A0A023GQ97_DROME Loading...

Eye-enriched kainate receptor, isoform D

AlphaFold DB , UniProt , Accession A0A023GQ97, Species DROME (Drosophila melanogaster, Fruit fly), Gene Ekar, Length 898 aa.

						>A0A023GQ97_DROME|A0A023GQ97|Ekar
MLIASGFLLFQFLSYGLGVPPLVRIGAIFSNQPGMYNSELAFRYAIHRLNMDKSLLPETTVDYYVEYVNRFDSFETVQKVCKLIRVGVQAVFSPTDSVLATHINSICDALDIPNIGRSAHDFSINVYPSKQLVNYAFNDVIQYLNWTRFGILHEKENGIINLHQLSRSFHGEVHMRQVSRDSYVSALNEFKGKEIHNIIIDTNSNGISILLKNILQQQMNEYKYHYLFTSFDLETYDLEDFKYNFVNITSFRLVDTADVGVKQILKDIGLYSHHIFKKPYLNLHIKKSTILESEPALMFDSVYVFAIGLQTLEQSHSLTLLNISCEEENSWDGGLSLINYLNAVEWKGLTGPIQFKDGQRVQFKLDLIKLKQHSIVKVGEWTPHGHLNITEPSMFFDAGSMNVTLVVITILETPYVMMHYGKNFTGNERFYGFCVDILETISREVGFDYILDLVPDRKYGAKDPETGEWNGMVAQLMKYADLAVGSMTITYARESVIDFTKPFMNLGISILFKVPTSEPTRLFSFMNPLAIEIWIYVLIAYFLVSLCIYIVGKLSPIEWKCINACDLENISIGNQFSLTDSFWFTIGTFMQQSPDIYPRAMSTRIISSTWGFFSLIIVASYTANLAAFLTTERMINPIENAEDLASQTEISYGTLDSGSTMTFFRDSVIETYKKIWRSMDNKKPSAFTTTYEDGIKRVNQGNYAFLMESTMLDYIVQRDCNLTQIGGLLDTKGYGIATPKGSPWRDKISLAILELQERGDIQMLYDKWWKNTDETCTRKNTSKQSKANSLGLESIGGVFVVLIAGIIVAAVVAFFEFWYNFRYNYEATPSQSVVNNKYNQDGILESERNYTPPDRSFWIEIAEELRYASWCMNKQKRPALTRTCSKCTIPKGQRINKL
					

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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	50.6	Low	43.7	Very low	241 Å²	241	140.2 Å²	140.2	100%	1.187	76%	0.756	S	S	*	*				0	127	0	-131	171.1	175.7	0	0	106.6
2	L	43.8	Very low	43.1	Very low	158 Å²	158	142.2 Å²	142.2	83%	0.827	75%	0.753	S	S	*	*			trans	84.7	43	-175.8	-68.2	156.1	0	0	0	119.8
3	I	45.9	Very low	42.4	Very low	160 Å²	160	142.2 Å²	142.2	82%	0.821	75%	0.752	S	S	*	*	S	Bend	trans	-131.3	-1.7	157.4	-58.4	-179.9	0	0	0	112.5	S5	I3-S5 PolarHBondContact O-N 3.41Å
4	A	43.2	Very low	41.9	Very low	93 Å²	93	138.3 Å²	138.3	77%	0.769	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	2.6	-174.8	0	0	0	0	0	115.4
5	S	46.9	Very low	41.6	Very low	91 Å²	91	142.8 Å²	142.8	64%	0.636	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	6	-174.1	44.4	0	0	0	0	114.9	I3	I3-S5 PolarHBondContact O-N 3.41Å
6	G	44.9	Very low	41.2	Very low	53 Å²	53	137.9 Å²	137.9	55%	0.546	74%	0.742	S	S	.	*	S	Bend	trans	-100.8	-16.9	177.5	0	0	0	0	0	115.4
7	F	43.7	Very low	41	Very low	175 Å²	175	140.8 Å²	140.8	77%	0.768	76%	0.756	S	S	*	*	S	Bend	trans	-92	-13.1	-173	-108.5	-90.6	0	0	0	114.8
8	L	42.8	Very low	40.6	Very low	123 Å²	123	136.6 Å²	136.6	64%	0.644	75%	0.752	S	S	*	*	S	Bend	trans	-86.3	-13	179.2	-85.8	160.6	0	0	0	114
9	L	41.9	Very low	40.4	Very low	133 Å²	133	136.2 Å²	136.2	70%	0.696	75%	0.753	S	S	*	*	S	Bend	trans	-91.6	-12.6	178.7	-102.8	151.9	0	0	0	113.9
10	F	39.7	Very low	40.9	Very low	168 Å²	168	132.2 Å²	132.2	74%	0.737	73%	0.733	S	S	*	*	S	Bend	trans	-97.5	-11.1	177	-113.3	-88.5	0	0	0	114.2
11	Q	37.2	Very low	42.3	Very low	147 Å²	147	129.2 Å²	129.2	69%	0.687	72%	0.72	S	S	*	*	S	Bend	trans	-85	-11.8	172.7	-91.1	-174.9	-28.1	0	0	114.2
12	F	36.1	Very low	43.8	Very low	164 Å²	164	121.2 Å²	121.2	72%	0.719	68%	0.682	S	S	*	*	S	Bend	trans	-92.9	-4.3	174.1	-89.3	-79.3	0	0	0	114.4
13	L	34.7	Very low	45.9	Very low	142 Å²	142	113.9 Å²	113.9	74%	0.743	64%	0.644	S	S	*	*	S	Bend	trans	-105.9	15.9	-179.9	-99.6	146.1	0	0	0	113.8
14	S	35.1	Very low	47.9	Very low	88 Å²	88	110.1 Å²	110.1	62%	0.615	62%	0.619	S	S	*	*			trans	-121.9	32.9	174.7	45.5	0	0	0	0	113	G16	S14-G16 PolarHBondContact O-N 3.46Å; S14-G16 VanDerWaalsContact O-N 3.15Å
15	Y	36.8	Very low	50.3	Low	206 Å²	206	105.7 Å²	105.7	81%	0.808	58%	0.583	S	S	*	*			trans	-70.5	104.3	149.1	-85.1	-83.3	0	0	0	106.7
16	G	35.4	Very low	52.4	Low	65 Å²	65	101.3 Å²	101.3	67%	0.67	55%	0.552	S	S	*	*			trans	-52.6	150.3	-176.2	0	0	0	0	0	111.9	S14 G18	S14-G16 PolarHBondContact O-N 3.46Å; S14-G16 VanDerWaalsContact O-N 3.15Å; G16-G18 PolarHBondContact O-N 2.87Å
17	L	37.3	Very low	54.7	Low	186 Å²	186	98.8 Å²	98.8	97%	0.974	53%	0.526	S	S	*	.			trans	-56.1	84.4	148.2	-81.8	95.3	0	0	0	107.6
18	G	35.2	Very low	56.8	Low	66 Å²	66	90.5 Å²	90.5	68%	0.68	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-77.9	121.3	168.4	0	0	0	0	0	107.6	G16	G16-G18 PolarHBondContact O-N 2.87Å
19	V	36.8	Very low	58.9	Low	128 Å²	128	85 Å²	85	78%	0.776	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-51.2	136.7	163.4	178.1	0	0	0	0	107.5
20	P	49.7	Very low	60.8	Low	56 Å²	56	79 Å²	79	36%	0.364	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-49.6	138.1	176.3	19.7	-33.2	0	0	0	110.6	L22 E58 T60	P20-L22 PolarHBondContact O-N 3.32Å; P20-L22 VanDerWaalsContact O-N 3.14Å; P20-E58 VanDerWaalsContact CA-O 3.29Å; P20-E58 WeakPolarHBondContact CA-O 3.28Å; P20-E58 WeakPolarHBondContact CB-O 3.16Å; P20-T60 HydrophobicContact CB-CG2 4.37Å; P20-T60 HydrophobicContact CG-CG2 4.2Å
21	P	70.5	Confident	62.3	Low	71 Å²	71	75.9 Å²	75.9	46%	0.461	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-50	123.5	172.2	17.4	-31.9	0	0	0	110.4	E58 T59 T60	P21-E58 WeakPolarHBondContact CD-O 3.39Å; P21-T59 HydrophobicContact CG-CG2 4.5Å; P21-T59 WeakPolarHBondContact CG-OG1 3.5Å; P21-T59 WeakPolarHBondContact O-CA 3.35Å; P21-T59 WeakPolarHBondContact O-CG2 3.35Å; P21-T60 PolarHBondContact O-N 3.28Å; P21-T60 VanDerWaalsContact O-N 3.09Å
22	L	81.9	Confident	63.5	Low	73 Å²	73	73 Å²	73	38%	0.382	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	115.9	178.9	-178.2	71.8	0	0	0	108.5	P20 D62	P20-L22 PolarHBondContact O-N 3.32Å; P20-L22 VanDerWaalsContact O-N 3.14Å; L22-D62 HydrophobicContact CD1-CB 3.79Å; L22-D62 HydrophobicContact CG-CB 4.46Å
23	V	87.3	Confident	64.3	Low	4 Å²	4	71.1 Å²	71.1	2%	0.024	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	127.2	176	160.3	0	0	0	0	109	I25 T59 T60 V61 D62 F305 L309	V23-I25 HydrophobicContact CG1-CG2 4.35Å; V23-T59 HydrophobicContact CB-CG2 4.09Å; V23-T59 HydrophobicContact CG2-CG2 3.55Å; V23-T60 PolarHBondContact N-O 3.29Å; V23-V61 HydrophobicContact CG1-CG2 4.41Å; V23-V61 CarbonylContact O-C 3.47Å; V23-V61 WeakPolarHBondContact O-CA 3.36Å; V23-D62 PolarHBondContact O-N 3.42Å; V23-F305 HydrophobicContact CG1-CE1 3.95Å; V23-F305 HydrophobicContact CG1-CZ 3.97Å; V23-L309 HydrophobicContact CB-CD2 4.43Å; V23-L309 HydrophobicContact CG1-CD2 4.05Å; V23-L309 HydrophobicContact CG2-CD2 4.04Å
24	R	89.6	Confident	65.2	Low	80 Å²	80	66.6 Å²	66.6	30%	0.302	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.9	-178.9	-64.9	-179.9	-174.4	157	5.9	110	D62 Y64 V86 V88 Q89	R24-D62 CarbonylContact C-O 3.48Å; R24-D62 WeakPolarHBondContact CA-O 3.23Å; R24-Y64 HydrophobicContact CB-CE2 4.35Å; R24-Y64 HydrophobicContact CG-CE2 4.17Å; R24-V86 PolarHBondContact NH1-O 2.98Å; R24-V88 HydrophobicContact CB-CG1 4.43Å; R24-V88 CarbonylContact O-C 3.43Å; R24-V88 VanDerWaalsContact O-CA 3.3Å; R24-V88 WeakPolarHBondContact O-CA 3.32Å; R24-Q89 PolarHBondContact O-N 3.37Å
25	I	92.3	Very high	66.3	Low	0 Å²	0	63.5 Å²	63.5	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	146.9	174.8	57.9	172.2	0	0	0	111.5	V23 F42 I46 V61 D62 Y63 Y64 A90 F92 F305	V23-I25 HydrophobicContact CG1-CG2 4.35Å; I25-F42 HydrophobicContact CD1-CE2 4.1Å; I25-F42 HydrophobicContact CD1-CZ 3.86Å; I25-F42 HydrophobicContact CG1-CZ 4.38Å; I25-I46 HydrophobicContact CD1-CD1 3.75Å; I25-I46 HydrophobicContact CD1-CG1 4.16Å; I25-V61 HydrophobicContact CD1-CG1 3.64Å; I25-V61 HydrophobicContact CG1-CG1 3.84Å; I25-V61 HydrophobicContact CG2-CG1 4.42Å; I25-D62 WeakPolarHBondContact CG1-O 3.45Å; I25-D62 PolarHBondContact N-O 3.04Å; I25-Y63 CarbonylContact O-C 3.56Å; I25-Y63 VanDerWaalsContact O-CA 3.29Å; I25-Y63 WeakPolarHBondContact O-CA 3.41Å; I25-Y64 PolarHBondContact O-N 3.3Å; I25-A90 HydrophobicContact CG2-CB 4.37Å; I25-F92 HydrophobicContact CB-CD2 4.46Å; I25-F92 HydrophobicContact CB-CE2 3.99Å; I25-F92 HydrophobicContact CD1-CD2 4.44Å; I25-F92 HydrophobicContact CD1-CE2 3.74Å; I25-F92 HydrophobicContact CD1-CZ 4.42Å; I25-F92 HydrophobicContact CG1-CE2 4.39Å; I25-F92 HydrophobicContact CG2-CE2 4.24Å; I25-F305 HydrophobicContact CG2-CD1 4.17Å; I25-F305 HydrophobicContact CG2-CE1 3.49Å; I25-F305 VanDerWaalsContact CG2-CE1 3.49Å; I25-F305 HydrophobicContact CG2-CE2 4.38Å; I25-F305 HydrophobicContact CG2-CZ 3.61Å
26	G	92.2	Very high	67.9	Low	0 Å²	0	56.2 Å²	56.2	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	140.2	177.3	0	0	0	0	0	111.2	Y64 A90 V91 F92	G26-Y64 CarbonylContact C-O 3.57Å; G26-Y64 WeakPolarHBondContact CA-O 3.34Å; G26-A90 PolarHBondContact N-O 2.83Å; G26-V91 CarbonylContact O-C 3.51Å; G26-V91 WeakPolarHBondContact O-CA 3.45Å; G26-F92 WeakPolarHBondContact O-CD2 3.31Å; G26-F92 PolarHBondContact O-N 3.47Å
27	A	91.6	Very high	69.9	Low	0 Å²	0	55.8 Å²	55.8	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	141	172.3	0	0	0	0	0	111.2	F29 F42 Y64 V65 E66 F92 M298	A27-F29 HydrophobicContact CB-CE2 3.87Å; A27-F29 HydrophobicContact CB-CZ 4.13Å; A27-F42 HydrophobicContact CB-CD1 4.18Å; A27-F42 HydrophobicContact CB-CE1 3.59Å; A27-F42 HydrophobicContact CB-CE2 4.03Å; A27-F42 HydrophobicContact CB-CZ 3.49Å; A27-F42 VanDerWaalsContact CB-CZ 3.49Å; A27-Y64 PolarHBondContact N-O 3.37Å; A27-V65 WeakPolarHBondContact O-CA 3.47Å; A27-E66 PolarHBondContact O-N 3.43Å; A27-F92 HydrophobicContact CB-CB 4.06Å; A27-M298 HydrophobicContact CB-CE 4.46Å
28	I	89.4	Confident	72	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	122.8	-179.3	-60.7	172	0	0	0	109	E66 V68 V80 L83 V91 F92 I103	I28-E66 WeakPolarHBondContact CA-O 3.45Å; I28-V68 HydrophobicContact CG2-CB 4.34Å; I28-V68 HydrophobicContact CG2-CG1 3.88Å; I28-V68 HydrophobicContact CG2-CG2 3.48Å; I28-V68 VanDerWaalsContact CG2-CG2 3.48Å; I28-V80 HydrophobicContact CD1-CB 4.43Å; I28-V80 HydrophobicContact CD1-CG2 3.34Å; I28-L83 HydrophobicContact CD1-CD1 4.07Å; I28-L83 HydrophobicContact CG1-CD1 3.74Å; I28-V91 HydrophobicContact CD1-CG1 4.17Å; I28-F92 PolarHBondContact N-O 3.37Å; I28-I103 HydrophobicContact CD1-CD1 3.97Å; I28-I103 HydrophobicContact CD1-CG1 4.29Å
29	F	87.1	Confident	74.4	Confident	8 Å²	8	44.7 Å²	44.7	4%	0.035	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	151.3	176.5	-60.8	-71.9	0	0	0	111.9	A27 E39 F42 V65 E66 Y67 V68 M298	A27-F29 HydrophobicContact CB-CE2 3.87Å; A27-F29 HydrophobicContact CB-CZ 4.13Å; F29-E39 HydrophobicContact CD2-CB 4.08Å; F29-E39 HydrophobicContact CD2-CG 4.01Å; F29-E39 HydrophobicContact CE1-CB 4.4Å; F29-E39 HydrophobicContact CE2-CB 3.94Å; F29-E39 HydrophobicContact CE2-CG 3.79Å; F29-E39 HydrophobicContact CG-CB 4.39Å; F29-E39 HydrophobicContact CZ-CB 4.11Å; F29-E39 HydrophobicContact CZ-CG 4.36Å; F29-F42 HydrophobicContact CE2-CD1 4.36Å; F29-F42 HydrophobicContact CZ-CB 3.95Å; F29-F42 HydrophobicContact CZ-CD1 4.23Å; F29-F42 HydrophobicContact CZ-CG 4.12Å; F29-V65 HydrophobicContact CD2-CG1 3.53Å; F29-V65 HydrophobicContact CE2-CG1 3.85Å; F29-V65 HydrophobicContact CE2-CG2 4.33Å; F29-E66 PolarHBondContact N-O 2.88Å; F29-Y67 HydrophobicContact CB-CD1 4.29Å; F29-Y67 HydrophobicContact CB-CE1 4.46Å; F29-Y67 WeakPolarHBondContact O-CA 3.37Å; F29-V68 PolarHBondContact O-N 3.5Å; F29-M298 HydrophobicContact CE1-CE 3.9Å; F29-M298 HydrophobicContact CE1-SD 4.33Å; F29-M298 HydrophobicContact CZ-CE 3.75Å
30	S	80.5	Confident	76.6	Confident	7 Å²	7	39 Å²	39	5%	0.049	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	145.3	174	-167.9	0	0	0	0	110.9	Q32 M35 V68	S30-Q32 PolarHBondContact O-N 3.3Å; S30-M35 WeakPolarHBondContact CB-SD 3.45Å; S30-V68 WeakPolarHBondContact CA-O 3.23Å
31	N	71.3	Confident	78.4	Confident	102 Å²	102	36.4 Å²	36.4	55%	0.545	20%	0.204	S	C	.	.	S	Bend	trans	-68.9	15.7	179	-85.7	-32.2	0	0	0	115.5	Y67 V68	N31-Y67 VanDerWaalsContact OD1-CB 3.29Å; N31-Y67 WeakPolarHBondContact OD1-CB 3.39Å; N31-V68 PolarHBondContact N-O 2.9Å; N31-V68 VanDerWaalsContact N-O 3.08Å
32	Q	63.4	Low	79.4	Confident	86 Å²	86	33 Å²	33	40%	0.402	18%	0.182	S	C	.	.	S	Bend	trans	-83.9	144.2	-175.4	-67.6	-144.7	-12.6	0	0	114	S30 G34 M35	S30-Q32 PolarHBondContact O-N 3.3Å; Q32-G34 PolarHBondContact O-N 3.15Å; Q32-G34 VanDerWaalsContact O-N 3.12Å; Q32-M35 PolarHBondContact O-N 3.14Å
33	P	51.6	Low	79.7	Confident	125 Å²	125	32.1 Å²	32.1	81%	0.812	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	111.1	169.8	27.2	-31.3	0	0	0	109.5
34	G	54.3	Low	79.8	Confident	47 Å²	47	32.6 Å²	32.6	49%	0.485	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	139	-37.5	-178.1	0	0	0	0	0	113.2	Q32 Y36 N37	Q32-G34 PolarHBondContact O-N 3.15Å; Q32-G34 VanDerWaalsContact O-N 3.12Å; G34-Y36 PolarHBondContact O-N 3.25Å; G34-Y36 VanDerWaalsContact O-N 3.15Å; G34-N37 PolarHBondContact O-N 2.99Å
35	M	58.2	Low	79.9	Confident	24 Å²	24	28.8 Å²	28.8	12%	0.118	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-3.8	179.7	-78	-164.8	150.7	0	0	114.8	S30 Q32 N37 S38 E39 T95	S30-M35 WeakPolarHBondContact CB-SD 3.45Å; Q32-M35 PolarHBondContact O-N 3.14Å; M35-N37 PolarHBondContact O-N 3.43Å; M35-S38 PolarHBondContact O-N 3.47Å; M35-S38 VanDerWaalsContact O-N 3.15Å; M35-E39 PolarHBondContact O-N 2.95Å; M35-E39 VanDerWaalsContact O-N 3.17Å; M35-T95 WeakPolarHBondContact CE-OG1 3.32Å
36	Y	69.7	Low	79.8	Confident	52 Å²	52	28.9 Å²	28.9	20%	0.204	16%	0.161	C	C	.	.	H	α-helix	trans	-58.1	-32.6	172.9	179.8	-90.3	0	0	0	112.5	G34 E39 L40 F276 L281	G34-Y36 PolarHBondContact O-N 3.25Å; G34-Y36 VanDerWaalsContact O-N 3.15Å; Y36-E39 PolarHBondContact O-N 2.95Å; Y36-L40 VanDerWaalsContact O-CB 3.31Å; Y36-L40 WeakPolarHBondContact O-CB 3.39Å; Y36-L40 PolarHBondContact O-N 3.38Å; Y36-F276 HydrophobicContact CE2-CD1 4.01Å; Y36-F276 AromaticContact CE2-CE1 3.49Å; Y36-F276 HydrophobicContact CE2-CE1 3.49Å; Y36-F276 VanDerWaalsContact CE2-CE1 3.49Å; Y36-F276 HydrophobicContact CE2-CE2 4.25Å; Y36-F276 AromaticContact CE2-CZ 3.61Å; Y36-F276 HydrophobicContact CE2-CZ 3.61Å; Y36-F276 AromaticContact CZ-CD1 3.92Å; Y36-F276 AromaticContact CZ-CD2 3.98Å; Y36-F276 AromaticContact CZ-CE1 3.71Å; Y36-F276 AromaticContact CZ-CE2 3.75Å; Y36-F276 AromaticContact CZ-CZ 3.6Å; Y36-F276 WeakPolarHBondContact OH-CD1 3.31Å; Y36-F276 WeakPolarHBondContact OH-CD2 3.27Å; Y36-F276 WeakPolarHBondContact OH-CE1 3.45Å; Y36-F276 WeakPolarHBondContact OH-CE2 3.45Å; Y36-F276 WeakPolarHBondContact OH-CG 3.39Å; Y36-F276 WeakPolarHBondContact OH-CZ 3.34Å; Y36-L281 HydrophobicContact CD1-CD2 4.41Å; Y36-L281 HydrophobicContact CD2-CD2 4.37Å; Y36-L281 HydrophobicContact CE1-CD2 3.69Å; Y36-L281 HydrophobicContact CE2-CD2 3.61Å; Y36-L281 WeakPolarHBondContact OH-CD2 3.39Å
37	N	77.1	Confident	79.7	Confident	57 Å²	57	32.3 Å²	32.3	31%	0.305	18%	0.177	S	C	.	.	H	α-helix	trans	-66.3	-38.5	177.5	-66.7	-15.1	0	0	0	111.7	G34 M35 L40 A41 E292 P295	G34-N37 PolarHBondContact O-N 2.99Å; M35-N37 PolarHBondContact O-N 3.43Å; N37-L40 PolarHBondContact O-N 3.47Å; N37-A41 WeakPolarHBondContact O-CB 3.35Å; N37-A41 PolarHBondContact O-N 3.17Å; N37-E292 PolarHBondContact ND2-OE2 3.48Å; N37-P295 HydrophobicContact CB-CB 4.48Å; N37-P295 HydrophobicContact CB-CG 3.58Å
38	S	82.6	Confident	79.6	Confident	7 Å²	7	35.7 Å²	35.7	5%	0.049	19%	0.19	C	C	.	.	H	α-helix	trans	-70	-39.7	177.5	-54.9	0	0	0	0	111.7	M35 A41 F42	M35-S38 PolarHBondContact O-N 3.47Å; M35-S38 VanDerWaalsContact O-N 3.15Å; S38-A41 PolarHBondContact O-N 2.99Å; S38-F42 WeakPolarHBondContact O-CB 3.27Å; S38-F42 PolarHBondContact O-N 3.34Å
39	E	85.3	Confident	79.7	Confident	12 Å²	12	35.9 Å²	35.9	6%	0.056	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-44.1	172.6	-175.8	-173.4	160.3	0	0	111.7	F29 M35 Y36 A41 F42 R43 Y67	F29-E39 HydrophobicContact CD2-CB 4.08Å; F29-E39 HydrophobicContact CD2-CG 4.01Å; F29-E39 HydrophobicContact CE1-CB 4.4Å; F29-E39 HydrophobicContact CE2-CB 3.94Å; F29-E39 HydrophobicContact CE2-CG 3.79Å; F29-E39 HydrophobicContact CG-CB 4.39Å; F29-E39 HydrophobicContact CZ-CB 4.11Å; F29-E39 HydrophobicContact CZ-CG 4.36Å; M35-E39 PolarHBondContact O-N 2.95Å; M35-E39 VanDerWaalsContact O-N 3.17Å; Y36-E39 PolarHBondContact O-N 2.95Å; E39-A41 VanDerWaalsContact C-N 3.34Å; E39-A41 PolarHBondContact O-N 3.01Å; E39-F42 WeakPolarHBondContact O-CB 3.09Å; E39-F42 PolarHBondContact O-N 3.49Å; E39-R43 WeakPolarHBondContact O-CG 3.32Å; E39-R43 PolarHBondContact O-N 3.4Å; E39-R43 IonicContact OE1-CZ 3.69Å; E39-R43 IonicContact OE1-NE 3.18Å; E39-R43 PolarHBondContact OE1-NE 3.2Å; E39-R43 IonicContact OE1-NH2 3.02Å; E39-R43 PolarHBondContact OE1-NH2 3.38Å; E39-Y67 PolarHBondContact OE1-OH 3.42Å; E39-Y67 WeakPolarHBondContact OE2-CE1 3.39Å; E39-Y67 PolarHBondContact OE2-OH 2.96Å
40	L	84	Confident	79.8	Confident	8 Å²	8	38.2 Å²	38.2	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-60.2	-45.2	176.8	177.5	66.8	0	0	0	111.2	Y36 N37 R43 Y44 I268 Y271 F276	Y36-L40 VanDerWaalsContact O-CB 3.31Å; Y36-L40 WeakPolarHBondContact O-CB 3.39Å; Y36-L40 PolarHBondContact O-N 3.38Å; N37-L40 PolarHBondContact O-N 3.47Å; L40-R43 PolarHBondContact O-N 3.34Å; L40-Y44 VanDerWaalsContact O-CB 3.29Å; L40-Y44 WeakPolarHBondContact O-CB 3.26Å; L40-Y44 PolarHBondContact O-N 2.84Å; L40-I268 HydrophobicContact CD2-CG2 3.97Å; L40-I268 HydrophobicContact CG-CG2 4.24Å; L40-Y271 HydrophobicContact CD1-CD1 4.07Å; L40-Y271 HydrophobicContact CD1-CE1 4.41Å; L40-F276 HydrophobicContact CD1-CE2 4.01Å
41	A	87.4	Confident	80.1	Confident	2 Å²	2	44.5 Å²	44.5	2%	0.017	23%	0.234	C	C	.	.	H	α-helix	trans	-62.3	-41.3	177.1	0	0	0	0	0	112.1	N37 S38 E39 A45 P295	N37-A41 WeakPolarHBondContact O-CB 3.35Å; N37-A41 PolarHBondContact O-N 3.17Å; S38-A41 PolarHBondContact O-N 2.99Å; E39-A41 VanDerWaalsContact C-N 3.34Å; E39-A41 PolarHBondContact O-N 3.01Å; A41-A45 VanDerWaalsContact O-CB 3.3Å; A41-A45 WeakPolarHBondContact O-CB 3.19Å; A41-A45 PolarHBondContact O-N 2.87Å; A41-P295 HydrophobicContact CB-CB 3.85Å; A41-P295 VanDerWaalsContact CB-O 3.32Å; A41-P295 WeakPolarHBondContact CB-O 3.31Å
42	F	89.8	Confident	80.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.8	-52.2	175	177.9	-104.6	0	0	0	112.5	I25 A27 F29 S38 E39 Y44 A45 I46 Y63 V65 F92 M298 V302	I25-F42 HydrophobicContact CD1-CE2 4.1Å; I25-F42 HydrophobicContact CD1-CZ 3.86Å; I25-F42 HydrophobicContact CG1-CZ 4.38Å; A27-F42 HydrophobicContact CB-CD1 4.18Å; A27-F42 HydrophobicContact CB-CE1 3.59Å; A27-F42 HydrophobicContact CB-CE2 4.03Å; A27-F42 HydrophobicContact CB-CZ 3.49Å; A27-F42 VanDerWaalsContact CB-CZ 3.49Å; F29-F42 HydrophobicContact CE2-CD1 4.36Å; F29-F42 HydrophobicContact CZ-CB 3.95Å; F29-F42 HydrophobicContact CZ-CD1 4.23Å; F29-F42 HydrophobicContact CZ-CG 4.12Å; S38-F42 WeakPolarHBondContact O-CB 3.27Å; S38-F42 PolarHBondContact O-N 3.34Å; E39-F42 WeakPolarHBondContact O-CB 3.09Å; E39-F42 PolarHBondContact O-N 3.49Å; F42-Y44 VanDerWaalsContact C-N 3.32Å; F42-Y44 PolarHBondContact O-N 3.46Å; F42-A45 PolarHBondContact O-N 3.27Å; F42-I46 HydrophobicContact CD1-CD1 3.82Å; F42-I46 HydrophobicContact CD2-CD1 4.15Å; F42-I46 HydrophobicContact CE1-CD1 3.39Å; F42-I46 HydrophobicContact CE2-CD1 3.77Å; F42-I46 HydrophobicContact CG-CD1 4.19Å; F42-I46 HydrophobicContact CZ-CD1 3.38Å; F42-I46 WeakPolarHBondContact O-CG1 3.35Å; F42-I46 PolarHBondContact O-N 3.31Å; F42-I46 VanDerWaalsContact O-N 3.13Å; F42-Y63 AromaticContact CE1-CD2 3.98Å; F42-Y63 HydrophobicContact CE1-CD2 3.98Å; F42-Y63 HydrophobicContact CE1-CG 4.17Å; F42-V65 HydrophobicContact CE1-CG2 4.33Å; F42-F92 HydrophobicContact CE2-CB 4.42Å; F42-F92 HydrophobicContact CE2-CD1 4.32Å; F42-F92 AromaticContact CE2-CD2 3.8Å; F42-F92 HydrophobicContact CE2-CD2 3.8Å; F42-F92 HydrophobicContact CE2-CE2 4.11Å; F42-F92 AromaticContact CE2-CG 3.92Å; F42-F92 HydrophobicContact CE2-CG 3.92Å; F42-F92 HydrophobicContact CE2-CZ 4.48Å; F42-F92 HydrophobicContact CZ-CD2 4.27Å; F42-M298 HydrophobicContact CB-CE 4Å; F42-M298 HydrophobicContact CB-CG 3.84Å; F42-M298 HydrophobicContact CD2-CE 3.26Å; F42-M298 HydrophobicContact CD2-CG 4.37Å; F42-M298 HydrophobicContact CE2-CE 3.84Å; F42-M298 HydrophobicContact CG-CE 3.79Å; F42-V302 HydrophobicContact CD2-CG2 3.48Å; F42-V302 VanDerWaalsContact CD2-CG2 3.48Å; F42-V302 HydrophobicContact CE2-CG2 3.8Å
43	R	89.4	Confident	81.6	Confident	53 Å²	53	44.5 Å²	44.5	20%	0.2	23%	0.231	C	C	.	.	H	α-helix	trans	-60.4	-42.7	178.9	-69.9	175.5	179.2	-126.9	3.7	111.6	E39 L40 H47 Y63 Y271	E39-R43 WeakPolarHBondContact O-CG 3.32Å; E39-R43 PolarHBondContact O-N 3.4Å; E39-R43 IonicContact OE1-CZ 3.69Å; E39-R43 IonicContact OE1-NE 3.18Å; E39-R43 PolarHBondContact OE1-NE 3.2Å; E39-R43 IonicContact OE1-NH2 3.02Å; E39-R43 PolarHBondContact OE1-NH2 3.38Å; L40-R43 PolarHBondContact O-N 3.34Å; R43-H47 WeakPolarHBondContact O-CB 3.44Å; R43-H47 PolarHBondContact O-N 2.77Å; R43-Y63 HydrophobicContact CG-CE2 4.07Å; R43-Y271 HydrophobicContact CB-CE1 4.39Å
44	Y	88.9	Confident	83.2	Confident	15 Å²	15	42.2 Å²	42.2	6%	0.059	22%	0.218	C	C	.	.	H	α-helix	trans	-65.6	-42.4	177.4	175	-99.1	0	0	0	112	L40 F42 I46 H47 R48 I264 D267 I268 Y271 F299	L40-Y44 VanDerWaalsContact O-CB 3.29Å; L40-Y44 WeakPolarHBondContact O-CB 3.26Å; L40-Y44 PolarHBondContact O-N 2.84Å; F42-Y44 VanDerWaalsContact C-N 3.32Å; F42-Y44 PolarHBondContact O-N 3.46Å; Y44-I46 VanDerWaalsContact C-N 3.34Å; Y44-I46 PolarHBondContact O-N 2.82Å; Y44-H47 PolarHBondContact O-N 2.87Å; Y44-R48 WeakPolarHBondContact O-CB 3.32Å; Y44-R48 PolarHBondContact O-N 3.33Å; Y44-I264 HydrophobicContact CE1-CG2 4.23Å; Y44-D267 HydrophobicContact CE2-CB 4.12Å; Y44-D267 WeakPolarHBondContact OH-CB 3.42Å; Y44-I268 HydrophobicContact CD1-CD1 4.01Å; Y44-I268 HydrophobicContact CD1-CG1 3.31Å; Y44-I268 HydrophobicContact CD2-CG1 4.33Å; Y44-I268 HydrophobicContact CE1-CD1 4.32Å; Y44-I268 HydrophobicContact CE1-CG1 3.59Å; Y44-I268 HydrophobicContact CG-CG1 3.72Å; Y44-Y271 AromaticContact CD2-CD1 3.85Å; Y44-Y271 HydrophobicContact CD2-CD1 3.85Å; Y44-Y271 HydrophobicContact CD2-CD2 4.07Å; Y44-Y271 HydrophobicContact CD2-CE1 4.46Å; Y44-Y271 AromaticContact CD2-CG 3.61Å; Y44-Y271 HydrophobicContact CD2-CG 3.61Å; Y44-Y271 HydrophobicContact CE2-CG 4.42Å; Y44-Y271 HydrophobicContact CG-CD1 4.33Å; Y44-F299 HydrophobicContact CD1-CD2 4.27Å; Y44-F299 AromaticContact CD1-CE2 3.94Å; Y44-F299 HydrophobicContact CD1-CE2 3.94Å; Y44-F299 AromaticContact CE1-CE2 3.95Å; Y44-F299 HydrophobicContact CE1-CE2 3.95Å
45	A	90.9	Very high	84.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.9	-46.2	177.6	0	0	0	0	0	111.4	A41 F42 R48 L49 F299 V302 Y303	A41-A45 VanDerWaalsContact O-CB 3.3Å; A41-A45 WeakPolarHBondContact O-CB 3.19Å; A41-A45 PolarHBondContact O-N 2.87Å; F42-A45 PolarHBondContact O-N 3.27Å; A45-R48 PolarHBondContact O-N 3.47Å; A45-L49 WeakPolarHBondContact O-CB 3.43Å; A45-L49 PolarHBondContact O-N 2.9Å; A45-F299 HydrophobicContact CB-CD2 3.61Å; A45-F299 HydrophobicContact CB-CE2 3.95Å; A45-F299 HydrophobicContact CB-CG 4.28Å; A45-V302 HydrophobicContact CB-CB 3.89Å; A45-V302 HydrophobicContact CB-CG1 4.03Å; A45-V302 HydrophobicContact CB-CG2 4Å; A45-Y303 HydrophobicContact CB-CE2 4.49Å
46	I	91.5	Very high	85.9	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-68.2	-42.6	178.6	-62.3	160.5	0	0	0	111.5	I25 F42 Y44 R48 L49 N50 V61 Y63 V302	I25-I46 HydrophobicContact CD1-CD1 3.75Å; I25-I46 HydrophobicContact CD1-CG1 4.16Å; F42-I46 HydrophobicContact CD1-CD1 3.82Å; F42-I46 HydrophobicContact CD2-CD1 4.15Å; F42-I46 HydrophobicContact CE1-CD1 3.39Å; F42-I46 HydrophobicContact CE2-CD1 3.77Å; F42-I46 HydrophobicContact CG-CD1 4.19Å; F42-I46 HydrophobicContact CZ-CD1 3.38Å; F42-I46 WeakPolarHBondContact O-CG1 3.35Å; F42-I46 PolarHBondContact O-N 3.31Å; F42-I46 VanDerWaalsContact O-N 3.13Å; Y44-I46 VanDerWaalsContact C-N 3.34Å; Y44-I46 PolarHBondContact O-N 2.82Å; I46-R48 VanDerWaalsContact C-N 3.29Å; I46-R48 PolarHBondContact O-N 3.46Å; I46-L49 PolarHBondContact O-N 3.28Å; I46-N50 WeakPolarHBondContact O-CB 3.17Å; I46-N50 PolarHBondContact O-N 2.91Å; I46-N50 PolarHBondContact O-ND2 3.45Å; I46-V61 HydrophobicContact CG2-CB 4.43Å; I46-V61 HydrophobicContact CG2-CG1 4.33Å; I46-Y63 HydrophobicContact CB-CD1 4.4Å; I46-Y63 HydrophobicContact CD1-CD1 3.79Å; I46-Y63 HydrophobicContact CD1-CG 3.76Å; I46-Y63 HydrophobicContact CG2-CD1 3.9Å; I46-Y63 HydrophobicContact CG2-CE1 4.43Å; I46-V302 HydrophobicContact CG1-CG1 3.9Å
47	H	89.8	Confident	86.4	Confident	73 Å²	73	41.3 Å²	41.3	34%	0.338	21%	0.21	S	C	.	.	H	α-helix	trans	-57.8	-44.9	175	172.6	-90.6	0	0	0	111.2	R43 Y44 N50 M51 Y271	R43-H47 WeakPolarHBondContact O-CB 3.44Å; R43-H47 PolarHBondContact O-N 2.77Å; Y44-H47 PolarHBondContact O-N 2.87Å; H47-N50 PolarHBondContact O-N 3.5Å; H47-M51 WeakPolarHBondContact NE2-CE 3.35Å; H47-M51 WeakPolarHBondContact O-CB 3.39Å; H47-M51 WeakPolarHBondContact O-CG 3.35Å; H47-M51 PolarHBondContact O-N 2.93Å; H47-Y271 HydrophobicContact CB-CE2 3.94Å; H47-Y271 AromaticContact CD2-CE2 3.84Å; H47-Y271 AromaticContact CG-CE2 3.55Å; H47-Y271 AromaticContact ND1-CE2 3.73Å
48	R	90	Very high	86.6	Confident	71 Å²	71	45.6 Å²	45.6	27%	0.268	23%	0.228	S	C	.	.	H	α-helix	trans	-65.7	-44.1	177.1	-176.1	177.4	174	-168.9	-2.1	111.6	Y44 A45 I46 N50 M51 D52 Y303	Y44-R48 WeakPolarHBondContact O-CB 3.32Å; Y44-R48 PolarHBondContact O-N 3.33Å; A45-R48 PolarHBondContact O-N 3.47Å; I46-R48 VanDerWaalsContact C-N 3.29Å; I46-R48 PolarHBondContact O-N 3.46Å; R48-N50 VanDerWaalsContact C-N 3.32Å; R48-N50 PolarHBondContact O-N 3.25Å; R48-M51 PolarHBondContact O-N 2.87Å; R48-D52 WeakPolarHBondContact O-CB 3.43Å; R48-D52 PolarHBondContact O-N 2.89Å; R48-Y303 WeakPolarHBondContact CD-OH 3.34Å
49	L	90.1	Very high	86.6	Confident	4 Å²	4	45.5 Å²	45.5	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-57.4	-44.5	176.9	-170	85.1	0	0	0	111.8	A45 I46 D52 L55 L56 V61 Y303 A306	A45-L49 WeakPolarHBondContact O-CB 3.43Å; A45-L49 PolarHBondContact O-N 2.9Å; I46-L49 PolarHBondContact O-N 3.28Å; L49-D52 CarbonylContact O-C 3.43Å; L49-D52 VanDerWaalsContact O-O 3.13Å; L49-L55 HydrophobicContact CD1-CB 4.49Å; L49-L56 HydrophobicContact CD2-CD1 3.93Å; L49-L56 HydrophobicContact CG-CD1 4.46Å; L49-V61 HydrophobicContact CD2-CB 4.21Å; L49-V61 HydrophobicContact CD2-CG2 3.69Å; L49-Y303 HydrophobicContact CD1-CE1 4.44Å; L49-A306 HydrophobicContact CD1-CB 3.46Å; L49-A306 VanDerWaalsContact CD1-CB 3.46Å; L49-A306 HydrophobicContact CD2-CB 3.93Å; L49-A306 HydrophobicContact CG-CB 4.33Å
50	N	90.1	Very high	86.8	Confident	57 Å²	57	47.1 Å²	47.1	31%	0.305	24%	0.238	S	C	.	.	H	α-helix	trans	-73.3	-26.9	179.7	-73.5	-27.7	0	0	0	113.3	I46 H47 R48 V61	I46-N50 WeakPolarHBondContact O-CB 3.17Å; I46-N50 PolarHBondContact O-N 2.91Å; I46-N50 PolarHBondContact O-ND2 3.45Å; H47-N50 PolarHBondContact O-N 3.5Å; R48-N50 VanDerWaalsContact C-N 3.32Å; R48-N50 PolarHBondContact O-N 3.25Å; N50-V61 PolarHBondContact ND2-O 3.29Å; N50-V61 PolarHBondContact OD1-N 3.33Å
51	M	86.4	Confident	87	Confident	138 Å²	138	46.9 Å²	46.9	68%	0.68	24%	0.237	S	C	*	.	H	α-helix	trans	-79	-38.8	175.1	-73.1	-69.5	-175.5	0	0	112	H47 R48 K53	H47-M51 WeakPolarHBondContact NE2-CE 3.35Å; H47-M51 WeakPolarHBondContact O-CB 3.39Å; H47-M51 WeakPolarHBondContact O-CG 3.35Å; H47-M51 PolarHBondContact O-N 2.93Å; R48-M51 PolarHBondContact O-N 2.87Å; M51-K53 PolarHBondContact O-N 3.39Å
52	D	86	Confident	87.2	Confident	67 Å²	67	49.5 Å²	49.5	36%	0.358	25%	0.25	S	S	.	.			trans	-94.5	88.7	-179.1	-170.3	-6.6	0	0	0	110.8	R48 L49 S54	R48-D52 WeakPolarHBondContact O-CB 3.43Å; R48-D52 PolarHBondContact O-N 2.89Å; L49-D52 CarbonylContact O-C 3.43Å; L49-D52 VanDerWaalsContact O-O 3.13Å; D52-S54 VanDerWaalsContact CG-OG 3.22Å; D52-S54 PolarHBondContact O-N 3.49Å; D52-S54 VanDerWaalsContact OD1-CB 3.25Å; D52-S54 WeakPolarHBondContact OD1-CB 3.35Å; D52-S54 PolarHBondContact OD1-N 3.26Å; D52-S54 PolarHBondContact OD1-OG 3.23Å; D52-S54 PolarHBondContact OD2-OG 2.9Å
53	K	81.3	Confident	87.3	Confident	122 Å²	122	52.7 Å²	52.7	53%	0.53	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	11.9	-179.4	-69.1	-161.6	168.5	-147.7	0	115.1	M51 P57	M51-K53 PolarHBondContact O-N 3.39Å; K53-P57 PolarHBondContact NZ-O 2.78Å; K53-P57 WeakPolarHBondContact O-CA 3.39Å
54	S	85.2	Confident	87.4	Confident	77 Å²	77	54 Å²	54	54%	0.538	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-35.4	177.6	57.3	0	0	0	0	113.3	D52	D52-S54 VanDerWaalsContact CG-OG 3.22Å; D52-S54 PolarHBondContact O-N 3.49Å; D52-S54 VanDerWaalsContact OD1-CB 3.25Å; D52-S54 WeakPolarHBondContact OD1-CB 3.35Å; D52-S54 PolarHBondContact OD1-N 3.26Å; D52-S54 PolarHBondContact OD1-OG 3.23Å; D52-S54 PolarHBondContact OD2-OG 2.9Å
55	L	83.1	Confident	87.4	Confident	23 Å²	23	54.7 Å²	54.7	12%	0.12	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-52.2	178.2	-80.6	117.1	0	0	0	112.5	L49 P57 Y303 I307 Q310	L49-L55 HydrophobicContact CD1-CB 4.49Å; L55-P57 WeakPolarHBondContact O-CD 3.39Å; L55-Y303 HydrophobicContact CD1-CD1 4.42Å; L55-Y303 HydrophobicContact CD1-CE1 3.95Å; L55-I307 HydrophobicContact CD2-CD1 4.49Å; L55-I307 HydrophobicContact CD2-CG1 3.64Å; L55-Q310 VanDerWaalsContact O-CD 3.23Å; L55-Q310 WeakPolarHBondContact O-CG 3.45Å; L55-Q310 PolarHBondContact O-NE2 3.14Å
56	L	85.1	Confident	87.4	Confident	6 Å²	6	55.9 Å²	55.9	3%	0.031	28%	0.28	C	S	.	.			trans	-121.1	88.5	-178	-64	177	0	0	0	109.7	L49 V61 A306 L309 Q310	L49-L56 HydrophobicContact CD2-CD1 3.93Å; L49-L56 HydrophobicContact CG-CD1 4.46Å; L56-V61 HydrophobicContact CD1-CG2 3.88Å; L56-A306 HydrophobicContact CD1-CB 4.32Å; L56-L309 HydrophobicContact CD1-CD2 4.04Å; L56-L309 HydrophobicContact CD2-CD2 4.35Å; L56-L309 HydrophobicContact CD2-CG 4.45Å; L56-Q310 HydrophobicContact CD2-CB 4.04Å
57	P	81.4	Confident	87.2	Confident	75 Å²	75	59.8 Å²	59.8	49%	0.487	30%	0.295	S	S	.	.	S	Bend	trans	-72.9	-37.3	-174.5	26	-32.5	0	0	0	113	K53 L55	K53-P57 PolarHBondContact NZ-O 2.78Å; K53-P57 WeakPolarHBondContact O-CA 3.39Å; L55-P57 WeakPolarHBondContact O-CD 3.39Å
