O-CB 3.3Å; G750-S752 VanDerWaalsContact C-N 3.26Å; G750-S752 PolarHBondContact O-N 2.93Å
753	T	83.9	Confident	81.9	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	134	167.5	-64	0	0	0	0	107.6	L696 V708 T710 V744 G746 N747	L696-T753 PolarHBondContact N-O 3.35Å; L696-T753 PolarHBondContact O-N 3.01Å; V708-T753 PolarHBondContact O-OG1 2.99Å; T710-T753 WeakPolarHBondContact OG1-CB 3.44Å; T710-T753 VanDerWaalsContact OG1-CG2 3.31Å; T710-T753 WeakPolarHBondContact OG1-CG2 3.3Å; T710-T753 PolarHBondContact OG1-OG1 2.98Å; V744-T753 HydrophobicContact CG1-CG2 4.46Å; G746-T753 WeakPolarHBondContact O-CG2 3.35Å; N747-T753 HydrophobicContact CB-CG2 4.48Å
754	V	87.3	Confident	80.5	Confident	10 Å²	10	35.6 Å²	35.6	6%	0.061	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	133.1	174.8	-178.2	0	0	0	0	110.1	V694 E695 E745	V694-V754 WeakPolarHBondContact O-CA 3.41Å; E695-V754 HydrophobicContact CB-CG2 4.03Å; E695-V754 HydrophobicContact CG-CG2 3.86Å; E745-V754 HydrophobicContact CB-CB 4.33Å; E745-V754 HydrophobicContact CG-CB 4.5Å; E745-V754 HydrophobicContact CG-CG1 4.29Å; E745-V754 PolarHBondContact N-O 2.74Å
755	F	89.7	Confident	79.4	Confident	0 Å²	0	35 Å²	35	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	165.7	167.7	71.4	-86.5	0	0	0	111.3	W693 V694 L696 C713 L729 I730 A743 V744 F757	W693-F755 CarbonylContact C-O 3.57Å; W693-F755 WeakPolarHBondContact CA-O 3.49Å; V694-F755 HydrophobicContact CB-CD1 4.08Å; V694-F755 HydrophobicContact CB-CD2 4.45Å; V694-F755 HydrophobicContact CB-CE1 3.65Å; V694-F755 HydrophobicContact CB-CE2 4.05Å; V694-F755 HydrophobicContact CB-CG 4.47Å; V694-F755 HydrophobicContact CB-CZ 3.63Å; V694-F755 HydrophobicContact CG1-CD1 4.39Å; V694-F755 HydrophobicContact CG1-CE1 3.61Å; V694-F755 HydrophobicContact CG1-CZ 3.76Å; V694-F755 HydrophobicContact CG2-CE1 4.47Å; V694-F755 HydrophobicContact CG2-CE2 4.1Å; V694-F755 HydrophobicContact CG2-CZ 3.95Å; V694-F755 PolarHBondContact N-O 2.78Å; V694-F755 PolarHBondContact O-N 3.05Å; L696-F755 HydrophobicContact CD1-CE1 4.29Å; C713-F755 HydrophobicContact CB-CE1 4.37Å; C713-F755 HydrophobicContact CB-CZ 4.06Å; L729-F755 HydrophobicContact CD1-CE2 4.12Å; I730-F755 HydrophobicContact CD1-CB 3.87Å; I730-F755 HydrophobicContact CD1-CD1 3.79Å; I730-F755 HydrophobicContact CD1-CD2 4.22Å; I730-F755 HydrophobicContact CD1-CE1 4.34Å; I730-F755 HydrophobicContact CD1-CG 3.72Å; A743-F755 CarbonylContact O-C 3.43Å; A743-F755 WeakPolarHBondContact O-CA 3.17Å; A743-F755 WeakPolarHBondContact O-CB 3.18Å; V744-F755 HydrophobicContact CG2-CB 3.94Å; F755-F757 HydrophobicContact CD2-CD1 4.23Å; F755-F757 AromaticContact CE2-CD1 3.85Å; F755-F757 HydrophobicContact CE2-CD1 3.85Å; F755-F757 HydrophobicContact CE2-CE1 4.15Å
756	S	89.8	Confident	78	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	152	175.3	57.6	0	0	0	0	110.4	R691 L692 V742 A743	R691-S756 PolarHBondContact NE-OG 3.48Å; R691-S756 PolarHBondContact NH2-OG 2.67Å; L692-S756 CarbonylContact O-C 3.58Å; L692-S756 WeakPolarHBondContact O-CA 3.28Å; L692-S756 WeakPolarHBondContact O-CB 3.14Å; V742-S756 CarbonylContact C-O 3.56Å; V742-S756 WeakPolarHBondContact CA-O 3.28Å; A743-S756 PolarHBondContact N-O 2.81Å; A743-S756 PolarHBondContact O-N 2.84Å