58	E	80.7	Confident	87.1	Confident	146 Å²	146	56.3 Å²	56.3	68%	0.682	28%	0.279	S	S	*	.	S	Bend	trans	-104.8	-12.1	-174	-61.8	-170.2	175.4	0	0	113.2	P20 P21	P20-E58 VanDerWaalsContact CA-O 3.29Å; P20-E58 WeakPolarHBondContact CA-O 3.28Å; P20-E58 WeakPolarHBondContact CB-O 3.16Å; P21-E58 WeakPolarHBondContact CD-O 3.39Å
59	T	83.1	Confident	86.7	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.031	29%	0.286	C	S	.	.			trans	-110.1	137.9	-174	-55.4	0	0	0	0	111	P21 V23 L309 E313	P21-T59 HydrophobicContact CG-CG2 4.5Å; P21-T59 WeakPolarHBondContact CG-OG1 3.5Å; P21-T59 WeakPolarHBondContact O-CA 3.35Å; P21-T59 WeakPolarHBondContact O-CG2 3.35Å; V23-T59 HydrophobicContact CB-CG2 4.09Å; V23-T59 HydrophobicContact CG2-CG2 3.55Å; T59-L309 HydrophobicContact CG2-CD2 4.39Å; T59-E313 WeakPolarHBondContact CB-OE1 3.23Å; T59-E313 WeakPolarHBondContact CG2-OE1 3.39Å; T59-E313 VanDerWaalsContact OG1-CD 3.27Å; T59-E313 PolarHBondContact OG1-OE1 2.8Å; T59-E313 PolarHBondContact OG1-OE2 3.08Å
60	T	87.6	Confident	85.9	Confident	46 Å²	46	60.5 Å²	60.5	28%	0.282	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	133.3	173.9	54.7	0	0	0	0	110.4	P20 P21 V23	P20-T60 HydrophobicContact CB-CG2 4.37Å; P20-T60 HydrophobicContact CG-CG2 4.2Å; P21-T60 PolarHBondContact O-N 3.28Å; P21-T60 VanDerWaalsContact O-N 3.09Å; V23-T60 PolarHBondContact N-O 3.29Å
61	V	89.6	Confident	85.3	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.024	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.2	-178	-178.3	0	0	0	0	109.9	V23 I25 I46 L49 N50 L56	V23-V61 HydrophobicContact CG1-CG2 4.41Å; V23-V61 CarbonylContact O-C 3.47Å; V23-V61 WeakPolarHBondContact O-CA 3.36Å; I25-V61 HydrophobicContact CD1-CG1 3.64Å; I25-V61 HydrophobicContact CG1-CG1 3.84Å; I25-V61 HydrophobicContact CG2-CG1 4.42Å; I46-V61 HydrophobicContact CG2-CB 4.43Å; I46-V61 HydrophobicContact CG2-CG1 4.33Å; L49-V61 HydrophobicContact CD2-CB 4.21Å; L49-V61 HydrophobicContact CD2-CG2 3.69Å; N50-V61 PolarHBondContact ND2-O 3.29Å; N50-V61 PolarHBondContact OD1-N 3.33Å; L56-V61 HydrophobicContact CD1-CG2 3.88Å
62	D	90.8	Very high	85.2	Confident	56 Å²	56	62.2 Å²	62.2	30%	0.299	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	151.7	173	-173.2	31.5	0	0	0	110.5	L22 V23 R24 I25 Y64	L22-D62 HydrophobicContact CD1-CB 3.79Å; L22-D62 HydrophobicContact CG-CB 4.46Å; V23-D62 PolarHBondContact O-N 3.42Å; R24-D62 CarbonylContact C-O 3.48Å; R24-D62 WeakPolarHBondContact CA-O 3.23Å; I25-D62 WeakPolarHBondContact CG1-O 3.45Å; I25-D62 PolarHBondContact N-O 3.04Å; D62-Y64 PolarHBondContact OD2-OH 2.92Å
63	Y	91.8	Very high	85.1	Confident	68 Å²	68	61.3 Å²	61.3	27%	0.267	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	146	-170.1	69.9	-89	0	0	0	114.1	I25 F42 R43 I46 V65	I25-Y63 CarbonylContact O-C 3.56Å; I25-Y63 VanDerWaalsContact O-CA 3.29Å; I25-Y63 WeakPolarHBondContact O-CA 3.41Å; F42-Y63 AromaticContact CE1-CD2 3.98Å; F42-Y63 HydrophobicContact CE1-CD2 3.98Å; F42-Y63 HydrophobicContact CE1-CG 4.17Å; R43-Y63 HydrophobicContact CG-CE2 4.07Å; I46-Y63 HydrophobicContact CB-CD1 4.4Å; I46-Y63 HydrophobicContact CD1-CD1 3.79Å; I46-Y63 HydrophobicContact CD1-CG 3.76Å; I46-Y63 HydrophobicContact CG2-CD1 3.9Å; I46-Y63 HydrophobicContact CG2-CE1 4.43Å; Y63-V65 HydrophobicContact CD2-CG2 3.84Å; Y63-V65 HydrophobicContact CE2-CG2 4.06Å
64	Y	91.8	Very high	85.4	Confident	81 Å²	81	62 Å²	62	32%	0.318	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.3	177	-65.5	-93	0	0	0	109.5	R24 I25 G26 A27 D62 V86 V88	R24-Y64 HydrophobicContact CB-CE2 4.35Å; R24-Y64 HydrophobicContact CG-CE2 4.17Å; I25-Y64 PolarHBondContact O-N 3.3Å; G26-Y64 CarbonylContact C-O 3.57Å; G26-Y64 WeakPolarHBondContact CA-O 3.34Å; A27-Y64 PolarHBondContact N-O 3.37Å; D62-Y64 PolarHBondContact OD2-OH 2.92Å; Y64-V86 HydrophobicContact CD1-CG1 4.06Å; Y64-V86 HydrophobicContact CD2-CG1 3.82Å; Y64-V86 HydrophobicContact CE1-CG1 3.81Å; Y64-V86 HydrophobicContact CE2-CG1 3.61Å; Y64-V86 HydrophobicContact CG-CG1 4.07Å; Y64-V88 HydrophobicContact CD2-CG1 4.4Å
65	V	89.7	Confident	85.6	Confident	28 Å²	28	61 Å²	61	17%	0.17	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.4	179.9	-178.6	0	0	0	0	109.8	A27 F29 F42 Y63 Y67	A27-V65 WeakPolarHBondContact O-CA 3.47Å; F29-V65 HydrophobicContact CD2-CG1 3.53Å; F29-V65 HydrophobicContact CE2-CG1 3.85Å; F29-V65 HydrophobicContact CE2-CG2 4.33Å; F42-V65 HydrophobicContact CE1-CG2 4.33Å; Y63-V65 HydrophobicContact CD2-CG2 3.84Å; Y63-V65 HydrophobicContact CE2-CG2 4.06Å; V65-Y67 HydrophobicContact CG1-CE1 4.28Å; V65-Y67 HydrophobicContact CG1-CE2 4.29Å
66	E	90.4	Very high	85.8	Confident	26 Å²	26	59.9 Å²	59.9	12%	0.121	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	151.5	170	-70.4	-69.5	165.6	0	0	110.7	A27 I28 F29 K79 K82 L83	A27-E66 PolarHBondContact O-N 3.43Å; I28-E66 WeakPolarHBondContact CA-O 3.45Å; F29-E66 PolarHBondContact N-O 2.88Å; E66-K79 HydrophobicContact CB-CB 4.15Å; E66-K79 HydrophobicContact CB-CD 4.36Å; E66-K79 HydrophobicContact CB-CG 4.45Å; E66-K79 HydrophobicContact CG-CB 4.48Å; E66-K79 HydrophobicContact CG-CD 4.37Å; E66-K79 WeakPolarHBondContact OE2-CD 3.18Å; E66-K79 WeakPolarHBondContact OE2-CE 3.35Å; E66-K79 IonicContact OE2-NZ 3.04Å; E66-K79 PolarHBondContact OE2-NZ 2.93Å; E66-K82 WeakPolarHBondContact OE1-CD 3.23Å; E66-K82 WeakPolarHBondContact OE1-CE 3.48Å; E66-K82 IonicContact OE1-NZ 3.25Å; E66-K82 PolarHBondContact OE1-NZ 3.33Å; E66-K82 IonicContact OE2-NZ 3.72Å; E66-L83 HydrophobicContact CG-CD1 4.46Å; E66-L83 HydrophobicContact CG-CD2 3.96Å; E66-L83 HydrophobicContact CG-CG 4.11Å
67	Y	87.4	Confident	86	Confident	83 Å²	83	62 Å²	62	33%	0.325	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	138.4	-179.7	-57.8	-82.9	0	0	0	110.5	F29 N31 E39 V65	F29-Y67 HydrophobicContact CB-CD1 4.29Å; F29-Y67 HydrophobicContact CB-CE1 4.46Å; F29-Y67 WeakPolarHBondContact O-CA 3.37Å; N31-Y67 VanDerWaalsContact OD1-CB 3.29Å; N31-Y67 WeakPolarHBondContact OD1-CB 3.39Å; E39-Y67 PolarHBondContact OE1-OH 3.42Å; E39-Y67 WeakPolarHBondContact OE2-CE1 3.39Å; E39-Y67 PolarHBondContact OE2-OH 2.96Å; V65-Y67 HydrophobicContact CG1-CE1 4.28Å; V65-Y67 HydrophobicContact CG1-CE2 4.29Å
68	V	86.6	Confident	86.4	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	154.2	-177.4	-63.9	0	0	0	0	111.1	I28 F29 S30 N31 K79 L99	I28-V68 HydrophobicContact CG2-CB 4.34Å; I28-V68 HydrophobicContact CG2-CG1 3.88Å; I28-V68 HydrophobicContact CG2-CG2 3.48Å; I28-V68 VanDerWaalsContact CG2-CG2 3.48Å; F29-V68 PolarHBondContact O-N 3.5Å; S30-V68 WeakPolarHBondContact CA-O 3.23Å; N31-V68 PolarHBondContact N-O 2.9Å; N31-V68 VanDerWaalsContact N-O 3.08Å; V68-K79 HydrophobicContact CG1-CB 4.01Å; V68-K79 HydrophobicContact CG1-CG 3.79Å; V68-L99 HydrophobicContact CG2-CD1 3.83Å
69	N	83.4	Confident	86.9	Confident	79 Å²	79	59.3 Å²	59.3	42%	0.422	28%	0.281	S	S	.	.			trans	-82.9	143.3	169.8	-165.5	-0.4	0	0	0	111.5	F71 D72 E75	N69-F71 PolarHBondContact O-N 3.38Å; N69-F71 VanDerWaalsContact O-N 3.12Å; N69-D72 HydrophobicContact CB-CB 4.13Å; N69-D72 PolarHBondContact O-N 3.47Å; N69-E75 PolarHBondContact N-OE2 3.37Å; N69-E75 VanDerWaalsContact N-OE2 3.07Å
70	R	72.6	Confident	87.2	Confident	84 Å²	84	59 Å²	59	32%	0.317	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-32.8	-175.7	-173.6	172.5	-163.9	-158.6	7.4	114.2	D96 L99	R70-D96 WeakPolarHBondContact CG-OD2 3Å; R70-D96 IonicContact CZ-OD1 3.94Å; R70-D96 VanDerWaalsContact NE-CG 3.26Å; R70-D96 IonicContact NE-OD1 3.93Å; R70-D96 PolarHBondContact NE-OD1 3.18Å; R70-D96 IonicContact NE-OD2 2.79Å; R70-D96 PolarHBondContact NE-OD2 3.11Å; R70-D96 IonicContact NH2-OD1 3.05Å; R70-D96 PolarHBondContact NH2-OD1 3.31Å; R70-L99 WeakPolarHBondContact O-CD2 3.44Å
71	F	76.4	Confident	87.3	Confident	169 Å²	169	57.7 Å²	57.7	74%	0.741	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	1.9	-173.4	-57	-71.2	0	0	0	113.5	N69	N69-F71 PolarHBondContact O-N 3.38Å; N69-F71 VanDerWaalsContact O-N 3.12Å
72	D	84.3	Confident	87.4	Confident	62 Å²	62	62.5 Å²	62.5	33%	0.332	29%	0.292	S	S	.	.			trans	-106.2	89.4	-178.2	-162	-24.6	0	0	0	110.7	N69 F74 E75 T76	N69-D72 HydrophobicContact CB-CB 4.13Å; N69-D72 PolarHBondContact O-N 3.47Å; D72-F74 VanDerWaalsContact C-N 3.28Å; D72-F74 PolarHBondContact O-N 2.95Å; D72-F74 PolarHBondContact OD1-N 3.48Å; D72-F74 VanDerWaalsContact OD1-N 3.13Å; D72-E75 HydrophobicContact CB-CB 3.91Å; D72-E75 VanDerWaalsContact CG-CB 3.42Å; D72-E75 PolarHBondContact OD1-N 3.05Å; D72-T76 PolarHBondContact O-N 3.42Å; D72-T76 PolarHBondContact O-OG1 2.97Å
73	S	85.3	Confident	87.4	Confident	48 Å²	48	60 Å²	60	34%	0.336	28%	0.279	S	S	.	.	H	α-helix	trans	-66.4	-32.3	176.3	54.7	0	0	0	0	112	T76 V77 H102	S73-T76 WeakPolarHBondContact O-CB 3.36Å; S73-T76 PolarHBondContact O-N 3.49Å; S73-V77 WeakPolarHBondContact O-CG2 3.24Å; S73-V77 PolarHBondContact O-N 3.05Å; S73-H102 WeakPolarHBondContact CB-CD2 3.45Å; S73-H102 WeakPolarHBondContact CB-NE2 3.41Å
74	F	87.3	Confident	87.2	Confident	137 Å²	137	57 Å²	57	60%	0.601	27%	0.267	S	S	*	.	H	α-helix	trans	-71.8	-45.2	-178.5	-179.3	-105	0	0	0	111.8	D72 T76 V77 Q78	D72-F74 VanDerWaalsContact C-N 3.28Å; D72-F74 PolarHBondContact O-N 2.95Å; D72-F74 PolarHBondContact OD1-N 3.48Å; D72-F74 VanDerWaalsContact OD1-N 3.13Å; F74-T76 PolarHBondContact O-N 3.26Å; F74-V77 PolarHBondContact O-N 3.28Å; F74-Q78 HydrophobicContact CE1-CG 4.34Å; F74-Q78 HydrophobicContact CZ-CG 4.41Å; F74-Q78 WeakPolarHBondContact O-CG 3.44Å; F74-Q78 PolarHBondContact O-N 3.26Å; F74-Q78 VanDerWaalsContact O-N 3.1Å
75	E	89.1	Confident	87	Confident	54 Å²	54	60.5 Å²	60.5	25%	0.252	28%	0.28	S	S	.	.	H	α-helix	trans	-55.4	-44.1	171	-177.9	-177.8	-154.3	0	0	110.3	N69 D72 V77 Q78 K79	N69-E75 PolarHBondContact N-OE2 3.37Å; N69-E75 VanDerWaalsContact N-OE2 3.07Å; D72-E75 HydrophobicContact CB-CB 3.91Å; D72-E75 VanDerWaalsContact CG-CB 3.42Å; D72-E75 PolarHBondContact OD1-N 3.05Å; E75-V77 PolarHBondContact O-N 3.19Å; E75-Q78 PolarHBondContact O-N 3.28Å; E75-K79 HydrophobicContact CG-CG 4.33Å; E75-K79 VanDerWaalsContact O-CG 3.31Å; E75-K79 WeakPolarHBondContact O-CG 3.3Å; E75-K79 PolarHBondContact O-N 3.04Å
76	T	88.2	Confident	86.9	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58.6	-47.9	179.5	-58.5	0	0	0	0	112	D72 S73 F74 Q78 K79 V80 L99 I103	D72-T76 PolarHBondContact O-N 3.42Å; D72-T76 PolarHBondContact O-OG1 2.97Å; S73-T76 WeakPolarHBondContact O-CB 3.36Å; S73-T76 PolarHBondContact O-N 3.49Å; F74-T76 PolarHBondContact O-N 3.26Å; T76-Q78 VanDerWaalsContact C-N 3.35Å; T76-Q78 PolarHBondContact O-N 3.44Å; T76-K79 PolarHBondContact O-N 3.18Å; T76-V80 HydrophobicContact CG2-CG2 4.41Å; T76-V80 VanDerWaalsContact O-CG2 3.25Å; T76-V80 WeakPolarHBondContact O-CG2 3.48Å; T76-V80 PolarHBondContact O-N 2.95Å; T76-L99 WeakPolarHBondContact OG1-CD2 3.43Å; T76-I103 HydrophobicContact CG2-CD1 3.95Å; T76-I103 HydrophobicContact CG2-CG1 3.66Å
77	V	88.6	Confident	86.7	Confident	51 Å²	51	60.5 Å²	60.5	31%	0.309	28%	0.283	S	S	.	.	H	α-helix	trans	-58.6	-45.4	176.3	168.9	0	0	0	0	111.4	S73 F74 E75 K79 V80 C81 I106	S73-V77 WeakPolarHBondContact O-CG2 3.24Å; S73-V77 PolarHBondContact O-N 3.05Å; F74-V77 PolarHBondContact O-N 3.28Å; E75-V77 PolarHBondContact O-N 3.19Å; V77-K79 VanDerWaalsContact C-N 3.33Å; V77-K79 PolarHBondContact O-N 3.06Å; V77-V80 PolarHBondContact O-N 3.32Å; V77-C81 WeakPolarHBondContact O-CB 3.16Å; V77-C81 PolarHBondContact O-N 3.43Å; V77-C81 PolarHBondContact O-SG 3.02Å; V77-C81 VanDerWaalsContact O-SG 3.38Å; V77-I106 HydrophobicContact CB-CD1 4.03Å; V77-I106 HydrophobicContact CG1-CD1 3.72Å; V77-I106 HydrophobicContact CG2-CD1 3.83Å
78	Q	89.9	Confident	86.8	Confident	111 Å²	111	56.6 Å²	56.6	52%	0.519	27%	0.268	S	S	.	.	H	α-helix	trans	-61.4	-40.6	178.4	-69.9	-172.9	-17.5	0	0	112.5	F74 E75 T76 K82	F74-Q78 HydrophobicContact CE1-CG 4.34Å; F74-Q78 HydrophobicContact CZ-CG 4.41Å; F74-Q78 WeakPolarHBondContact O-CG 3.44Å; F74-Q78 PolarHBondContact O-N 3.26Å; F74-Q78 VanDerWaalsContact O-N 3.1Å; E75-Q78 PolarHBondContact O-N 3.28Å; T76-Q78 VanDerWaalsContact C-N 3.35Å; T76-Q78 PolarHBondContact O-N 3.44Å; Q78-K82 PolarHBondContact O-N 3.36Å
79	K	90.8	Very high	86.8	Confident	53 Å²	53	57 Å²	57	23%	0.23	27%	0.27	C	S	.	.	H	α-helix	trans	-69.1	-41.7	178	-66.4	-55.3	-164.1	157.1	0	112.5	E66 V68 E75 T76 V77 C81 K82 L83	E66-K79 HydrophobicContact CB-CB 4.15Å; E66-K79 HydrophobicContact CB-CD 4.36Å; E66-K79 HydrophobicContact CB-CG 4.45Å; E66-K79 HydrophobicContact CG-CB 4.48Å; E66-K79 HydrophobicContact CG-CD 4.37Å; E66-K79 WeakPolarHBondContact OE2-CD 3.18Å; E66-K79 WeakPolarHBondContact OE2-CE 3.35Å; E66-K79 IonicContact OE2-NZ 3.04Å; E66-K79 PolarHBondContact OE2-NZ 2.93Å; V68-K79 HydrophobicContact CG1-CB 4.01Å; V68-K79 HydrophobicContact CG1-CG 3.79Å; E75-K79 HydrophobicContact CG-CG 4.33Å; E75-K79 VanDerWaalsContact O-CG 3.31Å; E75-K79 WeakPolarHBondContact O-CG 3.3Å; E75-K79 PolarHBondContact O-N 3.04Å; T76-K79 PolarHBondContact O-N 3.18Å; V77-K79 VanDerWaalsContact C-N 3.33Å; V77-K79 PolarHBondContact O-N 3.06Å; K79-C81 VanDerWaalsContact C-N 3.34Å; K79-C81 PolarHBondContact O-N 2.76Å; K79-K82 WeakPolarHBondContact O-CB 3.39Å; K79-K82 PolarHBondContact O-N 3.08Å; K79-L83 PolarHBondContact O-N 3.48Å
80	V	90.4	Very high	87.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-58.2	-48.7	173.2	174.2	0	0	0	0	109.9	I28 T76 V77 K82 L83 I84 I103 I106	I28-V80 HydrophobicContact CD1-CB 4.43Å; I28-V80 HydrophobicContact CD1-CG2 3.34Å; T76-V80 HydrophobicContact CG2-CG2 4.41Å; T76-V80 VanDerWaalsContact O-CG2 3.25Å; T76-V80 WeakPolarHBondContact O-CG2 3.48Å; T76-V80 PolarHBondContact O-N 2.95Å; V77-V80 PolarHBondContact O-N 3.32Å; V80-K82 VanDerWaalsContact C-N 3.26Å; V80-K82 PolarHBondContact O-N 3.32Å; V80-L83 WeakPolarHBondContact O-CA 3.18Å; V80-L83 WeakPolarHBondContact O-CB 3.35Å; V80-L83 PolarHBondContact O-N 2.89Å; V80-I84 HydrophobicContact CG1-CD1 3.77Å; V80-I84 HydrophobicContact CG1-CG1 4.41Å; V80-I84 WeakPolarHBondContact O-CG1 3.43Å; V80-I84 PolarHBondContact O-N 3.15Å; V80-I103 HydrophobicContact CG2-CB 4.42Å; V80-I103 HydrophobicContact CG2-CG1 3.8Å; V80-I103 HydrophobicContact CG2-CG2 4.2Å; V80-I106 HydrophobicContact CB-CD1 4.27Å; V80-I106 HydrophobicContact CG1-CB 4.29Å; V80-I106 HydrophobicContact CG1-CD1 4.14Å; V80-I106 HydrophobicContact CG1-CG2 3.91Å
81	C	90	Very high	88.1	Confident	17 Å²	17	49.2 Å²	49.2	12%	0.115	24%	0.235	C	C	.	.	H	α-helix	trans	-64.7	-30.8	179.5	-70.6	0	0	0	0	113.5	V77 K79 I84 R85 C325	V77-C81 WeakPolarHBondContact O-CB 3.16Å; V77-C81 PolarHBondContact O-N 3.43Å; V77-C81 PolarHBondContact O-SG 3.02Å; V77-C81 VanDerWaalsContact O-SG 3.38Å; K79-C81 VanDerWaalsContact C-N 3.34Å; K79-C81 PolarHBondContact O-N 2.76Å; C81-I84 PolarHBondContact O-N 3.09Å; C81-R85 WeakPolarHBondContact O-CG 3.49Å; C81-R85 PolarHBondContact O-N 2.86Å; C81-C325 WeakPolarHBondContact CA-SG 3.49Å; C81-C325 HydrophobicContact CB-CB 3.76Å; C81-C325 WeakPolarHBondContact CB-SG 3.44Å; C81-C325 WeakPolarHBondContact SG-CB 3.29Å; C81-C325 CovalentContact SG-SG 2.04Å; C81-C325 PolarHBondContact SG-SG 3.11Å
82	K	90.7	Very high	88.8	Confident	106 Å²	106	41.2 Å²	41.2	46%	0.461	20%	0.2	S	C	.	.	H	α-helix	trans	-63.9	-42.9	170.1	-173.6	-173.9	173.2	-160.9	0	111.7	E66 Q78 K79 V80 R85 V86	E66-K82 WeakPolarHBondContact OE1-CD 3.23Å; E66-K82 WeakPolarHBondContact OE1-CE 3.48Å; E66-K82 IonicContact OE1-NZ 3.25Å; E66-K82 PolarHBondContact OE1-NZ 3.33Å; E66-K82 IonicContact OE2-NZ 3.72Å; Q78-K82 PolarHBondContact O-N 3.36Å; K79-K82 WeakPolarHBondContact O-CB 3.39Å; K79-K82 PolarHBondContact O-N 3.08Å; V80-K82 VanDerWaalsContact C-N 3.26Å; V80-K82 PolarHBondContact O-N 3.32Å; K82-R85 PolarHBondContact O-N 3.38Å; K82-V86 WeakPolarHBondContact O-CG2 3.5Å; K82-V86 PolarHBondContact O-N 3.25Å
83	L	90.3	Very high	88.8	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-63.6	-41.6	175.8	-67.2	171.7	0	0	0	111.3	I28 E66 K79 V80 R85 V86 G87 V88	I28-L83 HydrophobicContact CD1-CD1 4.07Å; I28-L83 HydrophobicContact CG1-CD1 3.74Å; E66-L83 HydrophobicContact CG-CD1 4.46Å; E66-L83 HydrophobicContact CG-CD2 3.96Å; E66-L83 HydrophobicContact CG-CG 4.11Å; K79-L83 PolarHBondContact O-N 3.48Å; V80-L83 WeakPolarHBondContact O-CA 3.18Å; V80-L83 WeakPolarHBondContact O-CB 3.35Å; V80-L83 PolarHBondContact O-N 2.89Å; L83-R85 PolarHBondContact O-N 3.34Å; L83-V86 WeakPolarHBondContact O-CB 3.43Å; L83-V86 PolarHBondContact O-N 3.31Å; L83-V86 VanDerWaalsContact O-N 3.09Å; L83-G87 PolarHBondContact O-N 3.21Å; L83-V88 HydrophobicContact CB-CG1 4.35Å; L83-V88 HydrophobicContact CB-CG2 4.01Å; L83-V88 WeakPolarHBondContact O-CG1 3.49Å; L83-V88 WeakPolarHBondContact O-CG2 3.32Å
84	I	88.7	Confident	88.4	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-63.9	-41.1	178.7	-65.1	171.3	0	0	0	111.2	V80 C81 V86 G87 I106 L110 I112	V80-I84 HydrophobicContact CG1-CD1 3.77Å; V80-I84 HydrophobicContact CG1-CG1 4.41Å; V80-I84 WeakPolarHBondContact O-CG1 3.43Å; V80-I84 PolarHBondContact O-N 3.15Å; C81-I84 PolarHBondContact O-N 3.09Å; I84-V86 PolarHBondContact O-N 3.46Å; I84-G87 WeakPolarHBondContact O-CA 3.29Å; I84-G87 PolarHBondContact O-N 3.29Å; I84-I106 HydrophobicContact CD1-CG2 3.73Å; I84-L110 HydrophobicContact CD1-CD1 3.63Å; I84-L110 HydrophobicContact CG2-CD1 4.32Å; I84-I112 HydrophobicContact CD1-CD1 3.94Å; I84-I112 HydrophobicContact CG1-CD1 3.79Å; I84-I112 HydrophobicContact CG2-CD1 4.03Å
85	R	86.9	Confident	87.6	Confident	156 Å²	156	32.1 Å²	32.1	59%	0.589	16%	0.156	S	C	*	.	H	α-helix	trans	-61.4	-25.2	173.7	-74.3	175.4	-179.9	176.6	0.7	113.8	C81 K82 L83 E326	C81-R85 WeakPolarHBondContact O-CG 3.49Å; C81-R85 PolarHBondContact O-N 2.86Å; K82-R85 PolarHBondContact O-N 3.38Å; L83-R85 PolarHBondContact O-N 3.34Å; R85-E326 IonicContact NH2-OE1 2.74Å; R85-E326 PolarHBondContact NH2-OE1 3.32Å
86	V	87.6	Confident	86.9	Confident	43 Å²	43	30.4 Å²	30.4	26%	0.261	15%	0.149	S	C	.	.	H	α-helix	trans	-76	-15.1	173.1	173.8	0	0	0	0	111.6	R24 Y64 K82 L83 I84	R24-V86 PolarHBondContact NH1-O 2.98Å; Y64-V86 HydrophobicContact CD1-CG1 4.06Å; Y64-V86 HydrophobicContact CD2-CG1 3.82Å; Y64-V86 HydrophobicContact CE1-CG1 3.81Å; Y64-V86 HydrophobicContact CE2-CG1 3.61Å; Y64-V86 HydrophobicContact CG-CG1 4.07Å; K82-V86 WeakPolarHBondContact O-CG2 3.5Å; K82-V86 PolarHBondContact O-N 3.25Å; L83-V86 WeakPolarHBondContact O-CB 3.43Å; L83-V86 PolarHBondContact O-N 3.31Å; L83-V86 VanDerWaalsContact O-N 3.09Å; I84-V86 PolarHBondContact O-N 3.46Å
87	G	85.9	Confident	86.2	Confident	10 Å²	10	33.1 Å²	33.1	10%	0.103	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	46.1	179.8	0	0	0	0	0	112.8	L83 I84	L83-G87 PolarHBondContact O-N 3.21Å; I84-G87 WeakPolarHBondContact O-CA 3.29Å; I84-G87 PolarHBondContact O-N 3.29Å
88	V	89.4	Confident	85.7	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.006	18%	0.178	C	C	.	.			trans	-77	136.4	175.8	-61.2	0	0	0	0	111.7	R24 Y64 L83 V91 L321	R24-V88 HydrophobicContact CB-CG1 4.43Å; R24-V88 CarbonylContact O-C 3.43Å; R24-V88 VanDerWaalsContact O-CA 3.3Å; R24-V88 WeakPolarHBondContact O-CA 3.32Å; Y64-V88 HydrophobicContact CD2-CG1 4.4Å; L83-V88 HydrophobicContact CB-CG1 4.35Å; L83-V88 HydrophobicContact CB-CG2 4.01Å; L83-V88 WeakPolarHBondContact O-CG1 3.49Å; L83-V88 WeakPolarHBondContact O-CG2 3.32Å; V88-V91 HydrophobicContact CG2-CG2 4.06Å; V88-L321 WeakPolarHBondContact O-CD1 2.94Å
89	Q	87.3	Confident	85.3	Confident	9 Å²	9	29.7 Å²	29.7	4%	0.042	15%	0.154	C	C	.	.	S	Bend	trans	-91.6	-14.6	-176.6	-69.3	158.1	-40.3	0	0	113.4	R24 L321 W331	R24-Q89 PolarHBondContact O-N 3.37Å; Q89-L321 HydrophobicContact CB-CD1 4.2Å; Q89-L321 HydrophobicContact CG-CD1 3.5Å; Q89-W331 HydrophobicContact CB-CH2 4.03Å; Q89-W331 HydrophobicContact CG-CH2 4.11Å; Q89-W331 HydrophobicContact CG-CZ2 4.29Å
90	A	90	Very high	84.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	150.9	169.8	0	0	0	0	0	110.4	I25 G26 P113 F305	I25-A90 HydrophobicContact CG2-CB 4.37Å; G26-A90 PolarHBondContact N-O 2.83Å; A90-P113 WeakPolarHBondContact CA-O 3.49Å; A90-F305 HydrophobicContact CB-CD2 3.75Å; A90-F305 HydrophobicContact CB-CE2 3.38Å; A90-F305 HydrophobicContact CB-CZ 4.11Å
91	V	92.2	Very high	84.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.6	175.9	-179.1	0	0	0	0	109.3	G26 I28 V88 I103 I112 P113 N114 I115	G26-V91 CarbonylContact O-C 3.51Å; G26-V91 WeakPolarHBondContact O-CA 3.45Å; I28-V91 HydrophobicContact CD1-CG1 4.17Å; V88-V91 HydrophobicContact CG2-CG2 4.06Å; V91-I103 HydrophobicContact CG1-CG2 4.05Å; V91-I112 HydrophobicContact CG2-CG2 4.19Å; V91-P113 PolarHBondContact N-O 2.89Å; V91-N114 CarbonylContact O-C 3.57Å; V91-N114 WeakPolarHBondContact O-CA 3.45Å; V91-N114 PolarHBondContact O-OD1 3.31Å; V91-I115 PolarHBondContact O-N 3.13Å
92	F	91.9	Very high	84.3	Confident	1 Å²	1	33.1 Å²	33.1	0%	0.004	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	118.5	172.9	-67.4	-97	0	0	0	109.4	I25 G26 A27 I28 F42 I115 M298 S301 V302 F305	I25-F92 HydrophobicContact CB-CD2 4.46Å; I25-F92 HydrophobicContact CB-CE2 3.99Å; I25-F92 HydrophobicContact CD1-CD2 4.44Å; I25-F92 HydrophobicContact CD1-CE2 3.74Å; I25-F92 HydrophobicContact CD1-CZ 4.42Å; I25-F92 HydrophobicContact CG1-CE2 4.39Å; I25-F92 HydrophobicContact CG2-CE2 4.24Å; G26-F92 WeakPolarHBondContact O-CD2 3.31Å; G26-F92 PolarHBondContact O-N 3.47Å; A27-F92 HydrophobicContact CB-CB 4.06Å; I28-F92 PolarHBondContact N-O 3.37Å; F42-F92 HydrophobicContact CE2-CB 4.42Å; F42-F92 HydrophobicContact CE2-CD1 4.32Å; F42-F92 AromaticContact CE2-CD2 3.8Å; F42-F92 HydrophobicContact CE2-CD2 3.8Å; F42-F92 HydrophobicContact CE2-CE2 4.11Å; F42-F92 AromaticContact CE2-CG 3.92Å; F42-F92 HydrophobicContact CE2-CG 3.92Å; F42-F92 HydrophobicContact CE2-CZ 4.48Å; F42-F92 HydrophobicContact CZ-CD2 4.27Å; F92-I115 WeakPolarHBondContact CA-O 3.44Å; F92-I115 HydrophobicContact CD1-CB 4.04Å; F92-I115 HydrophobicContact CD1-CG2 4.36Å; F92-I115 HydrophobicContact CE1-CB 4.08Å; F92-I115 HydrophobicContact CE1-CD1 3.99Å; F92-I115 HydrophobicContact CE1-CG2 4.25Å; F92-I115 HydrophobicContact CZ-CD1 4.05Å; F92-M298 HydrophobicContact CB-CE 3.59Å; F92-M298 HydrophobicContact CD1-CE 4.06Å; F92-M298 HydrophobicContact CG-CE 4.05Å; F92-S301 WeakPolarHBondContact CD1-OG 3.36Å; F92-S301 WeakPolarHBondContact CE1-OG 3.3Å; F92-V302 HydrophobicContact CE1-CG2 4.25Å; F92-V302 HydrophobicContact CZ-CG2 4.42Å; F92-F305 HydrophobicContact CZ-CB 3.84Å; F92-F305 HydrophobicContact CZ-CG 4.13Å
93	S	84.8	Confident	84.2	Confident	10 Å²	10	28.1 Å²	28.1	7%	0.07	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-91.4	152.8	-173.5	-80.6	0	0	0	0	114	I103 N114 I115	S93-I103 WeakPolarHBondContact OG-CG2 3.4Å; S93-N114 WeakPolarHBondContact CB-OD1 3.25Å; S93-N114 PolarHBondContact OG-ND2 2.91Å; S93-N114 PolarHBondContact OG-OD1 3.04Å; S93-I115 PolarHBondContact N-O 3.05Å
94	P	77.1	Confident	84	Confident	5 Å²	5	28.2 Å²	28.2	3%	0.032	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-67.5	164.3	172.4	30.9	-35.7	0	0	0	111.9	D96 L99 I103	P94-D96 PolarHBondContact O-N 3.45Å; P94-L99 HydrophobicContact CG-CB 3.95Å; P94-L99 HydrophobicContact CG-CD1 4.13Å; P94-I103 VanDerWaalsContact CD-CD1 3.48Å; P94-I103 HydrophobicContact CG-CD1 4.12Å
95	T	70.8	Confident	84	Confident	40 Å²	40	31.9 Å²	31.9	25%	0.245	18%	0.179	C	C	.	.	S	Bend	trans	-74.2	-12.1	-179.2	58.1	0	0	0	0	114	M35 S97 R117 E294	M35-T95 WeakPolarHBondContact CE-OG1 3.32Å; T95-S97 PolarHBondContact O-N 3.07Å; T95-R117 WeakPolarHBondContact O-CD 3.08Å; T95-E294 HydrophobicContact CG2-CG 4.23Å; T95-E294 PolarHBondContact OG1-OE1 2.99Å
96	D	74.3	Confident	84	Confident	19 Å²	19	25.7 Å²	25.7	10%	0.102	16%	0.157	C	C	.	.			trans	-73.3	121.9	-180	-82.6	-46.5	0	0	0	112.2	R70 P94 V98 L99 A100	R70-D96 WeakPolarHBondContact CG-OD2 3Å; R70-D96 IonicContact CZ-OD1 3.94Å; R70-D96 VanDerWaalsContact NE-CG 3.26Å; R70-D96 IonicContact NE-OD1 3.93Å; R70-D96 PolarHBondContact NE-OD1 3.18Å; R70-D96 IonicContact NE-OD2 2.79Å; R70-D96 PolarHBondContact NE-OD2 3.11Å; R70-D96 IonicContact NH2-OD1 3.05Å; R70-D96 PolarHBondContact NH2-OD1 3.31Å; P94-D96 PolarHBondContact O-N 3.45Å; D96-V98 VanDerWaalsContact C-N 3.3Å; D96-V98 PolarHBondContact O-N 2.89Å; D96-L99 HydrophobicContact CB-CB 4.41Å; D96-L99 HydrophobicContact CB-CD1 4.44Å; D96-L99 HydrophobicContact CB-CG 4.36Å; D96-L99 PolarHBondContact O-N 2.9Å; D96-A100 WeakPolarHBondContact O-CB 3.38Å; D96-A100 PolarHBondContact O-N 3.02Å
97	S	73.1	Confident	84.1	Confident	57 Å²	57	23.7 Å²	23.7	40%	0.399	15%	0.145	S	C	.	.	H	α-helix	trans	-62.8	-34.2	-174.9	60.3	0	0	0	0	113.8	T95 T101	T95-S97 PolarHBondContact O-N 3.07Å; S97-T101 WeakPolarHBondContact O-CG2 3.38Å; S97-T101 PolarHBondContact O-N 2.55Å; S97-T101 PolarHBondContact O-OG1 2.9Å
98	V	77.8	Confident	84.2	Confident	88 Å²	88	26.3 Å²	26.3	53%	0.533	16%	0.157	S	C	.	.	H	α-helix	trans	-71.6	-41.6	-177.4	-178.4	0	0	0	0	111.3	D96 T101 H102	D96-V98 VanDerWaalsContact C-N 3.3Å; D96-V98 PolarHBondContact O-N 2.89Å; V98-T101 PolarHBondContact O-OG1 3.35Å; V98-H102 PolarHBondContact O-CD2 3.37Å
99	L	81.4	Confident	84.2	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-70.4	-41	176.2	-64.4	-173.4	0	0	0	111	V68 R70 T76 P94 D96 T101 H102 I103	V68-L99 HydrophobicContact CG2-CD1 3.83Å; R70-L99 WeakPolarHBondContact O-CD2 3.44Å; T76-L99 WeakPolarHBondContact OG1-CD2 3.43Å; P94-L99 HydrophobicContact CG-CB 3.95Å; P94-L99 HydrophobicContact CG-CD1 4.13Å; D96-L99 HydrophobicContact CB-CB 4.41Å; D96-L99 HydrophobicContact CB-CD1 4.44Å; D96-L99 HydrophobicContact CB-CG 4.36Å; D96-L99 PolarHBondContact O-N 2.9Å; L99-T101 VanDerWaalsContact C-N 3.3Å; L99-T101 PolarHBondContact O-N 2.72Å; L99-H102 PolarHBondContact O-N 3.37Å; L99-H102 VanDerWaalsContact O-N 3.17Å; L99-I103 WeakPolarHBondContact O-CG1 3.18Å; L99-I103 PolarHBondContact O-N 3.49Å; L99-I103 VanDerWaalsContact O-N 3.1Å
100	A	80.9	Confident	84.2	Confident	2 Å²	2	28.8 Å²	28.8	2%	0.017	18%	0.178	C	C	.	.	H	α-helix	trans	-57.2	-41.6	179.3	0	0	0	0	0	112.1	D96 H102 I103 N104	D96-A100 WeakPolarHBondContact O-CB 3.38Å; D96-A100 PolarHBondContact O-N 3.02Å; A100-H102 VanDerWaalsContact C-N 3.32Å; A100-H102 PolarHBondContact O-N 3.36Å; A100-I103 PolarHBondContact O-N 3.18Å; A100-N104 WeakPolarHBondContact O-CB 3.09Å; A100-N104 PolarHBondContact O-N 2.9Å; A100-N104 PolarHBondContact O-ND2 3.29Å
101	T	82.8	Confident	84.2	Confident	70 Å²	70	30.4 Å²	30.4	43%	0.429	19%	0.187	S	C	.	.	H	α-helix	trans	-60.8	-38.7	178.7	45	0	0	0	0	113.2	S97 V98 L99 S105	S97-T101 WeakPolarHBondContact O-CG2 3.38Å; S97-T101 PolarHBondContact O-N 2.55Å; S97-T101 PolarHBondContact O-OG1 2.9Å; V98-T101 PolarHBondContact O-OG1 3.35Å; L99-T101 VanDerWaalsContact C-N 3.3Å; L99-T101 PolarHBondContact O-N 2.72Å; T101-S105 PolarHBondContact O-N 3.49Å; T101-S105 VanDerWaalsContact O-N 3.15Å
102	H	86	Confident	84	Confident	71 Å²	71	30.5 Å²	30.5	33%	0.329	19%	0.187	S	C	.	.	H	α-helix	trans	-72.4	-37.9	178	-67.3	-62.1	0	0	0	112.2	S73 V98 L99 A100 S105	S73-H102 WeakPolarHBondContact CB-CD2 3.45Å; S73-H102 WeakPolarHBondContact CB-NE2 3.41Å; V98-H102 PolarHBondContact O-CD2 3.37Å; L99-H102 PolarHBondContact O-N 3.37Å; L99-H102 VanDerWaalsContact O-N 3.17Å; A100-H102 VanDerWaalsContact C-N 3.32Å; A100-H102 PolarHBondContact O-N 3.36Å; H102-S105 PolarHBondContact O-N 3.06Å
103	I	88	Confident	84	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.2	-45.7	175.4	-61.3	163.3	0	0	0	110.1	I28 T76 V80 V91 S93 P94 L99 A100 S105 I106 C107	I28-I103 HydrophobicContact CD1-CD1 3.97Å; I28-I103 HydrophobicContact CD1-CG1 4.29Å; T76-I103 HydrophobicContact CG2-CD1 3.95Å; T76-I103 HydrophobicContact CG2-CG1 3.66Å; V80-I103 HydrophobicContact CG2-CB 4.42Å; V80-I103 HydrophobicContact CG2-CG1 3.8Å; V80-I103 HydrophobicContact CG2-CG2 4.2Å; V91-I103 HydrophobicContact CG1-CG2 4.05Å; S93-I103 WeakPolarHBondContact OG-CG2 3.4Å; P94-I103 VanDerWaalsContact CD-CD1 3.48Å; P94-I103 HydrophobicContact CG-CD1 4.12Å; L99-I103 WeakPolarHBondContact O-CG1 3.18Å; L99-I103 PolarHBondContact O-N 3.49Å; L99-I103 VanDerWaalsContact O-N 3.1Å; A100-I103 PolarHBondContact O-N 3.18Å; I103-S105 VanDerWaalsContact C-N 3.3Å; I103-S105 PolarHBondContact O-N 2.89Å; I103-I106 PolarHBondContact O-N 3.49Å; I103-C107 WeakPolarHBondContact O-CB 3.42Å; I103-C107 PolarHBondContact O-N 2.97Å; I103-C107 PolarHBondContact O-SG 3.2Å
104	N	86.8	Confident	84.3	Confident	6 Å²	6	30.1 Å²	30.1	3%	0.032	18%	0.184	C	C	.	.	H	α-helix	trans	-56.1	-45.5	176.9	-66.2	-38.3	0	0	0	111.6	A100 I106 C107 D108 N114 S118 H120	A100-N104 WeakPolarHBondContact O-CB 3.09Å; A100-N104 PolarHBondContact O-N 2.9Å; A100-N104 PolarHBondContact O-ND2 3.29Å; N104-I106 PolarHBondContact O-N 3.02Å; N104-C107 PolarHBondContact O-N 3.49Å; N104-D108 WeakPolarHBondContact O-CB 3.37Å; N104-D108 PolarHBondContact O-N 3.3Å; N104-N114 PolarHBondContact OD1-ND2 3.18Å; N104-S118 WeakPolarHBondContact ND2-CB 3.46Å; N104-S118 PolarHBondContact ND2-OG 2.77Å; N104-H120 PolarHBondContact ND2-CD2 3.02Å
105	S	88.3	Confident	84.9	Confident	81 Å²	81	29.9 Å²	29.9	57%	0.566	18%	0.183	S	C	*	.	H	α-helix	trans	-58.5	-33.1	-177.7	-173.5	0	0	0	0	113.1	T101 H102 I103 A109	T101-S105 PolarHBondContact O-N 3.49Å; T101-S105 VanDerWaalsContact O-N 3.15Å; H102-S105 PolarHBondContact O-N 3.06Å; I103-S105 VanDerWaalsContact C-N 3.3Å; I103-S105 PolarHBondContact O-N 2.89Å; S105-A109 WeakPolarHBondContact O-CB 3.42Å; S105-A109 PolarHBondContact O-N 2.79Å