757	F	88.6	Confident	76.9	Confident	8 Å²	8	36.9 Å²	36.9	4%	0.035	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	164.5	177.4	70.3	-75.6	0	0	0	109.4	R691 L692 V694 L729 V742 F755 F760 L771	R691-F757 WeakPolarHBondContact CA-O 3.48Å; L692-F757 HydrophobicContact CB-CE1 4.32Å; L692-F757 HydrophobicContact CD1-CZ 4.27Å; L692-F757 PolarHBondContact N-O 2.89Å; L692-F757 PolarHBondContact O-N 3.06Å; L692-F757 VanDerWaalsContact O-N 3.1Å; V694-F757 HydrophobicContact CG2-CE1 3.9Å; L729-F757 HydrophobicContact CD1-CD1 3.97Å; L729-F757 HydrophobicContact CD1-CD2 4.01Å; L729-F757 HydrophobicContact CD1-CE1 4.03Å; L729-F757 HydrophobicContact CD1-CE2 4.07Å; L729-F757 HydrophobicContact CD1-CG 3.98Å; L729-F757 HydrophobicContact CD1-CZ 4.09Å; L729-F757 HydrophobicContact CD2-CB 4.06Å; L729-F757 HydrophobicContact CD2-CD2 3.84Å; L729-F757 HydrophobicContact CD2-CG 3.98Å; V742-F757 HydrophobicContact CG2-CB 3.88Å; F755-F757 HydrophobicContact CD2-CD1 4.23Å; F755-F757 AromaticContact CE2-CD1 3.85Å; F755-F757 HydrophobicContact CE2-CD1 3.85Å; F755-F757 HydrophobicContact CE2-CE1 4.15Å; F757-F760 HydrophobicContact CD2-CD1 4.3Å; F757-F760 AromaticContact CD2-CE1 3.99Å; F757-F760 HydrophobicContact CD2-CE1 3.99Å; F757-F760 HydrophobicContact CE2-CD1 4.24Å; F757-F760 AromaticContact CE2-CE1 3.84Å; F757-F760 HydrophobicContact CE2-CE1 3.84Å; F757-L771 HydrophobicContact CE1-CD1 4.22Å; F757-L771 HydrophobicContact CE1-CD2 4.28Å; F757-L771 HydrophobicContact CZ-CD1 4.17Å; F757-L771 HydrophobicContact CZ-CD2 3.89Å
758	N	83.3	Confident	76	Confident	31 Å²	31	41.1 Å²	41.1	17%	0.166	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	136.6	170.8	-72	15.7	0	0	0	110.2	N689 Q690 T741	N689-N758 PolarHBondContact O-ND2 2.6Å; N689-N758 PolarHBondContact OD1-ND2 2.87Å; Q690-N758 CarbonylContact O-C 3.53Å; Q690-N758 WeakPolarHBondContact O-CA 3.44Å; T741-N758 HydrophobicContact CG2-CB 3.88Å; T741-N758 PolarHBondContact OG1-N 3.35Å; T741-N758 VanDerWaalsContact OG1-N 3.13Å
759	T	76.3	Confident	75.3	Confident	20 Å²	20	43.6 Å²	43.6	12%	0.123	28%	0.278	C	S	.	.			trans	-60.8	147.1	178.6	52.3	0	0	0	0	112.9	I686 D687 N689 Q690 L692	I686-T759 HydrophobicContact CG2-CG2 3.52Å; D687-T759 PolarHBondContact O-OG1 2.85Å; N689-T759 WeakPolarHBondContact CA-O 3.29Å; N689-T759 PolarHBondContact N-O 3.14Å; N689-T759 PolarHBondContact N-OG1 3.25Å; Q690-T759 PolarHBondContact N-OG1 3.46Å; Q690-T759 WeakPolarHBondContact O-CG2 3.49Å; Q690-T759 PolarHBondContact O-N 3.46Å; Q690-T759 PolarHBondContact O-OG1 2.99Å; L692-T759 HydrophobicContact CD1-CG2 3.47Å; L692-T759 VanDerWaalsContact CD1-CG2 3.47Å; L692-T759 HydrophobicContact CD2-CG2 4.4Å; L692-T759 HydrophobicContact CG-CG2 3.59Å
760	F	76.2	Confident	74.5	Confident	48 Å²	48	41.1 Å²	41.1	21%	0.211	26%	0.263	C	S	.	.			trans	-149.2	163.8	179.7	60.9	-84	0	0	0	109.1	A715 Y727 L729 F757 F762	A715-F760 HydrophobicContact CB-CE2 4.24Å; A715-F760 HydrophobicContact CB-CZ 3.61Å; Y727-F760 HydrophobicContact CD1-CE1 4.1Å; Y727-F760 HydrophobicContact CD1-CE2 4.23Å; Y727-F760 AromaticContact CD1-CZ 3.71Å; Y727-F760 HydrophobicContact CD1-CZ 3.71Å; Y727-F760 HydrophobicContact CG-CE2 4.07Å; Y727-F760 AromaticContact CG-CZ 3.97Å; Y727-F760 HydrophobicContact CG-CZ 3.97Å; L729-F760 HydrophobicContact CD2-CE1 4.05Å; F757-F760 HydrophobicContact CD2-CD1 4.3Å; F757-F760 AromaticContact CD2-CE1 3.99Å; F757-F760 HydrophobicContact CD2-CE1 3.99Å; F757-F760 HydrophobicContact CE2-CD1 4.24Å; F757-F760 AromaticContact CE2-CE1 3.84Å; F757-F760 HydrophobicContact CE2-CE1 3.84Å; F760-F762 HydrophobicContact CE2-CE1 4.24Å; F760-F762 AromaticContact CE2-CE2 3.95Å; F760-F762 HydrophobicContact CE2-CE2 3.95Å; F760-F762 AromaticContact CE2-CZ 3.79Å; F760-F762 HydrophobicContact CE2-CZ 3.79Å
761	Q	71.4	Confident	73.8	Confident	96 Å²	96	42 Å²	42	45%	0.449	27%	0.266	S	S	.	.			trans	-120.9	145.7	173.5	179.4	-174.9	3.4	0	0	109.4	L688	L688-Q761 HydrophobicContact CD2-CB 3.88Å
762	F	68.8	Low	73.3	Confident	20 Å²	20	42 Å²	42	9%	0.088	27%	0.266	C	S	.	.			trans	-75.2	125.2	171.9	-72.1	-75.2	0	0	0	111.3	A715 D717 L725 F760 G764 S765 V769	A715-F762 HydrophobicContact CB-CE2 4.18Å; A715-F762 HydrophobicContact CB-CZ 4.3Å; A715-F762 WeakPolarHBondContact O-CZ 2.96Å; D717-F762 HydrophobicContact CB-CB 4.32Å; D717-F762 HydrophobicContact CB-CD2 4.11Å; D717-F762 HydrophobicContact CB-CG 4.33Å; L725-F762 HydrophobicContact CB-CB 4.27Å; L725-F762 HydrophobicContact CB-CD1 3.55Å; L725-F762 HydrophobicContact CB-CE1 3.98Å; L725-F762 HydrophobicContact CB-CG 3.92Å; L725-F762 HydrophobicContact CD1-CB 3.81Å; L725-F762 HydrophobicContact CD1-CD1 4.43Å; L725-F762 HydrophobicContact CD1-CG 4.39Å; F760-F762 HydrophobicContact CE2-CE1 4.24Å; F760-F762 AromaticContact CE2-CE2 3.95Å; F760-F762 HydrophobicContact CE2-CE2 3.95Å; F760-F762 AromaticContact CE2-CZ 3.79Å; F760-F762 HydrophobicContact CE2-CZ 3.79Å; F762-G764 PolarHBondContact O-N 3.41Å; F762-G764 VanDerWaalsContact O-N 3.11Å; F762-S765 PolarHBondContact O-N 2.98Å; F762-S765 VanDerWaalsContact O-N 3.14Å; F762-S765 PolarHBondContact O-OG 2.96Å; F762-S765 VanDerWaalsContact O-OG 3.11Å; F762-V769 HydrophobicContact CD2-CG2 4.24Å; F762-V769 HydrophobicContact CE2-CG1 4.31Å
763	T	69.8	Low	72.6	Confident	134 Å²	134	40.5 Å²	40.5	82%	0.822	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	114.1	174.6	48.3	0	0	0	0	110.6
764	G	60.7	Low	71.9	Confident	86 Å²	86	42.4 Å²	42.4	89%	0.887	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.3	7.2	-179.5	0	0	0	0	0	115.7	F762	F762-G764 PolarHBondContact O-N 3.41Å; F762-G764 VanDerWaalsContact O-N 3.11Å
765	S	63.4	Low	71	Confident	23 Å²	23	42.3 Å²	42.3	16%	0.161	26%	0.262	C	S	.	.	S	Bend	trans	-98.5	166	174.5	77.4	0	0	0	0	113.6	F762 G767	F762-S765 PolarHBondContact O-N 2.98Å; F762-S765 VanDerWaalsContact O-N 3.14Å; F762-S765 PolarHBondContact O-OG 2.96Å; F762-S765 VanDerWaalsContact O-OG 3.11Å; S765-G767 PolarHBondContact O-N 3.11Å
766	S	56.7	Low	69.8	Low	101 Å²	101	43.4 Å²	43.4	71%	0.706	27%	0.268	S	S	*	.			trans	-77.8	36.1	177.6	64.9	0	0	0	0	114.2	N768	S766-N768 PolarHBondContact O-N 3.4Å
767	G	54.9	Low	68.6	Low	36 Å²	36	43.7 Å²	43.7	37%	0.371	27%	0.269	S	S	.	.	S	Bend	trans	80.1	-40.7	178.1	0	0	0	0	0	115.4	S765	S765-G767 PolarHBondContact O-N 3.11Å
768	N	63.9	Low	67.5	Low	96 Å²	96	43.3 Å²	43.3	51%	0.513	27%	0.267	S	S	.	.			trans	-66.4	137.4	-174.6	-63.5	-17.3	0	0	0	113.1	S766 F770	S766-N768 PolarHBondContact O-N 3.4Å; N768-F770 HydrophobicContact CB-CE2 3.67Å; N768-F770 HydrophobicContact CB-CZ 3.95Å
769	V	65.8	Low	66.6	Low	51 Å²	51	43.2 Å²	43.2	31%	0.309	27%	0.268	S	S	.	.			trans	-127.8	120.2	178.3	177.3	0	0	0	0	108.9	A715 T716 F762	A715-V769 HydrophobicContact CB-CG1 3.59Å; T716-V769 WeakPolarHBondContact O-CA 3.4Å; F762-V769 HydrophobicContact CD2-CG2 4.24Å; F762-V769 HydrophobicContact CE2-CG1 4.31Å
770	F	67.1	Low	66.2	Low	43 Å²	43	45.9 Å²	45.9	19%	0.189	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.8	-175.9	-61	-93.4	0	0	0	109.7	L644 A715 T716 R718 P719 N768 H772	L644-F770 HydrophobicContact CD2-CB 4.09Å; L644-F770 HydrophobicContact CD2-CD1 4.08Å; A715-F770 CarbonylContact C-O 3.5Å; A715-F770 WeakPolarHBondContact CA-O 3.35Å; T716-F770 PolarHBondContact N-O 3.43Å; T716-F770 PolarHBondContact O-N 3.36Å; R718-F770 WeakPolarHBondContact O-CB 3.19Å; R718-F770 VanDerWaalsContact O-CD2 3.27Å; R718-F770 WeakPolarHBondContact O-CD2 3.38Å; R718-F770 WeakPolarHBondContact O-CG 3.29Å; P719-F770 HydrophobicContact CB-CD1 4.19Å; P719-F770 HydrophobicContact CB-CE1 4.15Å; P719-F770 HydrophobicContact CG-CD1 4.2Å; P719-F770 HydrophobicContact CG-CE1 3.69Å; P719-F770 HydrophobicContact CG-CE2 4.15Å; P719-F770 HydrophobicContact CG-CZ 3.66Å; N768-F770 HydrophobicContact CB-CE2 3.67Å; N768-F770 HydrophobicContact CB-CZ 3.95Å; F770-H772 PolarHBondContact O-CD2 2.93Å; F770-H772 PolarHBondContact O-NE2 3.09Å