106	I	88.4	Confident	85.5	Confident	25 Å²	25	28.8 Å²	28.8	13%	0.128	18%	0.179	C	C	.	.	H	α-helix	trans	-80.6	-44.6	177.7	-63.6	168.9	0	0	0	110.5	V77 V80 I84 I103 N104 D108 A109 L110	V77-I106 HydrophobicContact CB-CD1 4.03Å; V77-I106 HydrophobicContact CG1-CD1 3.72Å; V77-I106 HydrophobicContact CG2-CD1 3.83Å; V80-I106 HydrophobicContact CB-CD1 4.27Å; V80-I106 HydrophobicContact CG1-CB 4.29Å; V80-I106 HydrophobicContact CG1-CD1 4.14Å; V80-I106 HydrophobicContact CG1-CG2 3.91Å; I84-I106 HydrophobicContact CD1-CG2 3.73Å; I103-I106 PolarHBondContact O-N 3.49Å; N104-I106 PolarHBondContact O-N 3.02Å; I106-D108 VanDerWaalsContact C-N 3.29Å; I106-D108 PolarHBondContact O-N 3.46Å; I106-A109 PolarHBondContact O-N 2.81Å; I106-L110 HydrophobicContact CG2-CD1 3.86Å; I106-L110 PolarHBondContact O-N 2.94Å; I106-L110 VanDerWaalsContact O-N 3.13Å
107	C	88.8	Confident	85.6	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.007	19%	0.187	C	C	.	.	H	α-helix	trans	-59.3	-40.5	177.5	-79.1	0	0	0	0	112.2	I103 N104 L110 D111 I112 N114	I103-C107 WeakPolarHBondContact O-CB 3.42Å; I103-C107 PolarHBondContact O-N 2.97Å; I103-C107 PolarHBondContact O-SG 3.2Å; N104-C107 PolarHBondContact O-N 3.49Å; C107-L110 PolarHBondContact O-N 2.87Å; C107-D111 CarbonylContact O-C 3.57Å; C107-D111 PolarHBondContact O-N 3.2Å; C107-D111 VanDerWaalsContact O-N 3.08Å; C107-I112 WeakPolarHBondContact CB-O 3.36Å; C107-I112 PolarHBondContact O-N 2.99Å; C107-N114 HydrophobicContact CB-CB 3.99Å
108	D	88.6	Confident	85.6	Confident	66 Å²	66	29.5 Å²	29.5	35%	0.353	18%	0.175	S	C	.	.	H	α-helix	trans	-68.2	-39.9	176.9	-161.6	46.1	0	0	0	111.9	N104 I106 L110 F122	N104-D108 WeakPolarHBondContact O-CB 3.37Å; N104-D108 PolarHBondContact O-N 3.3Å; I106-D108 VanDerWaalsContact C-N 3.29Å; I106-D108 PolarHBondContact O-N 3.46Å; D108-L110 VanDerWaalsContact C-N 3.29Å; D108-L110 PolarHBondContact O-N 2.75Å; D108-F122 WeakPolarHBondContact OD1-CD2 3.4Å
109	A	88.4	Confident	85	Confident	54 Å²	54	26.8 Å²	26.8	45%	0.446	16%	0.162	S	C	.	.	H	α-helix	trans	-69.5	-25.4	177.4	0	0	0	0	0	113.7	S105 I106	S105-A109 WeakPolarHBondContact O-CB 3.42Å; S105-A109 PolarHBondContact O-N 2.79Å; I106-A109 PolarHBondContact O-N 2.81Å
110	L	88.5	Confident	84.9	Confident	7 Å²	7	30.9 Å²	30.9	4%	0.037	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	6.5	-175.2	-62.6	173.8	0	0	0	113.2	I84 I106 C107 D108 I112 I323 W331	I84-L110 HydrophobicContact CD1-CD1 3.63Å; I84-L110 HydrophobicContact CG2-CD1 4.32Å; I106-L110 HydrophobicContact CG2-CD1 3.86Å; I106-L110 PolarHBondContact O-N 2.94Å; I106-L110 VanDerWaalsContact O-N 3.13Å; C107-L110 PolarHBondContact O-N 2.87Å; D108-L110 VanDerWaalsContact C-N 3.29Å; D108-L110 PolarHBondContact O-N 2.75Å; L110-I112 HydrophobicContact CB-CD1 4.08Å; L110-I112 HydrophobicContact CB-CG1 4.11Å; L110-I112 PolarHBondContact O-N 3.23Å; L110-I323 HydrophobicContact CD2-CG2 4.03Å; L110-W331 PolarHBondContact O-N 2.88Å; L110-W331 VanDerWaalsContact O-N 3.13Å
111	D	88.9	Confident	84.7	Confident	35 Å²	35	37.3 Å²	37.3	19%	0.187	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	35.5	-174	-63.5	-14	0	0	0	113.3	C107 F122 S330 G334	C107-D111 CarbonylContact O-C 3.57Å; C107-D111 PolarHBondContact O-N 3.2Å; C107-D111 VanDerWaalsContact O-N 3.08Å; D111-F122 HydrophobicContact CB-CD1 4.25Å; D111-F122 HydrophobicContact CB-CE1 3.62Å; D111-F122 HydrophobicContact CB-CZ 3.8Å; D111-F122 VanDerWaalsContact CG-CZ 3.45Å; D111-F122 VanDerWaalsContact OD1-CE2 3.28Å; D111-F122 WeakPolarHBondContact OD1-CE2 3.41Å; D111-F122 WeakPolarHBondContact OD1-CZ 3.35Å; D111-S330 WeakPolarHBondContact OD2-CB 3.26Å; D111-S330 PolarHBondContact OD2-OG 3.08Å; D111-G334 WeakPolarHBondContact O-CA 3.22Å
112	I	89	Confident	84.8	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	20%	0.2	C	C	.	.			trans	-99.2	119.8	177.9	-60.4	175.6	0	0	0	109.3	I84 V91 C107 L110 N114	I84-I112 HydrophobicContact CD1-CD1 3.94Å; I84-I112 HydrophobicContact CG1-CD1 3.79Å; I84-I112 HydrophobicContact CG2-CD1 4.03Å; V91-I112 HydrophobicContact CG2-CG2 4.19Å; C107-I112 WeakPolarHBondContact CB-O 3.36Å; C107-I112 PolarHBondContact O-N 2.99Å; L110-I112 HydrophobicContact CB-CD1 4.08Å; L110-I112 HydrophobicContact CB-CG1 4.11Å; L110-I112 PolarHBondContact O-N 3.23Å; I112-N114 PolarHBondContact O-N 3.32Å
113	P	90.3	Very high	84.9	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.185	C	C	.	.			trans	-59.5	127	179.4	-26.9	36.3	0	0	0	113.2	A90 V91 L337 I338 L341	A90-P113 WeakPolarHBondContact CA-O 3.49Å; V91-P113 PolarHBondContact N-O 2.89Å; P113-L337 HydrophobicContact CG-CB 4.24Å; P113-L337 HydrophobicContact CG-CD2 3.95Å; P113-L337 HydrophobicContact CG-CG 4.03Å; P113-I338 HydrophobicContact CB-CD1 4.15Å; P113-I338 HydrophobicContact CG-CB 4.38Å; P113-L341 HydrophobicContact CB-CD1 3.83Å; P113-L341 HydrophobicContact CG-CD1 4.33Å
114	N	91.5	Very high	85	Confident	3 Å²	3	32 Å²	32	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.6	171.9	-174.8	27	0	0	0	111.4	V91 S93 N104 C107 I112 F122 S123 I124	V91-N114 CarbonylContact O-C 3.57Å; V91-N114 WeakPolarHBondContact O-CA 3.45Å; V91-N114 PolarHBondContact O-OD1 3.31Å; S93-N114 WeakPolarHBondContact CB-OD1 3.25Å; S93-N114 PolarHBondContact OG-ND2 2.91Å; S93-N114 PolarHBondContact OG-OD1 3.04Å; N104-N114 PolarHBondContact OD1-ND2 3.18Å; C107-N114 HydrophobicContact CB-CB 3.99Å; I112-N114 PolarHBondContact O-N 3.32Å; N114-F122 PolarHBondContact N-O 3.43Å; N114-S123 CarbonylContact O-C 3.5Å; N114-S123 WeakPolarHBondContact O-CA 3.42Å; N114-S123 WeakPolarHBondContact O-CB 3.28Å; N114-I124 PolarHBondContact O-N 3.35Å
115	I	90.8	Very high	85.2	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.2	179.4	-52.6	175.5	0	0	0	108.7	V91 F92 S93 I124 V126 F305 L341	V91-I115 PolarHBondContact O-N 3.13Å; F92-I115 WeakPolarHBondContact CA-O 3.44Å; F92-I115 HydrophobicContact CD1-CB 4.04Å; F92-I115 HydrophobicContact CD1-CG2 4.36Å; F92-I115 HydrophobicContact CE1-CB 4.08Å; F92-I115 HydrophobicContact CE1-CD1 3.99Å; F92-I115 HydrophobicContact CE1-CG2 4.25Å; F92-I115 HydrophobicContact CZ-CD1 4.05Å; S93-I115 PolarHBondContact N-O 3.05Å; I115-I124 HydrophobicContact CG1-CB 4.49Å; I115-V126 HydrophobicContact CG2-CG2 3.64Å; I115-F305 HydrophobicContact CD1-CB 3.71Å; I115-F305 HydrophobicContact CD1-CD2 3.96Å; I115-F305 HydrophobicContact CD1-CG 4.26Å; I115-L341 HydrophobicContact CD1-CD1 4.34Å; I115-L341 HydrophobicContact CD1-CD2 4.47Å
116	G	83.8	Confident	85.2	Confident	16 Å²	16	28.6 Å²	28.6	17%	0.165	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.6	-132.9	-174.9	0	0	0	0	0	113.7	I124 N125 V126	G116-I124 PolarHBondContact N-O 3.35Å; G116-N125 WeakPolarHBondContact O-CA 3.31Å; G116-N125 PolarHBondContact O-OD1 3.45Å; G116-V126 PolarHBondContact O-N 3.43Å
117	R	76.4	Confident	85.2	Confident	69 Å²	69	28.6 Å²	28.6	26%	0.26	16%	0.159	S	C	.	.	S	Bend	trans	-109.3	-5.7	-174	-167	172	172.5	159.8	3.8	114.6	T95 N125 Y127	T95-R117 WeakPolarHBondContact O-CD 3.08Å; R117-N125 VanDerWaalsContact CA-OD1 3.28Å; R117-N125 WeakPolarHBondContact CA-OD1 3.37Å; R117-N125 PolarHBondContact O-OD1 3.01Å; R117-Y127 HydrophobicContact CG-CG 4.3Å
118	S	71.5	Confident	85.3	Confident	23 Å²	23	28.5 Å²	28.5	16%	0.161	16%	0.159	C	C	.	.			trans	-103.7	150.3	-179.3	-149.2	0	0	0	0	111.1	N104 H120 S123	N104-S118 WeakPolarHBondContact ND2-CB 3.46Å; N104-S118 PolarHBondContact ND2-OG 2.77Å; S118-H120 PolarHBondContact OG-CD2 2.77Å; S118-H120 VanDerWaalsContact OG-CD2 3.32Å; S118-H120 PolarHBondContact OG-NE2 3.19Å; S118-H120 VanDerWaalsContact OG-NE2 3.15Å; S118-S123 PolarHBondContact O-OG 3.37Å
119	A	66.8	Low	85.2	Confident	30 Å²	30	25.7 Å²	25.7	25%	0.248	14%	0.144	C	C	.	.			trans	-123.1	112	177	0	0	0	0	0	109.8	N125 Q359	A119-N125 HydrophobicContact CB-CB 4.09Å; A119-Q359 HydrophobicContact CB-CG 3.46Å; A119-Q359 VanDerWaalsContact CB-CG 3.46Å
120	H	77.5	Confident	84.9	Confident	88 Å²	88	27.3 Å²	27.3	41%	0.407	14%	0.141	S	C	.	.	S	Bend	trans	-147.6	169.2	176.7	-60.9	-78.8	0	0	0	107.1	N104 S118 F122 S123	N104-H120 PolarHBondContact ND2-CD2 3.02Å; S118-H120 PolarHBondContact OG-CD2 2.77Å; S118-H120 VanDerWaalsContact OG-CD2 3.32Å; S118-H120 PolarHBondContact OG-NE2 3.19Å; S118-H120 VanDerWaalsContact OG-NE2 3.15Å; H120-F122 VanDerWaalsContact C-N 3.29Å; H120-F122 PolarHBondContact O-N 3.07Å; H120-F122 VanDerWaalsContact O-N 3.12Å; H120-S123 WeakPolarHBondContact CA-OG 3.47Å; H120-S123 WeakPolarHBondContact CB-OG 3.37Å; H120-S123 PolarHBondContact N-OG 3.49Å; H120-S123 PolarHBondContact O-N 3.39Å; H120-S123 PolarHBondContact O-OG 3.21Å
121	D	77.9	Confident	84.7	Confident	137 Å²	137	32.6 Å²	32.6	73%	0.733	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-41.2	-168.8	-62.7	-14.6	0	0	0	113.9
122	F	84.1	Confident	84.7	Confident	26 Å²	26	32.7 Å²	32.7	11%	0.114	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	27.9	174.8	-76.3	-91.5	0	0	0	115.1	D108 D111 N114 H120 L335 I338	D108-F122 WeakPolarHBondContact OD1-CD2 3.4Å; D111-F122 HydrophobicContact CB-CD1 4.25Å; D111-F122 HydrophobicContact CB-CE1 3.62Å; D111-F122 HydrophobicContact CB-CZ 3.8Å; D111-F122 VanDerWaalsContact CG-CZ 3.45Å; D111-F122 VanDerWaalsContact OD1-CE2 3.28Å; D111-F122 WeakPolarHBondContact OD1-CE2 3.41Å; D111-F122 WeakPolarHBondContact OD1-CZ 3.35Å; N114-F122 PolarHBondContact N-O 3.43Å; H120-F122 VanDerWaalsContact C-N 3.29Å; H120-F122 PolarHBondContact O-N 3.07Å; H120-F122 VanDerWaalsContact O-N 3.12Å; F122-L335 HydrophobicContact CE1-CD1 4.5Å; F122-L335 HydrophobicContact CZ-CD1 4.03Å; F122-I338 HydrophobicContact CD1-CB 4.35Å; F122-I338 HydrophobicContact CD1-CG2 4.08Å; F122-I338 HydrophobicContact CE1-CG2 4Å
123	S	88.9	Confident	84.7	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.014	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	140.2	177.9	61.6	0	0	0	0	114.7	N114 S118 H120	N114-S123 CarbonylContact O-C 3.5Å; N114-S123 WeakPolarHBondContact O-CA 3.42Å; N114-S123 WeakPolarHBondContact O-CB 3.28Å; S118-S123 PolarHBondContact O-OG 3.37Å; H120-S123 WeakPolarHBondContact CA-OG 3.47Å; H120-S123 WeakPolarHBondContact CB-OG 3.37Å; H120-S123 PolarHBondContact N-OG 3.49Å; H120-S123 PolarHBondContact O-N 3.39Å; H120-S123 PolarHBondContact O-OG 3.21Å
124	I	90	Very high	84.6	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	118.7	177.6	-58.1	-62.4	0	0	0	109.4	N114 I115 G116 V126 I338 L341 N342 F355	N114-I124 PolarHBondContact O-N 3.35Å; I115-I124 HydrophobicContact CG1-CB 4.49Å; G116-I124 PolarHBondContact N-O 3.35Å; I124-V126 HydrophobicContact CG2-CG2 4.34Å; I124-I338 HydrophobicContact CD1-CD1 3.7Å; I124-I338 HydrophobicContact CG1-CD1 3.67Å; I124-L341 HydrophobicContact CD1-CB 4.17Å; I124-L341 HydrophobicContact CG1-CB 3.99Å; I124-N342 HydrophobicContact CD1-CB 4.47Å; I124-N342 WeakPolarHBondContact CD1-OD1 3.33Å; I124-F355 HydrophobicContact CG2-CD1 3.85Å; I124-F355 HydrophobicContact CG2-CD2 4.35Å; I124-F355 HydrophobicContact CG2-CE1 3.48Å; I124-F355 VanDerWaalsContact CG2-CE1 3.48Å; I124-F355 HydrophobicContact CG2-CE2 4.02Å; I124-F355 HydrophobicContact CG2-CG 4.28Å; I124-F355 HydrophobicContact CG2-CZ 3.57Å
125	N	90	Very high	84.4	Confident	12 Å²	12	37.8 Å²	37.8	6%	0.064	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	102.5	174.5	179.4	21.3	0	0	0	111.1	G116 R117 A119 Y127 F355 G358 R360	G116-N125 WeakPolarHBondContact O-CA 3.31Å; G116-N125 PolarHBondContact O-OD1 3.45Å; R117-N125 VanDerWaalsContact CA-OD1 3.28Å; R117-N125 WeakPolarHBondContact CA-OD1 3.37Å; R117-N125 PolarHBondContact O-OD1 3.01Å; A119-N125 HydrophobicContact CB-CB 4.09Å; N125-Y127 VanDerWaalsContact C-N 3.3Å; N125-Y127 PolarHBondContact ND2-O 3Å; N125-Y127 VanDerWaalsContact OD1-CB 3.25Å; N125-Y127 WeakPolarHBondContact OD1-CB 3.44Å; N125-Y127 PolarHBondContact OD1-N 3.24Å; N125-Y127 PolarHBondContact OD1-O 3.04Å; N125-F355 WeakPolarHBondContact O-CE1 3.3Å; N125-G358 WeakPolarHBondContact CB-O 3.44Å; N125-G358 PolarHBondContact N-O 3.15Å; N125-R360 WeakPolarHBondContact O-CB 3.44Å; N125-R360 PolarHBondContact O-N 3.02Å
126	V	89.3	Confident	84.4	Confident	4 Å²	4	37.8 Å²	37.8	2%	0.024	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	-19.7	178	-172.3	0	0	0	0	111.9	I115 G116 I124 L297 D300 F355 R360	I115-V126 HydrophobicContact CG2-CG2 3.64Å; G116-V126 PolarHBondContact O-N 3.43Å; I124-V126 HydrophobicContact CG2-CG2 4.34Å; V126-L297 HydrophobicContact CG1-CD2 4.06Å; V126-L297 WeakPolarHBondContact O-CD2 3.48Å; V126-D300 HydrophobicContact CG1-CB 4.45Å; V126-F355 HydrophobicContact CG2-CZ 4.4Å; V126-R360 WeakPolarHBondContact O-CD 3.36Å; V126-R360 PolarHBondContact O-NH1 2.95Å
127	Y	88.5	Confident	84.7	Confident	25 Å²	25	37.2 Å²	37.2	10%	0.098	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	138.1	175.4	-168.8	-89.2	0	0	0	110.4	R117 N125 S129 F231 L297	R117-Y127 HydrophobicContact CG-CG 4.3Å; N125-Y127 VanDerWaalsContact C-N 3.3Å; N125-Y127 PolarHBondContact ND2-O 3Å; N125-Y127 VanDerWaalsContact OD1-CB 3.25Å; N125-Y127 WeakPolarHBondContact OD1-CB 3.44Å; N125-Y127 PolarHBondContact OD1-N 3.24Å; N125-Y127 PolarHBondContact OD1-O 3.04Å; Y127-S129 PolarHBondContact O-N 2.81Å; Y127-F231 HydrophobicContact CE2-CE2 4.23Å; Y127-F231 AromaticContact CZ-CE2 3.87Å; Y127-F231 WeakPolarHBondContact OH-CE2 3.39Å; Y127-L297 HydrophobicContact CD2-CD1 3.59Å; Y127-L297 HydrophobicContact CE2-CD1 4.25Å
128	P	89.6	Confident	85.2	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.3	135.8	176.9	-29.3	36.2	0	0	0	113.1	K130 V133 L253 F363	P128-K130 PolarHBondContact O-N 3.31Å; P128-V133 HydrophobicContact CB-CG2 3.73Å; P128-L253 HydrophobicContact CG-CD1 3.98Å; P128-L253 HydrophobicContact CG-CD2 4.27Å; P128-F363 HydrophobicContact CB-CD1 3.91Å; P128-F363 HydrophobicContact CB-CD2 3.93Å; P128-F363 HydrophobicContact CB-CE1 3.82Å; P128-F363 HydrophobicContact CB-CE2 3.82Å; P128-F363 HydrophobicContact CB-CG 3.97Å; P128-F363 HydrophobicContact CB-CZ 3.77Å; P128-F363 HydrophobicContact CG-CD2 4.2Å; P128-F363 HydrophobicContact CG-CG 4.21Å
129	S	87.1	Confident	86.1	Confident	6 Å²	6	35.3 Å²	35.3	4%	0.042	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-55.6	129.9	-178.3	-179.4	0	0	0	0	111.8	Y127 Q131 L132 V133 Q359 R360	Y127-S129 PolarHBondContact O-N 2.81Å; S129-Q131 PolarHBondContact O-N 2.78Å; S129-L132 PolarHBondContact O-N 2.93Å; S129-L132 VanDerWaalsContact O-N 3.12Å; S129-V133 WeakPolarHBondContact O-CG2 3.45Å; S129-V133 PolarHBondContact O-N 2.88Å; S129-Q359 PolarHBondContact OG-OE1 2.78Å; S129-Q359 VanDerWaalsContact OG-OE1 3.13Å; S129-R360 PolarHBondContact N-O 3.5Å
130	K	83	Confident	87.2	Confident	88 Å²	88	33.9 Å²	33.9	38%	0.383	16%	0.161	S	C	.	.	H	α-helix	trans	-56.5	-36.2	-177.6	-66.6	-176.2	-178.9	-178	0	112.3	P128 N134	P128-K130 PolarHBondContact O-N 3.31Å; K130-N134 PolarHBondContact O-N 3.07Å; K130-N134 VanDerWaalsContact O-N 3.07Å; K130-N134 PolarHBondContact O-ND2 3.09Å
131	Q	84.6	Confident	87.7	Confident	119 Å²	119	30 Å²	30	56%	0.556	14%	0.142	S	C	*	.	H	α-helix	trans	-65.6	-44	179.8	-68	-180	-11	0	0	111.6	S129 N134 Y135	S129-Q131 PolarHBondContact O-N 2.78Å; Q131-N134 PolarHBondContact O-N 3.49Å; Q131-Y135 WeakPolarHBondContact O-CD2 3.32Å; Q131-Y135 PolarHBondContact O-N 3.36Å
132	L	88.3	Confident	88.2	Confident	36 Å²	36	30.2 Å²	30.2	19%	0.188	14%	0.139	C	C	.	.	H	α-helix	trans	-69.2	-40.5	179.2	-66.7	177.9	0	0	0	111.5	S129 N134 Y135 A136 V361 F363 W381 P383	S129-L132 PolarHBondContact O-N 2.93Å; S129-L132 VanDerWaalsContact O-N 3.12Å; L132-N134 VanDerWaalsContact C-N 3.27Å; L132-N134 PolarHBondContact O-N 2.98Å; L132-Y135 HydrophobicContact CD2-CD2 4.14Å; L132-Y135 HydrophobicContact CD2-CE2 4.48Å; L132-Y135 WeakPolarHBondContact O-CB 3.16Å; L132-Y135 PolarHBondContact O-N 3Å; L132-Y135 VanDerWaalsContact O-N 3.13Å; L132-A136 PolarHBondContact O-N 2.81Å; L132-V361 WeakPolarHBondContact CD1-O 3.44Å; L132-F363 HydrophobicContact CB-CE1 3.86Å; L132-F363 HydrophobicContact CB-CZ 3.65Å; L132-F363 HydrophobicContact CD1-CE1 3.82Å; L132-F363 HydrophobicContact CD1-CZ 4.45Å; L132-W381 HydrophobicContact CB-CH2 4.19Å; L132-W381 WeakPolarHBondContact O-CH2 3.44Å; L132-P383 HydrophobicContact CD1-CB 4.36Å; L132-P383 HydrophobicContact CD1-CG 4.31Å; L132-P383 HydrophobicContact CD2-CB 4.49Å
133	V	88.6	Confident	88.4	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	15%	0.148	C	C	.	.	H	α-helix	trans	-60.7	-37.4	174.3	174.6	0	0	0	0	111.5	P128 S129 Y135 A136 F137 I159 F231 F363	P128-V133 HydrophobicContact CB-CG2 3.73Å; S129-V133 WeakPolarHBondContact O-CG2 3.45Å; S129-V133 PolarHBondContact O-N 2.88Å; V133-Y135 VanDerWaalsContact C-N 3.34Å; V133-Y135 PolarHBondContact O-N 3.28Å; V133-A136 VanDerWaalsContact O-CB 3.31Å; V133-A136 WeakPolarHBondContact O-CB 3.37Å; V133-A136 PolarHBondContact O-N 2.96Å; V133-A136 VanDerWaalsContact O-N 3.15Å; V133-F137 HydrophobicContact CG1-CD2 3.92Å; V133-F137 HydrophobicContact CG1-CE2 3.53Å; V133-F137 VanDerWaalsContact O-CD2 3.22Å; V133-F137 WeakPolarHBondContact O-CD2 3.33Å; V133-F137 PolarHBondContact O-N 3.15Å; V133-I159 HydrophobicContact CG1-CG2 3.7Å; V133-F231 HydrophobicContact CG1-CZ 4.43Å; V133-F363 HydrophobicContact CG2-CE2 4.21Å; V133-F363 HydrophobicContact CG2-CZ 4.06Å
134	N	87.7	Confident	88.3	Confident	4 Å²	4	33.8 Å²	33.8	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-64.4	-35.9	174.9	-78.3	-32.7	0	0	0	113.2	K130 Q131 L132 A136 F137 N138 I159 I160 N161	K130-N134 PolarHBondContact O-N 3.07Å; K130-N134 VanDerWaalsContact O-N 3.07Å; K130-N134 PolarHBondContact O-ND2 3.09Å; Q131-N134 PolarHBondContact O-N 3.49Å; L132-N134 VanDerWaalsContact C-N 3.27Å; L132-N134 PolarHBondContact O-N 2.98Å; N134-A136 VanDerWaalsContact C-N 3.3Å; N134-A136 PolarHBondContact O-N 3.42Å; N134-F137 PolarHBondContact O-N 3.18Å; N134-N138 VanDerWaalsContact O-CG 3.3Å; N134-N138 PolarHBondContact O-N 3.39Å; N134-I159 VanDerWaalsContact CG-O 3.3Å; N134-I159 PolarHBondContact ND2-O 2.95Å; N134-I159 PolarHBondContact OD1-O 3.02Å; N134-I160 WeakPolarHBondContact OD1-CA 3.44Å; N134-N161 WeakPolarHBondContact ND2-CB 3.15Å; N134-N161 PolarHBondContact ND2-N 2.78Å; N134-N161 VanDerWaalsContact ND2-N 3.19Å
135	Y	88.9	Confident	88.1	Confident	107 Å²	107	40.1 Å²	40.1	42%	0.42	19%	0.188	S	C	.	.	H	α-helix	trans	-63.3	-38.2	172.2	-64.8	-47.2	0	0	0	111.7	Q131 L132 V133 F137 N138 D139 Q164	Q131-Y135 WeakPolarHBondContact O-CD2 3.32Å; Q131-Y135 PolarHBondContact O-N 3.36Å; L132-Y135 HydrophobicContact CD2-CD2 4.14Å; L132-Y135 HydrophobicContact CD2-CE2 4.48Å; L132-Y135 WeakPolarHBondContact O-CB 3.16Å; L132-Y135 PolarHBondContact O-N 3Å; L132-Y135 VanDerWaalsContact O-N 3.13Å; V133-Y135 VanDerWaalsContact C-N 3.34Å; V133-Y135 PolarHBondContact O-N 3.28Å; Y135-F137 PolarHBondContact O-N 3.13Å; Y135-N138 PolarHBondContact O-N 3.31Å; Y135-D139 VanDerWaalsContact O-CG 3.28Å; Y135-D139 PolarHBondContact O-N 3.2Å; Y135-Q164 VanDerWaalsContact CZ-NE2 3.29Å
136	A	90.3	Very high	88	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.9	-44.7	175.2	0	0	0	0	0	112.9	L132 V133 N134 D139 V140 F251 L365 W381	L132-A136 PolarHBondContact O-N 2.81Å; V133-A136 VanDerWaalsContact O-CB 3.31Å; V133-A136 WeakPolarHBondContact O-CB 3.37Å; V133-A136 PolarHBondContact O-N 2.96Å; V133-A136 VanDerWaalsContact O-N 3.15Å; N134-A136 VanDerWaalsContact C-N 3.3Å; N134-A136 PolarHBondContact O-N 3.42Å; A136-D139 PolarHBondContact O-N 3.38Å; A136-V140 WeakPolarHBondContact O-CG2 3.25Å; A136-V140 PolarHBondContact O-N 3.29Å; A136-F251 HydrophobicContact CB-CE2 3.87Å; A136-F251 HydrophobicContact CB-CZ 3.78Å; A136-F251 WeakPolarHBondContact O-CZ 3.48Å; A136-L365 HydrophobicContact CB-CD1 3.99Å; A136-W381 VanDerWaalsContact CA-CE2 3.49Å; A136-W381 HydrophobicContact CB-CD2 3.4Å; A136-W381 VanDerWaalsContact CB-CD2 3.4Å; A136-W381 VanDerWaalsContact CB-CE2 3.49Å; A136-W381 HydrophobicContact CB-CE3 3.77Å; A136-W381 HydrophobicContact CB-CG 3.77Å; A136-W381 HydrophobicContact CB-CH2 4.23Å; A136-W381 HydrophobicContact CB-CZ2 3.91Å; A136-W381 HydrophobicContact CB-CZ3 4.17Å
137	F	89.1	Confident	87.8	Confident	4 Å²	4	45 Å²	45	2%	0.018	22%	0.217	C	C	.	.	H	α-helix	trans	-67.4	-38.4	176	-73.6	-73.3	0	0	0	112.4	V133 N134 Y135 V140 I141 I159 L227 T229 F251	V133-F137 HydrophobicContact CG1-CD2 3.92Å; V133-F137 HydrophobicContact CG1-CE2 3.53Å; V133-F137 VanDerWaalsContact O-CD2 3.22Å; V133-F137 WeakPolarHBondContact O-CD2 3.33Å; V133-F137 PolarHBondContact O-N 3.15Å; N134-F137 PolarHBondContact O-N 3.18Å; Y135-F137 PolarHBondContact O-N 3.13Å; F137-V140 PolarHBondContact O-N 2.99Å; F137-I141 VanDerWaalsContact O-CG1 3.28Å; F137-I141 WeakPolarHBondContact O-CG1 3.45Å; F137-I141 PolarHBondContact O-N 3.04Å; F137-I159 HydrophobicContact CE2-CG2 4.28Å; F137-L227 HydrophobicContact CD1-CD1 4.37Å; F137-L227 HydrophobicContact CD1-CD2 3.99Å; F137-L227 HydrophobicContact CD1-CG 4.19Å; F137-L227 HydrophobicContact CE1-CD1 4.3Å; F137-L227 HydrophobicContact CE1-CG 4.31Å; F137-T229 HydrophobicContact CE1-CG2 4.38Å; F137-T229 HydrophobicContact CZ-CG2 4.21Å; F137-F251 HydrophobicContact CD1-CD2 4.03Å; F137-F251 AromaticContact CD1-CE2 3.83Å; F137-F251 HydrophobicContact CD1-CE2 3.83Å; F137-F251 AromaticContact CE1-CD2 3.57Å; F137-F251 HydrophobicContact CE1-CD2 3.57Å; F137-F251 AromaticContact CE1-CE2 3.87Å; F137-F251 HydrophobicContact CE1-CE2 3.87Å; F137-F251 HydrophobicContact CE2-CD2 4.19Å; F137-F251 HydrophobicContact CG-CE2 4.15Å; F137-F251 AromaticContact CZ-CD2 3.63Å; F137-F251 HydrophobicContact CZ-CD2 3.63Å; F137-F251 HydrophobicContact CZ-CE2 4.21Å
138	N	87.8	Confident	87.8	Confident	22 Å²	22	47.7 Å²	47.7	12%	0.118	23%	0.227	C	C	.	.	H	α-helix	trans	-62.4	-43.4	175.6	-73.4	-9.3	0	0	0	112.1	N134 Y135 V140 I141 Q142 L165	N134-N138 VanDerWaalsContact O-CG 3.3Å; N134-N138 PolarHBondContact O-N 3.39Å; Y135-N138 PolarHBondContact O-N 3.31Å; N138-V140 VanDerWaalsContact C-N 3.25Å; N138-V140 PolarHBondContact O-N 3.49Å; N138-I141 PolarHBondContact O-N 2.97Å; N138-Q142 WeakPolarHBondContact O-CB 3.49Å; N138-Q142 PolarHBondContact O-N 3.33Å; N138-L165 WeakPolarHBondContact OD1-CD2 3.48Å; N138-L165 WeakPolarHBondContact OD1-CG 3.49Å
139	D	89.8	Confident	87.8	Confident	30 Å²	30	47.7 Å²	47.7	16%	0.16	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-36.9	178.1	-69.4	-10.7	0	0	0	111	Y135 A136 Y143 W381 H386 L387	Y135-D139 VanDerWaalsContact O-CG 3.28Å; Y135-D139 PolarHBondContact O-N 3.2Å; A136-D139 PolarHBondContact O-N 3.38Å; D139-Y143 VanDerWaalsContact O-CB 3.3Å; D139-Y143 WeakPolarHBondContact O-CB 3.3Å; D139-Y143 PolarHBondContact O-N 2.77Å; D139-W381 PolarHBondContact OD2-NE1 3.35Å; D139-H386 IonicContact OD1-ND1 2.69Å; D139-H386 IonicContact OD2-CG 2.69Å; D139-H386 IonicContact OD2-ND1 2.73Å; D139-H386 PolarHBondContact OD2-ND1 3.14Å; D139-L387 HydrophobicContact CB-CB 3.9Å
140	V	89.8	Confident	87.9	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-67.6	-47.5	174.2	173.5	0	0	0	0	111.4	A136 F137 N138 Q142 Y143 L144 L227 F251 L367 L387	A136-V140 WeakPolarHBondContact O-CG2 3.25Å; A136-V140 PolarHBondContact O-N 3.29Å; F137-V140 PolarHBondContact O-N 2.99Å; N138-V140 VanDerWaalsContact C-N 3.25Å; N138-V140 PolarHBondContact O-N 3.49Å; V140-Q142 VanDerWaalsContact C-N 3.25Å; V140-Q142 PolarHBondContact O-N 2.66Å; V140-Y143 PolarHBondContact O-N 2.67Å; V140-L144 HydrophobicContact CG1-CD1 3.8Å; V140-L144 HydrophobicContact CG1-CG 4.35Å; V140-L144 VanDerWaalsContact O-CG 3.23Å; V140-L144 WeakPolarHBondContact O-CG 3.46Å; V140-L144 PolarHBondContact O-N 3.08Å; V140-L227 HydrophobicContact CG1-CD1 4.45Å; V140-L227 HydrophobicContact CG1-CD2 4.29Å; V140-F251 HydrophobicContact CG2-CE1 4.32Å; V140-F251 HydrophobicContact CG2-CE2 4.06Å; V140-F251 HydrophobicContact CG2-CZ 3.48Å; V140-F251 VanDerWaalsContact CG2-CZ 3.48Å; V140-L367 HydrophobicContact CG2-CD1 4.09Å; V140-L367 HydrophobicContact CG2-CD2 4.19Å; V140-L387 HydrophobicContact CG2-CD1 4.39Å; V140-L387 HydrophobicContact CG2-CD2 3.9Å
141	I	88.8	Confident	88.2	Confident	5 Å²	5	43.3 Å²	43.3	3%	0.026	21%	0.207	C	C	.	.	H	α-helix	trans	-58.9	-41.7	178.3	-67.5	165.8	0	0	0	110.5	F137 N138 L144 N145 W146 F149 L165 F169 I199 L227	F137-I141 VanDerWaalsContact O-CG1 3.28Å; F137-I141 WeakPolarHBondContact O-CG1 3.45Å; F137-I141 PolarHBondContact O-N 3.04Å; N138-I141 PolarHBondContact O-N 2.97Å; I141-L144 PolarHBondContact O-N 3.37Å; I141-N145 PolarHBondContact O-N 3.01Å; I141-W146 HydrophobicContact CG1-CE3 4.24Å; I141-W146 HydrophobicContact CG2-CB 4.06Å; I141-W146 PolarHBondContact O-N 3.36Å; I141-F149 HydrophobicContact CD1-CZ 4.2Å; I141-F149 HydrophobicContact CG2-CE1 4.04Å; I141-L165 HydrophobicContact CD1-CD2 4.12Å; I141-F169 HydrophobicContact CG2-CD2 4.24Å; I141-F169 HydrophobicContact CG2-CE2 3.92Å; I141-I199 HydrophobicContact CD1-CD1 3.73Å; I141-I199 HydrophobicContact CG1-CD1 4.38Å; I141-L227 HydrophobicContact CG1-CD2 4.47Å
142	Q	87.8	Confident	88.4	Confident	142 Å²	142	37.7 Å²	37.7	66%	0.664	18%	0.181	S	C	*	.	H	α-helix	trans	-68.5	-42.7	177.7	-169.5	176.3	-3.6	0	0	111.7	N138 V140 L144 N145	N138-Q142 WeakPolarHBondContact O-CB 3.49Å; N138-Q142 PolarHBondContact O-N 3.33Å; V140-Q142 VanDerWaalsContact C-N 3.25Å; V140-Q142 PolarHBondContact O-N 2.66Å; Q142-L144 VanDerWaalsContact C-N 3.26Å; Q142-L144 PolarHBondContact O-N 3.46Å; Q142-N145 PolarHBondContact O-N 3.47Å; Q142-N145 VanDerWaalsContact O-N 3.11Å; Q142-N145 PolarHBondContact O-OD1 2.74Å
143	Y	88.2	Confident	88.4	Confident	76 Å²	76	37.4 Å²	37.4	30%	0.298	18%	0.178	S	C	.	.	H	α-helix	trans	-60	-37.3	175	178.2	-98.3	0	0	0	112.3	D139 V140 N145 L387 I389 F395 F396	D139-Y143 VanDerWaalsContact O-CB 3.3Å; D139-Y143 WeakPolarHBondContact O-CB 3.3Å; D139-Y143 PolarHBondContact O-N 2.77Å; V140-Y143 PolarHBondContact O-N 2.67Å; Y143-N145 VanDerWaalsContact C-N 3.27Å; Y143-N145 PolarHBondContact O-N 2.04Å; Y143-L387 HydrophobicContact CG-CD2 4.25Å; Y143-I389 HydrophobicContact CD1-CD1 3.48Å; Y143-I389 VanDerWaalsContact CD1-CD1 3.48Å; Y143-I389 HydrophobicContact CD2-CD1 3.64Å; Y143-I389 HydrophobicContact CE1-CD1 3.21Å; Y143-I389 HydrophobicContact CE2-CD1 3.38Å; Y143-I389 HydrophobicContact CG-CD1 3.68Å; Y143-F395 HydrophobicContact CE1-CD1 4.49Å; Y143-F395 HydrophobicContact CE1-CD2 4.27Å; Y143-F395 HydrophobicContact CE1-CG 4.18Å; Y143-F396 HydrophobicContact CE1-CE2 4.37Å; Y143-F396 HydrophobicContact CE1-CZ 4.42Å
144	L	86.7	Confident	88.1	Confident	27 Å²	27	38.9 Å²	38.9	14%	0.141	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-3.9	178.6	-60.7	175.2	0	0	0	114.1	V140 I141 Q142 W146 H225 F395	V140-L144 HydrophobicContact CG1-CD1 3.8Å; V140-L144 HydrophobicContact CG1-CG 4.35Å; V140-L144 VanDerWaalsContact O-CG 3.23Å; V140-L144 WeakPolarHBondContact O-CG 3.46Å; V140-L144 PolarHBondContact O-N 3.08Å; I141-L144 PolarHBondContact O-N 3.37Å; Q142-L144 VanDerWaalsContact C-N 3.26Å; Q142-L144 PolarHBondContact O-N 3.46Å; L144-W146 HydrophobicContact CB-CG 4.11Å; L144-W146 HydrophobicContact CD1-CD2 4.46Å; L144-W146 HydrophobicContact CD1-CZ2 3.77Å; L144-W146 PolarHBondContact O-N 2.98Å; L144-W146 VanDerWaalsContact O-N 3.15Å; L144-H225 VanDerWaalsContact CD1-CE1 3.46Å; L144-H225 WeakPolarHBondContact CD1-CE1 3.4Å; L144-F395 HydrophobicContact CD1-CZ 4.5Å; L144-F395 HydrophobicContact CD2-CD1 3.83Å; L144-F395 HydrophobicContact CD2-CE1 3.11Å; L144-F395 HydrophobicContact CD2-CZ 3.56Å; L144-F395 HydrophobicContact CG-CE1 4.38Å
145	N	86.6	Confident	87.3	Confident	134 Å²	134	41.5 Å²	41.5	72%	0.717	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.6	38.1	-174.6	-72.1	-32.8	0	0	0	112.8	I141 Q142 Y143 T147	I141-N145 PolarHBondContact O-N 3.01Å; Q142-N145 PolarHBondContact O-N 3.47Å; Q142-N145 VanDerWaalsContact O-N 3.11Å; Q142-N145 PolarHBondContact O-OD1 2.74Å; Y143-N145 VanDerWaalsContact C-N 3.27Å; Y143-N145 PolarHBondContact O-N 2.04Å; N145-T147 PolarHBondContact O-N 3.19Å
146	W	88.1	Confident	86	Confident	15 Å²	15	44.7 Å²	44.7	6%	0.057	22%	0.215	C	C	.	.			trans	-64	128.8	175.3	-74.1	5.9	0	0	0	109	I141 L144 F149 F169 N197 I199 H225 L227	I141-W146 HydrophobicContact CG1-CE3 4.24Å; I141-W146 HydrophobicContact CG2-CB 4.06Å; I141-W146 PolarHBondContact O-N 3.36Å; L144-W146 HydrophobicContact CB-CG 4.11Å; L144-W146 HydrophobicContact CD1-CD2 4.46Å; L144-W146 HydrophobicContact CD1-CZ2 3.77Å; L144-W146 PolarHBondContact O-N 2.98Å; L144-W146 VanDerWaalsContact O-N 3.15Å; W146-F149 HydrophobicContact CB-CD1 4.2Å; W146-F149 HydrophobicContact CE3-CB 3.83Å; W146-F149 HydrophobicContact CE3-CD1 4.1Å; W146-F149 AromaticContact CE3-CG 3.93Å; W146-F149 HydrophobicContact CE3-CG 3.93Å; W146-F149 HydrophobicContact CZ3-CB 4.24Å; W146-F149 HydrophobicContact CZ3-CG 4.46Å; W146-F169 WeakPolarHBondContact O-CE2 3.42Å; W146-F169 WeakPolarHBondContact O-CZ 3.44Å; W146-N197 HydrophobicContact CD2-CB 3.84Å; W146-N197 HydrophobicContact CE3-CB 3.95Å; W146-N197 HydrophobicContact CG-CB 4.43Å; W146-N197 HydrophobicContact CH2-CB 4.09Å; W146-N197 HydrophobicContact CZ2-CB 4Å; W146-N197 HydrophobicContact CZ3-CB 4.06Å; W146-I199 HydrophobicContact CZ3-CD1 4.26Å; W146-I199 HydrophobicContact CZ3-CG1 3.8Å; W146-H225 HydrophobicContact CZ2-CB 3.97Å; W146-H225 AromaticContact CZ2-CD2 3.84Å; W146-H225 AromaticContact CZ2-CE1 3.89Å; W146-H225 AromaticContact CZ2-CG 3.58Å; W146-H225 AromaticContact CZ2-ND1 3.64Å; W146-H225 AromaticContact NE1-ND1 3.97Å; W146-L227 HydrophobicContact CH2-CB 3.84Å; W146-L227 HydrophobicContact CH2-CD2 4.39Å; W146-L227 HydrophobicContact CZ3-CB 4.39Å; W146-L227 HydrophobicContact CZ3-CD2 4.4Å
147	T	84.7	Confident	84.6	Confident	103 Å²	103	50.1 Å²	50.1	63%	0.632	24%	0.244	S	C	*	.	S	Bend	trans	-110.7	-21.8	175.8	53.6	0	0	0	0	112.4	N145 G171 E172	N145-T147 PolarHBondContact O-N 3.19Å; T147-G171 CarbonylContact O-C 3.59Å; T147-G171 VanDerWaalsContact O-CA 3.3Å; T147-G171 WeakPolarHBondContact O-CA 3.48Å; T147-E172 PolarHBondContact O-N 3.12Å
148	R	87.8	Confident	83.2	Confident	81 Å²	81	51 Å²	51	31%	0.306	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	122.6	-179.4	-172.5	175	-165.3	-135.5	-7.3	109.7	E172 K193 N197	R148-E172 WeakPolarHBondContact CA-O 3.5Å; R148-E172 WeakPolarHBondContact CD-OE2 3.48Å; R148-E172 HydrophobicContact CG-CB 4.23Å; R148-E172 IonicContact CZ-OE2 3.96Å; R148-E172 IonicContact NE-OE2 3.86Å; R148-E172 PolarHBondContact NE-OE2 3.46Å; R148-E172 IonicContact NH2-OE2 3.57Å; R148-K193 PolarHBondContact NH1-O 3.17Å; R148-K193 PolarHBondContact NH2-O 3.2Å; R148-N197 PolarHBondContact O-ND2 3.27Å
149	F	90.3	Very high	82	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	158.1	177.8	64.7	-91.8	0	0	0	112.9	I141 W146 I151 F169 E172 V173 H174 N197 I199	I141-F149 HydrophobicContact CD1-CZ 4.2Å; I141-F149 HydrophobicContact CG2-CE1 4.04Å; W146-F149 HydrophobicContact CB-CD1 4.2Å; W146-F149 HydrophobicContact CE3-CB 3.83Å; W146-F149 HydrophobicContact CE3-CD1 4.1Å; W146-F149 AromaticContact CE3-CG 3.93Å; W146-F149 HydrophobicContact CE3-CG 3.93Å; W146-F149 HydrophobicContact CZ3-CB 4.24Å; W146-F149 HydrophobicContact CZ3-CG 4.46Å; F149-I151 HydrophobicContact CD2-CG1 4.04Å; F149-I151 HydrophobicContact CE2-CD1 3.91Å; F149-I151 HydrophobicContact CE2-CG1 3.75Å; F149-F169 HydrophobicContact CD1-CE1 4.14Å; F149-F169 AromaticContact CD1-CZ 3.98Å; F149-F169 HydrophobicContact CD1-CZ 3.98Å; F149-F169 AromaticContact CE1-CD1 4Å; F149-F169 HydrophobicContact CE1-CD1 4Å; F149-F169 HydrophobicContact CE1-CD2 4.36Å; F149-F169 AromaticContact CE1-CE1 3.51Å; F149-F169 HydrophobicContact CE1-CE1 3.51Å; F149-F169 AromaticContact CE1-CE2 3.94Å; F149-F169 HydrophobicContact CE1-CE2 3.94Å; F149-F169 HydrophobicContact CE1-CG 4.39Å; F149-F169 AromaticContact CE1-CZ 3.49Å; F149-F169 HydrophobicContact CE1-CZ 3.49Å; F149-F169 VanDerWaalsContact CE1-CZ 3.49Å; F149-F169 HydrophobicContact CZ-CE1 4.4Å; F149-E172 PolarHBondContact N-O 2.85Å; F149-E172 VanDerWaalsContact N-O 3.17Å; F149-V173 HydrophobicContact CE1-CG2 4.01Å; F149-V173 HydrophobicContact CE2-CG1 4Å; F149-V173 HydrophobicContact CE2-CG2 4.23Å; F149-V173 HydrophobicContact CZ-CG1 4.34Å; F149-V173 HydrophobicContact CZ-CG2 3.77Å; F149-V173 WeakPolarHBondContact O-CA 3.27Å; F149-H174 PolarHBondContact O-N 3.48Å; F149-N197 CarbonylContact C-O 3.58Å; F149-N197 VanDerWaalsContact CA-O 3.24Å; F149-N197 WeakPolarHBondContact CA-O 3.44Å; F149-N197 HydrophobicContact CB-CB 3.67Å; F149-N197 WeakPolarHBondContact CB-O 3.49Å; F149-I199 HydrophobicContact CD2-CD1 3.73Å; F149-I199 HydrophobicContact CD2-CG1 4.05Å; F149-I199 HydrophobicContact CE2-CD1 3.52Å; F149-I199 HydrophobicContact CE2-CG1 4.32Å; F149-I199 HydrophobicContact CZ-CD1 4.35Å
150	G	89.7	Confident	80.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	146.2	175.3	0	0	0	0	0	112.1	H174 N197 I198 I199	G150-H174 CarbonylContact C-O 3.5Å; G150-H174 WeakPolarHBondContact CA-O 3.46Å; G150-N197 PolarHBondContact N-O 3.4Å; G150-I198 CarbonylContact O-C 3.5Å; G150-I198 WeakPolarHBondContact O-CA 3.31Å; G150-I199 PolarHBondContact O-N 3Å
151	I	89.4	Confident	79.7	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	120.2	170.2	-53.2	176.7	0	0	0	108.5	F149 I160 L162 V173 H174 M175 R176 I199	F149-I151 HydrophobicContact CD2-CG1 4.04Å; F149-I151 HydrophobicContact CE2-CD1 3.91Å; F149-I151 HydrophobicContact CE2-CG1 3.75Å; I151-I160 HydrophobicContact CD1-CG2 4.42Å; I151-I160 HydrophobicContact CG2-CD1 4.21Å; I151-L162 HydrophobicContact CD1-CD2 4.39Å; I151-V173 HydrophobicContact CD1-CG1 3.7Å; I151-V173 HydrophobicContact CG1-CG1 4.01Å; I151-H174 PolarHBondContact N-O 3.06Å; I151-M175 HydrophobicContact CB-CE 3.92Å; I151-M175 HydrophobicContact CB-CG 4.49Å; I151-M175 HydrophobicContact CD1-CE 4.2Å; I151-M175 HydrophobicContact CG2-CE 3.53Å; I151-M175 WeakPolarHBondContact O-CA 3.43Å; I151-R176 PolarHBondContact O-N 3.35Å; I151-I199 HydrophobicContact CG1-CB 4.4Å; I151-I199 HydrophobicContact CG1-CD1 4.41Å
152	L	89.1	Confident	78.4	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	112.6	175.5	-176.8	153	0	0	0	108.1	V178 Y183 A186 F190 I199 D201 T202 L210	L152-V178 HydrophobicContact CD1-CG1 4.39Å; L152-V178 HydrophobicContact CD1-CG2 4.32Å; L152-V178 HydrophobicContact CD2-CG2 3.34Å; L152-V178 HydrophobicContact CG-CG1 4.22Å; L152-V178 HydrophobicContact CG-CG2 3.53Å; L152-Y183 HydrophobicContact CD1-CD1 4.47Å; L152-Y183 HydrophobicContact CD2-CD1 4.28Å; L152-Y183 HydrophobicContact CD2-CE1 4.05Å; L152-A186 HydrophobicContact CD1-CB 4.43Å; L152-F190 HydrophobicContact CB-CE2 4.28Å; L152-I199 PolarHBondContact N-O 3.02Å; L152-D201 PolarHBondContact O-N 3Å; L152-T202 HydrophobicContact CD2-CG2 3.49Å; L152-T202 VanDerWaalsContact CD2-CG2 3.49Å; L152-L210 HydrophobicContact CD1-CD1 4.2Å; L152-L210 HydrophobicContact CD2-CD2 4.31Å
153	H	86.8	Confident	77.3	Confident	30 Å²	30	55.7 Å²	55.7	14%	0.139	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135.7	-177.6	74.8	103.1	0	0	0	112.3	K155 R176 Q177 V178 D201	H153-K155 PolarHBondContact ND1-O 3.08Å; H153-R176 PolarHBondContact CD2-O 3.2Å; H153-R176 PolarHBondContact N-O 3.46Å; H153-Q177 WeakPolarHBondContact NE2-CB 3.29Å; H153-Q177 CarbonylContact O-C 3.6Å; H153-Q177 VanDerWaalsContact O-CA 3.28Å; H153-Q177 WeakPolarHBondContact O-CA 3.49Å; H153-V178 WeakPolarHBondContact O-CG2 3.48Å; H153-V178 PolarHBondContact O-N 3.09Å; H153-D201 CarbonylContact C-O 3.55Å; H153-D201 VanDerWaalsContact CA-O 3.32Å; H153-D201 WeakPolarHBondContact CA-O 3.36Å; H153-D201 HydrophobicContact CB-CB 4.25Å
154	E	83.1	Confident	76.2	Confident	32 Å²	32	53.6 Å²	53.6	15%	0.15	27%	0.272	C	S	.	.			trans	-102.9	-30.1	175.5	-174.5	-175	162.6	0	0	111.8	V178 Y183 D201 T202 N203	E154-V178 WeakPolarHBondContact CA-O 3.29Å; E154-V178 WeakPolarHBondContact CG-O 3.36Å; E154-Y183 PolarHBondContact OE2-OH 3.41Å; E154-D201 PolarHBondContact N-O 2.9Å; E154-T202 HydrophobicContact CB-CG2 4.25Å; E154-T202 WeakPolarHBondContact OE2-CB 3.48Å; E154-N203 PolarHBondContact OE1-ND2 3.22Å; E154-N203 PolarHBondContact OE2-N 3.32Å
155	K	70.8	Confident	75.2	Confident	60 Å²	60	53 Å²	53	26%	0.261	27%	0.27	S	S	.	.			trans	-81.8	137.2	-177	-65.7	170	-175.1	156.3	0	110.7	H153 N157 T202 N203	H153-K155 PolarHBondContact ND1-O 3.08Å; K155-N157 VanDerWaalsContact C-N 3.35Å; K155-T202 PolarHBondContact NZ-O 3.09Å; K155-N203 WeakPolarHBondContact CE-OD1 3.42Å; K155-N203 WeakPolarHBondContact CG-OD1 3.44Å
156	E	62.4	Low	74.1	Confident	174 Å²	174	50.8 Å²	50.8	81%	0.813	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-38.6	170.8	-67.8	179.4	171.2	0	0	111.1
157	N	60.4	Low	72.9	Confident	113 Å²	113	58.7 Å²	58.7	60%	0.604	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	68.4	172.2	-70.3	-24.1	0	0	0	110.3	K155	K155-N157 VanDerWaalsContact C-N 3.35Å
158	G	60.2	Low	72	Confident	23 Å²	23	57.6 Å²	57.6	24%	0.237	29%	0.29	C	S	.	.			trans	-59.1	163.7	177.1	0	0	0	0	0	113.8	D201	G158-D201 WeakPolarHBondContact CA-OD2 3.48Å
159	I	61.6	Low	71.2	Confident	10 Å²	10	55.8 Å²	55.8	5%	0.051	29%	0.285	C	S	.	.	S	Bend	trans	-66.1	-37.9	174	-67.8	169.7	0	0	0	109.3	V133 N134 F137 N161 D201	V133-I159 HydrophobicContact CG1-CG2 3.7Å; N134-I159 VanDerWaalsContact CG-O 3.3Å; N134-I159 PolarHBondContact ND2-O 2.95Å; N134-I159 PolarHBondContact OD1-O 3.02Å; F137-I159 HydrophobicContact CE2-CG2 4.28Å; I159-N161 PolarHBondContact O-N 2.79Å; I159-D201 PolarHBondContact N-OD2 3.46Å
160	I	63.7	Low	70.1	Confident	17 Å²	17	64.7 Å²	64.7	9%	0.087	33%	0.326	C	S	.	.	S	Bend	trans	-74.7	107.7	-176	-62.2	-177.5	0	0	0	110.3	N134 I151 L162 L165 I199 D201 T229	N134-I160 WeakPolarHBondContact OD1-CA 3.44Å; I151-I160 HydrophobicContact CD1-CG2 4.42Å; I151-I160 HydrophobicContact CG2-CD1 4.21Å; I160-L162 PolarHBondContact O-N 3.23Å; I160-L165 HydrophobicContact CB-CD1 4.37Å; I160-L165 HydrophobicContact CG2-CD1 3.15Å; I160-I199 HydrophobicContact CD1-CG2 3.5Å; I160-D201 HydrophobicContact CD1-CB 4.46Å; I160-T229 HydrophobicContact CD1-CG2 3.84Å; I160-T229 HydrophobicContact CG1-CG2 4.16Å
161	N	67.4	Low	69.4	Low	79 Å²	79	66.5 Å²	66.5	42%	0.422	35%	0.345	S	S	.	.			trans	-80.4	105	172.1	-170.9	-11.8	0	0	0	110.2	N134 I159 H163 Q164 L165	N134-N161 WeakPolarHBondContact ND2-CB 3.15Å; N134-N161 PolarHBondContact ND2-N 2.78Å; N134-N161 VanDerWaalsContact ND2-N 3.19Å; I159-N161 PolarHBondContact O-N 2.79Å; N161-H163 VanDerWaalsContact C-N 3.32Å; N161-H163 PolarHBondContact O-N 3.5Å; N161-H163 PolarHBondContact OD1-N 3.3Å; N161-Q164 HydrophobicContact CB-CB 4.24Å; N161-Q164 PolarHBondContact O-N 3.19Å; N161-Q164 VanDerWaalsContact O-N 3.13Å; N161-L165 PolarHBondContact O-N 3.14Å; N161-L165 VanDerWaalsContact O-N 3.13Å
162	L	62.8	Low	69	Low	80 Å²	80	71 Å²	71	42%	0.419	37%	0.366	S	S	.	.	H	α-helix	trans	-59.5	-39.7	-174.6	-72.2	166.9	0	0	0	114.1	I151 I160 Q164 L165 S166 M175	I151-L162 HydrophobicContact CD1-CD2 4.39Å; I160-L162 PolarHBondContact O-N 3.23Å; L162-Q164 PolarHBondContact O-N 3.24Å; L162-L165 PolarHBondContact O-N 2.67Å; L162-S166 WeakPolarHBondContact O-CB 3.38Å; L162-S166 PolarHBondContact O-N 3.03Å; L162-S166 PolarHBondContact O-OG 3.06Å; L162-M175 HydrophobicContact CD1-CE 3.71Å; L162-M175 HydrophobicContact CD1-SD 3.44Å; L162-M175 WeakPolarHBondContact CD1-SD 3.42Å; L162-M175 HydrophobicContact CD2-CE 3.1Å; L162-M175 HydrophobicContact CD2-SD 3.54Å; L162-M175 VanDerWaalsContact CD2-SD 3.54Å; L162-M175 HydrophobicContact CG-CE 3.8Å; L162-M175 HydrophobicContact CG-SD 4.07Å
163	H	62.9	Low	68.9	Low	112 Å²	112	73.9 Å²	73.9	52%	0.519	38%	0.384	S	S	.	.	H	α-helix	trans	-67.7	-25.7	-178.2	-177.9	-92.4	0	0	0	112.1	N161 S166 R167	N161-H163 VanDerWaalsContact C-N 3.32Å; N161-H163 PolarHBondContact O-N 3.5Å; N161-H163 PolarHBondContact OD1-N 3.3Å; H163-S166 PolarHBondContact O-OG 3.3Å; H163-R167 PolarHBondContact CE1-NE 2.92Å; H163-R167 VanDerWaalsContact CE1-NE 3.26Å; H163-R167 PolarHBondContact CE1-NH2 2.94Å; H163-R167 PolarHBondContact NE2-NH2 3.3Å; H163-R167 WeakPolarHBondContact O-CG 3.21Å
164	Q	65.4	Low	68.9	Low	32 Å²	32	73.9 Å²	73.9	15%	0.15	38%	0.384	C	S	.	.	H	α-helix	trans	-82.6	-43.7	176.7	-170.3	175	-20.2	0	0	111	Y135 N161 L162 R167 S168	Y135-Q164 VanDerWaalsContact CZ-NE2 3.29Å; N161-Q164 HydrophobicContact CB-CB 4.24Å; N161-Q164 PolarHBondContact O-N 3.19Å; N161-Q164 VanDerWaalsContact O-N 3.13Å; L162-Q164 PolarHBondContact O-N 3.24Å; Q164-R167 PolarHBondContact O-N 3.37Å; Q164-S168 PolarHBondContact O-N 3.32Å; Q164-S168 PolarHBondContact O-OG 2.84Å
165	L	67.1	Low	68.9	Low	16 Å²	16	75.3 Å²	75.3	8%	0.084	39%	0.391	C	S	.	.	H	α-helix	trans	-64.3	-40.9	176.7	-101.5	147.4	0	0	0	113.3	N138 I141 I160 N161 L162 R167 S168 F169	N138-L165 WeakPolarHBondContact OD1-CD2 3.48Å; N138-L165 WeakPolarHBondContact OD1-CG 3.49Å; I141-L165 HydrophobicContact CD1-CD2 4.12Å; I160-L165 HydrophobicContact CB-CD1 4.37Å; I160-L165 HydrophobicContact CG2-CD1 3.15Å; N161-L165 PolarHBondContact O-N 3.14Å; N161-L165 VanDerWaalsContact O-N 3.13Å; L162-L165 PolarHBondContact O-N 2.67Å; L165-R167 PolarHBondContact O-N 3.07Å; L165-S168 PolarHBondContact O-N 3.36Å; L165-F169 WeakPolarHBondContact O-CB 3.24Å; L165-F169 PolarHBondContact O-N 3.47Å; L165-F169 VanDerWaalsContact O-N 3.16Å
166	S	62.9	Low	69.7	Low	86 Å²	86	77.6 Å²	77.6	60%	0.601	40%	0.398	S	S	*	.	H	α-helix	trans	-67.2	-24.1	179.7	73.3	0	0	0	0	113.5	L162 H163	L162-S166 WeakPolarHBondContact O-CB 3.38Å; L162-S166 PolarHBondContact O-N 3.03Å; L162-S166 PolarHBondContact O-OG 3.06Å; H163-S166 PolarHBondContact O-OG 3.3Å
167	R	63.4	Low	70.8	Confident	182 Å²	182	75.4 Å²	75.4	69%	0.687	39%	0.388	S	S	*	.	H	α-helix	trans	-82.9	-31.4	177.9	-77	-177.9	176.6	-165.9	-2.1	112.8	H163 Q164 L165	H163-R167 PolarHBondContact CE1-NE 2.92Å; H163-R167 VanDerWaalsContact CE1-NE 3.26Å; H163-R167 PolarHBondContact CE1-NH2 2.94Å; H163-R167 PolarHBondContact NE2-NH2 3.3Å; H163-R167 WeakPolarHBondContact O-CG 3.21Å; Q164-R167 PolarHBondContact O-N 3.37Å; L165-R167 PolarHBondContact O-N 3.07Å
168	S	64	Low	72	Confident	79 Å²	79	70.3 Å²	70.3	55%	0.552	36%	0.361	S	S	*	.	H	α-helix	trans	-92.4	-17.3	-174.5	-60.9	0	0	0	0	113.7	Q164 L165	Q164-S168 PolarHBondContact O-N 3.32Å; Q164-S168 PolarHBondContact O-OG 2.84Å; L165-S168 PolarHBondContact O-N 3.36Å
169	F	71.4	Confident	73.1	Confident	43 Å²	43	72.5 Å²	72.5	19%	0.189	37%	0.372	C	S	.	.			trans	-110.8	127	-172.1	-170.9	-105.6	0	0	0	113	I141 W146 F149 L165 V173	I141-F169 HydrophobicContact CG2-CD2 4.24Å; I141-F169 HydrophobicContact CG2-CE2 3.92Å; W146-F169 WeakPolarHBondContact O-CE2 3.42Å; W146-F169 WeakPolarHBondContact O-CZ 3.44Å; F149-F169 HydrophobicContact CD1-CE1 4.14Å; F149-F169 AromaticContact CD1-CZ 3.98Å; F149-F169 HydrophobicContact CD1-CZ 3.98Å; F149-F169 AromaticContact CE1-CD1 4Å; F149-F169 HydrophobicContact CE1-CD1 4Å; F149-F169 HydrophobicContact CE1-CD2 4.36Å; F149-F169 AromaticContact CE1-CE1 3.51Å; F149-F169 HydrophobicContact CE1-CE1 3.51Å; F149-F169 AromaticContact CE1-CE2 3.94Å; F149-F169 HydrophobicContact CE1-CE2 3.94Å; F149-F169 HydrophobicContact CE1-CG 4.39Å; F149-F169 AromaticContact CE1-CZ 3.49Å; F149-F169 HydrophobicContact CE1-CZ 3.49Å; F149-F169 VanDerWaalsContact CE1-CZ 3.49Å; F149-F169 HydrophobicContact CZ-CE1 4.4Å; L165-F169 WeakPolarHBondContact O-CB 3.24Å; L165-F169 PolarHBondContact O-N 3.47Å; L165-F169 VanDerWaalsContact O-N 3.16Å; F169-V173 HydrophobicContact CD1-CG2 3.72Å; F169-V173 HydrophobicContact CE1-CG2 3.92Å
170	H	67.2	Low	73.9	Confident	187 Å²	187	78.1 Å²	78.1	87%	0.866	39%	0.393	S	S	*	.			trans	-102.7	69.8	176.1	-65.7	-58.2	0	0	0	110.8
171	G	74.6	Confident	74.7	Confident	39 Å²	39	84.7 Å²	84.7	40%	0.402	43%	0.428	S	S	.	.	S	Bend	trans	-163.6	-177	178.9	0	0	0	0	0	113.4	T147	T147-G171 CarbonylContact O-C 3.59Å; T147-G171 VanDerWaalsContact O-CA 3.3Å; T147-G171 WeakPolarHBondContact O-CA 3.48Å
172	E	82.7	Confident	75.6	Confident	95 Å²	95	82.5 Å²	82.5	44%	0.444	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	119.1	-176.2	-171.3	-179.4	-157.9	0	0	111	T147 R148 F149 H174	T147-E172 PolarHBondContact O-N 3.12Å; R148-E172 WeakPolarHBondContact CA-O 3.5Å; R148-E172 WeakPolarHBondContact CD-OE2 3.48Å; R148-E172 HydrophobicContact CG-CB 4.23Å; R148-E172 IonicContact CZ-OE2 3.96Å; R148-E172 IonicContact NE-OE2 3.86Å; R148-E172 PolarHBondContact NE-OE2 3.46Å; R148-E172 IonicContact NH2-OE2 3.57Å; F149-E172 PolarHBondContact N-O 2.85Å; F149-E172 VanDerWaalsContact N-O 3.17Å; E172-H174 IonicContact OE1-CE1 3.12Å; E172-H174 PolarHBondContact OE1-CE1 2.95Å; E172-H174 IonicContact OE1-NE2 2.66Å; E172-H174 PolarHBondContact OE1-NE2 3.41Å; E172-H174 VanDerWaalsContact OE1-NE2 3.08Å; E172-H174 IonicContact OE2-NE2 2.91Å
173	V	86.4	Confident	76.8	Confident	63 Å²	63	78.7 Å²	78.7	38%	0.382	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	120.9	-179.6	-176.4	0	0	0	0	109.6	F149 I151 F169	F149-V173 HydrophobicContact CE1-CG2 4.01Å; F149-V173 HydrophobicContact CE2-CG1 4Å; F149-V173 HydrophobicContact CE2-CG2 4.23Å; F149-V173 HydrophobicContact CZ-CG1 4.34Å; F149-V173 HydrophobicContact CZ-CG2 3.77Å; F149-V173 WeakPolarHBondContact O-CA 3.27Å; I151-V173 HydrophobicContact CD1-CG1 3.7Å; I151-V173 HydrophobicContact CG1-CG1 4.01Å; F169-V173 HydrophobicContact CD1-CG2 3.72Å; F169-V173 HydrophobicContact CE1-CG2 3.92Å
174	H	86.8	Confident	78	Confident	30 Å²	30	75.6 Å²	75.6	14%	0.139	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	116.1	176.1	-65.2	-74.1	0	0	0	110.9	F149 G150 I151 E172 F190 I195	F149-H174 PolarHBondContact O-N 3.48Å; G150-H174 CarbonylContact C-O 3.5Å; G150-H174 WeakPolarHBondContact CA-O 3.46Å; I151-H174 PolarHBondContact N-O 3.06Å; E172-H174 IonicContact OE1-CE1 3.12Å; E172-H174 PolarHBondContact OE1-CE1 2.95Å; E172-H174 IonicContact OE1-NE2 2.66Å; E172-H174 PolarHBondContact OE1-NE2 3.41Å; E172-H174 VanDerWaalsContact OE1-NE2 3.08Å; E172-H174 IonicContact OE2-NE2 2.91Å; H174-F190 HydrophobicContact CB-CE1 4.11Å; H174-I195 HydrophobicContact CB-CD1 3.82Å; H174-I195 WeakPolarHBondContact CD2-CD1 3.35Å
175	M	83.3	Confident	79.2	Confident	62 Å²	62	78.1 Å²	78.1	31%	0.305	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.3	-178.3	-179.7	169	-107.7	0	0	112.3	I151 L162	I151-M175 HydrophobicContact CB-CE 3.92Å; I151-M175 HydrophobicContact CB-CG 4.49Å; I151-M175 HydrophobicContact CD1-CE 4.2Å; I151-M175 HydrophobicContact CG2-CE 3.53Å; I151-M175 WeakPolarHBondContact O-CA 3.43Å; L162-M175 HydrophobicContact CD1-CE 3.71Å; L162-M175 HydrophobicContact CD1-SD 3.44Å; L162-M175 WeakPolarHBondContact CD1-SD 3.42Å; L162-M175 HydrophobicContact CD2-CE 3.1Å; L162-M175 HydrophobicContact CD2-SD 3.54Å; L162-M175 VanDerWaalsContact CD2-SD 3.54Å; L162-M175 HydrophobicContact CG-CE 3.8Å; L162-M175 HydrophobicContact CG-SD 4.07Å
176	R	86.6	Confident	80.2	Confident	108 Å²	108	77.6 Å²	77.6	41%	0.408	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	124.6	170.4	-70.8	-60.6	-177.4	-169.1	1.1	112.1	I151 H153 A186 E189 F190	I151-R176 PolarHBondContact O-N 3.35Å; H153-R176 PolarHBondContact CD2-O 3.2Å; H153-R176 PolarHBondContact N-O 3.46Å; R176-A186 HydrophobicContact CB-CB 4.38Å; R176-E189 IonicContact CZ-OE1 3.61Å; R176-E189 IonicContact CZ-OE2 3.69Å; R176-E189 VanDerWaalsContact NE-CD 3.33Å; R176-E189 IonicContact NE-OE1 2.83Å; R176-E189 PolarHBondContact NE-OE1 2.74Å; R176-E189 IonicContact NE-OE2 3.63Å; R176-E189 PolarHBondContact NE-OE2 2.85Å; R176-E189 VanDerWaalsContact NH2-CD 3.25Å; R176-E189 IonicContact NH2-OE1 3.54Å; R176-E189 PolarHBondContact NH2-OE1 3.44Å; R176-E189 IonicContact NH2-OE2 3.57Å; R176-E189 PolarHBondContact NH2-OE2 3.34Å; R176-F190 HydrophobicContact CB-CZ 4.18Å; R176-F190 HydrophobicContact CG-CE1 4.03Å; R176-F190 HydrophobicContact CG-CZ 4.08Å
177	Q	86.1	Confident	81.5	Confident	127 Å²	127	73.6 Å²	73.6	59%	0.593	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	132.3	165.2	-169.9	175.4	-0.8	0	0	108.9	H153	H153-Q177 WeakPolarHBondContact NE2-CB 3.29Å; H153-Q177 CarbonylContact O-C 3.6Å; H153-Q177 VanDerWaalsContact O-CA 3.28Å; H153-Q177 WeakPolarHBondContact O-CA 3.49Å
178	V	84.6	Confident	82.8	Confident	7 Å²	7	68.4 Å²	68.4	4%	0.042	37%	0.365	C	S	.	.			trans	-132.7	141.7	-176.4	-76.8	0	0	0	0	112.1	L152 H153 E154 S182 Y183 A186	L152-V178 HydrophobicContact CD1-CG1 4.39Å; L152-V178 HydrophobicContact CD1-CG2 4.32Å; L152-V178 HydrophobicContact CD2-CG2 3.34Å; L152-V178 HydrophobicContact CG-CG1 4.22Å; L152-V178 HydrophobicContact CG-CG2 3.53Å; H153-V178 WeakPolarHBondContact O-CG2 3.48Å; H153-V178 PolarHBondContact O-N 3.09Å; E154-V178 WeakPolarHBondContact CA-O 3.29Å; E154-V178 WeakPolarHBondContact CG-O 3.36Å; V178-S182 VanDerWaalsContact CA-OG 3.28Å; V178-S182 WeakPolarHBondContact CA-OG 3.46Å; V178-S182 WeakPolarHBondContact CB-OG 3.47Å; V178-Y183 HydrophobicContact CB-CD1 3.96Å; V178-Y183 HydrophobicContact CB-CE1 4.07Å; V178-Y183 HydrophobicContact CG1-CD1 4.39Å; V178-Y183 HydrophobicContact CG2-CD1 3.87Å; V178-Y183 HydrophobicContact CG2-CE1 3.63Å; V178-A186 HydrophobicContact CG1-CB 3.47Å; V178-A186 VanDerWaalsContact CG1-CB 3.47Å
179	S	84.7	Confident	84	Confident	68 Å²	68	67 Å²	67	48%	0.476	35%	0.35	S	S	.	.			trans	-102.1	170.9	160.5	67.2	0	0	0	0	110.6	D181 S182	S179-D181 PolarHBondContact O-N 2.87Å; S179-D181 VanDerWaalsContact O-N 3.09Å; S179-S182 PolarHBondContact N-OG 3.39Å; S179-S182 PolarHBondContact O-N 3.36Å; S179-S182 PolarHBondContact O-OG 2.55Å; S179-S182 PolarHBondContact OG-OG 2.8Å
180	R	78.4	Confident	84.9	Confident	128 Å²	128	64.9 Å²	64.9	48%	0.483	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-35.4	-177.8	-69.6	-176.7	-175.5	173.8	1.1	114.5	Y183	R180-Y183 VanDerWaalsContact O-CD2 3.27Å; R180-Y183 WeakPolarHBondContact O-CD2 3.17Å
181	D	80	Confident	85.9	Confident	155 Å²	155	59.8 Å²	59.8	83%	0.829	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-15.3	-177	-55.6	-38.9	0	0	0	113	S179	S179-D181 PolarHBondContact O-N 2.87Å; S179-D181 VanDerWaalsContact O-N 3.09Å
182	S	86.8	Confident	86.5	Confident	34 Å²	34	61.1 Å²	61.1	24%	0.238	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-5.3	-172.7	68.6	0	0	0	0	114.6	V178 S179 V184 S185 A186	V178-S182 VanDerWaalsContact CA-OG 3.28Å; V178-S182 WeakPolarHBondContact CA-OG 3.46Å; V178-S182 WeakPolarHBondContact CB-OG 3.47Å; S179-S182 PolarHBondContact N-OG 3.39Å; S179-S182 PolarHBondContact O-N 3.36Å; S179-S182 PolarHBondContact O-OG 2.55Å; S179-S182 PolarHBondContact OG-OG 2.8Å; S182-V184 VanDerWaalsContact C-N 3.3Å; S182-V184 PolarHBondContact O-N 3.38Å; S182-S185 PolarHBondContact O-N 3.09Å; S182-S185 VanDerWaalsContact O-N 3.15Å; S182-A186 PolarHBondContact O-N 3.26Å; S182-A186 VanDerWaalsContact O-N 3.1Å
183	Y	87.8	Confident	86.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-55.3	-43.4	-177.4	-70.5	-47.7	0	0	0	112.7	L152 E154 V178 R180 S185 A186 L187 T202 I209 L210 N213	L152-Y183 HydrophobicContact CD1-CD1 4.47Å; L152-Y183 HydrophobicContact CD2-CD1 4.28Å; L152-Y183 HydrophobicContact CD2-CE1 4.05Å; E154-Y183 PolarHBondContact OE2-OH 3.41Å; V178-Y183 HydrophobicContact CB-CD1 3.96Å; V178-Y183 HydrophobicContact CB-CE1 4.07Å; V178-Y183 HydrophobicContact CG1-CD1 4.39Å; V178-Y183 HydrophobicContact CG2-CD1 3.87Å; V178-Y183 HydrophobicContact CG2-CE1 3.63Å; R180-Y183 VanDerWaalsContact O-CD2 3.27Å; R180-Y183 WeakPolarHBondContact O-CD2 3.17Å; Y183-S185 PolarHBondContact O-N 3.17Å; Y183-A186 PolarHBondContact O-N 3.42Å; Y183-L187 WeakPolarHBondContact O-CB 3.39Å; Y183-L187 VanDerWaalsContact O-CG 3.27Å; Y183-L187 WeakPolarHBondContact O-CG 3.5Å; Y183-L187 PolarHBondContact O-N 2.93Å; Y183-T202 HydrophobicContact CE1-CG2 3.97Å; Y183-I209 HydrophobicContact CD2-CG2 4.12Å; Y183-I209 HydrophobicContact CE2-CB 4.48Å; Y183-I209 HydrophobicContact CE2-CG2 4.28Å; Y183-L210 HydrophobicContact CD1-CD1 3.74Å; Y183-L210 HydrophobicContact CE1-CD1 4.27Å; Y183-L210 HydrophobicContact CG-CD1 3.93Å; Y183-N213 WeakPolarHBondContact CB-ND2 3.37Å
184	V	88.6	Confident	86.6	Confident	47 Å²	47	64 Å²	64	29%	0.285	34%	0.338	S	S	.	.	H	α-helix	trans	-62.4	-43	-179.6	173.8	0	0	0	0	111.5	S182 L187 N188 N213	S182-V184 VanDerWaalsContact C-N 3.3Å; S182-V184 PolarHBondContact O-N 3.38Å; V184-L187 PolarHBondContact O-N 3.34Å; V184-N188 WeakPolarHBondContact O-CB 3.35Å; V184-N188 PolarHBondContact O-N 3.16Å; V184-N188 PolarHBondContact O-ND2 3.05Å; V184-N213 HydrophobicContact CG2-CB 4.3Å
185	S	89.4	Confident	86.7	Confident	84 Å²	84	62.6 Å²	62.6	59%	0.587	33%	0.332	S	S	*	.	H	α-helix	trans	-64.5	-41.8	178.7	-171.7	0	0	0	0	111.7	S182 Y183 N188 E189	S182-S185 PolarHBondContact O-N 3.09Å; S182-S185 VanDerWaalsContact O-N 3.15Å; Y183-S185 PolarHBondContact O-N 3.17Å; S185-N188 PolarHBondContact O-N 3.12Å; S185-E189 PolarHBondContact O-N 3.35Å; S185-E189 VanDerWaalsContact O-N 3.07Å
186	A	89.1	Confident	87	Confident	6 Å²	6	62.7 Å²	62.7	5%	0.05	33%	0.331	C	S	.	.	H	α-helix	trans	-67.1	-42.4	178.5	0	0	0	0	0	112.1	L152 R176 V178 S182 Y183 E189 F190	L152-A186 HydrophobicContact CD1-CB 4.43Å; R176-A186 HydrophobicContact CB-CB 4.38Å; V178-A186 HydrophobicContact CG1-CB 3.47Å; V178-A186 VanDerWaalsContact CG1-CB 3.47Å; S182-A186 PolarHBondContact O-N 3.26Å; S182-A186 VanDerWaalsContact O-N 3.1Å; Y183-A186 PolarHBondContact O-N 3.42Å; A186-E189 PolarHBondContact O-N 2.84Å; A186-F190 WeakPolarHBondContact O-CG 3.19Å; A186-F190 PolarHBondContact O-N 3.48Å
187	L	90.3	Very high	87.3	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-41.7	175.5	-71.5	173.8	0	0	0	111.8	Y183 V184 E189 F190 K191 L210 N213 I214 Q217 M219	Y183-L187 WeakPolarHBondContact O-CB 3.39Å; Y183-L187 VanDerWaalsContact O-CG 3.27Å; Y183-L187 WeakPolarHBondContact O-CG 3.5Å; Y183-L187 PolarHBondContact O-N 2.93Å; V184-L187 PolarHBondContact O-N 3.34Å; L187-E189 VanDerWaalsContact C-N 3.33Å; L187-E189 PolarHBondContact O-N 2.93Å; L187-F190 PolarHBondContact O-N 3.39Å; L187-K191 WeakPolarHBondContact O-CB 3.48Å; L187-K191 PolarHBondContact O-N 3.3Å; L187-L210 HydrophobicContact CD1-CD1 4.22Å; L187-N213 HydrophobicContact CD1-CB 3.98Å; L187-I214 HydrophobicContact CD1-CG1 3.97Å; L187-I214 HydrophobicContact CD2-CG1 4.2Å; L187-Q217 HydrophobicContact CB-CG 4.35Å; L187-M219 HydrophobicContact CB-SD 3.85Å; L187-M219 HydrophobicContact CD2-CE 4.11Å; L187-M219 HydrophobicContact CD2-SD 4.02Å; L187-M219 HydrophobicContact CG-SD 4.44Å
188	N	89.6	Confident	87.6	Confident	72 Å²	72	53.3 Å²	53.3	39%	0.385	29%	0.293	S	S	.	.	H	α-helix	trans	-62.8	-38.5	175.5	-83	-27.6	0	0	0	112.9	V184 S185 K191 G192 Q217	V184-N188 WeakPolarHBondContact O-CB 3.35Å; V184-N188 PolarHBondContact O-N 3.16Å; V184-N188 PolarHBondContact O-ND2 3.05Å; S185-N188 PolarHBondContact O-N 3.12Å; N188-K191 PolarHBondContact O-N 2.83Å; N188-G192 PolarHBondContact O-N 2.8Å; N188-Q217 PolarHBondContact OD1-OE1 2.81Å
189	E	90	Very high	87.9	Confident	49 Å²	49	53 Å²	53	23%	0.229	29%	0.291	C	S	.	.	H	α-helix	trans	-64.2	-44.4	174.3	-173	-173.7	163.9	0	0	111.7	R176 S185 A186 L187 K191 G192 K193	R176-E189 IonicContact CZ-OE1 3.61Å; R176-E189 IonicContact CZ-OE2 3.69Å; R176-E189 VanDerWaalsContact NE-CD 3.33Å; R176-E189 IonicContact NE-OE1 2.83Å; R176-E189 PolarHBondContact NE-OE1 2.74Å; R176-E189 IonicContact NE-OE2 3.63Å; R176-E189 PolarHBondContact NE-OE2 2.85Å; R176-E189 VanDerWaalsContact NH2-CD 3.25Å; R176-E189 IonicContact NH2-OE1 3.54Å; R176-E189 PolarHBondContact NH2-OE1 3.44Å; R176-E189 IonicContact NH2-OE2 3.57Å; R176-E189 PolarHBondContact NH2-OE2 3.34Å; S185-E189 PolarHBondContact O-N 3.35Å; S185-E189 VanDerWaalsContact O-N 3.07Å; A186-E189 PolarHBondContact O-N 2.84Å; L187-E189 VanDerWaalsContact C-N 3.33Å; L187-E189 PolarHBondContact O-N 2.93Å; E189-K191 VanDerWaalsContact C-N 3.33Å; E189-K191 PolarHBondContact O-N 2.94Å; E189-G192 PolarHBondContact O-N 3.43Å; E189-K193 HydrophobicContact CG-CD 4.24Å; E189-K193 WeakPolarHBondContact O-CG 3.47Å; E189-K193 PolarHBondContact O-N 2.91Å; E189-K193 IonicContact OE1-NZ 3.81Å; E189-K193 PolarHBondContact OE1-NZ 2.89Å
190	F	90.9	Very high	88.2	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64	-39.5	176.8	-68.6	-19	0	0	0	112.2	L152 H174 R176 A186 L187 K193 E194 I195 I198	L152-F190 HydrophobicContact CB-CE2 4.28Å; H174-F190 HydrophobicContact CB-CE1 4.11Å; R176-F190 HydrophobicContact CB-CZ 4.18Å; R176-F190 HydrophobicContact CG-CE1 4.03Å; R176-F190 HydrophobicContact CG-CZ 4.08Å; A186-F190 WeakPolarHBondContact O-CG 3.19Å; A186-F190 PolarHBondContact O-N 3.48Å; L187-F190 PolarHBondContact O-N 3.39Å; F190-K193 PolarHBondContact O-N 3.46Å; F190-E194 PolarHBondContact O-N 2.89Å; F190-I195 HydrophobicContact CB-CB 4.24Å; F190-I195 HydrophobicContact CD1-CD1 3.7Å; F190-I195 HydrophobicContact CE1-CD1 4.33Å; F190-I195 HydrophobicContact CG-CD1 4.41Å; F190-I195 PolarHBondContact O-N 3.14Å; F190-I198 HydrophobicContact CB-CD1 4.44Å; F190-I198 HydrophobicContact CD2-CD1 4.04Å; F190-I198 HydrophobicContact CD2-CG1 4.35Å; F190-I198 HydrophobicContact CD2-CG2 4.41Å; F190-I198 HydrophobicContact CE2-CG2 4.25Å
191	K	88.1	Confident	88.7	Confident	79 Å²	79	44 Å²	44	34%	0.343	25%	0.247	S	C	.	.	H	α-helix	trans	-62	-47.1	173.5	-171.1	174.2	-176.5	173.3	0	111.7	L187 N188 E189 K193 E194 Q217 M219	L187-K191 WeakPolarHBondContact O-CB 3.48Å; L187-K191 PolarHBondContact O-N 3.3Å; N188-K191 PolarHBondContact O-N 2.83Å; E189-K191 VanDerWaalsContact C-N 3.33Å; E189-K191 PolarHBondContact O-N 2.94Å; K191-K193 VanDerWaalsContact C-N 3.25Å; K191-K193 PolarHBondContact O-N 3.3Å; K191-E194 PolarHBondContact O-N 2.97Å; K191-E194 VanDerWaalsContact O-N 3.12Å; K191-Q217 PolarHBondContact NZ-O 3.28Å; K191-M219 HydrophobicContact CB-SD 4.2Å; K191-M219 HydrophobicContact CD-CG 4.35Å
192	G	86.3	Confident	88.9	Confident	68 Å²	68	36.7 Å²	36.7	70%	0.701	21%	0.208	S	C	*	.	H	α-helix	trans	-65.4	-25.3	178.8	0	0	0	0	0	114.3	N188 E189	N188-G192 PolarHBondContact O-N 2.8Å; E189-G192 PolarHBondContact O-N 3.43Å
193	K	86.3	Confident	88.5	Confident	78 Å²	78	37.2 Å²	37.2	34%	0.339	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	2.6	175.3	-71.7	178.5	175.2	173.5	0	114	R148 E189 F190 K191 I195	R148-K193 PolarHBondContact NH1-O 3.17Å; R148-K193 PolarHBondContact NH2-O 3.2Å; E189-K193 HydrophobicContact CG-CD 4.24Å; E189-K193 WeakPolarHBondContact O-CG 3.47Å; E189-K193 PolarHBondContact O-N 2.91Å; E189-K193 IonicContact OE1-NZ 3.81Å; E189-K193 PolarHBondContact OE1-NZ 2.89Å; F190-K193 PolarHBondContact O-N 3.46Å; K191-K193 VanDerWaalsContact C-N 3.25Å; K191-K193 PolarHBondContact O-N 3.3Å; K193-I195 VanDerWaalsContact C-N 3.31Å; K193-I195 HydrophobicContact CB-CD1 3.76Å; K193-I195 HydrophobicContact CB-CG1 3.93Å; K193-I195 HydrophobicContact CD-CD1 4.17Å; K193-I195 PolarHBondContact O-N 3.02Å
194	E	84.9	Confident	88	Confident	139 Å²	139	39.8 Å²	39.8	65%	0.65	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	42.9	-175.5	-58.7	-174.4	159.4	0	0	113.1	F190 K191 H196	F190-E194 PolarHBondContact O-N 2.89Å; K191-E194 PolarHBondContact O-N 2.97Å; K191-E194 VanDerWaalsContact O-N 3.12Å; E194-H196 PolarHBondContact O-CE1 2.96Å; E194-H196 PolarHBondContact O-ND1 3.47Å; E194-H196 VanDerWaalsContact O-ND1 3.15Å