771	L	67.8	Low	65.6	Low	28 Å²	28	51.6 Å²	51.6	15%	0.147	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	135.7	177.2	-69.2	175	0	0	0	110.9	L644 M668 V694 A715 L729 F757	L644-L771 WeakPolarHBondContact CD2-O 3.08Å; M668-L771 HydrophobicContact CE-CB 3.9Å; M668-L771 HydrophobicContact SD-CB 4.22Å; V694-L771 HydrophobicContact CG2-CD1 4.03Å; A715-L771 HydrophobicContact CB-CD2 4.06Å; L729-L771 HydrophobicContact CD1-CD2 3.82Å; F757-L771 HydrophobicContact CE1-CD1 4.22Å; F757-L771 HydrophobicContact CE1-CD2 4.28Å; F757-L771 HydrophobicContact CZ-CD1 4.17Å; F757-L771 HydrophobicContact CZ-CD2 3.89Å
772	H	70.9	Confident	65.5	Low	7 Å²	7	49.7 Å²	49.7	3%	0.032	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	136.4	177.1	-57.6	-71.1	0	0	0	108.8	C713 W714 T716 P719 P721 F770	C713-H772 CarbonylContact C-O 3.39Å; C713-H772 WeakPolarHBondContact CA-O 3.23Å; W714-H772 HydrophobicContact CD2-CB 3.92Å; W714-H772 VanDerWaalsContact CE2-CB 3.48Å; W714-H772 HydrophobicContact CG-CB 4.3Å; W714-H772 HydrophobicContact CH2-CB 4.34Å; W714-H772 HydrophobicContact CZ2-CB 3.73Å; W714-H772 PolarHBondContact N-O 2.96Å; W714-H772 AromaticContact NE1-CD2 3.8Å; W714-H772 AromaticContact NE1-CG 3.87Å; W714-H772 PolarHBondContact O-N 3.42Å; T716-H772 PolarHBondContact OG1-CD2 2.76Å; T716-H772 PolarHBondContact OG1-NE2 2.9Å; P719-H772 PolarHBondContact O-CE1 2.94Å; P721-H772 HydrophobicContact CB-CB 4.18Å; F770-H772 PolarHBondContact O-CD2 2.93Å; F770-H772 PolarHBondContact O-NE2 3.09Å
773	C	68.9	Low	65.7	Low	9 Å²	9	53.2 Å²	53.2	6%	0.061	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	124.2	172.2	-70.5	0	0	0	0	109.9	L696 S712 C713 V775	L696-C773 HydrophobicContact CD1-CB 3.97Å; L696-C773 HydrophobicContact CD2-CB 4.19Å; S712-C773 CarbonylContact O-C 3.23Å; S712-C773 WeakPolarHBondContact O-CA 3.43Å; C713-C773 HydrophobicContact CB-CB 4.21Å; C713-C773 WeakPolarHBondContact CB-SG 3.32Å; C713-C773 WeakPolarHBondContact SG-CB 3.16Å; C713-C773 CovalentContact SG-SG 2.04Å; C713-C773 PolarHBondContact SG-SG 2.92Å; C773-V775 HydrophobicContact CB-CG2 3.98Å
774	K	68.3	Low	65.9	Low	41 Å²	41	50 Å²	50	18%	0.178	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	114.5	162.2	177.2	163.9	171.4	-71.6	0	107.3	D711 S712 W714 E776 V813 A814	D711-K774 HydrophobicContact CB-CG 4.23Å; D711-K774 VanDerWaalsContact CG-NZ 3.28Å; D711-K774 PolarHBondContact N-O 3.5Å; D711-K774 IonicContact OD1-NZ 3.17Å; D711-K774 VanDerWaalsContact OD2-CD 3.29Å; D711-K774 WeakPolarHBondContact OD2-CD 3.31Å; D711-K774 IonicContact OD2-NZ 3.87Å; D711-K774 PolarHBondContact OD2-NZ 2.98Å; S712-K774 PolarHBondContact N-O 2.93Å; S712-K774 PolarHBondContact O-N 2.89Å; W714-K774 HydrophobicContact CH2-CB 4.12Å; W714-K774 HydrophobicContact CZ3-CB 3.94Å; K774-E776 IonicContact NZ-OE1 2.66Å; K774-E776 PolarHBondContact NZ-OE1 2.91Å; K774-V813 WeakPolarHBondContact CA-O 3.07Å; K774-A814 HydrophobicContact CD-CB 4.04Å
775	V	68.9	Low	66.7	Low	7 Å²	7	45.9 Å²	45.9	4%	0.042	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.1	-176	-149.5	0	0	0	0	107.7	L696 V708 V709 C773 V813	L696-V775 HydrophobicContact CD1-CG2 4.28Å; V708-V775 HydrophobicContact CG1-CG1 3.37Å; V709-V775 CarbonylContact O-C 3.54Å; V709-V775 WeakPolarHBondContact O-CA 2.91Å; C773-V775 HydrophobicContact CB-CG2 3.98Å; V775-V813 PolarHBondContact N-O 2.83Å; V775-V813 VanDerWaalsContact O-CA 3.3Å; V775-V813 WeakPolarHBondContact O-CA 3.14Å; V775-V813 WeakPolarHBondContact O-CB 3.15Å; V775-V813 WeakPolarHBondContact O-CG2 3.49Å; V775-V813 PolarHBondContact O-N 3.29Å