195	I	89.3	Confident	87.4	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	24%	0.236	C	C	.	.			trans	-91.3	111.8	176.3	-60.2	163.3	0	0	0	108.6	H174 F190 K193 I198	H174-I195 HydrophobicContact CB-CD1 3.82Å; H174-I195 WeakPolarHBondContact CD2-CD1 3.35Å; F190-I195 HydrophobicContact CB-CB 4.24Å; F190-I195 HydrophobicContact CD1-CD1 3.7Å; F190-I195 HydrophobicContact CE1-CD1 4.33Å; F190-I195 HydrophobicContact CG-CD1 4.41Å; F190-I195 PolarHBondContact O-N 3.14Å; K193-I195 VanDerWaalsContact C-N 3.31Å; K193-I195 HydrophobicContact CB-CD1 3.76Å; K193-I195 HydrophobicContact CB-CG1 3.93Å; K193-I195 HydrophobicContact CD-CD1 4.17Å; K193-I195 PolarHBondContact O-N 3.02Å; I195-I198 HydrophobicContact CG2-CG1 4.43Å
196	H	89.2	Confident	87.1	Confident	63 Å²	63	37.9 Å²	37.9	29%	0.292	21%	0.208	S	C	.	.			trans	-99.2	-27.7	-174.2	-60.4	105.2	0	0	0	113.9	E194 K223 Y224 H225	E194-H196 PolarHBondContact O-CE1 2.96Å; E194-H196 PolarHBondContact O-ND1 3.47Å; E194-H196 VanDerWaalsContact O-ND1 3.15Å; H196-K223 WeakPolarHBondContact CB-O 3.33Å; H196-Y224 HydrophobicContact CB-CD1 4.37Å; H196-Y224 AromaticContact CD2-CE1 3.82Å; H196-Y224 WeakPolarHBondContact O-CA 3.29Å; H196-H225 PolarHBondContact O-N 3.26Å
197	N	92.5	Very high	87	Confident	37 Å²	37	37.7 Å²	37.7	20%	0.198	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	121.7	178.4	-57.9	-37	0	0	0	109.3	W146 R148 F149 G150 H225	W146-N197 HydrophobicContact CD2-CB 3.84Å; W146-N197 HydrophobicContact CE3-CB 3.95Å; W146-N197 HydrophobicContact CG-CB 4.43Å; W146-N197 HydrophobicContact CH2-CB 4.09Å; W146-N197 HydrophobicContact CZ2-CB 4Å; W146-N197 HydrophobicContact CZ3-CB 4.06Å; R148-N197 PolarHBondContact O-ND2 3.27Å; F149-N197 CarbonylContact C-O 3.58Å; F149-N197 VanDerWaalsContact CA-O 3.24Å; F149-N197 WeakPolarHBondContact CA-O 3.44Å; F149-N197 HydrophobicContact CB-CB 3.67Å; F149-N197 WeakPolarHBondContact CB-O 3.49Å; G150-N197 PolarHBondContact N-O 3.4Å; N197-H225 CarbonylContact C-O 3.6Å; N197-H225 WeakPolarHBondContact CA-O 3.22Å
198	I	93	Very high	86.8	Confident	1 Å²	1	40 Å²	40	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	125.5	-172.6	-56.4	171	0	0	0	110.3	G150 F190 I195 I200 M219 H225 Y226 L227	G150-I198 CarbonylContact O-C 3.5Å; G150-I198 WeakPolarHBondContact O-CA 3.31Å; F190-I198 HydrophobicContact CB-CD1 4.44Å; F190-I198 HydrophobicContact CD2-CD1 4.04Å; F190-I198 HydrophobicContact CD2-CG1 4.35Å; F190-I198 HydrophobicContact CD2-CG2 4.41Å; F190-I198 HydrophobicContact CE2-CG2 4.25Å; I195-I198 HydrophobicContact CG2-CG1 4.43Å; I198-I200 HydrophobicContact CG2-CG1 4.19Å; I198-M219 HydrophobicContact CD1-CE 3.71Å; I198-H225 PolarHBondContact N-O 3.24Å; I198-Y226 HydrophobicContact CB-CD1 3.95Å; I198-Y226 HydrophobicContact CB-CE1 4.08Å; I198-Y226 HydrophobicContact CD1-CE1 3.78Å; I198-Y226 HydrophobicContact CG1-CE1 4.41Å; I198-Y226 HydrophobicContact CG2-CD1 4.42Å; I198-Y226 WeakPolarHBondContact O-CA 3.28Å; I198-L227 PolarHBondContact O-N 3.38Å
199	I	91.6	Very high	86.7	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	129.2	171.6	-52.3	-178.6	0	0	0	109.1	I141 W146 F149 G150 I151 L152 I160 L227 T229	I141-I199 HydrophobicContact CD1-CD1 3.73Å; I141-I199 HydrophobicContact CG1-CD1 4.38Å; W146-I199 HydrophobicContact CZ3-CD1 4.26Å; W146-I199 HydrophobicContact CZ3-CG1 3.8Å; F149-I199 HydrophobicContact CD2-CD1 3.73Å; F149-I199 HydrophobicContact CD2-CG1 4.05Å; F149-I199 HydrophobicContact CE2-CD1 3.52Å; F149-I199 HydrophobicContact CE2-CG1 4.32Å; F149-I199 HydrophobicContact CZ-CD1 4.35Å; G150-I199 PolarHBondContact O-N 3Å; I151-I199 HydrophobicContact CG1-CB 4.4Å; I151-I199 HydrophobicContact CG1-CD1 4.41Å; L152-I199 PolarHBondContact N-O 3.02Å; I160-I199 HydrophobicContact CD1-CG2 3.5Å; I199-L227 CarbonylContact C-O 3.57Å; I199-L227 WeakPolarHBondContact CA-O 3.46Å; I199-L227 HydrophobicContact CD1-CD2 4.43Å; I199-L227 HydrophobicContact CG1-CB 4.34Å; I199-L227 HydrophobicContact CG1-CD2 4.33Å; I199-T229 HydrophobicContact CG2-CG2 4.1Å
200	I	90.8	Very high	86.7	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.015	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	109.8	-175.8	-63.7	168.8	0	0	0	109.4	I198 T202 L210 I214 Y226 L227 F228 T229	I198-I200 HydrophobicContact CG2-CG1 4.19Å; I200-T202 HydrophobicContact CG2-CG2 3.82Å; I200-L210 HydrophobicContact CB-CD2 4.33Å; I200-L210 HydrophobicContact CD1-CD2 3.71Å; I200-L210 HydrophobicContact CG1-CD2 4.01Å; I200-L210 HydrophobicContact CG2-CD2 3.36Å; I200-I214 HydrophobicContact CD1-CD1 4.35Å; I200-Y226 HydrophobicContact CD1-CD1 3.62Å; I200-Y226 HydrophobicContact CD1-CE1 4.38Å; I200-Y226 HydrophobicContact CD1-CG 4.29Å; I200-Y226 HydrophobicContact CG1-CD1 4.47Å; I200-L227 PolarHBondContact N-O 3.04Å; I200-F228 HydrophobicContact CB-CD1 3.9Å; I200-F228 HydrophobicContact CB-CE1 4.03Å; I200-F228 HydrophobicContact CB-CG 4.46Å; I200-F228 HydrophobicContact CD1-CD1 4.19Å; I200-F228 HydrophobicContact CD1-CE1 3.55Å; I200-F228 HydrophobicContact CD1-CE2 3.97Å; I200-F228 HydrophobicContact CD1-CZ 3.42Å; I200-F228 VanDerWaalsContact CD1-CZ 3.42Å; I200-F228 HydrophobicContact CG1-CE1 4.39Å; I200-F228 HydrophobicContact CG2-CD1 3.8Å; I200-F228 HydrophobicContact CG2-CE1 3.76Å; I200-T229 PolarHBondContact O-N 3.13Å; I200-T229 PolarHBondContact O-OG1 3.02Å
201	D	88.1	Confident	86.7	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.011	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	79.6	171.7	-167.7	18.6	0	0	0	111.2	L152 H153 E154 G158 I159 I160 T229	L152-D201 PolarHBondContact O-N 3Å; H153-D201 CarbonylContact C-O 3.55Å; H153-D201 VanDerWaalsContact CA-O 3.32Å; H153-D201 WeakPolarHBondContact CA-O 3.36Å; H153-D201 HydrophobicContact CB-CB 4.25Å; E154-D201 PolarHBondContact N-O 2.9Å; G158-D201 WeakPolarHBondContact CA-OD2 3.48Å; I159-D201 PolarHBondContact N-OD2 3.46Å; I160-D201 HydrophobicContact CD1-CB 4.46Å; D201-T229 WeakPolarHBondContact CA-OG1 3.47Å; D201-T229 HydrophobicContact CB-CG2 3.89Å; D201-T229 PolarHBondContact OD1-OG1 2.96Å
202	T	83.6	Confident	86.8	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.018	22%	0.224	C	C	.	.			trans	-115.3	169.5	-177.7	54.6	0	0	0	0	112.3	L152 E154 K155 Y183 I200 I207 L210	L152-T202 HydrophobicContact CD2-CG2 3.49Å; L152-T202 VanDerWaalsContact CD2-CG2 3.49Å; E154-T202 HydrophobicContact CB-CG2 4.25Å; E154-T202 WeakPolarHBondContact OE2-CB 3.48Å; K155-T202 PolarHBondContact NZ-O 3.09Å; Y183-T202 HydrophobicContact CE1-CG2 3.97Å; I200-T202 HydrophobicContact CG2-CG2 3.82Å; T202-I207 VanDerWaalsContact OG1-CG1 3.28Å; T202-I207 WeakPolarHBondContact OG1-CG1 3.34Å; T202-L210 HydrophobicContact CG2-CD2 4.25Å
203	N	80.2	Confident	86.9	Confident	45 Å²	45	38.3 Å²	38.3	24%	0.241	20%	0.195	C	C	.	.			trans	-74.5	154	169.6	-68.2	-41.4	0	0	0	110.5	E154 K155 N205 G206 I207	E154-N203 PolarHBondContact OE1-ND2 3.22Å; E154-N203 PolarHBondContact OE2-N 3.32Å; K155-N203 WeakPolarHBondContact CE-OD1 3.42Å; K155-N203 WeakPolarHBondContact CG-OD1 3.44Å; N203-N205 VanDerWaalsContact C-N 3.25Å; N203-N205 PolarHBondContact O-N 3.43Å; N203-G206 WeakPolarHBondContact O-CA 3.28Å; N203-G206 PolarHBondContact O-N 3.07Å; N203-I207 PolarHBondContact O-N 3.31Å
204	S	76.8	Confident	87.2	Confident	54 Å²	54	34.6 Å²	34.6	38%	0.378	18%	0.179	S	C	.	.	H	α-helix	trans	-52.4	-43.7	179.9	-50.2	0	0	0	0	112.3	G206 I207 Y236	S204-G206 VanDerWaalsContact C-N 3.26Å; S204-G206 PolarHBondContact O-N 3.45Å; S204-I207 PolarHBondContact O-N 3.31Å; S204-Y236 VanDerWaalsContact C-OH 3.3Å; S204-Y236 WeakPolarHBondContact CA-OH 3.43Å; S204-Y236 VanDerWaalsContact CB-OH 3.3Å; S204-Y236 WeakPolarHBondContact CB-OH 3.39Å; S204-Y236 PolarHBondContact O-OH 3.13Å
205	N	76.6	Confident	87.4	Confident	91 Å²	91	30.2 Å²	30.2	49%	0.487	16%	0.16	S	C	.	.	H	α-helix	trans	-63.9	-28.4	176.3	-66.6	-20.6	0	0	0	113.8	N203 S208	N203-N205 VanDerWaalsContact C-N 3.25Å; N203-N205 PolarHBondContact O-N 3.43Å; N205-S208 PolarHBondContact O-OG 2.96Å
206	G	81.3	Confident	87.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-77.5	-28.7	-178.8	0	0	0	0	0	113.8	N203 S204 S208 I209 L210	N203-G206 WeakPolarHBondContact O-CA 3.28Å; N203-G206 PolarHBondContact O-N 3.07Å; S204-G206 VanDerWaalsContact C-N 3.26Å; S204-G206 PolarHBondContact O-N 3.45Å; G206-S208 PolarHBondContact O-N 2.9Å; G206-I209 PolarHBondContact O-N 3.44Å; G206-L210 WeakPolarHBondContact O-CB 3.38Å; G206-L210 PolarHBondContact O-N 3.4Å
207	I	87.1	Confident	87.3	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-59	-45.6	-177.3	-66.6	173.1	0	0	0	111.3	T202 N203 S204 I209 L210 L211 F228 Y236	T202-I207 VanDerWaalsContact OG1-CG1 3.28Å; T202-I207 WeakPolarHBondContact OG1-CG1 3.34Å; N203-I207 PolarHBondContact O-N 3.31Å; S204-I207 PolarHBondContact O-N 3.31Å; I207-I209 VanDerWaalsContact C-N 3.29Å; I207-I209 PolarHBondContact O-N 2.89Å; I207-L210 PolarHBondContact O-N 2.89Å; I207-L211 HydrophobicContact CG2-CD1 3.92Å; I207-L211 HydrophobicContact CG2-CG 4.24Å; I207-L211 WeakPolarHBondContact O-CG 3.21Å; I207-L211 PolarHBondContact O-N 3.03Å; I207-F228 HydrophobicContact CG2-CE1 4.07Å; I207-Y236 HydrophobicContact CB-CD1 4.39Å; I207-Y236 HydrophobicContact CB-CE1 3.95Å; I207-Y236 HydrophobicContact CB-CE2 4.19Å; I207-Y236 HydrophobicContact CD1-CE2 3.84Å; I207-Y236 HydrophobicContact CG2-CD1 4Å; I207-Y236 HydrophobicContact CG2-CD2 3.87Å; I207-Y236 HydrophobicContact CG2-CE1 4.05Å; I207-Y236 HydrophobicContact CG2-CE2 3.93Å; I207-Y236 HydrophobicContact CG2-CG 3.93Å
208	S	86.9	Confident	87	Confident	52 Å²	52	39.5 Å²	39.5	36%	0.364	20%	0.202	S	C	.	.	H	α-helix	trans	-61.5	-35.5	179.9	68.3	0	0	0	0	113.6	N205 G206 K212	N205-S208 PolarHBondContact O-OG 2.96Å; G206-S208 PolarHBondContact O-N 2.9Å; S208-K212 WeakPolarHBondContact O-CG 3.32Å; S208-K212 PolarHBondContact O-N 3.3Å
209	I	88.2	Confident	86.7	Confident	62 Å²	62	39.4 Å²	39.4	32%	0.318	20%	0.202	S	C	.	.	H	α-helix	trans	-75.1	-42.7	177.5	-61.5	169.5	0	0	0	109.5	Y183 G206 I207 K212 N213	Y183-I209 HydrophobicContact CD2-CG2 4.12Å; Y183-I209 HydrophobicContact CE2-CB 4.48Å; Y183-I209 HydrophobicContact CE2-CG2 4.28Å; G206-I209 PolarHBondContact O-N 3.44Å; I207-I209 VanDerWaalsContact C-N 3.29Å; I207-I209 PolarHBondContact O-N 2.89Å; I209-K212 PolarHBondContact O-N 3.5Å; I209-N213 VanDerWaalsContact O-CG 3.28Å; I209-N213 PolarHBondContact O-N 3.47Å; I209-N213 PolarHBondContact O-ND2 2.92Å
210	L	90.1	Very high	86.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-45.1	178.7	-178.4	67.4	0	0	0	111.9	L152 Y183 L187 I200 T202 G206 I207 K212 N213 I214	L152-L210 HydrophobicContact CD1-CD1 4.2Å; L152-L210 HydrophobicContact CD2-CD2 4.31Å; Y183-L210 HydrophobicContact CD1-CD1 3.74Å; Y183-L210 HydrophobicContact CE1-CD1 4.27Å; Y183-L210 HydrophobicContact CG-CD1 3.93Å; L187-L210 HydrophobicContact CD1-CD1 4.22Å; I200-L210 HydrophobicContact CB-CD2 4.33Å; I200-L210 HydrophobicContact CD1-CD2 3.71Å; I200-L210 HydrophobicContact CG1-CD2 4.01Å; I200-L210 HydrophobicContact CG2-CD2 3.36Å; T202-L210 HydrophobicContact CG2-CD2 4.25Å; G206-L210 WeakPolarHBondContact O-CB 3.38Å; G206-L210 PolarHBondContact O-N 3.4Å; I207-L210 PolarHBondContact O-N 2.89Å; L210-K212 VanDerWaalsContact C-N 3.31Å; L210-K212 PolarHBondContact O-N 3.13Å; L210-N213 PolarHBondContact O-N 2.91Å; L210-N213 VanDerWaalsContact O-N 3.09Å; L210-I214 HydrophobicContact CG-CD1 4.09Å; L210-I214 WeakPolarHBondContact O-CG1 3.49Å; L210-I214 PolarHBondContact O-N 3.26Å
211	L	90.4	Very high	85.9	Confident	9 Å²	9	43.7 Å²	43.7	5%	0.047	22%	0.223	C	C	.	.	H	α-helix	trans	-57.4	-44.1	176.4	-71.8	171.9	0	0	0	111.3	I207 N213 I214 L215 F228 L238 F241	I207-L211 HydrophobicContact CG2-CD1 3.92Å; I207-L211 HydrophobicContact CG2-CG 4.24Å; I207-L211 WeakPolarHBondContact O-CG 3.21Å; I207-L211 PolarHBondContact O-N 3.03Å; L211-N213 VanDerWaalsContact C-N 3.34Å; L211-N213 PolarHBondContact O-N 3.33Å; L211-I214 PolarHBondContact O-N 3.33Å; L211-L215 WeakPolarHBondContact O-CG 3.39Å; L211-L215 PolarHBondContact O-N 3.45Å; L211-L215 VanDerWaalsContact O-N 3.15Å; L211-F228 HydrophobicContact CD2-CZ 3.92Å; L211-L238 HydrophobicContact CD1-CD2 3.82Å; L211-L238 HydrophobicContact CD2-CD2 4.04Å; L211-F241 HydrophobicContact CB-CE2 4.07Å; L211-F241 HydrophobicContact CB-CZ 4.21Å; L211-F241 HydrophobicContact CD2-CD2 4.49Å; L211-F241 HydrophobicContact CD2-CE1 4.5Å; L211-F241 HydrophobicContact CD2-CE2 3.79Å; L211-F241 HydrophobicContact CD2-CZ 3.78Å; L211-F241 HydrophobicContact CG-CE2 4.44Å
212	K	89.8	Confident	85.4	Confident	141 Å²	141	48.7 Å²	48.7	61%	0.613	24%	0.242	S	C	*	.	H	α-helix	trans	-61.5	-41.6	174.3	-70.5	176.8	-178.7	-179	0	112.4	S208 I209 L210 L215 Q216	S208-K212 WeakPolarHBondContact O-CG 3.32Å; S208-K212 PolarHBondContact O-N 3.3Å; I209-K212 PolarHBondContact O-N 3.5Å; L210-K212 VanDerWaalsContact C-N 3.31Å; L210-K212 PolarHBondContact O-N 3.13Å; K212-L215 PolarHBondContact O-N 3.46Å; K212-Q216 WeakPolarHBondContact O-CG 3.43Å; K212-Q216 PolarHBondContact O-N 3.3Å
213	N	89.2	Confident	85.2	Confident	19 Å²	19	52.6 Å²	52.6	10%	0.102	26%	0.259	C	S	.	.	H	α-helix	trans	-67.3	-36	178.2	-68.1	-20.5	0	0	0	112.2	Y183 V184 L187 I209 L210 L211 L215 Q216 Q217	Y183-N213 WeakPolarHBondContact CB-ND2 3.37Å; V184-N213 HydrophobicContact CG2-CB 4.3Å; L187-N213 HydrophobicContact CD1-CB 3.98Å; I209-N213 VanDerWaalsContact O-CG 3.28Å; I209-N213 PolarHBondContact O-N 3.47Å; I209-N213 PolarHBondContact O-ND2 2.92Å; L210-N213 PolarHBondContact O-N 2.91Å; L210-N213 VanDerWaalsContact O-N 3.09Å; L211-N213 VanDerWaalsContact C-N 3.34Å; L211-N213 PolarHBondContact O-N 3.33Å; N213-L215 VanDerWaalsContact C-N 3.33Å; N213-L215 PolarHBondContact O-N 3.08Å; N213-Q216 PolarHBondContact O-N 2.92Å; N213-Q217 WeakPolarHBondContact O-CG 3.43Å; N213-Q217 PolarHBondContact O-N 3.44Å
214	I	91.4	Very high	85.7	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-43.8	174	-70.7	166.9	0	0	0	110.5	L187 I200 L210 L211 Q217 Q218 M219 Y226 F241	L187-I214 HydrophobicContact CD1-CG1 3.97Å; L187-I214 HydrophobicContact CD2-CG1 4.2Å; I200-I214 HydrophobicContact CD1-CD1 4.35Å; L210-I214 HydrophobicContact CG-CD1 4.09Å; L210-I214 WeakPolarHBondContact O-CG1 3.49Å; L210-I214 PolarHBondContact O-N 3.26Å; L211-I214 PolarHBondContact O-N 3.33Å; I214-Q217 PolarHBondContact O-N 3.31Å; I214-Q218 PolarHBondContact O-N 2.73Å; I214-M219 HydrophobicContact CG2-CB 4.08Å; I214-M219 WeakPolarHBondContact CG2-O 3.48Å; I214-M219 PolarHBondContact O-N 3.24Å; I214-Y226 HydrophobicContact CD1-CD1 4.28Å; I214-Y226 HydrophobicContact CD1-CE1 3.82Å; I214-Y226 HydrophobicContact CG1-CE1 4.41Å; I214-Y226 HydrophobicContact CG2-CE2 4.19Å; I214-Y226 WeakPolarHBondContact CG2-OH 3.41Å; I214-F241 HydrophobicContact CB-CE1 4.41Å; I214-F241 HydrophobicContact CB-CZ 4.33Å; I214-F241 HydrophobicContact CG2-CE1 3.71Å; I214-F241 HydrophobicContact CG2-CZ 4.12Å
215	L	89.6	Confident	86.4	Confident	46 Å²	46	48.7 Å²	48.7	24%	0.241	23%	0.233	C	C	.	.	H	α-helix	trans	-63.6	-43.8	175.5	-64.7	173	0	0	0	111.7	L211 K212 N213 Q217 Q218 N220 D240 F241	L211-L215 WeakPolarHBondContact O-CG 3.39Å; L211-L215 PolarHBondContact O-N 3.45Å; L211-L215 VanDerWaalsContact O-N 3.15Å; K212-L215 PolarHBondContact O-N 3.46Å; N213-L215 VanDerWaalsContact C-N 3.33Å; N213-L215 PolarHBondContact O-N 3.08Å; L215-Q217 VanDerWaalsContact C-N 3.28Å; L215-Q217 PolarHBondContact O-N 2.98Å; L215-Q218 PolarHBondContact O-N 3Å; L215-Q218 VanDerWaalsContact O-N 3.07Å; L215-N220 HydrophobicContact CD2-CB 3.97Å; L215-N220 VanDerWaalsContact CD2-ND2 3.29Å; L215-N220 WeakPolarHBondContact CD2-ND2 3.37Å; L215-D240 HydrophobicContact CD1-CB 3.74Å; L215-D240 WeakPolarHBondContact CD1-OD2 3.33Å; L215-D240 HydrophobicContact CD2-CB 4.02Å; L215-F241 HydrophobicContact CD1-CE2 4.03Å; L215-F241 HydrophobicContact CD1-CZ 4.26Å; L215-F241 HydrophobicContact CD2-CD1 4.45Å; L215-F241 HydrophobicContact CD2-CD2 4.46Å; L215-F241 HydrophobicContact CD2-CE1 3.95Å; L215-F241 HydrophobicContact CD2-CE2 3.94Å; L215-F241 HydrophobicContact CD2-CZ 3.67Å; L215-F241 HydrophobicContact CG-CE1 4.38Å; L215-F241 HydrophobicContact CG-CE2 3.94Å; L215-F241 HydrophobicContact CG-CZ 3.66Å
216	Q	88.4	Confident	87.2	Confident	132 Å²	132	44.4 Å²	44.4	62%	0.617	21%	0.21	S	C	*	.	H	α-helix	trans	-60.9	-35.3	176.9	-73.9	177.9	-3.8	0	0	113.1	K212 N213 Q218	K212-Q216 WeakPolarHBondContact O-CG 3.43Å; K212-Q216 PolarHBondContact O-N 3.3Å; N213-Q216 PolarHBondContact O-N 2.92Å; Q216-Q218 VanDerWaalsContact C-N 3.28Å
217	Q	87.4	Confident	87.7	Confident	37 Å²	37	44.4 Å²	44.4	17%	0.173	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	1.7	177.7	-63.5	-50.7	-40.2	0	0	113.9	L187 N188 K191 N213 I214 L215 M219	L187-Q217 HydrophobicContact CB-CG 4.35Å; N188-Q217 PolarHBondContact OD1-OE1 2.81Å; K191-Q217 PolarHBondContact NZ-O 3.28Å; N213-Q217 WeakPolarHBondContact O-CG 3.43Å; N213-Q217 PolarHBondContact O-N 3.44Å; I214-Q217 PolarHBondContact O-N 3.31Å; L215-Q217 VanDerWaalsContact C-N 3.28Å; L215-Q217 PolarHBondContact O-N 2.98Å; Q217-M219 HydrophobicContact CB-CG 4Å; Q217-M219 HydrophobicContact CB-SD 4.14Å; Q217-M219 PolarHBondContact O-N 3.5Å
218	Q	86.2	Confident	88	Confident	128 Å²	128	44.4 Å²	44.4	60%	0.598	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	36.7	-175.1	-58.8	177.8	-41	0	0	112.4	I214 L215 Q216 N220	I214-Q218 PolarHBondContact O-N 2.73Å; L215-Q218 PolarHBondContact O-N 3Å; L215-Q218 VanDerWaalsContact O-N 3.07Å; Q216-Q218 VanDerWaalsContact C-N 3.28Å; Q218-N220 PolarHBondContact O-N 3.1Å
219	M	88.1	Confident	88.1	Confident	0 Å²	0	42 Å²	42	0%	0	19%	0.193	C	C	.	.			trans	-95.4	32.2	177.4	-63.9	177.7	62.9	0	0	111.7	L187 K191 I198 I214 Q217 Y224 Y226	L187-M219 HydrophobicContact CB-SD 3.85Å; L187-M219 HydrophobicContact CD2-CE 4.11Å; L187-M219 HydrophobicContact CD2-SD 4.02Å; L187-M219 HydrophobicContact CG-SD 4.44Å; K191-M219 HydrophobicContact CB-SD 4.2Å; K191-M219 HydrophobicContact CD-CG 4.35Å; I198-M219 HydrophobicContact CD1-CE 3.71Å; I214-M219 HydrophobicContact CG2-CB 4.08Å; I214-M219 WeakPolarHBondContact CG2-O 3.48Å; I214-M219 PolarHBondContact O-N 3.24Å; Q217-M219 HydrophobicContact CB-CG 4Å; Q217-M219 HydrophobicContact CB-SD 4.14Å; Q217-M219 PolarHBondContact O-N 3.5Å; M219-Y224 HydrophobicContact CB-CD2 4.24Å; M219-Y224 HydrophobicContact CB-CE1 4.32Å; M219-Y224 HydrophobicContact CB-CE2 3.93Å; M219-Y224 HydrophobicContact CE-CD1 4.11Å; M219-Y224 HydrophobicContact CE-CE1 3.54Å; M219-Y224 HydrophobicContact CG-CE1 4.36Å; M219-Y224 HydrophobicContact CG-CE2 4.23Å; M219-Y224 WeakPolarHBondContact O-CD2 3.48Å; M219-Y226 VanDerWaalsContact CB-OH 3.25Å; M219-Y226 WeakPolarHBondContact CB-OH 3.38Å; M219-Y226 WeakPolarHBondContact O-CE2 3.1Å; M219-Y226 PolarHBondContact O-OH 3.01Å
220	N	86	Confident	88.1	Confident	23 Å²	23	39.9 Å²	39.9	12%	0.123	18%	0.184	C	C	.	.			trans	-110.8	20.1	-177.4	63.2	-29.8	0	0	0	112.8	L215 Q218 F241 N244	L215-N220 HydrophobicContact CD2-CB 3.97Å; L215-N220 VanDerWaalsContact CD2-ND2 3.29Å; L215-N220 WeakPolarHBondContact CD2-ND2 3.37Å; Q218-N220 PolarHBondContact O-N 3.1Å; N220-F241 HydrophobicContact CB-CD1 4.04Å; N220-F241 HydrophobicContact CB-CE1 3.94Å; N220-N244 PolarHBondContact ND2-ND2 3.37Å; N220-N244 WeakPolarHBondContact O-CB 3.48Å
221	E	78.8	Confident	88	Confident	72 Å²	72	40.3 Å²	40.3	34%	0.336	19%	0.186	S	C	.	.	S	Bend	trans	-82	165	176.8	-63.7	171.5	-152.4	0	0	113	K223 Y224 N244	E221-K223 HydrophobicContact CB-CG 4.19Å; E221-K223 PolarHBondContact O-N 2.88Å; E221-K223 IonicContact OE1-NZ 3.54Å; E221-K223 WeakPolarHBondContact OE2-CE 3.19Å; E221-K223 IonicContact OE2-NZ 3.05Å; E221-K223 PolarHBondContact OE2-NZ 3.38Å; E221-Y224 HydrophobicContact CB-CD2 4.29Å; E221-Y224 PolarHBondContact O-N 3.14Å; E221-N244 CarbonylContact C-O 3.54Å
222	Y	77.4	Confident	87.9	Confident	107 Å²	107	40.8 Å²	40.8	42%	0.42	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-24.5	-179	73.2	-90.1	0	0	0	115	Y224 N244	Y222-Y224 VanDerWaalsContact C-N 3.3Å; Y222-Y224 PolarHBondContact O-N 2.78Å; Y222-N244 PolarHBondContact N-O 2.91Å
223	K	80.4	Confident	87.8	Confident	84 Å²	84	34.2 Å²	34.2	37%	0.365	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-23.3	179.4	65.7	-170.6	-175.5	-148.2	0	113.2	H196 E221	H196-K223 WeakPolarHBondContact CB-O 3.33Å; E221-K223 HydrophobicContact CB-CG 4.19Å; E221-K223 PolarHBondContact O-N 2.88Å; E221-K223 IonicContact OE1-NZ 3.54Å; E221-K223 WeakPolarHBondContact OE2-CE 3.19Å; E221-K223 IonicContact OE2-NZ 3.05Å; E221-K223 PolarHBondContact OE2-NZ 3.38Å
224	Y	88.9	Confident	87.6	Confident	5 Å²	5	35 Å²	35	2%	0.02	16%	0.163	C	C	.	.			trans	-87.6	140.7	-176.7	-68.8	-78.3	0	0	0	112.5	H196 M219 E221 Y222 N247	H196-Y224 HydrophobicContact CB-CD1 4.37Å; H196-Y224 AromaticContact CD2-CE1 3.82Å; H196-Y224 WeakPolarHBondContact O-CA 3.29Å; M219-Y224 HydrophobicContact CB-CD2 4.24Å; M219-Y224 HydrophobicContact CB-CE1 4.32Å; M219-Y224 HydrophobicContact CB-CE2 3.93Å; M219-Y224 HydrophobicContact CE-CD1 4.11Å; M219-Y224 HydrophobicContact CE-CE1 3.54Å; M219-Y224 HydrophobicContact CG-CE1 4.36Å; M219-Y224 HydrophobicContact CG-CE2 4.23Å; M219-Y224 WeakPolarHBondContact O-CD2 3.48Å; E221-Y224 HydrophobicContact CB-CD2 4.29Å; E221-Y224 PolarHBondContact O-N 3.14Å; Y222-Y224 VanDerWaalsContact C-N 3.3Å; Y222-Y224 PolarHBondContact O-N 2.78Å; Y224-N247 PolarHBondContact O-N 3.31Å; Y224-N247 VanDerWaalsContact O-N 3.13Å
225	H	91.6	Very high	87.2	Confident	12 Å²	12	37.6 Å²	37.6	6%	0.056	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	115.1	172.5	-164.3	162	0	0	0	110.6	L144 W146 H196 N197 I198 N247 T249	L144-H225 VanDerWaalsContact CD1-CE1 3.46Å; L144-H225 WeakPolarHBondContact CD1-CE1 3.4Å; W146-H225 HydrophobicContact CZ2-CB 3.97Å; W146-H225 AromaticContact CZ2-CD2 3.84Å; W146-H225 AromaticContact CZ2-CE1 3.89Å; W146-H225 AromaticContact CZ2-CG 3.58Å; W146-H225 AromaticContact CZ2-ND1 3.64Å; W146-H225 AromaticContact NE1-ND1 3.97Å; H196-H225 PolarHBondContact O-N 3.26Å; N197-H225 CarbonylContact C-O 3.6Å; N197-H225 WeakPolarHBondContact CA-O 3.22Å; I198-H225 PolarHBondContact N-O 3.24Å; H225-N247 CarbonylContact C-O 3.56Å; H225-N247 VanDerWaalsContact CA-O 3.27Å; H225-N247 WeakPolarHBondContact CA-O 3.31Å; H225-N247 HydrophobicContact CB-CB 3.96Å; H225-N247 PolarHBondContact CD2-O 2.91Å; H225-N247 VanDerWaalsContact CD2-O 3.26Å; H225-N247 VanDerWaalsContact CG-CB 3.5Å; H225-T249 WeakPolarHBondContact NE2-CG2 3.48Å; H225-T249 PolarHBondContact NE2-OG1 3.48Å
226	Y	93.2	Very high	87	Confident	1 Å²	1	37.5 Å²	37.5	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.3	176.2	-60.8	-78.1	0	0	0	112.1	I198 I200 I214 M219 V246 N247 I248 T249	I198-Y226 HydrophobicContact CB-CD1 3.95Å; I198-Y226 HydrophobicContact CB-CE1 4.08Å; I198-Y226 HydrophobicContact CD1-CE1 3.78Å; I198-Y226 HydrophobicContact CG1-CE1 4.41Å; I198-Y226 HydrophobicContact CG2-CD1 4.42Å; I198-Y226 WeakPolarHBondContact O-CA 3.28Å; I200-Y226 HydrophobicContact CD1-CD1 3.62Å; I200-Y226 HydrophobicContact CD1-CE1 4.38Å; I200-Y226 HydrophobicContact CD1-CG 4.29Å; I200-Y226 HydrophobicContact CG1-CD1 4.47Å; I214-Y226 HydrophobicContact CD1-CD1 4.28Å; I214-Y226 HydrophobicContact CD1-CE1 3.82Å; I214-Y226 HydrophobicContact CG1-CE1 4.41Å; I214-Y226 HydrophobicContact CG2-CE2 4.19Å; I214-Y226 WeakPolarHBondContact CG2-OH 3.41Å; M219-Y226 VanDerWaalsContact CB-OH 3.25Å; M219-Y226 WeakPolarHBondContact CB-OH 3.38Å; M219-Y226 WeakPolarHBondContact O-CE2 3.1Å; M219-Y226 PolarHBondContact O-OH 3.01Å; Y226-V246 HydrophobicContact CD2-CG2 3.71Å; Y226-V246 HydrophobicContact CE2-CG2 3.72Å; Y226-N247 PolarHBondContact N-O 2.9Å; Y226-I248 HydrophobicContact CD2-CG1 4.32Å; Y226-I248 WeakPolarHBondContact O-CA 3.22Å; Y226-T249 PolarHBondContact O-N 2.93Å; Y226-T249 PolarHBondContact O-OG1 2.95Å
227	L	93.2	Very high	86.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	109.2	172.1	180	60	0	0	0	109.6	F137 V140 I141 W146 I198 I199 I200 T249	F137-L227 HydrophobicContact CD1-CD1 4.37Å; F137-L227 HydrophobicContact CD1-CD2 3.99Å; F137-L227 HydrophobicContact CD1-CG 4.19Å; F137-L227 HydrophobicContact CE1-CD1 4.3Å; F137-L227 HydrophobicContact CE1-CG 4.31Å; V140-L227 HydrophobicContact CG1-CD1 4.45Å; V140-L227 HydrophobicContact CG1-CD2 4.29Å; I141-L227 HydrophobicContact CG1-CD2 4.47Å; W146-L227 HydrophobicContact CH2-CB 3.84Å; W146-L227 HydrophobicContact CH2-CD2 4.39Å; W146-L227 HydrophobicContact CZ3-CB 4.39Å; W146-L227 HydrophobicContact CZ3-CD2 4.4Å; I198-L227 PolarHBondContact O-N 3.38Å; I199-L227 CarbonylContact C-O 3.57Å; I199-L227 WeakPolarHBondContact CA-O 3.46Å; I199-L227 HydrophobicContact CD1-CD2 4.43Å; I199-L227 HydrophobicContact CG1-CB 4.34Å; I199-L227 HydrophobicContact CG1-CD2 4.33Å; I200-L227 PolarHBondContact N-O 3.04Å; L227-T249 WeakPolarHBondContact CA-O 3.29Å; L227-T249 WeakPolarHBondContact CD1-OG1 3.44Å
228	F	92.2	Very high	86.7	Confident	1 Å²	1	35.5 Å²	35.5	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	138.2	178.8	-73.5	-94	0	0	0	110.8	I200 I207 L211 L233 I248 T249 S250	I200-F228 HydrophobicContact CB-CD1 3.9Å; I200-F228 HydrophobicContact CB-CE1 4.03Å; I200-F228 HydrophobicContact CB-CG 4.46Å; I200-F228 HydrophobicContact CD1-CD1 4.19Å; I200-F228 HydrophobicContact CD1-CE1 3.55Å; I200-F228 HydrophobicContact CD1-CE2 3.97Å; I200-F228 HydrophobicContact CD1-CZ 3.42Å; I200-F228 VanDerWaalsContact CD1-CZ 3.42Å; I200-F228 HydrophobicContact CG1-CE1 4.39Å; I200-F228 HydrophobicContact CG2-CD1 3.8Å; I200-F228 HydrophobicContact CG2-CE1 3.76Å; I207-F228 HydrophobicContact CG2-CE1 4.07Å; L211-F228 HydrophobicContact CD2-CZ 3.92Å; F228-L233 HydrophobicContact CD1-CD1 4.42Å; F228-L233 HydrophobicContact CD2-CD1 3.96Å; F228-L233 HydrophobicContact CD2-CD2 4.36Å; F228-L233 HydrophobicContact CE2-CD1 4.21Å; F228-L233 HydrophobicContact CG-CD1 4.07Å; F228-I248 HydrophobicContact CD2-CG2 3.71Å; F228-I248 HydrophobicContact CE2-CG2 3.62Å; F228-T249 PolarHBondContact N-O 3.42Å; F228-S250 PolarHBondContact O-OG 3.27Å; F228-S250 VanDerWaalsContact O-OG 3.13Å
229	T	88.9	Confident	86.6	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.012	17%	0.165	C	C	.	.			trans	-84.2	-15.7	174.4	64.7	0	0	0	0	113.3	F137 I160 I199 I200 D201	F137-T229 HydrophobicContact CE1-CG2 4.38Å; F137-T229 HydrophobicContact CZ-CG2 4.21Å; I160-T229 HydrophobicContact CD1-CG2 3.84Å; I160-T229 HydrophobicContact CG1-CG2 4.16Å; I199-T229 HydrophobicContact CG2-CG2 4.1Å; I200-T229 PolarHBondContact O-N 3.13Å; I200-T229 PolarHBondContact O-OG1 3.02Å; D201-T229 WeakPolarHBondContact CA-OG1 3.47Å; D201-T229 HydrophobicContact CB-CG2 3.89Å; D201-T229 PolarHBondContact OD1-OG1 2.96Å
230	S	88.1	Confident	86.4	Confident	17 Å²	17	39.3 Å²	39.3	12%	0.119	19%	0.191	C	C	.	.			trans	-77.6	133	-179	176.6	0	0	0	0	111.7	D232 S250	S230-D232 PolarHBondContact O-N 2.92Å; S230-D232 PolarHBondContact OG-N 3.32Å; S230-S250 PolarHBondContact O-OG 2.76Å
231	F	89.7	Confident	86.3	Confident	10 Å²	10	38.4 Å²	38.4	4%	0.044	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-8.2	177.1	-58.9	-44.8	0	0	0	114.5	Y127 V133 F251 L253 L365	Y127-F231 HydrophobicContact CE2-CE2 4.23Å; Y127-F231 AromaticContact CZ-CE2 3.87Å; Y127-F231 WeakPolarHBondContact OH-CE2 3.39Å; V133-F231 HydrophobicContact CG1-CZ 4.43Å; F231-F251 VanDerWaalsContact CA-O 3.3Å; F231-F251 WeakPolarHBondContact CA-O 3.29Å; F231-F251 HydrophobicContact CD1-CB 3.89Å; F231-F251 HydrophobicContact CE1-CB 3.86Å; F231-L253 HydrophobicContact CB-CB 4.15Å; F231-L253 HydrophobicContact CD1-CB 4.5Å; F231-L253 HydrophobicContact CD2-CB 3.97Å; F231-L253 HydrophobicContact CD2-CD2 4.19Å; F231-L253 HydrophobicContact CE2-CB 4.49Å; F231-L253 HydrophobicContact CE2-CD2 4.37Å; F231-L253 HydrophobicContact CG-CB 3.97Å; F231-L365 HydrophobicContact CD1-CD2 4.48Å; F231-L365 HydrophobicContact CE1-CD1 4.42Å; F231-L365 HydrophobicContact CE1-CD2 3.83Å; F231-L365 HydrophobicContact CZ-CD2 4Å
232	D	87.3	Confident	86.5	Confident	19 Å²	19	37.6 Å²	37.6	10%	0.102	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	26.2	-167.9	-58.5	-52.1	0	0	0	112.6	S230 E234 T235 Y236 E292 S293	S230-D232 PolarHBondContact O-N 2.92Å; S230-D232 PolarHBondContact OG-N 3.32Å; D232-E234 PolarHBondContact O-N 2.9Å; D232-T235 HydrophobicContact CB-CG2 4.16Å; D232-T235 WeakPolarHBondContact O-CB 3.49Å; D232-T235 PolarHBondContact O-N 3.35Å; D232-T235 PolarHBondContact O-OG1 3.07Å; D232-Y236 WeakPolarHBondContact O-CD2 3.43Å; D232-Y236 WeakPolarHBondContact O-CE2 3.26Å; D232-E292 WeakPolarHBondContact OD1-CA 3.1Å; D232-S293 WeakPolarHBondContact OD1-CB 3.34Å; D232-S293 PolarHBondContact OD1-N 3.45Å; D232-S293 PolarHBondContact OD1-OG 2.98Å; D232-S293 PolarHBondContact OD2-OG 3.46Å
233	L	87.6	Confident	86.2	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-57	-34.8	-177.8	-177.1	66.8	0	0	0	112.7	F228 T235 Y236 L238 I248	F228-L233 HydrophobicContact CD1-CD1 4.42Å; F228-L233 HydrophobicContact CD2-CD1 3.96Å; F228-L233 HydrophobicContact CD2-CD2 4.36Å; F228-L233 HydrophobicContact CE2-CD1 4.21Å; F228-L233 HydrophobicContact CG-CD1 4.07Å; L233-T235 PolarHBondContact O-N 2.94Å; L233-T235 VanDerWaalsContact O-N 3.13Å; L233-Y236 PolarHBondContact O-N 3.47Å; L233-L238 HydrophobicContact CD1-CD1 4.19Å; L233-L238 HydrophobicContact CD2-CD1 4.31Å; L233-L238 HydrophobicContact CG-CD1 4.08Å; L233-I248 HydrophobicContact CD2-CG2 3.65Å
234	E	84.6	Confident	85.9	Confident	37 Å²	37	39.1 Å²	39.1	17%	0.173	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-64.2	-15.3	179.9	-57.6	-176.8	167.2	0	0	113.4	D232 R252 I290 I368 I375	D232-E234 PolarHBondContact O-N 2.9Å; E234-R252 VanDerWaalsContact OE1-CD 3.31Å; E234-R252 WeakPolarHBondContact OE1-CD 3.37Å; E234-R252 IonicContact OE1-CZ 2.75Å; E234-R252 IonicContact OE1-NE 2.89Å; E234-R252 IonicContact OE1-NH1 3.26Å; E234-R252 PolarHBondContact OE1-NH1 2.93Å; E234-R252 IonicContact OE2-NH1 2.94Å; E234-I290 HydrophobicContact CB-CD1 3.8Å; E234-I290 HydrophobicContact CB-CG2 4.46Å; E234-I290 VanDerWaalsContact O-CD1 3.24Å; E234-I290 WeakPolarHBondContact O-CD1 3.45Å; E234-I368 HydrophobicContact CG-CD1 3.83Å; E234-I375 HydrophobicContact CB-CD1 4.21Å; E234-I375 HydrophobicContact CG-CD1 3.89Å; E234-I375 HydrophobicContact CG-CG2 4.27Å
235	T	83	Confident	85.1	Confident	55 Å²	55	42.8 Å²	42.8	34%	0.337	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-78.8	-18.9	178.4	66.6	0	0	0	0	113.5	D232 L233 I290 E292	D232-T235 HydrophobicContact CB-CG2 4.16Å; D232-T235 WeakPolarHBondContact O-CB 3.49Å; D232-T235 PolarHBondContact O-N 3.35Å; D232-T235 PolarHBondContact O-OG1 3.07Å; L233-T235 PolarHBondContact O-N 2.94Å; L233-T235 VanDerWaalsContact O-N 3.13Å; T235-I290 HydrophobicContact CG2-CG2 4.16Å; T235-E292 HydrophobicContact CG2-CG 4.16Å
236	Y	85.2	Confident	84.9	Confident	44 Å²	44	42.4 Å²	42.4	17%	0.173	21%	0.205	C	C	.	.	S	Bend	trans	-93.7	149.9	-178	-58	-83	0	0	0	111.5	S204 I207 D232 L233 L238	S204-Y236 VanDerWaalsContact C-OH 3.3Å; S204-Y236 WeakPolarHBondContact CA-OH 3.43Å; S204-Y236 VanDerWaalsContact CB-OH 3.3Å; S204-Y236 WeakPolarHBondContact CB-OH 3.39Å; S204-Y236 PolarHBondContact O-OH 3.13Å; I207-Y236 HydrophobicContact CB-CD1 4.39Å; I207-Y236 HydrophobicContact CB-CE1 3.95Å; I207-Y236 HydrophobicContact CB-CE2 4.19Å; I207-Y236 HydrophobicContact CD1-CE2 3.84Å; I207-Y236 HydrophobicContact CG2-CD1 4Å; I207-Y236 HydrophobicContact CG2-CD2 3.87Å; I207-Y236 HydrophobicContact CG2-CE1 4.05Å; I207-Y236 HydrophobicContact CG2-CE2 3.93Å; I207-Y236 HydrophobicContact CG2-CG 3.93Å; D232-Y236 WeakPolarHBondContact O-CD2 3.43Å; D232-Y236 WeakPolarHBondContact O-CE2 3.26Å; L233-Y236 PolarHBondContact O-N 3.47Å; Y236-L238 PolarHBondContact O-N 3.15Å
237	D	83.6	Confident	84.6	Confident	118 Å²	118	44.7 Å²	44.7	63%	0.631	22%	0.218	S	C	*	.			trans	-74.4	119.6	173.7	-170.1	2.4	0	0	0	110.5	E239	D237-E239 WeakPolarHBondContact OD1-CB 3.32Å; D237-E239 PolarHBondContact OD1-N 3.3Å
238	L	86.6	Confident	84.6	Confident	8 Å²	8	44.7 Å²	44.7	4%	0.042	22%	0.218	C	C	.	.			trans	-117.7	14.6	179.2	-61.8	-179.6	0	0	0	112.1	L211 L233 Y236 D240 F241 K242 I248 L370 I375	L211-L238 HydrophobicContact CD1-CD2 3.82Å; L211-L238 HydrophobicContact CD2-CD2 4.04Å; L233-L238 HydrophobicContact CD1-CD1 4.19Å; L233-L238 HydrophobicContact CD2-CD1 4.31Å; L233-L238 HydrophobicContact CG-CD1 4.08Å; Y236-L238 PolarHBondContact O-N 3.15Å; L238-D240 VanDerWaalsContact C-N 3.29Å; L238-D240 PolarHBondContact O-N 3.45Å; L238-F241 HydrophobicContact CD2-CD2 4.25Å; L238-F241 PolarHBondContact O-N 2.83Å; L238-K242 PolarHBondContact O-N 3.46Å; L238-I248 HydrophobicContact CD2-CD1 4.44Å; L238-L370 HydrophobicContact CB-CD1 4.21Å; L238-L370 HydrophobicContact CB-CD2 4.23Å; L238-L370 HydrophobicContact CD1-CD1 4.15Å; L238-L370 HydrophobicContact CD1-CD2 4.32Å; L238-I375 HydrophobicContact CD1-CD1 3.94Å; L238-I375 HydrophobicContact CD1-CG1 4.39Å
239	E	83.8	Confident	84.6	Confident	105 Å²	105	44.7 Å²	44.7	49%	0.491	22%	0.217	S	C	.	.	H	α-helix	trans	-56.1	-42.8	-177.2	-168.8	161.5	-169.9	0	0	112.4	D237 F241 K242	D237-E239 WeakPolarHBondContact OD1-CB 3.32Å; D237-E239 PolarHBondContact OD1-N 3.3Å; E239-F241 PolarHBondContact O-N 3.24Å; E239-F241 VanDerWaalsContact O-N 3.12Å; E239-K242 WeakPolarHBondContact O-CB 3.36Å; E239-K242 PolarHBondContact O-N 3.08Å; E239-K242 VanDerWaalsContact O-N 3.17Å
240	D	83.8	Confident	84.8	Confident	103 Å²	103	44.6 Å²	44.6	55%	0.551	22%	0.217	S	C	*	.	H	α-helix	trans	-63.9	-17.2	177.4	-65.7	-33.1	0	0	0	114.4	L215 L238	L215-D240 HydrophobicContact CD1-CB 3.74Å; L215-D240 WeakPolarHBondContact CD1-OD2 3.33Å; L215-D240 HydrophobicContact CD2-CB 4.02Å; L238-D240 VanDerWaalsContact C-N 3.29Å; L238-D240 PolarHBondContact O-N 3.45Å
241	F	85.1	Confident	85	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-97.5	-15.4	-179.4	-68	-89.9	0	0	0	112.8	L211 I214 L215 N220 L238 E239 Y243 V246 I248 L370	L211-F241 HydrophobicContact CB-CE2 4.07Å; L211-F241 HydrophobicContact CB-CZ 4.21Å; L211-F241 HydrophobicContact CD2-CD2 4.49Å; L211-F241 HydrophobicContact CD2-CE1 4.5Å; L211-F241 HydrophobicContact CD2-CE2 3.79Å; L211-F241 HydrophobicContact CD2-CZ 3.78Å; L211-F241 HydrophobicContact CG-CE2 4.44Å; I214-F241 HydrophobicContact CB-CE1 4.41Å; I214-F241 HydrophobicContact CB-CZ 4.33Å; I214-F241 HydrophobicContact CG2-CE1 3.71Å; I214-F241 HydrophobicContact CG2-CZ 4.12Å; L215-F241 HydrophobicContact CD1-CE2 4.03Å; L215-F241 HydrophobicContact CD1-CZ 4.26Å; L215-F241 HydrophobicContact CD2-CD1 4.45Å; L215-F241 HydrophobicContact CD2-CD2 4.46Å; L215-F241 HydrophobicContact CD2-CE1 3.95Å; L215-F241 HydrophobicContact CD2-CE2 3.94Å; L215-F241 HydrophobicContact CD2-CZ 3.67Å; L215-F241 HydrophobicContact CG-CE1 4.38Å; L215-F241 HydrophobicContact CG-CE2 3.94Å; L215-F241 HydrophobicContact CG-CZ 3.66Å; N220-F241 HydrophobicContact CB-CD1 4.04Å; N220-F241 HydrophobicContact CB-CE1 3.94Å; L238-F241 HydrophobicContact CD2-CD2 4.25Å; L238-F241 PolarHBondContact O-N 2.83Å; E239-F241 PolarHBondContact O-N 3.24Å; E239-F241 VanDerWaalsContact O-N 3.12Å; F241-Y243 PolarHBondContact O-N 3Å; F241-V246 HydrophobicContact CB-CG1 3.77Å; F241-V246 HydrophobicContact CD1-CG1 3.76Å; F241-V246 HydrophobicContact CG-CG1 4.27Å; F241-V246 VanDerWaalsContact O-CG1 3.31Å; F241-V246 WeakPolarHBondContact O-CG1 3.23Å; F241-I248 HydrophobicContact CB-CD1 3.99Å; F241-I248 HydrophobicContact CD1-CD1 3.87Å; F241-I248 HydrophobicContact CG-CD1 3.94Å; F241-L370 HydrophobicContact CB-CD2 3.71Å
242	K	81.6	Confident	85.1	Confident	56 Å²	56	44.3 Å²	44.3	24%	0.243	21%	0.213	C	C	.	.	H	α-helix	trans	-65.2	-36.1	-176.2	-76.1	-178.7	-172.8	-175.5	0	113.6	L238 E239 L370 Q372 H373	L238-K242 PolarHBondContact O-N 3.46Å; E239-K242 WeakPolarHBondContact O-CB 3.36Å; E239-K242 PolarHBondContact O-N 3.08Å; E239-K242 VanDerWaalsContact O-N 3.17Å; K242-L370 HydrophobicContact CG-CD1 4.12Å; K242-Q372 WeakPolarHBondContact CB-O 3.43Å; K242-H373 PolarHBondContact NZ-O 3.28Å
243	Y	73	Confident	85.3	Confident	154 Å²	154	43.7 Å²	43.7	60%	0.604	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-14.9	-169.6	-61.6	-74.5	0	0	0	114.6	F241 F245	F241-Y243 PolarHBondContact O-N 3Å; Y243-F245 WeakPolarHBondContact O-CE2 3.48Å
244	N	72.3	Confident	85.4	Confident	69 Å²	69	43.9 Å²	43.9	37%	0.369	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	13.4	-172.2	-64.8	-19.7	0	0	0	114.1	N220 E221 Y222 V246	N220-N244 PolarHBondContact ND2-ND2 3.37Å; N220-N244 WeakPolarHBondContact O-CB 3.48Å; E221-N244 CarbonylContact C-O 3.54Å; Y222-N244 PolarHBondContact N-O 2.91Å; N244-V246 PolarHBondContact O-N 3.42Å
245	F	73.7	Confident	85.5	Confident	82 Å²	82	43.8 Å²	43.8	36%	0.36	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	20.9	176.2	-48.8	-67.2	0	0	0	115.5	Y243 N247 Q372 M401	Y243-F245 WeakPolarHBondContact O-CE2 3.48Å; F245-N247 PolarHBondContact O-N 2.9Å; F245-Q372 HydrophobicContact CD1-CG 4.2Å; F245-Q372 HydrophobicContact CE1-CG 3.66Å; F245-Q372 VanDerWaalsContact CE1-NE2 3.29Å; F245-M401 HydrophobicContact CD1-CE 3.58Å; F245-M401 HydrophobicContact CD1-SD 3.76Å; F245-M401 HydrophobicContact CD2-CE 3.71Å; F245-M401 HydrophobicContact CE1-CE 3.1Å; F245-M401 HydrophobicContact CE1-CG 4.28Å; F245-M401 HydrophobicContact CE1-SD 3.27Å; F245-M401 WeakPolarHBondContact CE1-SD 3.16Å; F245-M401 HydrophobicContact CE2-CE 3.22Å; F245-M401 HydrophobicContact CE2-SD 4.45Å; F245-M401 HydrophobicContact CG-CE 3.89Å; F245-M401 HydrophobicContact CZ-CE 2.92Å; F245-M401 HydrophobicContact CZ-CG 4.37Å; F245-M401 HydrophobicContact CZ-SD 3.69Å
246	V	85.9	Confident	85.4	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.024	21%	0.205	C	C	.	.			trans	-64.5	133.1	173.7	61.2	0	0	0	0	110.5	Y226 F241 N244 I248	Y226-V246 HydrophobicContact CD2-CG2 3.71Å; Y226-V246 HydrophobicContact CE2-CG2 3.72Å; F241-V246 HydrophobicContact CB-CG1 3.77Å; F241-V246 HydrophobicContact CD1-CG1 3.76Å; F241-V246 HydrophobicContact CG-CG1 4.27Å; F241-V246 VanDerWaalsContact O-CG1 3.31Å; F241-V246 WeakPolarHBondContact O-CG1 3.23Å; N244-V246 PolarHBondContact O-N 3.42Å; V246-I248 HydrophobicContact CG1-CD1 4.23Å; V246-I248 HydrophobicContact CG1-CG1 4.19Å; V246-I248 HydrophobicContact CG2-CG1 4.26Å; V246-I248 PolarHBondContact O-N 3.35Å
247	N	87.9	Confident	85.3	Confident	49 Å²	49	43.5 Å²	43.5	26%	0.262	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	110.9	177.5	-73.6	-52.2	0	0	0	109.1	Y224 H225 Y226 F245 K369	Y224-N247 PolarHBondContact O-N 3.31Å; Y224-N247 VanDerWaalsContact O-N 3.13Å; H225-N247 CarbonylContact C-O 3.56Å; H225-N247 VanDerWaalsContact CA-O 3.27Å; H225-N247 WeakPolarHBondContact CA-O 3.31Å; H225-N247 HydrophobicContact CB-CB 3.96Å; H225-N247 PolarHBondContact CD2-O 2.91Å; H225-N247 VanDerWaalsContact CD2-O 3.26Å; H225-N247 VanDerWaalsContact CG-CB 3.5Å; Y226-N247 PolarHBondContact N-O 2.9Å; F245-N247 PolarHBondContact O-N 2.9Å; N247-K369 WeakPolarHBondContact OD1-CE 3.14Å; N247-K369 PolarHBondContact OD1-NZ 3.4Å
248	I	91.9	Very high	85.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.3	171.7	-57.1	-174.9	0	0	0	108.7	Y226 F228 L233 L238 F241 V246 K369 L370	Y226-I248 HydrophobicContact CD2-CG1 4.32Å; Y226-I248 WeakPolarHBondContact O-CA 3.22Å; F228-I248 HydrophobicContact CD2-CG2 3.71Å; F228-I248 HydrophobicContact CE2-CG2 3.62Å; L233-I248 HydrophobicContact CD2-CG2 3.65Å; L238-I248 HydrophobicContact CD2-CD1 4.44Å; F241-I248 HydrophobicContact CB-CD1 3.99Å; F241-I248 HydrophobicContact CD1-CD1 3.87Å; F241-I248 HydrophobicContact CG-CD1 3.94Å; V246-I248 HydrophobicContact CG1-CD1 4.23Å; V246-I248 HydrophobicContact CG1-CG1 4.19Å; V246-I248 HydrophobicContact CG2-CG1 4.26Å; V246-I248 PolarHBondContact O-N 3.35Å; I248-K369 CarbonylContact O-C 3.58Å; I248-K369 WeakPolarHBondContact O-CA 3.44Å; I248-L370 HydrophobicContact CB-CB 3.89Å; I248-L370 HydrophobicContact CB-CD2 4.26Å; I248-L370 HydrophobicContact CD1-CD2 3.89Å; I248-L370 HydrophobicContact CG1-CD2 4.21Å; I248-L370 PolarHBondContact O-N 2.89Å
249	T	92.8	Very high	85.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	143.3	179.5	47.9	0	0	0	0	110.7	H225 Y226 L227 F228 I368 K369 F395	H225-T249 WeakPolarHBondContact NE2-CG2 3.48Å; H225-T249 PolarHBondContact NE2-OG1 3.48Å; Y226-T249 PolarHBondContact O-N 2.93Å; Y226-T249 PolarHBondContact O-OG1 2.95Å; L227-T249 WeakPolarHBondContact CA-O 3.29Å; L227-T249 WeakPolarHBondContact CD1-OG1 3.44Å; F228-T249 PolarHBondContact N-O 3.42Å; T249-I368 WeakPolarHBondContact CA-O 3.12Å; T249-K369 HydrophobicContact CG2-CB 4.1Å; T249-K369 HydrophobicContact CG2-CD 4.34Å; T249-K369 HydrophobicContact CG2-CG 3.88Å; T249-F395 HydrophobicContact CG2-CE2 4.5Å; T249-F395 HydrophobicContact CG2-CZ 3.88Å
250	S	93.3	Very high	85.5	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	164	171.3	-164.8	0	0	0	0	110.5	F228 S230 I368	F228-S250 PolarHBondContact O-OG 3.27Å; F228-S250 VanDerWaalsContact O-OG 3.13Å; S230-S250 PolarHBondContact O-OG 2.76Å; S250-I368 PolarHBondContact N-O 2.88Å; S250-I368 WeakPolarHBondContact O-CG1 3.49Å; S250-I368 PolarHBondContact O-N 3.38Å
251	F	93	Very high	85.7	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	154.3	164	-74.9	-66.7	0	0	0	110.7	A136 F137 V140 F231 L365 D366 L367 W381	A136-F251 HydrophobicContact CB-CE2 3.87Å; A136-F251 HydrophobicContact CB-CZ 3.78Å; A136-F251 WeakPolarHBondContact O-CZ 3.48Å; F137-F251 HydrophobicContact CD1-CD2 4.03Å; F137-F251 AromaticContact CD1-CE2 3.83Å; F137-F251 HydrophobicContact CD1-CE2 3.83Å; F137-F251 AromaticContact CE1-CD2 3.57Å; F137-F251 HydrophobicContact CE1-CD2 3.57Å; F137-F251 AromaticContact CE1-CE2 3.87Å; F137-F251 HydrophobicContact CE1-CE2 3.87Å; F137-F251 HydrophobicContact CE2-CD2 4.19Å; F137-F251 HydrophobicContact CG-CE2 4.15Å; F137-F251 AromaticContact CZ-CD2 3.63Å; F137-F251 HydrophobicContact CZ-CD2 3.63Å; F137-F251 HydrophobicContact CZ-CE2 4.21Å; V140-F251 HydrophobicContact CG2-CE1 4.32Å; V140-F251 HydrophobicContact CG2-CE2 4.06Å; V140-F251 HydrophobicContact CG2-CZ 3.48Å; V140-F251 VanDerWaalsContact CG2-CZ 3.48Å; F231-F251 VanDerWaalsContact CA-O 3.3Å; F231-F251 WeakPolarHBondContact CA-O 3.29Å; F231-F251 HydrophobicContact CD1-CB 3.89Å; F231-F251 HydrophobicContact CE1-CB 3.86Å; F251-L365 HydrophobicContact CB-CB 4.42Å; F251-L365 HydrophobicContact CD1-CB 3.76Å; F251-L365 HydrophobicContact CD1-CD1 4.36Å; F251-L365 HydrophobicContact CE1-CB 4.33Å; F251-L365 HydrophobicContact CG-CB 4.27Å; F251-L365 HydrophobicContact CG-CD1 4.23Å; F251-D366 CarbonylContact C-O 3.58Å; F251-D366 WeakPolarHBondContact CA-O 3.47Å; F251-L367 HydrophobicContact CD1-CB 4.22Å; F251-L367 HydrophobicContact CD1-CD1 4Å; F251-L367 HydrophobicContact CE1-CB 4.03Å; F251-L367 HydrophobicContact CE1-CD1 3.8Å; F251-L367 HydrophobicContact CE1-CG 4.46Å; F251-L367 HydrophobicContact CZ-CD1 4.17Å; F251-W381 HydrophobicContact CE1-CB 4.05Å
252	R	91.8	Very high	85.7	Confident	21 Å²	21	42.8 Å²	42.8	8%	0.079	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129.4	174.4	-179.9	-177.8	71.3	170.6	13.1	108.9	E234 V254 D255 T256 D366 I368	E234-R252 VanDerWaalsContact OE1-CD 3.31Å; E234-R252 WeakPolarHBondContact OE1-CD 3.37Å; E234-R252 IonicContact OE1-CZ 2.75Å; E234-R252 IonicContact OE1-NE 2.89Å; E234-R252 IonicContact OE1-NH1 3.26Å; E234-R252 PolarHBondContact OE1-NH1 2.93Å; E234-R252 IonicContact OE2-NH1 2.94Å; R252-V254 VanDerWaalsContact CD-O 3.29Å; R252-V254 WeakPolarHBondContact CD-O 3.22Å; R252-V254 VanDerWaalsContact CG-O 3.26Å; R252-V254 WeakPolarHBondContact CG-O 3.16Å; R252-V254 PolarHBondContact NE-O 2.9Å; R252-D255 IonicContact CZ-OD1 2.82Å; R252-D255 IonicContact NH2-OD1 3.11Å; R252-D255 PolarHBondContact NH2-OD1 2.87Å; R252-T256 PolarHBondContact NH1-OG1 2.7Å; R252-D366 HydrophobicContact CB-CB 4.32Å; R252-D366 IonicContact CZ-OD2 2.76Å; R252-D366 PolarHBondContact N-O 3.45Å; R252-D366 IonicContact NE-OD2 2.67Å; R252-D366 IonicContact NH2-OD2 3.16Å; R252-D366 PolarHBondContact NH2-OD2 3.35Å; R252-D366 PolarHBondContact O-N 3.2Å; R252-I368 HydrophobicContact CB-CD1 4.21Å; R252-I368 HydrophobicContact CB-CG1 4.34Å; R252-I368 HydrophobicContact CB-CG2 4.12Å
253	L	91.2	Very high	85.9	Confident	6 Å²	6	45.7 Å²	45.7	3%	0.031	24%	0.241	C	C	.	.	S	Bend	trans	-90.5	-38	-179.3	-177.8	63.4	0	0	0	112.7	P128 F231 L297 T350 L365	P128-L253 HydrophobicContact CG-CD1 3.98Å; P128-L253 HydrophobicContact CG-CD2 4.27Å; F231-L253 HydrophobicContact CB-CB 4.15Å; F231-L253 HydrophobicContact CD1-CB 4.5Å; F231-L253 HydrophobicContact CD2-CB 3.97Å; F231-L253 HydrophobicContact CD2-CD2 4.19Å; F231-L253 HydrophobicContact CE2-CB 4.49Å; F231-L253 HydrophobicContact CE2-CD2 4.37Å; F231-L253 HydrophobicContact CG-CB 3.97Å; L253-L297 HydrophobicContact CD2-CD1 4.4Å; L253-L297 HydrophobicContact CD2-CD2 4.22Å; L253-L297 HydrophobicContact CD2-CG 4.36Å; L253-T350 HydrophobicContact CD2-CG2 3.94Å; L253-T350 HydrophobicContact CG-CG2 4.09Å; L253-L365 HydrophobicContact CB-CD2 4.45Å; L253-L365 HydrophobicContact CD1-CD2 3.8Å
254	V	90.4	Very high	86.5	Confident	7 Å²	7	39.2 Å²	39.2	4%	0.042	22%	0.217	C	C	.	.	S	Bend	trans	-98.8	121.6	-178.1	-179.2	0	0	0	0	109.4	R252 T256 V261 A296 T350	R252-V254 VanDerWaalsContact CD-O 3.29Å; R252-V254 WeakPolarHBondContact CD-O 3.22Å; R252-V254 VanDerWaalsContact CG-O 3.26Å; R252-V254 WeakPolarHBondContact CG-O 3.16Å; R252-V254 PolarHBondContact NE-O 2.9Å; V254-T256 PolarHBondContact O-N 3.36Å; V254-V261 HydrophobicContact CG1-CG1 3.79Å; V254-A296 HydrophobicContact CG2-CB 3.53Å; V254-T350 HydrophobicContact CG2-CG2 4.15Å
255	D	86.9	Confident	87	Confident	35 Å²	35	37.4 Å²	37.4	19%	0.187	21%	0.207	C	C	.	.			trans	-81.6	100.4	178	-168.4	-5.2	0	0	0	110.6	R252 A257 D258 K364	R252-D255 IonicContact CZ-OD1 2.82Å; R252-D255 IonicContact NH2-OD1 3.11Å; R252-D255 PolarHBondContact NH2-OD1 2.87Å; D255-A257 PolarHBondContact O-N 3Å; D255-A257 VanDerWaalsContact OD1-CB 3.28Å; D255-A257 WeakPolarHBondContact OD1-CB 3.39Å; D255-A257 PolarHBondContact OD1-N 3.41Å; D255-D258 PolarHBondContact O-N 2.96Å; D255-K364 IonicContact OD2-NZ 2.62Å
256	T	79.9	Confident	87.5	Confident	32 Å²	32	40.6 Å²	40.6	20%	0.196	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.4	177.6	55.1	0	0	0	0	113.2	R252 V254 K262 I290	R252-T256 PolarHBondContact NH1-OG1 2.7Å; V254-T256 PolarHBondContact O-N 3.36Å; T256-K262 WeakPolarHBondContact O-CE 3.25Å; T256-I290 HydrophobicContact CG2-CG2 4.24Å
257	A	82.8	Confident	87.3	Confident	61 Å²	61	42.8 Å²	42.8	50%	0.504	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-23.8	176.8	0	0	0	0	0	112.8	D255 V259 K262	D255-A257 PolarHBondContact O-N 3Å; D255-A257 VanDerWaalsContact OD1-CB 3.28Å; D255-A257 WeakPolarHBondContact OD1-CB 3.39Å; D255-A257 PolarHBondContact OD1-N 3.41Å; A257-V259 PolarHBondContact O-N 3.08Å; A257-K262 PolarHBondContact O-NZ 2.83Å
258	D	86.9	Confident	87	Confident	59 Å²	59	41.2 Å²	41.2	32%	0.316	22%	0.223	S	C	.	.			trans	-63.9	131	-178	-166.1	-30.5	0	0	0	111	D255 G260 V261 K262	D255-D258 PolarHBondContact O-N 2.96Å; D258-G260 VanDerWaalsContact C-N 3.28Å; D258-G260 PolarHBondContact O-N 3.42Å; D258-G260 PolarHBondContact OD1-N 3.15Å; D258-V261 HydrophobicContact CB-CB 4.26Å; D258-V261 HydrophobicContact CB-CG2 3.9Å; D258-V261 PolarHBondContact O-N 3.45Å; D258-K262 WeakPolarHBondContact O-CG 3.47Å; D258-K262 PolarHBondContact O-N 3.26Å; D258-K262 VanDerWaalsContact O-N 3.07Å
259	V	86.9	Confident	86.2	Confident	111 Å²	111	42.7 Å²	42.7	67%	0.673	24%	0.239	S	C	*	.	H	α-helix	trans	-62.1	-38	-179.6	-177.6	0	0	0	0	110.9	A257 K262 Q263	A257-V259 PolarHBondContact O-N 3.08Å; V259-K262 PolarHBondContact O-N 3.03Å; V259-Q263 PolarHBondContact O-N 3.39Å
260	G	84.6	Confident	85.5	Confident	33 Å²	33	47.4 Å²	47.4	34%	0.34	26%	0.263	S	S	.	.	H	α-helix	trans	-64.7	-43.2	179.1	0	0	0	0	0	112.1	D258 Q263 I264	D258-G260 VanDerWaalsContact C-N 3.28Å; D258-G260 PolarHBondContact O-N 3.42Å; D258-G260 PolarHBondContact OD1-N 3.15Å; G260-Q263 PolarHBondContact O-N 3.32Å; G260-I264 VanDerWaalsContact O-CG1 3.27Å; G260-I264 WeakPolarHBondContact O-CG1 3.13Å; G260-I264 PolarHBondContact O-N 3.12Å; G260-I264 VanDerWaalsContact O-N 3.1Å
261	V	87.3	Confident	84.7	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.024	27%	0.269	C	S	.	.	H	α-helix	trans	-64.5	-44.4	177.2	178.2	0	0	0	0	110.6	V254 D258 Q263 I264 L265 L349	V254-V261 HydrophobicContact CG1-CG1 3.79Å; D258-V261 HydrophobicContact CB-CB 4.26Å; D258-V261 HydrophobicContact CB-CG2 3.9Å; D258-V261 PolarHBondContact O-N 3.45Å; V261-Q263 VanDerWaalsContact C-N 3.34Å; V261-Q263 PolarHBondContact O-N 3.34Å; V261-I264 PolarHBondContact O-N 2.8Å; V261-L265 HydrophobicContact CG1-CD1 4.14Å; V261-L265 WeakPolarHBondContact O-CB 3.3Å; V261-L265 WeakPolarHBondContact O-CG 3.49Å; V261-L265 PolarHBondContact O-N 3.08Å; V261-L349 HydrophobicContact CB-CD2 4.36Å; V261-L349 HydrophobicContact CG1-CD2 4.48Å; V261-L349 HydrophobicContact CG2-CD2 3.91Å
262	K	85.3	Confident	83.8	Confident	115 Å²	115	49 Å²	49	50%	0.5	27%	0.27	S	S	.	.	H	α-helix	trans	-60.3	-40.8	177.4	-73.9	177.9	-174.8	172.6	0	113	T256 A257 D258 V259 K266	T256-K262 WeakPolarHBondContact O-CE 3.25Å; A257-K262 PolarHBondContact O-NZ 2.83Å; D258-K262 WeakPolarHBondContact O-CG 3.47Å; D258-K262 PolarHBondContact O-N 3.26Å; D258-K262 VanDerWaalsContact O-N 3.07Å; V259-K262 PolarHBondContact O-N 3.03Å; K262-K266 PolarHBondContact O-N 3.39Å; K262-K266 VanDerWaalsContact O-N 3.11Å
263	Q	86.2	Confident	82.6	Confident	117 Å²	117	54.1 Å²	54.1	55%	0.547	30%	0.295	S	S	.	.	H	α-helix	trans	-65	-47.4	177.6	-176.5	175	-8.7	0	0	110.9	V259 G260 V261 L265 K266 D267	V259-Q263 PolarHBondContact O-N 3.39Å; G260-Q263 PolarHBondContact O-N 3.32Å; V261-Q263 VanDerWaalsContact C-N 3.34Å; V261-Q263 PolarHBondContact O-N 3.34Å; Q263-L265 VanDerWaalsContact C-N 3.32Å; Q263-L265 PolarHBondContact O-N 3.22Å; Q263-K266 WeakPolarHBondContact O-CB 3.28Å; Q263-K266 PolarHBondContact O-N 2.91Å; Q263-K266 VanDerWaalsContact O-N 3.14Å; Q263-D267 VanDerWaalsContact O-CG 3.27Å; Q263-D267 PolarHBondContact O-N 3.07Å
264	I	85.8	Confident	81.3	Confident	18 Å²	18	60.8 Å²	60.8	9%	0.092	33%	0.326	C	S	.	.	H	α-helix	trans	-62.6	-41.3	179.8	-68.3	170.1	0	0	0	111.2	Y44 G260 V261 K266 D267 I268 F299 L349	Y44-I264 HydrophobicContact CE1-CG2 4.23Å; G260-I264 VanDerWaalsContact O-CG1 3.27Å; G260-I264 WeakPolarHBondContact O-CG1 3.13Å; G260-I264 PolarHBondContact O-N 3.12Å; G260-I264 VanDerWaalsContact O-N 3.1Å; V261-I264 PolarHBondContact O-N 2.8Å; I264-K266 VanDerWaalsContact C-N 3.34Å; I264-K266 PolarHBondContact O-N 2.89Å; I264-D267 PolarHBondContact O-N 2.93Å; I264-I268 HydrophobicContact CG2-CD1 3.73Å; I264-I268 HydrophobicContact CG2-CG1 4.29Å; I264-I268 WeakPolarHBondContact O-CB 3.44Å; I264-I268 VanDerWaalsContact O-CG1 3.26Å; I264-I268 WeakPolarHBondContact O-CG1 3.44Å; I264-I268 PolarHBondContact O-N 2.87Å; I264-F299 HydrophobicContact CD1-CE1 4.36Å; I264-F299 HydrophobicContact CD1-CZ 4.23Å; I264-F299 HydrophobicContact CG2-CE2 4.23Å; I264-F299 HydrophobicContact CG2-CZ 4.33Å; I264-L349 HydrophobicContact CB-CD2 4.21Å; I264-L349 HydrophobicContact CD1-CD2 3.52Å; I264-L349 HydrophobicContact CG1-CD2 4.43Å; I264-L349 HydrophobicContact CG2-CD1 4.2Å; I264-L349 HydrophobicContact CG2-CD2 4.18Å
265	L	83.4	Confident	79.9	Confident	31 Å²	31	64 Å²	64	16%	0.162	34%	0.342	C	S	.	.	H	α-helix	trans	-57.1	-45.4	173.3	-89.6	174.7	0	0	0	112.8	V261 Q263 D267 G269 L291	V261-L265 HydrophobicContact CG1-CD1 4.14Å; V261-L265 WeakPolarHBondContact O-CB 3.3Å; V261-L265 WeakPolarHBondContact O-CG 3.49Å; V261-L265 PolarHBondContact O-N 3.08Å; Q263-L265 VanDerWaalsContact C-N 3.32Å; Q263-L265 PolarHBondContact O-N 3.22Å; L265-D267 VanDerWaalsContact C-N 3.34Å; L265-G269 PolarHBondContact O-N 2.76Å; L265-G269 VanDerWaalsContact O-N 3.08Å; L265-L291 HydrophobicContact CD1-CB 4.11Å; L265-L291 HydrophobicContact CD2-CB 3.53Å; L265-L291 HydrophobicContact CD2-CD1 3.81Å; L265-L291 HydrophobicContact CD2-CD2 4.19Å; L265-L291 HydrophobicContact CD2-CG 4.02Å; L265-L291 HydrophobicContact CG-CB 4.06Å
266	K	82.6	Confident	78.7	Confident	149 Å²	149	64.2 Å²	64.2	65%	0.648	34%	0.341	S	S	*	.	H	α-helix	trans	-63	-43.4	177.2	-171.4	-178.4	179.5	-176.5	0	111.2	K262 Q263 I264 G269 L270	K262-K266 PolarHBondContact O-N 3.39Å; K262-K266 VanDerWaalsContact O-N 3.11Å; Q263-K266 WeakPolarHBondContact O-CB 3.28Å; Q263-K266 PolarHBondContact O-N 2.91Å; Q263-K266 VanDerWaalsContact O-N 3.14Å; I264-K266 VanDerWaalsContact C-N 3.34Å; I264-K266 PolarHBondContact O-N 2.89Å; K266-G269 PolarHBondContact O-N 2.86Å; K266-L270 WeakPolarHBondContact O-CG 3.46Å; K266-L270 PolarHBondContact O-N 3.13Å
267	D	83.4	Confident	77.1	Confident	50 Å²	50	72 Å²	72	27%	0.267	37%	0.372	S	S	.	.	H	α-helix	trans	-70.1	-38.6	-178	-64.8	-17.5	0	0	0	112.3	Y44 Q263 I264 L265 G269 L270 Y271	Y44-D267 HydrophobicContact CE2-CB 4.12Å; Y44-D267 WeakPolarHBondContact OH-CB 3.42Å; Q263-D267 VanDerWaalsContact O-CG 3.27Å; Q263-D267 PolarHBondContact O-N 3.07Å; I264-D267 PolarHBondContact O-N 2.93Å; L265-D267 VanDerWaalsContact C-N 3.34Å; D267-G269 VanDerWaalsContact C-N 3.31Å; D267-G269 PolarHBondContact O-N 2.89Å; D267-L270 PolarHBondContact O-N 2.84Å; D267-Y271 WeakPolarHBondContact O-CB 3.23Å; D267-Y271 PolarHBondContact O-N 2.95Å
268	I	81.3	Confident	75.5	Confident	16 Å²	16	76.5 Å²	76.5	8%	0.082	38%	0.38	C	S	.	.	H	α-helix	trans	-59.9	-43.2	171.3	-70.7	167.8	0	0	0	110.3	L40 Y44 I264 L270 Y271 S272	L40-I268 HydrophobicContact CD2-CG2 3.97Å; L40-I268 HydrophobicContact CG-CG2 4.24Å; Y44-I268 HydrophobicContact CD1-CD1 4.01Å; Y44-I268 HydrophobicContact CD1-CG1 3.31Å; Y44-I268 HydrophobicContact CD2-CG1 4.33Å; Y44-I268 HydrophobicContact CE1-CD1 4.32Å; Y44-I268 HydrophobicContact CE1-CG1 3.59Å; Y44-I268 HydrophobicContact CG-CG1 3.72Å; I264-I268 HydrophobicContact CG2-CD1 3.73Å; I264-I268 HydrophobicContact CG2-CG1 4.29Å; I264-I268 WeakPolarHBondContact O-CB 3.44Å; I264-I268 VanDerWaalsContact O-CG1 3.26Å; I264-I268 WeakPolarHBondContact O-CG1 3.44Å; I264-I268 PolarHBondContact O-N 2.87Å; I268-L270 PolarHBondContact O-N 2.87Å; I268-Y271 PolarHBondContact O-N 2.85Å; I268-S272 WeakPolarHBondContact O-CB 3.38Å; I268-S272 PolarHBondContact O-N 2.66Å
269	G	74.9	Confident	73.3	Confident	31 Å²	31	78.3 Å²	78.3	32%	0.32	40%	0.396	S	S	.	.	H	α-helix	trans	-59.8	-43.2	176.3	0	0	0	0	0	112.8	L265 K266 D267 H273	L265-G269 PolarHBondContact O-N 2.76Å; L265-G269 VanDerWaalsContact O-N 3.08Å; K266-G269 PolarHBondContact O-N 2.86Å; D267-G269 VanDerWaalsContact C-N 3.31Å; D267-G269 PolarHBondContact O-N 2.89Å; G269-H273 PolarHBondContact O-N 3.05Å
270	L	77.8	Confident	71.3	Confident	99 Å²	99	83.5 Å²	83.5	52%	0.518	41%	0.405	S	S	.	.	H	α-helix	trans	-65.7	-44.9	175.3	-68.3	173.1	0	0	0	111.8	K266 D267 I268 S272 H273 H274	K266-L270 WeakPolarHBondContact O-CG 3.46Å; K266-L270 PolarHBondContact O-N 3.13Å; D267-L270 PolarHBondContact O-N 2.84Å; I268-L270 PolarHBondContact O-N 2.87Å; L270-S272 PolarHBondContact O-N 2.91Å; L270-H273 WeakPolarHBondContact O-CB 3.49Å; L270-H273 PolarHBondContact O-N 3.29Å; L270-H274 PolarHBondContact O-CD2 3.48Å; L270-H274 VanDerWaalsContact O-CD2 3.3Å; L270-H274 PolarHBondContact O-N 2.93Å
271	Y	77.5	Confident	69.5	Low	28 Å²	28	85 Å²	85	11%	0.11	41%	0.405	C	S	.	.	H	α-helix	trans	-61.9	-42.2	179.8	-178.1	-103.8	0	0	0	112.6	L40 R43 Y44 H47 D267 I268 H273 H274 I275	L40-Y271 HydrophobicContact CD1-CD1 4.07Å; L40-Y271 HydrophobicContact CD1-CE1 4.41Å; R43-Y271 HydrophobicContact CB-CE1 4.39Å; Y44-Y271 AromaticContact CD2-CD1 3.85Å; Y44-Y271 HydrophobicContact CD2-CD1 3.85Å; Y44-Y271 HydrophobicContact CD2-CD2 4.07Å; Y44-Y271 HydrophobicContact CD2-CE1 4.46Å; Y44-Y271 AromaticContact CD2-CG 3.61Å; Y44-Y271 HydrophobicContact CD2-CG 3.61Å; Y44-Y271 HydrophobicContact CE2-CG 4.42Å; Y44-Y271 HydrophobicContact CG-CD1 4.33Å; H47-Y271 HydrophobicContact CB-CE2 3.94Å; H47-Y271 AromaticContact CD2-CE2 3.84Å; H47-Y271 AromaticContact CG-CE2 3.55Å; H47-Y271 AromaticContact ND1-CE2 3.73Å; D267-Y271 WeakPolarHBondContact O-CB 3.23Å; D267-Y271 PolarHBondContact O-N 2.95Å; I268-Y271 PolarHBondContact O-N 2.85Å; Y271-H273 VanDerWaalsContact C-N 3.27Å; Y271-H273 PolarHBondContact O-N 3.24Å; Y271-H274 PolarHBondContact O-N 3.39Å; Y271-H274 VanDerWaalsContact O-N 3.12Å; Y271-I275 HydrophobicContact CD1-CD1 4.4Å; Y271-I275 HydrophobicContact CD2-CD1 4.38Å; Y271-I275 HydrophobicContact CE1-CD1 3.6Å; Y271-I275 HydrophobicContact CE1-CG1 4.39Å; Y271-I275 HydrophobicContact CE2-CD1 3.59Å; Y271-I275 HydrophobicContact CE2-CG1 4.28Å; Y271-I275 PolarHBondContact O-N 3.1Å; Y271-I275 WeakPolarHBondContact OH-CD1 3.29Å
272	S	72.9	Confident	67.3	Low	5 Å²	5	87.6 Å²	87.6	4%	0.035	42%	0.418	C	S	.	.	H	α-helix	trans	-55.8	-41.4	176.4	-173.3	0	0	0	0	112.4	I268 L270 H274 F276 I285	I268-S272 WeakPolarHBondContact O-CB 3.38Å; I268-S272 PolarHBondContact O-N 2.66Å; L270-S272 PolarHBondContact O-N 2.91Å; S272-H274 VanDerWaalsContact C-N 3.3Å; S272-H274 PolarHBondContact O-N 2.48Å; S272-F276 PolarHBondContact O-N 3.23Å; S272-I285 VanDerWaalsContact OG-CD1 3.27Å; S272-I285 WeakPolarHBondContact OG-CD1 3.45Å
273	H	66.1	Low	65.2	Low	129 Å²	129	89.4 Å²	89.4	60%	0.597	43%	0.433	S	S	*	.	H	α-helix	trans	-64.6	-32.2	179.8	-167	66.9	0	0	0	113.1	G269 L270 Y271	G269-H273 PolarHBondContact O-N 3.05Å; L270-H273 WeakPolarHBondContact O-CB 3.49Å; L270-H273 PolarHBondContact O-N 3.29Å; Y271-H273 VanDerWaalsContact C-N 3.27Å; Y271-H273 PolarHBondContact O-N 3.24Å
274	H	63.9	Low	63.3	Low	147 Å²	147	92.3 Å²	92.3	68%	0.681	45%	0.446	S	S	*	.	H	α-helix	trans	-81	-33.7	-177.6	-79.4	-68.9	0	0	0	113.9	L270 Y271 S272	L270-H274 PolarHBondContact O-CD2 3.48Å; L270-H274 VanDerWaalsContact O-CD2 3.3Å; L270-H274 PolarHBondContact O-N 2.93Å; Y271-H274 PolarHBondContact O-N 3.39Å; Y271-H274 VanDerWaalsContact O-N 3.12Å; S272-H274 VanDerWaalsContact C-N 3.3Å; S272-H274 PolarHBondContact O-N 2.48Å
275	I	62.8	Low	61.5	Low	73 Å²	73	93.8 Å²	93.8	37%	0.374	45%	0.453	S	S	.	.	H	α-helix	trans	-89.5	-37.5	-174	-67.2	-159.5	0	0	0	113.1	Y271 K277	Y271-I275 HydrophobicContact CD1-CD1 4.4Å; Y271-I275 HydrophobicContact CD2-CD1 4.38Å; Y271-I275 HydrophobicContact CE1-CD1 3.6Å; Y271-I275 HydrophobicContact CE1-CG1 4.39Å; Y271-I275 HydrophobicContact CE2-CD1 3.59Å; Y271-I275 HydrophobicContact CE2-CG1 4.28Å; Y271-I275 PolarHBondContact O-N 3.1Å; Y271-I275 WeakPolarHBondContact OH-CD1 3.29Å; I275-K277 PolarHBondContact O-N 2.74Å