776	E	64.1	Low	67.6	Low	24 Å²	24	46.8 Å²	46.8	11%	0.112	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	130.3	-177.6	-45.3	-156	150.5	0	0	109.6	V709 D711 K774 F810 I811 S812	V709-E776 HydrophobicContact CB-CB 4.46Å; V709-E776 PolarHBondContact N-O 3.29Å; V709-E776 PolarHBondContact O-N 3.17Å; D711-E776 HydrophobicContact CB-CG 4.13Å; K774-E776 IonicContact NZ-OE1 2.66Å; K774-E776 PolarHBondContact NZ-OE1 2.91Å; E776-F810 HydrophobicContact CB-CD1 4.39Å; E776-F810 WeakPolarHBondContact OE2-CD1 3.21Å; E776-I811 WeakPolarHBondContact CA-O 3.27Å; E776-I811 WeakPolarHBondContact CB-O 3.36Å; E776-S812 WeakPolarHBondContact OE1-CA 3.41Å; E776-S812 WeakPolarHBondContact OE1-CB 3.33Å
777	L	64.9	Low	68.6	Low	9 Å²	9	45.5 Å²	45.5	5%	0.047	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	116.4	170.2	-63.5	-178.7	0	0	0	107.7	I605 Y664 L701 V706 V708 I811	I605-L777 HydrophobicContact CD1-CB 4.19Å; I605-L777 HydrophobicContact CD1-CD1 4.22Å; I605-L777 HydrophobicContact CG1-CD1 3.88Å; Y664-L777 HydrophobicContact CE2-CD1 4.09Å; L701-L777 HydrophobicContact CD1-CD1 4.06Å; L701-L777 HydrophobicContact CD1-CD2 4.04Å; V706-L777 HydrophobicContact CG1-CB 4.19Å; V706-L777 HydrophobicContact CG1-CD2 4.19Å; V708-L777 HydrophobicContact CG2-CD2 3.87Å; L777-I811 HydrophobicContact CB-CB 4.28Å; L777-I811 HydrophobicContact CB-CD1 4.4Å; L777-I811 PolarHBondContact N-O 3.05Å; L777-I811 PolarHBondContact O-N 2.79Å
778	C	66.4	Low	69.9	Low	0 Å²	0	53 Å²	53	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.8	-180	174.9	0	0	0	0	109.5	V706 A707 V709 R780 C785 F810	V706-C778 WeakPolarHBondContact CA-O 3.2Å; A707-C778 PolarHBondContact N-O 2.04Å; A707-C778 PolarHBondContact O-N 2.79Å; V709-C778 HydrophobicContact CG2-CB 3.58Å; C778-R780 PolarHBondContact O-N 2.83Å; C778-C785 HydrophobicContact CB-CB 3.73Å; C778-C785 WeakPolarHBondContact CB-SG 3.36Å; C778-C785 WeakPolarHBondContact SG-CA 3.47Å; C778-C785 WeakPolarHBondContact SG-CB 3.33Å; C778-C785 CovalentContact SG-SG 2.04Å; C778-C785 PolarHBondContact SG-SG 2.9Å; C778-F810 HydrophobicContact CB-CD1 4.21Å; C778-F810 HydrophobicContact CB-CE1 4.04Å
779	V	63.6	Low	70.6	Confident	29 Å²	29	51.3 Å²	51.3	18%	0.176	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	120.2	173.6	-176.3	0	0	0	0	108.2	A600 Q781 N784 A809	A600-V779 HydrophobicContact CB-CG2 3.92Å; V779-Q781 PolarHBondContact O-N 2.97Å; V779-N784 PolarHBondContact O-ND2 2.9Å; V779-A809 HydrophobicContact CB-CB 4.2Å; V779-A809 HydrophobicContact CG2-CB 4.44Å
780	R	67	Low	70.5	Confident	75 Å²	75	53.5 Å²	53.5	28%	0.283	29%	0.286	S	S	.	.			trans	-70	124.1	-175.1	-64	-174.1	69.8	157.7	10.2	110.5	E703 D704 R705 A707 L749 C778	E703-R780 VanDerWaalsContact O-CD 3.24Å; E703-R780 WeakPolarHBondContact O-CD 3.18Å; E703-R780 PolarHBondContact O-NH1 3.25Å; D704-R780 WeakPolarHBondContact O-CB 3.37Å; D704-R780 WeakPolarHBondContact O-CD 3.45Å; R705-R780 PolarHBondContact O-N 2.68Å; A707-R780 HydrophobicContact CB-CG 3.79Å; L749-R780 PolarHBondContact O-NH1 2.79Å; C778-R780 PolarHBondContact O-N 2.83Å
781	Q	64.6	Low	69.7	Low	168 Å²	168	60.6 Å²	60.6	79%	0.785	32%	0.319	S	S	*	.	S	Bend	trans	-139.7	74.7	173.1	-159.7	172.9	27.2	0	0	107.5	V779 N784	V779-Q781 PolarHBondContact O-N 2.97Å; Q781-N784 PolarHBondContact N-ND2 2.76Å; Q781-N784 PolarHBondContact N-OD1 2.78Å
782	G	68.8	Low	68.4	Low	57 Å²	57	66.3 Å²	66.3	59%	0.588	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	-138.5	-167.9	0	0	0	0	0	112.3	N784	G782-N784 PolarHBondContact O-N 2.93Å
783	D	74	Confident	66.7	Low	93 Å²	93	70.6 Å²	70.6	50%	0.497	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	5.7	-179.6	-85.9	24.9	0	0	0	113.8	C785 I786 R788	D783-C785 PolarHBondContact O-N 2.69Å; D783-C785 VanDerWaalsContact O-N 3.07Å; D783-I786 HydrophobicContact CB-CD1 4.21Å; D783-I786 PolarHBondContact O-N 2.73Å; D783-R788 IonicContact OD2-CZ 2.66Å; D783-R788 IonicContact OD2-NH2 2.75Å; D783-R788 PolarHBondContact OD2-NH2 3.12Å