276	F	59.8	Low	59.6	Low	40 Å²	40	100.9 Å²	100.9	18%	0.175	48%	0.483	C	S	.	.			trans	-102.4	82.4	-171.7	-67	-88.2	0	0	0	112.1	Y36 L40 S272 K278 L281	Y36-F276 HydrophobicContact CE2-CD1 4.01Å; Y36-F276 AromaticContact CE2-CE1 3.49Å; Y36-F276 HydrophobicContact CE2-CE1 3.49Å; Y36-F276 VanDerWaalsContact CE2-CE1 3.49Å; Y36-F276 HydrophobicContact CE2-CE2 4.25Å; Y36-F276 AromaticContact CE2-CZ 3.61Å; Y36-F276 HydrophobicContact CE2-CZ 3.61Å; Y36-F276 AromaticContact CZ-CD1 3.92Å; Y36-F276 AromaticContact CZ-CD2 3.98Å; Y36-F276 AromaticContact CZ-CE1 3.71Å; Y36-F276 AromaticContact CZ-CE2 3.75Å; Y36-F276 AromaticContact CZ-CZ 3.6Å; Y36-F276 WeakPolarHBondContact OH-CD1 3.31Å; Y36-F276 WeakPolarHBondContact OH-CD2 3.27Å; Y36-F276 WeakPolarHBondContact OH-CE1 3.45Å; Y36-F276 WeakPolarHBondContact OH-CE2 3.45Å; Y36-F276 WeakPolarHBondContact OH-CG 3.39Å; Y36-F276 WeakPolarHBondContact OH-CZ 3.34Å; L40-F276 HydrophobicContact CD1-CE2 4.01Å; S272-F276 PolarHBondContact O-N 3.23Å; F276-K278 PolarHBondContact O-N 3.05Å; F276-L281 HydrophobicContact CB-CD2 4.29Å; F276-L281 HydrophobicContact CD1-CD2 4.26Å; F276-L281 HydrophobicContact CG-CD2 4.37Å
277	K	48.2	Very low	57.9	Low	197 Å²	197	103.2 Å²	103.2	86%	0.857	49%	0.493	S	S	*	.			trans	-67.9	26.2	172.7	-72.6	-175.1	176.5	178	0	114.8	I275	I275-K277 PolarHBondContact O-N 2.74Å
278	K	48.1	Very low	56.4	Low	154 Å²	154	104.4 Å²	104.4	67%	0.67	51%	0.505	S	S	*	.			trans	-98.9	122.2	176.4	-80	-170.7	178.5	179	0	111	F276 Y280 L281	F276-K278 PolarHBondContact O-N 3.05Å; K278-Y280 VanDerWaalsContact C-N 3.3Å; K278-Y280 PolarHBondContact O-N 3.48Å; K278-L281 PolarHBondContact O-N 3.15Å
279	P	41.3	Very low	55.4	Low	98 Å²	98	109.4 Å²	109.4	64%	0.636	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-62.6	-29.2	-174.3	-20.9	30.7	0	0	0	115	L281	P279-L281 VanDerWaalsContact C-N 3.32Å; P279-L281 PolarHBondContact O-N 2.91Å
280	Y	44.1	Very low	55.1	Low	219 Å²	219	110.2 Å²	110.2	86%	0.859	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-77.3	-14	-175.2	-66.8	-80.5	0	0	0	114.4	K278	K278-Y280 VanDerWaalsContact C-N 3.3Å; K278-Y280 PolarHBondContact O-N 3.48Å
281	L	47.3	Very low	54.9	Low	65 Å²	65	106.5 Å²	106.5	34%	0.34	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-90.8	-11.3	-179.1	-131	73.7	0	0	0	113.2	Y36 F276 K278 P279 L283	Y36-L281 HydrophobicContact CD1-CD2 4.41Å; Y36-L281 HydrophobicContact CD2-CD2 4.37Å; Y36-L281 HydrophobicContact CE1-CD2 3.69Å; Y36-L281 HydrophobicContact CE2-CD2 3.61Å; Y36-L281 WeakPolarHBondContact OH-CD2 3.39Å; F276-L281 HydrophobicContact CB-CD2 4.29Å; F276-L281 HydrophobicContact CD1-CD2 4.26Å; F276-L281 HydrophobicContact CG-CD2 4.37Å; K278-L281 PolarHBondContact O-N 3.15Å; P279-L281 VanDerWaalsContact C-N 3.32Å; P279-L281 PolarHBondContact O-N 2.91Å; L281-L283 VanDerWaalsContact C-N 3.32Å; L281-L283 PolarHBondContact O-N 3.39Å
282	N	41.2	Very low	55.2	Low	59 Å²	59	108.5 Å²	108.5	32%	0.316	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-2.3	-174.1	-76.3	-36.7	0	0	0	114.4
283	L	41.1	Very low	55.8	Low	153 Å²	153	108.6 Å²	108.6	80%	0.801	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-28.7	-176.3	-128.1	92.3	0	0	0	113.8	L281	L281-L283 VanDerWaalsContact C-N 3.32Å; L281-L283 PolarHBondContact O-N 3.39Å
284	H	45.7	Very low	56.8	Low	178 Å²	178	105.3 Å²	105.3	82%	0.824	51%	0.51	S	S	*	.	S	Bend	trans	-90	-20.3	-176.3	-81.3	-66.1	0	0	0	114.7
285	I	48.7	Very low	57.9	Low	48 Å²	48	98.4 Å²	98.4	25%	0.246	48%	0.478	C	S	.	.	S	Bend	trans	-93.3	-12.5	-175.2	-58	176.1	0	0	0	112.2	S272 K287	S272-I285 VanDerWaalsContact OG-CD1 3.27Å; S272-I285 WeakPolarHBondContact OG-CD1 3.45Å; I285-K287 PolarHBondContact O-N 3.08Å
286	K	42.4	Very low	59.1	Low	181 Å²	181	95 Å²	95	79%	0.787	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-1.6	-173.3	-98.3	-177.8	175.8	-178.4	0	115.6
287	K	46.8	Very low	60.6	Low	198 Å²	198	93.9 Å²	93.9	86%	0.861	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.8	8	-174.3	-100.4	-175.2	178.8	-175.3	0	116.8	I285 T289	I285-K287 PolarHBondContact O-N 3.08Å; K287-T289 PolarHBondContact O-N 2.9Å; K287-T289 VanDerWaalsContact O-N 3.13Å
288	S	52.7	Low	62.6	Low	75 Å²	75	85.5 Å²	85.5	52%	0.524	42%	0.421	S	S	.	.			trans	-82.1	98.3	-178	61.4	0	0	0	0	111.2	I290	S288-I290 PolarHBondContact O-N 2.8Å
289	T	59.6	Low	64.7	Low	121 Å²	121	78.5 Å²	78.5	74%	0.742	39%	0.39	S	S	*	.			trans	-75.8	0.7	167.7	44.8	0	0	0	0	113.2	K287	K287-T289 PolarHBondContact O-N 2.9Å; K287-T289 VanDerWaalsContact O-N 3.13Å
290	I	68.2	Low	67.1	Low	47 Å²	47	73.9 Å²	73.9	24%	0.241	36%	0.36	C	S	.	.	S	Bend	trans	-130.2	134.3	-168.4	-58	162.7	0	0	0	108.7	E234 T235 T256 S288	E234-I290 HydrophobicContact CB-CD1 3.8Å; E234-I290 HydrophobicContact CB-CG2 4.46Å; E234-I290 VanDerWaalsContact O-CD1 3.24Å; E234-I290 WeakPolarHBondContact O-CD1 3.45Å; T235-I290 HydrophobicContact CG2-CG2 4.16Å; T256-I290 HydrophobicContact CG2-CG2 4.24Å; S288-I290 PolarHBondContact O-N 2.8Å
291	L	74.4	Confident	69.3	Low	21 Å²	21	63.7 Å²	63.7	11%	0.11	32%	0.321	C	S	.	.			trans	-92.2	128.2	172.1	-166.4	50.6	0	0	0	109.2	L265 P295 A296 L349	L265-L291 HydrophobicContact CD1-CB 4.11Å; L265-L291 HydrophobicContact CD2-CB 3.53Å; L265-L291 HydrophobicContact CD2-CD1 3.81Å; L265-L291 HydrophobicContact CD2-CD2 4.19Å; L265-L291 HydrophobicContact CD2-CG 4.02Å; L265-L291 HydrophobicContact CG-CB 4.06Å; L291-P295 HydrophobicContact CD1-CB 3.95Å; L291-A296 HydrophobicContact CD2-CB 3.79Å; L291-A296 HydrophobicContact CG-CB 4.18Å; L291-L349 HydrophobicContact CD2-CD1 3.87Å
292	E	83.3	Confident	71.5	Confident	70 Å²	70	60.7 Å²	60.7	33%	0.327	31%	0.305	S	S	.	.			trans	-63.5	152.5	168.7	-69.6	170.1	161.6	0	0	110.9	N37 D232 T235 E294 P295 A296	N37-E292 PolarHBondContact ND2-OE2 3.48Å; D232-E292 WeakPolarHBondContact OD1-CA 3.1Å; T235-E292 HydrophobicContact CG2-CG 4.16Å; E292-E294 PolarHBondContact O-N 2.82Å; E292-P295 HydrophobicContact CB-CG 4.09Å; E292-P295 WeakPolarHBondContact O-CD 3.06Å; E292-A296 PolarHBondContact O-N 2.94Å
293	S	87.1	Confident	73.9	Confident	7 Å²	7	58.2 Å²	58.2	5%	0.049	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-37.1	-178.4	63.3	0	0	0	0	113.5	D232 A296 L297	D232-S293 WeakPolarHBondContact OD1-CB 3.34Å; D232-S293 PolarHBondContact OD1-N 3.45Å; D232-S293 PolarHBondContact OD1-OG 2.98Å; D232-S293 PolarHBondContact OD2-OG 3.46Å; S293-A296 PolarHBondContact O-N 3.43Å; S293-L297 WeakPolarHBondContact O-CG 3.38Å; S293-L297 PolarHBondContact O-N 3.39Å
294	E	85.5	Confident	76.4	Confident	60 Å²	60	51 Å²	51	28%	0.28	25%	0.253	S	S	.	.	H	α-helix	trans	-66.5	-50.9	-178.4	-68.9	-170.6	156.7	0	0	113.6	T95 E292 A296 L297 M298	T95-E294 HydrophobicContact CG2-CG 4.23Å; T95-E294 PolarHBondContact OG1-OE1 2.99Å; E292-E294 PolarHBondContact O-N 2.82Å; E294-A296 VanDerWaalsContact C-N 3.27Å; E294-A296 PolarHBondContact O-N 3.11Å; E294-L297 PolarHBondContact O-N 3.26Å; E294-M298 PolarHBondContact O-N 3.1Å
295	P	87.1	Confident	78.6	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.019	21%	0.214	C	C	.	.	H	α-helix	trans	-57.9	-36.5	172.7	-25.7	33.5	0	0	0	113.8	N37 A41 L291 E292 M298 F299	N37-P295 HydrophobicContact CB-CB 4.48Å; N37-P295 HydrophobicContact CB-CG 3.58Å; A41-P295 HydrophobicContact CB-CB 3.85Å; A41-P295 VanDerWaalsContact CB-O 3.32Å; A41-P295 WeakPolarHBondContact CB-O 3.31Å; L291-P295 HydrophobicContact CD1-CB 3.95Å; E292-P295 HydrophobicContact CB-CG 4.09Å; E292-P295 WeakPolarHBondContact O-CD 3.06Å; P295-M298 PolarHBondContact O-N 2.81Å; P295-F299 PolarHBondContact O-N 3.22Å
296	A	89.4	Confident	80.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.3	-42.8	177.4	0	0	0	0	0	112	V254 L291 E292 S293 E294 M298 F299 D300 L349 T350	V254-A296 HydrophobicContact CG2-CB 3.53Å; L291-A296 HydrophobicContact CD2-CB 3.79Å; L291-A296 HydrophobicContact CG-CB 4.18Å; E292-A296 PolarHBondContact O-N 2.94Å; S293-A296 PolarHBondContact O-N 3.43Å; E294-A296 VanDerWaalsContact C-N 3.27Å; E294-A296 PolarHBondContact O-N 3.11Å; A296-M298 VanDerWaalsContact C-N 3.32Å; A296-M298 PolarHBondContact O-N 3.46Å; A296-F299 PolarHBondContact O-N 3.42Å; A296-D300 PolarHBondContact O-N 3.12Å; A296-L349 HydrophobicContact CB-CB 4.18Å; A296-L349 HydrophobicContact CB-CD1 4.37Å; A296-T350 HydrophobicContact CB-CG2 3.9Å
297	L	90.6	Very high	83	Confident	18 Å²	18	32.7 Å²	32.7	9%	0.094	17%	0.17	C	C	.	.	H	α-helix	trans	-63.5	-38.2	174.3	-72.6	167	0	0	0	112	V126 Y127 L253 S293 E294 D300 S301 T350	V126-L297 HydrophobicContact CG1-CD2 4.06Å; V126-L297 WeakPolarHBondContact O-CD2 3.48Å; Y127-L297 HydrophobicContact CD2-CD1 3.59Å; Y127-L297 HydrophobicContact CE2-CD1 4.25Å; L253-L297 HydrophobicContact CD2-CD1 4.4Å; L253-L297 HydrophobicContact CD2-CD2 4.22Å; L253-L297 HydrophobicContact CD2-CG 4.36Å; S293-L297 WeakPolarHBondContact O-CG 3.38Å; S293-L297 PolarHBondContact O-N 3.39Å; E294-L297 PolarHBondContact O-N 3.26Å; L297-D300 PolarHBondContact O-N 2.88Å; L297-S301 WeakPolarHBondContact O-CB 3.1Å; L297-S301 PolarHBondContact O-N 3.08Å; L297-T350 HydrophobicContact CD2-CG2 3.86Å; L297-T350 HydrophobicContact CG-CG2 4.05Å
298	M	90.3	Very high	85.1	Confident	21 Å²	21	23.2 Å²	23.2	10%	0.103	13%	0.129	C	C	.	.	H	α-helix	trans	-65.4	-42.6	176.8	-164.8	68.9	-173	0	0	111.3	A27 F29 F42 F92 E294 P295 A296 S301 V302	A27-M298 HydrophobicContact CB-CE 4.46Å; F29-M298 HydrophobicContact CE1-CE 3.9Å; F29-M298 HydrophobicContact CE1-SD 4.33Å; F29-M298 HydrophobicContact CZ-CE 3.75Å; F42-M298 HydrophobicContact CB-CE 4Å; F42-M298 HydrophobicContact CB-CG 3.84Å; F42-M298 HydrophobicContact CD2-CE 3.26Å; F42-M298 HydrophobicContact CD2-CG 4.37Å; F42-M298 HydrophobicContact CE2-CE 3.84Å; F42-M298 HydrophobicContact CG-CE 3.79Å; F92-M298 HydrophobicContact CB-CE 3.59Å; F92-M298 HydrophobicContact CD1-CE 4.06Å; F92-M298 HydrophobicContact CG-CE 4.05Å; E294-M298 PolarHBondContact O-N 3.1Å; P295-M298 PolarHBondContact O-N 2.81Å; A296-M298 VanDerWaalsContact C-N 3.32Å; A296-M298 PolarHBondContact O-N 3.46Å; M298-S301 PolarHBondContact O-N 3.44Å; M298-S301 PolarHBondContact O-OG 2.8Å; M298-V302 PolarHBondContact O-N 2.97Å
299	F	91.1	Very high	86.8	Confident	7 Å²	7	19.7 Å²	19.7	3%	0.031	10%	0.104	C	C	.	.	H	α-helix	trans	-59	-48.3	173.2	-178.9	-84.9	0	0	0	111.4	Y44 A45 I264 P295 A296 S301 V302 Y303 L349	Y44-F299 HydrophobicContact CD1-CD2 4.27Å; Y44-F299 AromaticContact CD1-CE2 3.94Å; Y44-F299 HydrophobicContact CD1-CE2 3.94Å; Y44-F299 AromaticContact CE1-CE2 3.95Å; Y44-F299 HydrophobicContact CE1-CE2 3.95Å; A45-F299 HydrophobicContact CB-CD2 3.61Å; A45-F299 HydrophobicContact CB-CE2 3.95Å; A45-F299 HydrophobicContact CB-CG 4.28Å; I264-F299 HydrophobicContact CD1-CE1 4.36Å; I264-F299 HydrophobicContact CD1-CZ 4.23Å; I264-F299 HydrophobicContact CG2-CE2 4.23Å; I264-F299 HydrophobicContact CG2-CZ 4.33Å; P295-F299 PolarHBondContact O-N 3.22Å; A296-F299 PolarHBondContact O-N 3.42Å; F299-S301 VanDerWaalsContact C-N 3.28Å; F299-S301 PolarHBondContact O-N 3.16Å; F299-V302 PolarHBondContact O-N 2.8Å; F299-Y303 HydrophobicContact CD1-CD2 4.09Å; F299-Y303 HydrophobicContact CD1-CE2 4.28Å; F299-Y303 AromaticContact CE1-CD2 3.63Å; F299-Y303 HydrophobicContact CE1-CD2 3.63Å; F299-Y303 AromaticContact CE1-CE2 3.49Å; F299-Y303 HydrophobicContact CE1-CE2 3.49Å; F299-Y303 VanDerWaalsContact CE1-CE2 3.49Å; F299-Y303 AromaticContact CE2-CE2 3.85Å; F299-Y303 HydrophobicContact CE2-CE2 3.85Å; F299-Y303 AromaticContact CZ-CD2 3.88Å; F299-Y303 HydrophobicContact CZ-CD2 3.88Å; F299-Y303 AromaticContact CZ-CE2 3.23Å; F299-Y303 HydrophobicContact CZ-CE2 3.23Å; F299-Y303 AromaticContact CZ-CZ 3.97Å; F299-Y303 PolarHBondContact O-N 3.19Å; F299-L349 HydrophobicContact CB-CD1 3.85Å; F299-L349 HydrophobicContact CD1-CD1 3.41Å; F299-L349 VanDerWaalsContact CD1-CD1 3.41Å; F299-L349 HydrophobicContact CD1-CG 3.71Å; F299-L349 HydrophobicContact CD2-CD1 4.41Å; F299-L349 HydrophobicContact CE1-CD1 4.04Å; F299-L349 HydrophobicContact CE1-CG 4.06Å; F299-L349 HydrophobicContact CG-CD1 3.63Å; F299-L349 HydrophobicContact CG-CG 4.43Å
300	D	92.2	Very high	88.2	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62.4	-35.7	178.7	-74.6	-12.9	0	0	0	111.8	V126 A296 L297 V302 Y303 V304 G348 L349 T350 I353	V126-D300 HydrophobicContact CG1-CB 4.45Å; A296-D300 PolarHBondContact O-N 3.12Å; L297-D300 PolarHBondContact O-N 2.88Å; D300-V302 VanDerWaalsContact C-N 3.33Å; D300-V302 PolarHBondContact O-N 3.12Å; D300-Y303 PolarHBondContact O-N 3.14Å; D300-V304 WeakPolarHBondContact O-CG2 3.3Å; D300-V304 PolarHBondContact O-N 3.22Å; D300-G348 VanDerWaalsContact OD1-CA 3.23Å; D300-G348 WeakPolarHBondContact OD1-CA 3.24Å; D300-L349 PolarHBondContact OD1-N 2.95Å; D300-L349 PolarHBondContact OD2-N 3.16Å; D300-T350 WeakPolarHBondContact OD2-CB 3.22Å; D300-T350 WeakPolarHBondContact OD2-CG2 3.31Å; D300-T350 PolarHBondContact OD2-N 3.37Å; D300-T350 PolarHBondContact OD2-OG1 2.7Å; D300-I353 HydrophobicContact CB-CD1 3.81Å
301	S	91.8	Very high	89	Confident	6 Å²	6	16.7 Å²	16.7	4%	0.042	8%	0.084	C	C	.	.	H	α-helix	trans	-61.4	-38.3	178.8	76.8	0	0	0	0	113.2	F92 L297 M298 F299 V304 F305	F92-S301 WeakPolarHBondContact CD1-OG 3.36Å; F92-S301 WeakPolarHBondContact CE1-OG 3.3Å; L297-S301 WeakPolarHBondContact O-CB 3.1Å; L297-S301 PolarHBondContact O-N 3.08Å; M298-S301 PolarHBondContact O-N 3.44Å; M298-S301 PolarHBondContact O-OG 2.8Å; F299-S301 VanDerWaalsContact C-N 3.28Å; F299-S301 PolarHBondContact O-N 3.16Å; S301-V304 PolarHBondContact O-N 3.15Å; S301-F305 PolarHBondContact O-N 2.9Å
302	V	92.5	Very high	89.6	Confident	1 Å²	1	15.7 Å²	15.7	1%	0.006	8%	0.079	C	C	.	.	H	α-helix	trans	-67.4	-39.3	177	178.6	0	0	0	0	110.9	F42 A45 I46 F92 M298 F299 D300 F305 A306	F42-V302 HydrophobicContact CD2-CG2 3.48Å; F42-V302 VanDerWaalsContact CD2-CG2 3.48Å; F42-V302 HydrophobicContact CE2-CG2 3.8Å; A45-V302 HydrophobicContact CB-CB 3.89Å; A45-V302 HydrophobicContact CB-CG1 4.03Å; A45-V302 HydrophobicContact CB-CG2 4Å; I46-V302 HydrophobicContact CG1-CG1 3.9Å; F92-V302 HydrophobicContact CE1-CG2 4.25Å; F92-V302 HydrophobicContact CZ-CG2 4.42Å; M298-V302 PolarHBondContact O-N 2.97Å; F299-V302 PolarHBondContact O-N 2.8Å; D300-V302 VanDerWaalsContact C-N 3.33Å; D300-V302 PolarHBondContact O-N 3.12Å; V302-F305 WeakPolarHBondContact O-CB 3.26Å; V302-F305 PolarHBondContact O-N 2.9Å; V302-A306 WeakPolarHBondContact O-CB 3.5Å; V302-A306 PolarHBondContact O-N 3.4Å
303	Y	92.5	Very high	89.3	Confident	8 Å²	8	15.7 Å²	15.7	3%	0.031	8%	0.079	C	C	.	.	H	α-helix	trans	-70.8	-37.8	177.4	-86.7	-93.6	0	0	0	112.3	A45 R48 L49 L55 F299 D300 F305 A306 I307 W346	A45-Y303 HydrophobicContact CB-CE2 4.49Å; R48-Y303 WeakPolarHBondContact CD-OH 3.34Å; L49-Y303 HydrophobicContact CD1-CE1 4.44Å; L55-Y303 HydrophobicContact CD1-CD1 4.42Å; L55-Y303 HydrophobicContact CD1-CE1 3.95Å; F299-Y303 HydrophobicContact CD1-CD2 4.09Å; F299-Y303 HydrophobicContact CD1-CE2 4.28Å; F299-Y303 AromaticContact CE1-CD2 3.63Å; F299-Y303 HydrophobicContact CE1-CD2 3.63Å; F299-Y303 AromaticContact CE1-CE2 3.49Å; F299-Y303 HydrophobicContact CE1-CE2 3.49Å; F299-Y303 VanDerWaalsContact CE1-CE2 3.49Å; F299-Y303 AromaticContact CE2-CE2 3.85Å; F299-Y303 HydrophobicContact CE2-CE2 3.85Å; F299-Y303 AromaticContact CZ-CD2 3.88Å; F299-Y303 HydrophobicContact CZ-CD2 3.88Å; F299-Y303 AromaticContact CZ-CE2 3.23Å; F299-Y303 HydrophobicContact CZ-CE2 3.23Å; F299-Y303 AromaticContact CZ-CZ 3.97Å; F299-Y303 PolarHBondContact O-N 3.19Å; D300-Y303 PolarHBondContact O-N 3.14Å; Y303-F305 VanDerWaalsContact C-N 3.28Å; Y303-F305 PolarHBondContact O-N 3.27Å; Y303-A306 PolarHBondContact O-N 2.95Å; Y303-I307 WeakPolarHBondContact O-CB 3.23Å; Y303-I307 WeakPolarHBondContact O-CD1 3.36Å; Y303-I307 VanDerWaalsContact O-CG1 3.25Å; Y303-I307 WeakPolarHBondContact O-CG1 3.47Å; Y303-I307 PolarHBondContact O-N 3.06Å; Y303-W346 HydrophobicContact CD1-CZ2 4.19Å
304	V	92.9	Very high	88.7	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-57.9	-45.2	171.5	168.7	0	0	0	0	110.3	D300 S301 G308 L341 V344 I353 F355	D300-V304 WeakPolarHBondContact O-CG2 3.3Å; D300-V304 PolarHBondContact O-N 3.22Å; S301-V304 PolarHBondContact O-N 3.15Å; V304-G308 PolarHBondContact O-N 3.36Å; V304-L341 HydrophobicContact CG1-CD2 4.42Å; V304-V344 HydrophobicContact CG1-CB 4.34Å; V304-V344 HydrophobicContact CG1-CG1 4.29Å; V304-V344 HydrophobicContact CG1-CG2 4.39Å; V304-V344 HydrophobicContact CG2-CG1 4.36Å; V304-I353 HydrophobicContact CG2-CD1 4.27Å; V304-I353 HydrophobicContact CG2-CG2 4.29Å; V304-F355 HydrophobicContact CG1-CE2 3.73Å; V304-F355 HydrophobicContact CG1-CZ 4.08Å; V304-F355 HydrophobicContact CG2-CE2 4.19Å; V304-F355 HydrophobicContact CG2-CZ 4.2Å
305	F	92.6	Very high	87.9	Confident	1 Å²	1	22.7 Å²	22.7	0%	0.004	12%	0.118	C	C	.	.	H	α-helix	trans	-60	-48.7	174.7	177.5	-102.5	0	0	0	112.6	V23 I25 A90 F92 I115 S301 V302 Y303 I307 G308 L309 L337 L341	V23-F305 HydrophobicContact CG1-CE1 3.95Å; V23-F305 HydrophobicContact CG1-CZ 3.97Å; I25-F305 HydrophobicContact CG2-CD1 4.17Å; I25-F305 HydrophobicContact CG2-CE1 3.49Å; I25-F305 VanDerWaalsContact CG2-CE1 3.49Å; I25-F305 HydrophobicContact CG2-CE2 4.38Å; I25-F305 HydrophobicContact CG2-CZ 3.61Å; A90-F305 HydrophobicContact CB-CD2 3.75Å; A90-F305 HydrophobicContact CB-CE2 3.38Å; A90-F305 HydrophobicContact CB-CZ 4.11Å; F92-F305 HydrophobicContact CZ-CB 3.84Å; F92-F305 HydrophobicContact CZ-CG 4.13Å; I115-F305 HydrophobicContact CD1-CB 3.71Å; I115-F305 HydrophobicContact CD1-CD2 3.96Å; I115-F305 HydrophobicContact CD1-CG 4.26Å; S301-F305 PolarHBondContact O-N 2.9Å; V302-F305 WeakPolarHBondContact O-CB 3.26Å; V302-F305 PolarHBondContact O-N 2.9Å; Y303-F305 VanDerWaalsContact C-N 3.28Å; Y303-F305 PolarHBondContact O-N 3.27Å; F305-I307 PolarHBondContact O-N 2.94Å; F305-G308 PolarHBondContact O-N 3.37Å; F305-L309 HydrophobicContact CE1-CD2 4.14Å; F305-L309 HydrophobicContact CZ-CD2 4.45Å; F305-L309 VanDerWaalsContact O-CB 3.31Å; F305-L309 WeakPolarHBondContact O-CB 3.25Å; F305-L309 PolarHBondContact O-N 3.25Å; F305-L337 HydrophobicContact CE2-CD2 4.18Å; F305-L341 HydrophobicContact CD2-CD2 4.39Å
306	A	91.5	Very high	87.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.8	-38.3	-177.8	0	0	0	0	0	113.2	L49 L56 V302 Y303 L309 Q310	L49-A306 HydrophobicContact CD1-CB 3.46Å; L49-A306 VanDerWaalsContact CD1-CB 3.46Å; L49-A306 HydrophobicContact CD2-CB 3.93Å; L49-A306 HydrophobicContact CG-CB 4.33Å; L56-A306 HydrophobicContact CD1-CB 4.32Å; V302-A306 WeakPolarHBondContact O-CB 3.5Å; V302-A306 PolarHBondContact O-N 3.4Å; Y303-A306 PolarHBondContact O-N 2.95Å; A306-L309 PolarHBondContact O-N 3.21Å; A306-Q310 WeakPolarHBondContact O-CB 3.32Å; A306-Q310 PolarHBondContact O-N 3.17Å
307	I	91.4	Very high	86	Confident	22 Å²	22	33 Å²	33	11%	0.113	18%	0.177	C	C	.	.	H	α-helix	trans	-70.8	-42.5	177.3	-65.1	164.2	0	0	0	110.6	L55 Y303 F305 L309 Q310 T311 V344 W346	L55-I307 HydrophobicContact CD2-CD1 4.49Å; L55-I307 HydrophobicContact CD2-CG1 3.64Å; Y303-I307 WeakPolarHBondContact O-CB 3.23Å; Y303-I307 WeakPolarHBondContact O-CD1 3.36Å; Y303-I307 VanDerWaalsContact O-CG1 3.25Å; Y303-I307 WeakPolarHBondContact O-CG1 3.47Å; Y303-I307 PolarHBondContact O-N 3.06Å; F305-I307 PolarHBondContact O-N 2.94Å; I307-L309 VanDerWaalsContact C-N 3.29Å; I307-L309 PolarHBondContact O-N 3.36Å; I307-Q310 PolarHBondContact O-N 3.34Å; I307-T311 WeakPolarHBondContact O-CG2 3.3Å; I307-T311 PolarHBondContact O-N 3.21Å; I307-T311 PolarHBondContact O-OG1 3.09Å; I307-V344 HydrophobicContact CB-CG1 4.23Å; I307-V344 HydrophobicContact CB-CG2 4.48Å; I307-V344 HydrophobicContact CG2-CG1 4.03Å; I307-V344 HydrophobicContact CG2-CG2 4.27Å; I307-W346 HydrophobicContact CD1-CB 3.84Å; I307-W346 HydrophobicContact CD1-CD2 3.51Å; I307-W346 HydrophobicContact CD1-CE3 3.49Å; I307-W346 VanDerWaalsContact CD1-CE3 3.49Å; I307-W346 HydrophobicContact CD1-CG 3.66Å; I307-W346 HydrophobicContact CD1-CZ3 4.24Å
308	G	89.9	Confident	85	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60	-40.8	172.8	0	0	0	0	0	112.2	V304 F305 T311 L312	V304-G308 PolarHBondContact O-N 3.36Å; F305-G308 PolarHBondContact O-N 3.37Å; G308-T311 PolarHBondContact O-OG1 3.48Å; G308-L312 WeakPolarHBondContact O-CB 3.17Å; G308-L312 PolarHBondContact O-N 3.21Å; G308-L312 VanDerWaalsContact O-N 3.09Å
309	L	89.1	Confident	84	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.7	-46	175.4	179	64.3	0	0	0	112.1	V23 L56 T59 F305 A306 I307 T311 L312 E313 L318	V23-L309 HydrophobicContact CB-CD2 4.43Å; V23-L309 HydrophobicContact CG1-CD2 4.05Å; V23-L309 HydrophobicContact CG2-CD2 4.04Å; L56-L309 HydrophobicContact CD1-CD2 4.04Å; L56-L309 HydrophobicContact CD2-CD2 4.35Å; L56-L309 HydrophobicContact CD2-CG 4.45Å; T59-L309 HydrophobicContact CG2-CD2 4.39Å; F305-L309 HydrophobicContact CE1-CD2 4.14Å; F305-L309 HydrophobicContact CZ-CD2 4.45Å; F305-L309 VanDerWaalsContact O-CB 3.31Å; F305-L309 WeakPolarHBondContact O-CB 3.25Å; F305-L309 PolarHBondContact O-N 3.25Å; A306-L309 PolarHBondContact O-N 3.21Å; I307-L309 VanDerWaalsContact C-N 3.29Å; I307-L309 PolarHBondContact O-N 3.36Å; L309-T311 VanDerWaalsContact C-N 3.29Å; L309-T311 PolarHBondContact O-N 3.12Å; L309-L312 PolarHBondContact O-N 2.91Å; L309-L312 VanDerWaalsContact O-N 3.13Å; L309-E313 HydrophobicContact CD1-CG 4.35Å; L309-E313 HydrophobicContact CG-CG 4.5Å; L309-E313 WeakPolarHBondContact O-CG 3.49Å; L309-E313 PolarHBondContact O-N 3.32Å; L309-L318 HydrophobicContact CD1-CD1 3.28Å
310	Q	88.7	Confident	82.7	Confident	57 Å²	57	44.2 Å²	44.2	27%	0.266	24%	0.241	S	C	.	.	H	α-helix	trans	-58	-41.8	177.9	-175.9	-173.6	25.1	0	0	111.8	L55 L56 A306 I307	L55-Q310 VanDerWaalsContact O-CD 3.23Å; L55-Q310 WeakPolarHBondContact O-CG 3.45Å; L55-Q310 PolarHBondContact O-NE2 3.14Å; L56-Q310 HydrophobicContact CD2-CB 4.04Å; A306-Q310 WeakPolarHBondContact O-CB 3.32Å; A306-Q310 PolarHBondContact O-N 3.17Å; I307-Q310 PolarHBondContact O-N 3.34Å
311	T	86.1	Confident	81.5	Confident	48 Å²	48	45.4 Å²	45.4	29%	0.294	25%	0.247	S	C	.	.	H	α-helix	trans	-70.9	-32.2	177.6	53.5	0	0	0	0	112.6	I307 G308 L309	I307-T311 WeakPolarHBondContact O-CG2 3.3Å; I307-T311 PolarHBondContact O-N 3.21Å; I307-T311 PolarHBondContact O-OG1 3.09Å; G308-T311 PolarHBondContact O-OG1 3.48Å; L309-T311 VanDerWaalsContact C-N 3.29Å; L309-T311 PolarHBondContact O-N 3.12Å
312	L	85.3	Confident	80.5	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-70.7	-41.9	174.2	-176.5	152.7	0	0	0	112.2	G308 L309 Q314 S315 H316 L318 L337 Y340	G308-L312 WeakPolarHBondContact O-CB 3.17Å; G308-L312 PolarHBondContact O-N 3.21Å; G308-L312 VanDerWaalsContact O-N 3.09Å; L309-L312 PolarHBondContact O-N 2.91Å; L309-L312 VanDerWaalsContact O-N 3.13Å; L312-Q314 PolarHBondContact O-N 2.84Å; L312-Q314 VanDerWaalsContact O-N 3.11Å; L312-S315 PolarHBondContact O-N 3.02Å; L312-S315 PolarHBondContact O-OG 2.99Å; L312-S315 VanDerWaalsContact O-OG 3.11Å; L312-H316 HydrophobicContact CD2-CB 4.28Å; L312-H316 WeakPolarHBondContact CD2-O 3.47Å; L312-H316 PolarHBondContact O-N 3.07Å; L312-L318 HydrophobicContact CD1-CD2 4.21Å; L312-L318 HydrophobicContact CD2-CD1 4.03Å; L312-L318 HydrophobicContact CD2-CD2 3.78Å; L312-L318 HydrophobicContact CD2-CG 3.61Å; L312-L337 HydrophobicContact CD1-CB 3.84Å; L312-L337 HydrophobicContact CD1-CD1 4.01Å; L312-Y340 HydrophobicContact CB-CD2 3.85Å; L312-Y340 HydrophobicContact CB-CE2 4.28Å; L312-Y340 HydrophobicContact CB-CG 4.26Å; L312-Y340 HydrophobicContact CD1-CD2 3.99Å; L312-Y340 HydrophobicContact CD1-CE2 4.49Å; L312-Y340 HydrophobicContact CG-CD2 4.08Å; L312-Y340 HydrophobicContact CG-CE2 4.29Å
313	E	77.5	Confident	79.9	Confident	70 Å²	70	54 Å²	54	33%	0.327	29%	0.292	S	S	.	.	H	α-helix	trans	-60.5	-22.8	-179.9	-77.2	-177.9	172	0	0	113.1	T59 L309 S315	T59-E313 WeakPolarHBondContact CB-OE1 3.23Å; T59-E313 WeakPolarHBondContact CG2-OE1 3.39Å; T59-E313 VanDerWaalsContact OG1-CD 3.27Å; T59-E313 PolarHBondContact OG1-OE1 2.8Å; T59-E313 PolarHBondContact OG1-OE2 3.08Å; L309-E313 HydrophobicContact CD1-CG 4.35Å; L309-E313 HydrophobicContact CG-CG 4.5Å; L309-E313 WeakPolarHBondContact O-CG 3.49Å; L309-E313 PolarHBondContact O-N 3.32Å; E313-S315 VanDerWaalsContact C-N 3.3Å; E313-S315 PolarHBondContact O-N 3.33Å
314	Q	75.8	Confident	79.3	Confident	158 Å²	158	55 Å²	55	74%	0.738	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-21.7	173.8	-67	175.3	9	0	0	113.3	L312	L312-Q314 PolarHBondContact O-N 2.84Å; L312-Q314 VanDerWaalsContact O-N 3.11Å
315	S	68.6	Low	78.9	Confident	56 Å²	56	56.7 Å²	56.7	39%	0.392	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-32.9	-174.5	64.2	0	0	0	0	114.3	L312 E313 Y340	L312-S315 PolarHBondContact O-N 3.02Å; L312-S315 PolarHBondContact O-OG 2.99Å; L312-S315 VanDerWaalsContact O-OG 3.11Å; E313-S315 VanDerWaalsContact C-N 3.3Å; E313-S315 PolarHBondContact O-N 3.33Å; S315-Y340 PolarHBondContact OG-OH 3.05Å
316	H	69.5	Low	78.3	Confident	108 Å²	108	63.9 Å²	63.9	50%	0.5	35%	0.345	S	S	.	.			trans	-142.7	146	-174.2	-68.7	-66.9	0	0	0	113.4	L312	L312-H316 HydrophobicContact CD2-CB 4.28Å; L312-H316 WeakPolarHBondContact CD2-O 3.47Å; L312-H316 PolarHBondContact O-N 3.07Å
317	S	66.6	Low	77.6	Confident	111 Å²	111	69.5 Å²	69.5	78%	0.776	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-90.4	124.3	172.2	65.1	0	0	0	0	111
318	L	69.4	Low	76.6	Confident	45 Å²	45	76.8 Å²	76.8	24%	0.236	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-74.2	127.6	172.2	-65.7	168.1	0	0	0	111.2	L309 L312 W331	L309-L318 HydrophobicContact CD1-CD1 3.28Å; L312-L318 HydrophobicContact CD1-CD2 4.21Å; L312-L318 HydrophobicContact CD2-CD1 4.03Å; L312-L318 HydrophobicContact CD2-CD2 3.78Å; L312-L318 HydrophobicContact CD2-CG 3.61Å; L318-W331 HydrophobicContact CD2-CH2 3.93Å; L318-W331 HydrophobicContact CD2-CZ2 3.75Å
319	T	68.9	Low	76.2	Confident	93 Å²	93	81.4 Å²	81.4	57%	0.571	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-87.4	156.6	173.5	52	0	0	0	0	111.4	L321	T319-L321 PolarHBondContact O-N 3.41Å
320	L	64.1	Low	75.7	Confident	143 Å²	143	84.3 Å²	84.3	75%	0.749	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-67	129.9	174.1	-74.5	168	0	0	0	110.5
321	L	67.3	Low	75.5	Confident	25 Å²	25	82.1 Å²	82.1	13%	0.131	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-73.2	128.4	178	-79.3	152.1	0	0	0	111.6	V88 Q89 T319 I323 W331	V88-L321 WeakPolarHBondContact O-CD1 2.94Å; Q89-L321 HydrophobicContact CB-CD1 4.2Å; Q89-L321 HydrophobicContact CG-CD1 3.5Å; T319-L321 PolarHBondContact O-N 3.41Å; L321-I323 HydrophobicContact CD2-CD1 3.46Å; L321-I323 VanDerWaalsContact CD2-CD1 3.46Å; L321-I323 HydrophobicContact CD2-CG1 4.03Å; L321-W331 HydrophobicContact CD1-CD2 4.45Å; L321-W331 HydrophobicContact CD1-CZ2 4.39Å; L321-W331 HydrophobicContact CD2-CB 3.88Å; L321-W331 HydrophobicContact CD2-CD2 3.64Å; L321-W331 HydrophobicContact CD2-CE3 4.39Å; L321-W331 HydrophobicContact CD2-CG 3.35Å; L321-W331 HydrophobicContact CG-CD2 4.3Å; L321-W331 HydrophobicContact CG-CG 4.39Å; L321-W331 HydrophobicContact CG-CZ2 4.49Å
322	N	70.8	Confident	75.1	Confident	163 Å²	163	87.1 Å²	87.1	87%	0.872	46%	0.464	S	S	*	.			trans	-129.6	74.1	165.6	-171.8	24.2	0	0	0	109
323	I	79.3	Confident	74.7	Confident	25 Å²	25	87.8 Å²	87.8	13%	0.128	47%	0.472	C	S	.	.			trans	-122.9	145.2	-176.1	-56	-179.7	0	0	0	108.6	L110 L321 N329 W331	L110-I323 HydrophobicContact CD2-CG2 4.03Å; L321-I323 HydrophobicContact CD2-CD1 3.46Å; L321-I323 VanDerWaalsContact CD2-CD1 3.46Å; L321-I323 HydrophobicContact CD2-CG1 4.03Å; I323-N329 WeakPolarHBondContact CG2-O 3.41Å; I323-W331 HydrophobicContact CD1-CB 3.58Å; I323-W331 HydrophobicContact CD1-CG 4.24Å
324	S	81.1	Confident	75	Confident	28 Å²	28	84.5 Å²	84.5	20%	0.196	46%	0.456	C	S	.	.			trans	-119.1	145.6	175.3	-179	0	0	0	0	109.4	E326 E327	S324-E326 PolarHBondContact O-N 3.46Å; S324-E326 PolarHBondContact OG-N 3.32Å; S324-E327 PolarHBondContact O-N 2.87Å
325	C	83.8	Confident	75.4	Confident	36 Å²	36	81.7 Å²	81.7	24%	0.243	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-14.9	170.8	-75.1	0	0	0	0	114.2	C81	C81-C325 WeakPolarHBondContact CA-SG 3.49Å; C81-C325 HydrophobicContact CB-CB 3.76Å; C81-C325 WeakPolarHBondContact CB-SG 3.44Å; C81-C325 WeakPolarHBondContact SG-CB 3.29Å; C81-C325 CovalentContact SG-SG 2.04Å; C81-C325 PolarHBondContact SG-SG 3.11Å
326	E	80.7	Confident	76.2	Confident	153 Å²	153	81 Å²	81	72%	0.715	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-21.3	-179.8	-67.5	169.1	-156.6	0	0	112.2	R85 S324	R85-E326 IonicContact NH2-OE1 2.74Å; R85-E326 PolarHBondContact NH2-OE1 3.32Å; S324-E326 PolarHBondContact O-N 3.46Å; S324-E326 PolarHBondContact OG-N 3.32Å
327	E	75.8	Confident	77.1	Confident	118 Å²	118	75.9 Å²	75.9	55%	0.551	42%	0.417	S	S	*	.	S	Bend	trans	-113.7	115.7	177.3	-63	-179.7	-179.5	0	0	107.3	S324 N329	S324-E327 PolarHBondContact O-N 2.87Å; E327-N329 PolarHBondContact O-N 3.43Å; E327-N329 PolarHBondContact OE2-ND2 3.24Å
328	E	71.2	Confident	78.2	Confident	175 Å²	175	70.8 Å²	70.8	82%	0.818	38%	0.381	S	S	*	.			trans	-73.2	49.6	179.9	-66.1	179.2	175.5	0	0	112.2
329	N	80	Confident	79.1	Confident	97 Å²	97	73.1 Å²	73.1	52%	0.519	39%	0.394	S	S	.	.			trans	-90.3	118.2	175	-66	-32	0	0	0	108.5	I323 E327	I323-N329 WeakPolarHBondContact CG2-O 3.41Å; E327-N329 PolarHBondContact O-N 3.43Å; E327-N329 PolarHBondContact OE2-ND2 3.24Å
330	S	80.4	Confident	80.1	Confident	61 Å²	61	72 Å²	72	43%	0.427	38%	0.38	S	S	.	.			trans	-76.9	157.3	179.4	70.1	0	0	0	0	112.7	D111	D111-S330 WeakPolarHBondContact OD2-CB 3.26Å; D111-S330 PolarHBondContact OD2-OG 3.08Å