784	N	74.3	Confident	65.5	Low	66 Å²	66	82.5 Å²	82.5	35%	0.353	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.5	-172.4	70	-33.5	0	0	0	114.8	V779 Q781 G782	V779-N784 PolarHBondContact O-ND2 2.9Å; Q781-N784 PolarHBondContact N-ND2 2.76Å; Q781-N784 PolarHBondContact N-OD1 2.78Å; G782-N784 PolarHBondContact O-N 2.93Å
785	C	76.8	Confident	64	Low	1 Å²	1	84 Å²	84	1%	0.007	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-16.5	178.8	-55.5	0	0	0	0	114	A707 V709 C778 D783 Q787	A707-C785 HydrophobicContact CB-CB 3.69Å; V709-C785 HydrophobicContact CG2-CB 3.95Å; V709-C785 WeakPolarHBondContact CG2-O 3.35Å; C778-C785 HydrophobicContact CB-CB 3.73Å; C778-C785 WeakPolarHBondContact CB-SG 3.36Å; C778-C785 WeakPolarHBondContact SG-CA 3.47Å; C778-C785 WeakPolarHBondContact SG-CB 3.33Å; C778-C785 CovalentContact SG-SG 2.04Å; C778-C785 PolarHBondContact SG-SG 2.9Å; D783-C785 PolarHBondContact O-N 2.69Å; D783-C785 VanDerWaalsContact O-N 3.07Å; C785-Q787 PolarHBondContact O-N 3.07Å
786	I	82.3	Confident	62.4	Low	41 Å²	41	95.7 Å²	95.7	21%	0.21	51%	0.506	C	S	.	.			trans	-79.3	114	-170.1	-55.5	-179.8	0	0	0	110.5	L749 D783 R788	L749-I786 HydrophobicContact CD2-CD1 3.79Å; L749-I786 HydrophobicContact CD2-CG1 4.03Å; L749-I786 HydrophobicContact CD2-CG2 4.09Å; D783-I786 HydrophobicContact CB-CD1 4.21Å; D783-I786 PolarHBondContact O-N 2.73Å; I786-R788 HydrophobicContact CG2-CG 4.45Å; I786-R788 PolarHBondContact O-N 3.45Å
787	Q	78.4	Confident	61.7	Low	74 Å²	74	106.8 Å²	106.8	35%	0.346	55%	0.547	S	S	.	.			trans	-78.9	119.9	177.2	-62.8	-56.7	-37.5	0	0	111.2	V709 N747 C785	V709-Q787 HydrophobicContact CG1-CG 3.82Å; N747-Q787 HydrophobicContact CB-CB 4.33Å; N747-Q787 PolarHBondContact O-N 2.9Å; C785-Q787 PolarHBondContact O-N 3.07Å
788	R	80.9	Confident	60.1	Low	193 Å²	193	111.9 Å²	111.9	73%	0.728	58%	0.584	S	S	*	*			trans	-107.3	100.5	-178.3	-64.1	-173.1	-177.9	-164.4	2.2	111.3	D783 I786 A790	D783-R788 IonicContact OD2-CZ 2.66Å; D783-R788 IonicContact OD2-NH2 2.75Å; D783-R788 PolarHBondContact OD2-NH2 3.12Å; I786-R788 HydrophobicContact CG2-CG 4.45Å; I786-R788 PolarHBondContact O-N 3.45Å; R788-A790 PolarHBondContact O-N 2.94Å
789	C	78.3	Confident	58.4	Low	62 Å²	62	116.2 Å²	116.2	42%	0.419	62%	0.62	S	S	.	*			trans	-75.1	112	178.6	-56.7	0	0	0	0	111.6	C734 Q791	C734-C789 WeakPolarHBondContact CA-SG 3.47Å; C734-C789 HydrophobicContact CB-CB 3.96Å; C734-C789 WeakPolarHBondContact CB-SG 3.44Å; C734-C789 WeakPolarHBondContact SG-CA 3.45Å; C734-C789 WeakPolarHBondContact SG-CB 3.36Å; C734-C789 CovalentContact SG-SG 2.03Å; C734-C789 PolarHBondContact SG-SG 2.78Å; C789-Q791 PolarHBondContact O-N 2.94Å
790	A	63.4	Low	56.9	Low	97 Å²	97	125.6 Å²	125.6	80%	0.802	65%	0.652	S	S	*	*			trans	-69.7	119.4	175.7	0	0	0	0	0	111	R788	R788-A790 PolarHBondContact O-N 2.94Å
791	Q	50.8	Low	55	Low	191 Å²	191	128 Å²	128	89%	0.893	68%	0.677	S	S	*	*			trans	-68.6	148.4	170.2	-68.7	-163.1	-6	0	0	111.1	C789 A793	C789-Q791 PolarHBondContact O-N 2.94Å; Q791-A793 PolarHBondContact O-N 2.87Å; Q791-A793 VanDerWaalsContact O-N 3.15Å
792	T	41.3	Very low	53.6	Low	148 Å²	148	128.8 Å²	128.8	91%	0.908	68%	0.678	S	S	*	*			trans	-74.4	101.4	-162.1	35.4	0	0	0	0	114.2
793	A	34.6	Very low	51.6	Low	97 Å²	97	136.3 Å²	136.3	80%	0.802	69%	0.69	S	S	*	*			trans	-112.1	134	159.4	0	0	0	0	0	110.7	Q791 G795	Q791-A793 PolarHBondContact O-N 2.87Å; Q791-A793 VanDerWaalsContact O-N 3.15Å; A793-G795 PolarHBondContact O-N 2.82Å
794	R	44.4	Very low	49.7	Very low	260 Å²	260	140.9 Å²	140.9	98%	0.981	71%	0.708	S	S	*	*			trans	-76.6	118.2	-172.4	-70	177	177.3	163.7	-1.1	112.6
795	G	37.2	Very low	47.4	Very low	72 Å²	72	143.5 Å²	143.5	74%	0.742	73%	0.727	S	S	*	*			trans	105.8	109.3	137	0	0	0	0	0	119.1	A793	A793-G795 PolarHBondContact O-N 2.82Å
796	R	35.1	Very low	45	Very low	252 Å²	252	149 Å²	149	95%	0.951	76%	0.76	S	S	*	*				-164.5	151	101.8	-113.3	178.7	175.7	175.1	-1	109.5	S798	R796-S798 PolarHBondContact O-N 3.12Å
797	R	47.7	Very low	42.5	Very low	257 Å²	257	154.3 Å²	154.3	97%	0.97	79%	0.789	S	S	*	*			trans	-73.3	110	170.5	-64.7	-179.5	-172.9	173.6	2.5	108.4
798	S	32.1	Very low	40.2	Very low	117 Å²	117	157.6 Å²	157.6	82%	0.818	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-93.8	146.8	154.1	61.5	0	0	0	0	109	R796	R796-S798 PolarHBondContact O-N 3.12Å
799	A	30.8	Very low	37.8	Very low	91 Å²	91	150.3 Å²	150.3	75%	0.752	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-71.1	150.2	178.8	0	0	0	0	0	111.1	P801	A799-P801 WeakPolarHBondContact O-CD 3.2Å
800	R	32.6	Very low	35.6	Very low	225 Å²	225	150.7 Å²	150.7	85%	0.849	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-53.1	128.9	165.1	-79.2	175	161.5	174	-8.6	110.1	K802	R800-K802 PolarHBondContact O-N 3.49Å
801	P	27.7	Very low	33.9	Very low	126 Å²	126	146.3 Å²	146.3	82%	0.818	75%	0.747	S	S	*	*			trans	-69.3	113.6	145.1	-3.8	22.1	0	0	0	107	A799 Y803	A799-P801 WeakPolarHBondContact O-CD 3.2Å; P801-Y803 PolarHBondContact O-N 2.75Å
802	K	34	Very low	32.9	Very low	185 Å²	185	140.3 Å²	140.3	80%	0.804	73%	0.726	S	S	*	*			trans	-76.8	106.5	157.5	-92.8	-170	171.3	-168.5	0	106.8	R800	R800-K802 PolarHBondContact O-N 3.49Å
803	Y	26.4	Very low	32.5	Very low	215 Å²	215	134.3 Å²	134.3	84%	0.843	69%	0.69	S	S	*	*			trans	-142.9	107	152.7	-110.4	-84	0	0	0	107.7	P801	P801-Y803 PolarHBondContact O-N 2.75Å
804	E	33.9	Very low	32.2	Very low	188 Å²	188	132.7 Å²	132.7	88%	0.879	68%	0.676	S	S	*	*			trans	-73.2	122.3	157.1	-71.2	167.9	120.8	0	0	107
805	T	26.1	Very low	31.7	Very low	121 Å²	121	121.8 Å²	121.8	74%	0.742	64%	0.635	S	S	*	*			trans	-167.9	121.6	141.6	18.4	0	0	0	0	111.1
806	V	27.3	Very low	31.1	Very low	116 Å²	116	122.4 Å²	122.4	70%	0.703	62%	0.624	S	S	*	*			trans	58.8	93.6	155.1	-163.7	0	0	0	0	117.2	L808	V806-L808 HydrophobicContact CG1-CG 4.3Å; V806-L808 PolarHBondContact O-N 2.82Å
807	N	30.3	Very low	30.7	Very low	154 Å²	154	117.7 Å²	117.7	82%	0.824	61%	0.608	S	S	*	*			trans	-63.2	120	157.2	-79.9	-12	0	0	0	109.7
808	L	30	Very low	29.9	Very low	142 Å²	142	110.8 Å²	110.8	74%	0.743	59%	0.59	S	S	*	*			trans	-99.2	132.5	166.5	-79.5	160.2	0	0	0	109.5	V806	V806-L808 HydrophobicContact CG1-CG 4.3Å; V806-L808 PolarHBondContact O-N 2.82Å
809	A	30.4	Very low	29.8	Very low	40 Å²	40	110.4 Å²	110.4	33%	0.331	58%	0.578	S	S	.	*	S	Bend	trans	66.2	34.3	163.6	0	0	0	0	0	119.6	V779	V779-A809 HydrophobicContact CB-CB 4.2Å; V779-A809 HydrophobicContact CG2-CB 4.44Å
810	F	31.4	Very low	29.7	Very low	70 Å²	70	111.5 Å²	111.5	31%	0.307	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.5	117	162.2	-70.9	-89.5	0	0	0	110.8	E776 C778 S812	E776-F810 HydrophobicContact CB-CD1 4.39Å; E776-F810 WeakPolarHBondContact OE2-CD1 3.21Å; C778-F810 HydrophobicContact CB-CD1 4.21Å; C778-F810 HydrophobicContact CB-CE1 4.04Å; F810-S812 PolarHBondContact O-N 3.07Å
811	I	28.3	Very low	29.6	Very low	5 Å²	5	104.8 Å²	104.8	3%	0.026	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.1	97	162.8	-55.3	-176.9	0	0	0	107.5	A600 N601 I605 E776 L777 V813	A600-I811 HydrophobicContact CB-CD1 3.89Å; A600-I811 HydrophobicContact CB-CG1 3.71Å; N601-I811 WeakPolarHBondContact O-CD1 3.34Å; N601-I811 WeakPolarHBondContact O-CG1 3.14Å; I605-I811 HydrophobicContact CD1-CD1 3.52Å; I605-I811 HydrophobicContact CG1-CD1 4.07Å; E776-I811 WeakPolarHBondContact CA-O 3.27Å; E776-I811 WeakPolarHBondContact CB-O 3.36Å; L777-I811 HydrophobicContact CB-CB 4.28Å; L777-I811 HydrophobicContact CB-CD1 4.4Å; L777-I811 PolarHBondContact N-O 3.05Å; L777-I811 PolarHBondContact O-N 2.79Å; I811-V813 HydrophobicContact CG2-CG2 3.99Å; I811-V813 PolarHBondContact O-N 3.11Å; I811-V813 VanDerWaalsContact O-N 3.1Å
812	S	29.8	Very low	29.7	Very low	66 Å²	66	103.5 Å²	103.5	46%	0.462	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	98.8	176.7	58.6	0	0	0	0	111.5	E776 F810 A814	E776-S812 WeakPolarHBondContact OE1-CA 3.41Å; E776-S812 WeakPolarHBondContact OE1-CB 3.33Å; F810-S812 PolarHBondContact O-N 3.07Å; S812-A814 PolarHBondContact O-N 3.17Å
813	V	32.3	Very low	29.4	Very low	22 Å²	22	98.1 Å²	98.1	13%	0.133	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	83.9	176.9	-157.5	0	0	0	0	109.7	K774 V775 I811 W815	K774-V813 WeakPolarHBondContact CA-O 3.07Å; V775-V813 PolarHBondContact N-O 2.83Å; V775-V813 VanDerWaalsContact O-CA 3.3Å; V775-V813 WeakPolarHBondContact O-CA 3.14Å; V775-V813 WeakPolarHBondContact O-CB 3.15Å; V775-V813 WeakPolarHBondContact O-CG2 3.49Å; V775-V813 PolarHBondContact O-N 3.29Å; I811-V813 HydrophobicContact CG2-CG2 3.99Å; I811-V813 PolarHBondContact O-N 3.11Å; I811-V813 VanDerWaalsContact O-N 3.1Å; V813-W815 HydrophobicContact CG1-CZ2 4.21Å; V813-W815 VanDerWaalsContact CG1-NE1 3.28Å; V813-W815 PolarHBondContact O-N 3.42Å
814	A	27.6	Very low	29.6	Very low	63 Å²	63	89.7 Å²	89.7	52%	0.521	49%	0.493	S	S	.	.			trans	-72.7	114.9	166.5	0	0	0	0	0	109.4	K774 S812	K774-A814 HydrophobicContact CD-CB 4.04Å; S812-A814 PolarHBondContact O-N 3.17Å
815	W	34.6	Very low	29.3	Very low	31 Å²	31	82.2 Å²	82.2	12%	0.117	46%	0.464	C	S	.	.			trans	-88.9	136.7	174.2	-79.9	91.7	0	0	0	111.6	V641 V646 R647 V813	V641-W815 HydrophobicContact CB-CH2 3.92Å; V641-W815 HydrophobicContact CB-CZ3 4.41Å; V641-W815 HydrophobicContact CG1-CH2 3.86Å; V641-W815 HydrophobicContact CG1-CZ3 4.02Å; V641-W815 HydrophobicContact CG2-CH2 3.49Å; V641-W815 VanDerWaalsContact CG2-CH2 3.49Å; V641-W815 HydrophobicContact CG2-CZ2 3.87Å; V641-W815 HydrophobicContact CG2-CZ3 4.43Å; V646-W815 WeakPolarHBondContact O-CZ3 3.38Å; R647-W815 HydrophobicContact CG-CH2 4.18Å; R647-W815 HydrophobicContact CG-CZ3 4.44Å; V813-W815 HydrophobicContact CG1-CZ2 4.21Å; V813-W815 VanDerWaalsContact CG1-NE1 3.28Å; V813-W815 PolarHBondContact O-N 3.42Å
816	T	25.5	Very low	29.5	Very low	84 Å²	84	78.9 Å²	78.9	52%	0.515	44%	0.44	S	S	.	.			trans	-142.8	130.6	177.4	54.4	0	0	0	0	114.6	S645 V646 P721	S645-T816 CarbonylContact C-O 3.57Å; S645-T816 CarbonylContact O-C 3.59Å; V646-T816 PolarHBondContact N-O 2.67Å; P721-T816 HydrophobicContact CG-CG2 4.16Å
817	Y	26.7	Very low	29.7	Very low	154 Å²	154	75.5 Å²	75.5	60%	0.604	42%	0.417	S	S	*	.			trans	-94	0	145.9	-128	-34.9	0	0	0	110.4	S645 V646 P719 S720 P721	S645-Y817 VanDerWaalsContact CB-CG 3.47Å; S645-Y817 VanDerWaalsContact CB-CZ 3.46Å; S645-Y817 PolarHBondContact O-N 2.94Å; S645-Y817 VanDerWaalsContact O-N 3.1Å; S645-Y817 WeakPolarHBondContact OG-CE2 3.18Å; S645-Y817 PolarHBondContact OG-OH 3.23Å; V646-Y817 HydrophobicContact CG2-CD1 4.44Å; V646-Y817 HydrophobicContact CG2-CE1 4.36Å; P719-Y817 HydrophobicContact CB-CD2 3.21Å; P719-Y817 HydrophobicContact CB-CE2 3.42Å; P719-Y817 VanDerWaalsContact CB-CE2 3.42Å; P719-Y817 HydrophobicContact CB-CG 4.15Å; P719-Y817 HydrophobicContact CG-CE2 4.47Å; P719-Y817 WeakPolarHBondContact O-CB 3.21Å; P719-Y817 VanDerWaalsContact O-CD2 3.31Å; P719-Y817 WeakPolarHBondContact O-CD2 3.42Å; S720-Y817 WeakPolarHBondContact CA-O 3.35Å; S720-Y817 WeakPolarHBondContact CB-O 3.34Å; S720-Y817 PolarHBondContact OG-O 2.64Å; P721-Y817 VanDerWaalsContact CD-N 3.28Å; P721-Y817 WeakPolarHBondContact CD-O 3.46Å

Retrieved 817 of 817 residues in 2052.4 ms (Link to these results)

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