331	W	83.8	Confident	81.4	Confident	11 Å²	11	65.2 Å²	65.2	4%	0.042	34%	0.344	C	S	.	.			trans	-89.7	115.3	177.8	-179.7	39.2	0	0	0	112.5	Q89 L110 L318 L321 I323 G333 G334 L337	Q89-W331 HydrophobicContact CB-CH2 4.03Å; Q89-W331 HydrophobicContact CG-CH2 4.11Å; Q89-W331 HydrophobicContact CG-CZ2 4.29Å; L110-W331 PolarHBondContact O-N 2.88Å; L110-W331 VanDerWaalsContact O-N 3.13Å; L318-W331 HydrophobicContact CD2-CH2 3.93Å; L318-W331 HydrophobicContact CD2-CZ2 3.75Å; L321-W331 HydrophobicContact CD1-CD2 4.45Å; L321-W331 HydrophobicContact CD1-CZ2 4.39Å; L321-W331 HydrophobicContact CD2-CB 3.88Å; L321-W331 HydrophobicContact CD2-CD2 3.64Å; L321-W331 HydrophobicContact CD2-CE3 4.39Å; L321-W331 HydrophobicContact CD2-CG 3.35Å; L321-W331 HydrophobicContact CG-CD2 4.3Å; L321-W331 HydrophobicContact CG-CG 4.39Å; L321-W331 HydrophobicContact CG-CZ2 4.49Å; I323-W331 HydrophobicContact CD1-CB 3.58Å; I323-W331 HydrophobicContact CD1-CG 4.24Å; W331-G333 PolarHBondContact O-N 3.37Å; W331-G334 VanDerWaalsContact CE3-N 3.34Å; W331-G334 PolarHBondContact O-N 2.85Å; W331-L337 HydrophobicContact CH2-CD2 3.95Å; W331-L337 HydrophobicContact CZ3-CD2 4Å
332	D	77.2	Confident	82.5	Confident	153 Å²	153	65.8 Å²	65.8	82%	0.818	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-31.8	178.4	-63.8	-28.5	0	0	0	114.3	G334	D332-G334 VanDerWaalsContact C-N 3.34Å
333	G	77.8	Confident	83.5	Confident	15 Å²	15	61.4 Å²	61.4	16%	0.155	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-12.3	-179.9	0	0	0	0	0	114.8	W331 L337	W331-G333 PolarHBondContact O-N 3.37Å; G333-L337 PolarHBondContact O-N 2.79Å; G333-L337 VanDerWaalsContact O-N 3.15Å
334	G	83	Confident	84.1	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-65	-49.7	-173.7	0	0	0	0	0	114	D111 W331 D332 S336 L337 I338	D111-G334 WeakPolarHBondContact O-CA 3.22Å; W331-G334 VanDerWaalsContact CE3-N 3.34Å; W331-G334 PolarHBondContact O-N 2.85Å; D332-G334 VanDerWaalsContact C-N 3.34Å; G334-S336 VanDerWaalsContact C-N 3.32Å; G334-S336 PolarHBondContact O-N 3.48Å; G334-L337 PolarHBondContact O-N 2.85Å; G334-I338 PolarHBondContact O-N 2.85Å
335	L	85.1	Confident	84.6	Confident	99 Å²	99	65.7 Å²	65.7	52%	0.518	35%	0.35	S	S	.	.	H	α-helix	trans	-63.6	-37.4	-178.7	-173.2	67.9	0	0	0	112	F122 I338 N339	F122-L335 HydrophobicContact CE1-CD1 4.5Å; F122-L335 HydrophobicContact CZ-CD1 4.03Å; L335-I338 HydrophobicContact CD1-CG2 4.48Å; L335-I338 WeakPolarHBondContact O-CG2 3.24Å; L335-N339 VanDerWaalsContact O-CG 3.31Å; L335-N339 PolarHBondContact O-N 2.84Å; L335-N339 PolarHBondContact O-ND2 3.19Å
336	S	85.6	Confident	84.9	Confident	42 Å²	42	68.3 Å²	68.3	29%	0.294	36%	0.355	S	S	.	.	H	α-helix	trans	-64.1	-49.9	173.9	-62.6	0	0	0	0	110.4	G334 I338 N339 Y340	G334-S336 VanDerWaalsContact C-N 3.32Å; G334-S336 PolarHBondContact O-N 3.48Å; S336-I338 PolarHBondContact O-N 3.34Å; S336-N339 PolarHBondContact O-N 3.28Å; S336-Y340 WeakPolarHBondContact O-CD2 3.46Å; S336-Y340 PolarHBondContact O-N 2.84Å
337	L	87.4	Confident	85.4	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-62.4	-45.2	-176.7	-177.4	57.1	0	0	0	112.6	P113 F305 L312 W331 G333 G334 N339 Y340 L341	P113-L337 HydrophobicContact CG-CB 4.24Å; P113-L337 HydrophobicContact CG-CD2 3.95Å; P113-L337 HydrophobicContact CG-CG 4.03Å; F305-L337 HydrophobicContact CE2-CD2 4.18Å; L312-L337 HydrophobicContact CD1-CB 3.84Å; L312-L337 HydrophobicContact CD1-CD1 4.01Å; W331-L337 HydrophobicContact CH2-CD2 3.95Å; W331-L337 HydrophobicContact CZ3-CD2 4Å; G333-L337 PolarHBondContact O-N 2.79Å; G333-L337 VanDerWaalsContact O-N 3.15Å; G334-L337 PolarHBondContact O-N 2.85Å; L337-N339 VanDerWaalsContact C-N 3.31Å; L337-N339 PolarHBondContact O-N 3.4Å; L337-Y340 PolarHBondContact O-N 3.2Å; L337-L341 HydrophobicContact CD1-CD1 4.43Å; L337-L341 HydrophobicContact CD1-CG 4.33Å; L337-L341 HydrophobicContact CG-CD1 4.1Å; L337-L341 HydrophobicContact CG-CG 4.46Å; L337-L341 VanDerWaalsContact O-CG 3.26Å; L337-L341 WeakPolarHBondContact O-CG 3.45Å; L337-L341 PolarHBondContact O-N 2.9Å
338	I	89	Confident	86.1	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.021	33%	0.331	C	S	.	.	H	α-helix	trans	-63.7	-35.4	179.4	-167.3	68.7	0	0	0	112.7	P113 F122 I124 G334 L335 S336 L341 N342	P113-I338 HydrophobicContact CB-CD1 4.15Å; P113-I338 HydrophobicContact CG-CB 4.38Å; F122-I338 HydrophobicContact CD1-CB 4.35Å; F122-I338 HydrophobicContact CD1-CG2 4.08Å; F122-I338 HydrophobicContact CE1-CG2 4Å; I124-I338 HydrophobicContact CD1-CD1 3.7Å; I124-I338 HydrophobicContact CG1-CD1 3.67Å; G334-I338 PolarHBondContact O-N 2.85Å; L335-I338 HydrophobicContact CD1-CG2 4.48Å; L335-I338 WeakPolarHBondContact O-CG2 3.24Å; S336-I338 PolarHBondContact O-N 3.34Å; I338-L341 HydrophobicContact CD1-CD1 4.42Å; I338-L341 PolarHBondContact O-N 3.11Å; I338-N342 WeakPolarHBondContact O-CB 3.32Å; I338-N342 PolarHBondContact O-N 3.08Å; I338-N342 PolarHBondContact O-ND2 2.8Å
339	N	89.3	Confident	87	Confident	95 Å²	95	54.8 Å²	54.8	51%	0.508	29%	0.294	S	S	.	.	H	α-helix	trans	-65.9	-41.9	176.5	-77.2	-37.3	0	0	0	111.8	L335 S336 L337 N342 A343	L335-N339 VanDerWaalsContact O-CG 3.31Å; L335-N339 PolarHBondContact O-N 2.84Å; L335-N339 PolarHBondContact O-ND2 3.19Å; S336-N339 PolarHBondContact O-N 3.28Å; L337-N339 VanDerWaalsContact C-N 3.31Å; L337-N339 PolarHBondContact O-N 3.4Å; N339-N342 PolarHBondContact O-N 3.46Å; N339-A343 PolarHBondContact O-N 2.59Å
340	Y	90.1	Very high	87.5	Confident	70 Å²	70	50.2 Å²	50.2	28%	0.275	27%	0.27	S	S	.	.	H	α-helix	trans	-66.9	-38.1	173.5	-75.5	-71.8	0	0	0	112	L312 S315 S336 L337 N342 A343 V344	L312-Y340 HydrophobicContact CB-CD2 3.85Å; L312-Y340 HydrophobicContact CB-CE2 4.28Å; L312-Y340 HydrophobicContact CB-CG 4.26Å; L312-Y340 HydrophobicContact CD1-CD2 3.99Å; L312-Y340 HydrophobicContact CD1-CE2 4.49Å; L312-Y340 HydrophobicContact CG-CD2 4.08Å; L312-Y340 HydrophobicContact CG-CE2 4.29Å; S315-Y340 PolarHBondContact OG-OH 3.05Å; S336-Y340 WeakPolarHBondContact O-CD2 3.46Å; S336-Y340 PolarHBondContact O-N 2.84Å; L337-Y340 PolarHBondContact O-N 3.2Å; Y340-N342 PolarHBondContact O-N 3.21Å; Y340-A343 PolarHBondContact O-N 3.43Å; Y340-A343 VanDerWaalsContact O-N 3.16Å; Y340-V344 WeakPolarHBondContact O-CG2 3.47Å; Y340-V344 PolarHBondContact O-N 2.82Å
341	L	90.7	Very high	88.1	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.1	-40.8	174.5	-69	171	0	0	0	112.4	P113 I115 I124 V304 F305 L337 I338 A343 V344	P113-L341 HydrophobicContact CB-CD1 3.83Å; P113-L341 HydrophobicContact CG-CD1 4.33Å; I115-L341 HydrophobicContact CD1-CD1 4.34Å; I115-L341 HydrophobicContact CD1-CD2 4.47Å; I124-L341 HydrophobicContact CD1-CB 4.17Å; I124-L341 HydrophobicContact CG1-CB 3.99Å; V304-L341 HydrophobicContact CG1-CD2 4.42Å; F305-L341 HydrophobicContact CD2-CD2 4.39Å; L337-L341 HydrophobicContact CD1-CD1 4.43Å; L337-L341 HydrophobicContact CD1-CG 4.33Å; L337-L341 HydrophobicContact CG-CD1 4.1Å; L337-L341 HydrophobicContact CG-CG 4.46Å; L337-L341 VanDerWaalsContact O-CG 3.26Å; L337-L341 WeakPolarHBondContact O-CG 3.45Å; L337-L341 PolarHBondContact O-N 2.9Å; I338-L341 HydrophobicContact CD1-CD1 4.42Å; I338-L341 PolarHBondContact O-N 3.11Å; L341-A343 PolarHBondContact O-N 3.38Å; L341-V344 WeakPolarHBondContact O-CB 3.4Å; L341-V344 WeakPolarHBondContact O-CG2 3.39Å; L341-V344 PolarHBondContact O-N 2.93Å
342	N	90.6	Very high	88.5	Confident	36 Å²	36	49.5 Å²	49.5	19%	0.193	27%	0.267	C	S	.	.	H	α-helix	trans	-65.1	-25.9	175.2	-87.8	-45.3	0	0	0	113.2	I124 I338 N339 Y340 G358	I124-N342 HydrophobicContact CD1-CB 4.47Å; I124-N342 WeakPolarHBondContact CD1-OD1 3.33Å; I338-N342 WeakPolarHBondContact O-CB 3.32Å; I338-N342 PolarHBondContact O-N 3.08Å; I338-N342 PolarHBondContact O-ND2 2.8Å; N339-N342 PolarHBondContact O-N 3.46Å; Y340-N342 PolarHBondContact O-N 3.21Å; N342-G358 WeakPolarHBondContact OD1-CA 3.4Å; N342-G358 PolarHBondContact OD1-N 3.41Å
343	A	91.3	Very high	89.2	Confident	72 Å²	72	42.4 Å²	42.4	60%	0.595	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-0.3	178.7	0	0	0	0	0	113.8	N339 Y340 L341 E345	N339-A343 PolarHBondContact O-N 2.59Å; Y340-A343 PolarHBondContact O-N 3.43Å; Y340-A343 VanDerWaalsContact O-N 3.16Å; L341-A343 PolarHBondContact O-N 3.38Å; A343-E345 PolarHBondContact O-N 3.36Å
344	V	92.3	Very high	90	Very high	5 Å²	5	45 Å²	45	3%	0.03	24%	0.238	C	C	.	.			trans	-66.4	127.5	-177.8	173.5	0	0	0	0	111.2	V304 I307 Y340 L341 W346	V304-V344 HydrophobicContact CG1-CB 4.34Å; V304-V344 HydrophobicContact CG1-CG1 4.29Å; V304-V344 HydrophobicContact CG1-CG2 4.39Å; V304-V344 HydrophobicContact CG2-CG1 4.36Å; I307-V344 HydrophobicContact CB-CG1 4.23Å; I307-V344 HydrophobicContact CB-CG2 4.48Å; I307-V344 HydrophobicContact CG2-CG1 4.03Å; I307-V344 HydrophobicContact CG2-CG2 4.27Å; Y340-V344 WeakPolarHBondContact O-CG2 3.47Å; Y340-V344 PolarHBondContact O-N 2.82Å; L341-V344 WeakPolarHBondContact O-CB 3.4Å; L341-V344 WeakPolarHBondContact O-CG2 3.39Å; L341-V344 PolarHBondContact O-N 2.93Å; V344-W346 HydrophobicContact CG1-CB 4.17Å
345	E	92.6	Very high	90.4	Very high	137 Å²	137	45.8 Å²	45.8	64%	0.64	24%	0.241	S	C	*	.			trans	-116.3	117.3	167.9	-66.7	-174	174.5	0	0	109.3	A343 Q354	A343-E345 PolarHBondContact O-N 3.36Å; E345-Q354 HydrophobicContact CG-CG 4.17Å; E345-Q354 PolarHBondContact OE1-NE2 2.73Å
346	W	89.8	Confident	90.6	Very high	91 Å²	91	47.5 Å²	47.5	35%	0.345	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	150.1	-175.7	176.7	-117.4	0	0	0	111.6	Y303 I307 V344 P352 I353	Y303-W346 HydrophobicContact CD1-CZ2 4.19Å; I307-W346 HydrophobicContact CD1-CB 3.84Å; I307-W346 HydrophobicContact CD1-CD2 3.51Å; I307-W346 HydrophobicContact CD1-CE3 3.49Å; I307-W346 VanDerWaalsContact CD1-CE3 3.49Å; I307-W346 HydrophobicContact CD1-CG 3.66Å; I307-W346 HydrophobicContact CD1-CZ3 4.24Å; V344-W346 HydrophobicContact CG1-CB 4.17Å; W346-P352 CarbonylContact O-C 3.6Å; W346-I353 PolarHBondContact N-O 2.96Å; W346-I353 PolarHBondContact O-N 3.4Å
347	K	91.5	Very high	90.7	Very high	139 Å²	139	52 Å²	52	60%	0.604	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	98.1	168.2	-172.7	-175	173.4	-168.5	0	109.1
348	G	89.8	Confident	90.6	Very high	15 Å²	15	52 Å²	52	16%	0.155	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-167.7	179.2	0	0	0	0	0	113.8	D300 T350 G351	D300-G348 VanDerWaalsContact OD1-CA 3.23Å; D300-G348 WeakPolarHBondContact OD1-CA 3.24Å; G348-T350 PolarHBondContact O-N 3.12Å; G348-G351 PolarHBondContact N-O 3.08Å; G348-G351 PolarHBondContact O-N 3.41Å
349	L	90.1	Very high	90.6	Very high	9 Å²	9	55.2 Å²	55.2	5%	0.047	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-31.8	173.2	-65.5	-179.7	0	0	0	112	V261 I264 L291 A296 F299 D300 G351	V261-L349 HydrophobicContact CB-CD2 4.36Å; V261-L349 HydrophobicContact CG1-CD2 4.48Å; V261-L349 HydrophobicContact CG2-CD2 3.91Å; I264-L349 HydrophobicContact CB-CD2 4.21Å; I264-L349 HydrophobicContact CD1-CD2 3.52Å; I264-L349 HydrophobicContact CG1-CD2 4.43Å; I264-L349 HydrophobicContact CG2-CD1 4.2Å; I264-L349 HydrophobicContact CG2-CD2 4.18Å; L291-L349 HydrophobicContact CD2-CD1 3.87Å; A296-L349 HydrophobicContact CB-CB 4.18Å; A296-L349 HydrophobicContact CB-CD1 4.37Å; F299-L349 HydrophobicContact CB-CD1 3.85Å; F299-L349 HydrophobicContact CD1-CD1 3.41Å; F299-L349 VanDerWaalsContact CD1-CD1 3.41Å; F299-L349 HydrophobicContact CD1-CG 3.71Å; F299-L349 HydrophobicContact CD2-CD1 4.41Å; F299-L349 HydrophobicContact CE1-CD1 4.04Å; F299-L349 HydrophobicContact CE1-CG 4.06Å; F299-L349 HydrophobicContact CG-CD1 3.63Å; F299-L349 HydrophobicContact CG-CG 4.43Å; D300-L349 PolarHBondContact OD1-N 2.95Å; D300-L349 PolarHBondContact OD2-N 3.16Å; L349-G351 VanDerWaalsContact C-N 3.28Å; L349-G351 PolarHBondContact O-N 3.15Å
350	T	91.3	Very high	90.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	15.9	178.3	64.1	0	0	0	0	113.4	L253 V254 A296 L297 D300 G348 R360	L253-T350 HydrophobicContact CD2-CG2 3.94Å; L253-T350 HydrophobicContact CG-CG2 4.09Å; V254-T350 HydrophobicContact CG2-CG2 4.15Å; A296-T350 HydrophobicContact CB-CG2 3.9Å; L297-T350 HydrophobicContact CD2-CG2 3.86Å; L297-T350 HydrophobicContact CG-CG2 4.05Å; D300-T350 WeakPolarHBondContact OD2-CB 3.22Å; D300-T350 WeakPolarHBondContact OD2-CG2 3.31Å; D300-T350 PolarHBondContact OD2-N 3.37Å; D300-T350 PolarHBondContact OD2-OG1 2.7Å; G348-T350 PolarHBondContact O-N 3.12Å; T350-R360 PolarHBondContact O-NH2 2.88Å; T350-R360 PolarHBondContact OG1-NH1 3.4Å; T350-R360 PolarHBondContact OG1-NH2 3.32Å
351	G	91.2	Very high	90.8	Very high	11 Å²	11	49.5 Å²	49.5	11%	0.113	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.3	-155.3	-179.7	0	0	0	0	0	113.7	G348 L349	G348-G351 PolarHBondContact N-O 3.08Å; G348-G351 PolarHBondContact O-N 3.41Å; L349-G351 VanDerWaalsContact C-N 3.28Å; L349-G351 PolarHBondContact O-N 3.15Å
352	P	92.8	Very high	90.8	Very high	46 Å²	46	52.1 Å²	52.1	30%	0.299	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	140.4	-178.7	29	-33.6	0	0	0	110.9	W346 R360 Q362	W346-P352 CarbonylContact O-C 3.6Å; P352-R360 PolarHBondContact O-NH2 3.07Å; P352-Q362 HydrophobicContact CB-CG 4.12Å; P352-Q362 HydrophobicContact CG-CG 4.22Å; P352-Q362 CarbonylContact O-C 3.51Å
353	I	93.1	Very high	90.9	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	124.5	-179.3	-51.4	-178.4	0	0	0	107.6	D300 V304 W346 F355	D300-I353 HydrophobicContact CB-CD1 3.81Å; V304-I353 HydrophobicContact CG2-CD1 4.27Å; V304-I353 HydrophobicContact CG2-CG2 4.29Å; W346-I353 PolarHBondContact N-O 2.96Å; W346-I353 PolarHBondContact O-N 3.4Å; I353-F355 HydrophobicContact CG2-CD2 4.49Å; I353-F355 HydrophobicContact CG2-CE1 4.05Å; I353-F355 HydrophobicContact CG2-CE2 3.64Å; I353-F355 HydrophobicContact CG2-CZ 3.37Å
354	Q	93	Very high	91	Very high	71 Å²	71	49 Å²	49	33%	0.332	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	140.3	172.2	-170	-179.7	28	0	0	108.1	E345 R360 V361 Q362	E345-Q354 HydrophobicContact CG-CG 4.17Å; E345-Q354 PolarHBondContact OE1-NE2 2.73Å; Q354-R360 WeakPolarHBondContact O-CA 3.43Å; Q354-V361 PolarHBondContact O-N 2.98Å; Q354-Q362 HydrophobicContact CB-CB 3.69Å
355	F	92.1	Very high	91.1	Very high	15 Å²	15	48.7 Å²	48.7	7%	0.066	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	153.6	-176.8	-54.7	-77.6	0	0	0	112.3	I124 N125 V126 V304 I353 Q359 R360	I124-F355 HydrophobicContact CG2-CD1 3.85Å; I124-F355 HydrophobicContact CG2-CD2 4.35Å; I124-F355 HydrophobicContact CG2-CE1 3.48Å; I124-F355 VanDerWaalsContact CG2-CE1 3.48Å; I124-F355 HydrophobicContact CG2-CE2 4.02Å; I124-F355 HydrophobicContact CG2-CG 4.28Å; I124-F355 HydrophobicContact CG2-CZ 3.57Å; N125-F355 WeakPolarHBondContact O-CE1 3.3Å; V126-F355 HydrophobicContact CG2-CZ 4.4Å; V304-F355 HydrophobicContact CG1-CE2 3.73Å; V304-F355 HydrophobicContact CG1-CZ 4.08Å; V304-F355 HydrophobicContact CG2-CE2 4.19Å; V304-F355 HydrophobicContact CG2-CZ 4.2Å; I353-F355 HydrophobicContact CG2-CD2 4.49Å; I353-F355 HydrophobicContact CG2-CE1 4.05Å; I353-F355 HydrophobicContact CG2-CE2 3.64Å; I353-F355 HydrophobicContact CG2-CZ 3.37Å; F355-Q359 CarbonylContact C-O 3.56Å; F355-Q359 VanDerWaalsContact CA-O 3.26Å; F355-Q359 WeakPolarHBondContact CA-O 3.34Å; F355-R360 HydrophobicContact CD1-CB 4.14Å; F355-R360 HydrophobicContact CE1-CB 4.04Å
356	K	88.9	Confident	91.1	Very high	135 Å²	135	42.3 Å²	42.3	59%	0.587	21%	0.208	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141	121.5	166	-174.5	-179.7	178.1	-179.5	0	107.3	G358 Q359 V361	K356-G358 VanDerWaalsContact C-N 3.28Å; K356-G358 PolarHBondContact O-N 3.4Å; K356-Q359 PolarHBondContact N-O 3.38Å; K356-Q359 PolarHBondContact O-N 3.09Å; K356-V361 HydrophobicContact CB-CG1 3.64Å; K356-V361 HydrophobicContact CB-CG2 4.07Å
357	D	87.3	Confident	91.2	Very high	136 Å²	136	38 Å²	38	73%	0.727	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	46.3	-178.6	-48.7	-40.9	0	0	0	112.3	Q359	D357-Q359 PolarHBondContact O-N 2.93Å; D357-Q359 VanDerWaalsContact O-N 3.16Å
358	G	86.3	Confident	91.2	Very high	2 Å²	2	31.3 Å²	31.3	2%	0.021	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	-5.1	-177.5	0	0	0	0	0	115.6	N125 N342 K356	N125-G358 WeakPolarHBondContact CB-O 3.44Å; N125-G358 PolarHBondContact N-O 3.15Å; N342-G358 WeakPolarHBondContact OD1-CA 3.4Å; N342-G358 PolarHBondContact OD1-N 3.41Å; K356-G358 VanDerWaalsContact C-N 3.28Å; K356-G358 PolarHBondContact O-N 3.4Å
359	Q	89.8	Confident	91.2	Very high	71 Å²	71	31.2 Å²	31.2	33%	0.332	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	136.5	179.4	-64.6	-167.4	14.2	0	0	113.1	A119 S129 F355 K356 D357 V361	A119-Q359 HydrophobicContact CB-CG 3.46Å; A119-Q359 VanDerWaalsContact CB-CG 3.46Å; S129-Q359 PolarHBondContact OG-OE1 2.78Å; S129-Q359 VanDerWaalsContact OG-OE1 3.13Å; F355-Q359 CarbonylContact C-O 3.56Å; F355-Q359 VanDerWaalsContact CA-O 3.26Å; F355-Q359 WeakPolarHBondContact CA-O 3.34Å; K356-Q359 PolarHBondContact N-O 3.38Å; K356-Q359 PolarHBondContact O-N 3.09Å; D357-Q359 PolarHBondContact O-N 2.93Å; D357-Q359 VanDerWaalsContact O-N 3.16Å; Q359-V361 PolarHBondContact O-N 2.95Å
360	R	90.8	Very high	91.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	111.8	171.6	-174.3	174.8	178.1	-178	-2.3	111.4	N125 V126 S129 T350 P352 Q354 F355 Q362 F363	N125-R360 WeakPolarHBondContact O-CB 3.44Å; N125-R360 PolarHBondContact O-N 3.02Å; V126-R360 WeakPolarHBondContact O-CD 3.36Å; V126-R360 PolarHBondContact O-NH1 2.95Å; S129-R360 PolarHBondContact N-O 3.5Å; T350-R360 PolarHBondContact O-NH2 2.88Å; T350-R360 PolarHBondContact OG1-NH1 3.4Å; T350-R360 PolarHBondContact OG1-NH2 3.32Å; P352-R360 PolarHBondContact O-NH2 3.07Å; Q354-R360 WeakPolarHBondContact O-CA 3.43Å; F355-R360 HydrophobicContact CD1-CB 4.14Å; F355-R360 HydrophobicContact CE1-CB 4.04Å; R360-Q362 WeakPolarHBondContact CG-O 3.19Å; R360-Q362 PolarHBondContact NE-O 3.29Å; R360-Q362 VanDerWaalsContact NE-O 3.13Å; R360-F363 HydrophobicContact CG-CD1 4.47Å
361	V	90.9	Very high	90.5	Very high	44 Å²	44	34.3 Å²	34.3	27%	0.267	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	-28.9	-179.9	-69.5	0	0	0	0	113.2	L132 Q354 K356 Q359 P383	L132-V361 WeakPolarHBondContact CD1-O 3.44Å; Q354-V361 PolarHBondContact O-N 2.98Å; K356-V361 HydrophobicContact CB-CG1 3.64Å; K356-V361 HydrophobicContact CB-CG2 4.07Å; Q359-V361 PolarHBondContact O-N 2.95Å; V361-P383 WeakPolarHBondContact O-CG 3.49Å
362	Q	92.2	Very high	89.4	Confident	55 Å²	55	36.4 Å²	36.4	26%	0.257	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126	178.5	-170.3	69.7	-45.6	0	0	110.5	P352 Q354 R360	P352-Q362 HydrophobicContact CB-CG 4.12Å; P352-Q362 HydrophobicContact CG-CG 4.22Å; P352-Q362 CarbonylContact O-C 3.51Å; Q354-Q362 HydrophobicContact CB-CB 3.69Å; R360-Q362 WeakPolarHBondContact CG-O 3.19Å; R360-Q362 PolarHBondContact NE-O 3.29Å; R360-Q362 VanDerWaalsContact NE-O 3.13Å
363	F	93.1	Very high	88.3	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.197	C	C	.	.			trans	-165.6	168.1	175	57.9	-86.4	0	0	0	110.2	P128 L132 V133 R360 L365 W381 P383	P128-F363 HydrophobicContact CB-CD1 3.91Å; P128-F363 HydrophobicContact CB-CD2 3.93Å; P128-F363 HydrophobicContact CB-CE1 3.82Å; P128-F363 HydrophobicContact CB-CE2 3.82Å; P128-F363 HydrophobicContact CB-CG 3.97Å; P128-F363 HydrophobicContact CB-CZ 3.77Å; P128-F363 HydrophobicContact CG-CD2 4.2Å; P128-F363 HydrophobicContact CG-CG 4.21Å; L132-F363 HydrophobicContact CB-CE1 3.86Å; L132-F363 HydrophobicContact CB-CZ 3.65Å; L132-F363 HydrophobicContact CD1-CE1 3.82Å; L132-F363 HydrophobicContact CD1-CZ 4.45Å; V133-F363 HydrophobicContact CG2-CE2 4.21Å; V133-F363 HydrophobicContact CG2-CZ 4.06Å; R360-F363 HydrophobicContact CG-CD1 4.47Å; F363-L365 HydrophobicContact CD2-CD1 4.46Å; F363-L365 HydrophobicContact CD2-CD2 4.16Å; F363-L365 HydrophobicContact CD2-CG 3.92Å; F363-L365 HydrophobicContact CE2-CD1 3.89Å; F363-L365 HydrophobicContact CE2-CD2 4.32Å; F363-L365 HydrophobicContact CE2-CG 3.86Å; F363-W381 HydrophobicContact CD2-CZ3 4.41Å; F363-W381 HydrophobicContact CE2-CE3 4.15Å; F363-W381 AromaticContact CE2-CZ3 3.52Å; F363-W381 HydrophobicContact CE2-CZ3 3.52Å; F363-W381 HydrophobicContact CZ-CH2 4.34Å; F363-W381 AromaticContact CZ-CZ3 3.7Å; F363-W381 HydrophobicContact CZ-CZ3 3.7Å; F363-P383 HydrophobicContact CD1-CG 4.25Å; F363-P383 HydrophobicContact CE1-CG 4.05Å; F363-P383 HydrophobicContact CZ-CG 4.31Å; F363-P383 WeakPolarHBondContact O-CD 3.49Å
364	K	92.7	Very high	87.7	Confident	42 Å²	42	44 Å²	44	18%	0.183	22%	0.216	C	C	.	.			trans	-124	135.6	177.2	-179.3	-171	63.8	137.5	0	109.1	D255 D366 E380 T382	D255-K364 IonicContact OD2-NZ 2.62Å; K364-D366 IonicContact NZ-OD1 3.41Å; K364-D366 PolarHBondContact NZ-OD1 2.83Å; K364-D366 VanDerWaalsContact NZ-OD1 3.11Å; K364-D366 IonicContact NZ-OD2 2.75Å; K364-E380 HydrophobicContact CD-CG 3.93Å; K364-E380 WeakPolarHBondContact CD-OE1 3.42Å; K364-E380 HydrophobicContact CG-CG 3.77Å; K364-E380 WeakPolarHBondContact CG-OE1 3.49Å; K364-T382 HydrophobicContact CG-CG2 4.34Å
365	L	93.6	Very high	87.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	125.7	170.6	-61.1	177.7	0	0	0	109.6	A136 F231 F251 L253 F363 E380 W381	A136-L365 HydrophobicContact CB-CD1 3.99Å; F231-L365 HydrophobicContact CD1-CD2 4.48Å; F231-L365 HydrophobicContact CE1-CD1 4.42Å; F231-L365 HydrophobicContact CE1-CD2 3.83Å; F231-L365 HydrophobicContact CZ-CD2 4Å; F251-L365 HydrophobicContact CB-CB 4.42Å; F251-L365 HydrophobicContact CD1-CB 3.76Å; F251-L365 HydrophobicContact CD1-CD1 4.36Å; F251-L365 HydrophobicContact CE1-CB 4.33Å; F251-L365 HydrophobicContact CG-CB 4.27Å; F251-L365 HydrophobicContact CG-CD1 4.23Å; L253-L365 HydrophobicContact CB-CD2 4.45Å; L253-L365 HydrophobicContact CD1-CD2 3.8Å; F363-L365 HydrophobicContact CD2-CD1 4.46Å; F363-L365 HydrophobicContact CD2-CD2 4.16Å; F363-L365 HydrophobicContact CD2-CG 3.92Å; F363-L365 HydrophobicContact CE2-CD1 3.89Å; F363-L365 HydrophobicContact CE2-CD2 4.32Å; F363-L365 HydrophobicContact CE2-CG 3.86Å; L365-E380 CarbonylContact O-C 3.48Å; L365-E380 WeakPolarHBondContact O-CA 3.5Å; L365-W381 HydrophobicContact CB-CB 4.36Å; L365-W381 HydrophobicContact CD1-CE3 4.06Å; L365-W381 HydrophobicContact CG-CE3 4.35Å; L365-W381 PolarHBondContact N-O 3.17Å; L365-W381 PolarHBondContact O-N 3.46Å
366	D	92.8	Very high	87.1	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.011	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128.1	171.6	-65.8	-25.7	0	0	0	108.8	F251 R252 K364 K377	F251-D366 CarbonylContact C-O 3.58Å; F251-D366 WeakPolarHBondContact CA-O 3.47Å; R252-D366 HydrophobicContact CB-CB 4.32Å; R252-D366 IonicContact CZ-OD2 2.76Å; R252-D366 PolarHBondContact N-O 3.45Å; R252-D366 IonicContact NE-OD2 2.67Å; R252-D366 IonicContact NH2-OD2 3.16Å; R252-D366 PolarHBondContact NH2-OD2 3.35Å; R252-D366 PolarHBondContact O-N 3.2Å; K364-D366 IonicContact NZ-OD1 3.41Å; K364-D366 PolarHBondContact NZ-OD1 2.83Å; K364-D366 VanDerWaalsContact NZ-OD1 3.11Å; K364-D366 IonicContact NZ-OD2 2.75Å; D366-K377 HydrophobicContact CB-CD 4.03Å; D366-K377 HydrophobicContact CB-CG 4.31Å; D366-K377 WeakPolarHBondContact OD1-CE 3.42Å; D366-K377 IonicContact OD1-NZ 2.66Å; D366-K377 PolarHBondContact OD1-NZ 2.89Å; D366-K377 IonicContact OD2-NZ 3.06Å
367	L	92.7	Very high	87.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	122.1	172.5	-176	66.3	0	0	0	108.9	V140 F251 V378 G379 L387 F395	V140-L367 HydrophobicContact CG2-CD1 4.09Å; V140-L367 HydrophobicContact CG2-CD2 4.19Å; F251-L367 HydrophobicContact CD1-CB 4.22Å; F251-L367 HydrophobicContact CD1-CD1 4Å; F251-L367 HydrophobicContact CE1-CB 4.03Å; F251-L367 HydrophobicContact CE1-CD1 3.8Å; F251-L367 HydrophobicContact CE1-CG 4.46Å; F251-L367 HydrophobicContact CZ-CD1 4.17Å; L367-V378 HydrophobicContact CB-CG2 4.25Å; L367-V378 HydrophobicContact CD2-CG2 3.99Å; L367-V378 HydrophobicContact CG-CG2 3.8Å; L367-V378 WeakPolarHBondContact O-CG2 2.85Å; L367-V378 PolarHBondContact O-N 3.2Å; L367-G379 PolarHBondContact N-O 3.41Å; L367-G379 PolarHBondContact O-N 2.92Å; L367-L387 HydrophobicContact CD2-CD1 4Å; L367-F395 HydrophobicContact CD2-CE2 4.11Å
368	I	90.9	Very high	87.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	144	-179	57.4	163	0	0	0	111.2	E234 T249 S250 R252 I375 V376 K377	E234-I368 HydrophobicContact CG-CD1 3.83Å; T249-I368 WeakPolarHBondContact CA-O 3.12Å; S250-I368 PolarHBondContact N-O 2.88Å; S250-I368 WeakPolarHBondContact O-CG1 3.49Å; S250-I368 PolarHBondContact O-N 3.38Å; R252-I368 HydrophobicContact CB-CD1 4.21Å; R252-I368 HydrophobicContact CB-CG1 4.34Å; R252-I368 HydrophobicContact CB-CG2 4.12Å; I368-I375 HydrophobicContact CB-CG2 3.71Å; I368-I375 HydrophobicContact CD1-CG2 3.69Å; I368-I375 HydrophobicContact CG1-CG2 4.14Å; I368-I375 HydrophobicContact CG2-CG2 4.4Å; I368-V376 WeakPolarHBondContact CA-O 3.46Å; I368-K377 HydrophobicContact CG2-CB 4.49Å
369	K	89.8	Confident	87.3	Confident	13 Å²	13	34 Å²	34	6%	0.057	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	139.5	178.3	-174.1	178.1	179.5	-176.5	0	110.6	N247 I248 T249 K371 I375 V376 V378 F395	N247-K369 WeakPolarHBondContact OD1-CE 3.14Å; N247-K369 PolarHBondContact OD1-NZ 3.4Å; I248-K369 CarbonylContact O-C 3.58Å; I248-K369 WeakPolarHBondContact O-CA 3.44Å; T249-K369 HydrophobicContact CG2-CB 4.1Å; T249-K369 HydrophobicContact CG2-CD 4.34Å; T249-K369 HydrophobicContact CG2-CG 3.88Å; K369-K371 PolarHBondContact O-N 3.37Å; K369-I375 WeakPolarHBondContact O-CA 3.46Å; K369-V376 PolarHBondContact N-O 3.18Å; K369-V376 PolarHBondContact O-N 3.03Å; K369-V378 HydrophobicContact CB-CG1 3.73Å; K369-V378 HydrophobicContact CB-CG2 4.04Å; K369-F395 PolarHBondContact NZ-O 2.77Å
370	L	87.6	Confident	87.5	Confident	9 Å²	9	33.8 Å²	33.8	5%	0.047	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	121.1	169.7	-175.6	66.5	0	0	0	110	L238 F241 K242 I248 I375	L238-L370 HydrophobicContact CB-CD1 4.21Å; L238-L370 HydrophobicContact CB-CD2 4.23Å; L238-L370 HydrophobicContact CD1-CD1 4.15Å; L238-L370 HydrophobicContact CD1-CD2 4.32Å; F241-L370 HydrophobicContact CB-CD2 3.71Å; K242-L370 HydrophobicContact CG-CD1 4.12Å; I248-L370 HydrophobicContact CB-CB 3.89Å; I248-L370 HydrophobicContact CB-CD2 4.26Å; I248-L370 HydrophobicContact CD1-CD2 3.89Å; I248-L370 HydrophobicContact CG1-CD2 4.21Å; I248-L370 PolarHBondContact O-N 2.89Å; L370-I375 HydrophobicContact CD1-CG1 3.89Å
371	K	79.5	Confident	87.6	Confident	65 Å²	65	33.9 Å²	33.9	28%	0.283	17%	0.169	S	C	.	.			trans	-110.2	172.3	165.9	-75.2	-167.5	172.2	-174.6	0	110	K369 H373 S374 V376 M394	K369-K371 PolarHBondContact O-N 3.37Å; K371-H373 PolarHBondContact O-N 3.44Å; K371-S374 PolarHBondContact N-O 3.22Å; K371-S374 PolarHBondContact O-N 3.47Å; K371-V376 HydrophobicContact CB-CG2 4.48Å; K371-V376 HydrophobicContact CD-CG2 4.38Å; K371-M394 WeakPolarHBondContact CE-O 3.44Å
372	Q	67.9	Low	87.7	Confident	54 Å²	54	33.6 Å²	33.6	25%	0.252	17%	0.167	S	C	.	.	S	Bend	trans	-47.5	-34.7	-177.9	-71.2	167.9	2.5	0	0	115.2	K242 F245 M401	K242-Q372 WeakPolarHBondContact CB-O 3.43Å; F245-Q372 HydrophobicContact CD1-CG 4.2Å; F245-Q372 HydrophobicContact CE1-CG 3.66Å; F245-Q372 VanDerWaalsContact CE1-NE2 3.29Å; Q372-M401 PolarHBondContact NE2-SD 2.99Å
373	H	69.7	Low	87.6	Confident	151 Å²	151	32 Å²	32	70%	0.699	16%	0.162	S	C	*	.	S	Bend	trans	-110	-30.1	-172.9	-63.3	89.8	0	0	0	112.5	K242 K371	K242-H373 PolarHBondContact NZ-O 3.28Å; K371-H373 PolarHBondContact O-N 3.44Å
374	S	80.4	Confident	87.4	Confident	60 Å²	60	39.3 Å²	39.3	42%	0.42	20%	0.195	S	C	.	.	S	Bend	trans	-162.8	165.4	-175.6	56.6	0	0	0	0	112.7	K371	K371-S374 PolarHBondContact N-O 3.22Å; K371-S374 PolarHBondContact O-N 3.47Å
375	I	85.6	Confident	86.9	Confident	44 Å²	44	39.6 Å²	39.6	23%	0.226	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	131.1	164.6	-59.8	169.1	0	0	0	107.6	E234 L238 I368 K369 L370	E234-I375 HydrophobicContact CB-CD1 4.21Å; E234-I375 HydrophobicContact CG-CD1 3.89Å; E234-I375 HydrophobicContact CG-CG2 4.27Å; L238-I375 HydrophobicContact CD1-CD1 3.94Å; L238-I375 HydrophobicContact CD1-CG1 4.39Å; I368-I375 HydrophobicContact CB-CG2 3.71Å; I368-I375 HydrophobicContact CD1-CG2 3.69Å; I368-I375 HydrophobicContact CG1-CG2 4.14Å; I368-I375 HydrophobicContact CG2-CG2 4.4Å; K369-I375 WeakPolarHBondContact O-CA 3.46Å; L370-I375 HydrophobicContact CD1-CG1 3.89Å
376	V	87	Confident	86.7	Confident	43 Å²	43	44.5 Å²	44.5	26%	0.261	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141	-176.6	-168.6	0	0	0	0	109.6	I368 K369 K371 V378 M394	I368-V376 WeakPolarHBondContact CA-O 3.46Å; K369-V376 PolarHBondContact N-O 3.18Å; K369-V376 PolarHBondContact O-N 3.03Å; K371-V376 HydrophobicContact CB-CG2 4.48Å; K371-V376 HydrophobicContact CD-CG2 4.38Å; V376-V378 PolarHBondContact O-N 2.79Å; V376-M394 HydrophobicContact CG1-SD 4.33Å
377	K	88.9	Confident	86.6	Confident	62 Å²	62	46 Å²	46	27%	0.27	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	122	168.9	178.3	176.6	171.3	168.5	0	109.1	D366 I368 G379 E380	D366-K377 HydrophobicContact CB-CD 4.03Å; D366-K377 HydrophobicContact CB-CG 4.31Å; D366-K377 WeakPolarHBondContact OD1-CE 3.42Å; D366-K377 IonicContact OD1-NZ 2.66Å; D366-K377 PolarHBondContact OD1-NZ 2.89Å; D366-K377 IonicContact OD2-NZ 3.06Å; I368-K377 HydrophobicContact CG2-CB 4.49Å; K377-G379 VanDerWaalsContact CE-O 3.3Å; K377-G379 WeakPolarHBondContact CE-O 3.14Å; K377-E380 IonicContact NZ-OE2 2.74Å; K377-E380 PolarHBondContact NZ-OE2 3.44Å
378	V	88.7	Confident	86.5	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-16.6	-179.3	-66.7	0	0	0	0	113	L367 K369 V376 T390 M394 F395	L367-V378 HydrophobicContact CB-CG2 4.25Å; L367-V378 HydrophobicContact CD2-CG2 3.99Å; L367-V378 HydrophobicContact CG-CG2 3.8Å; L367-V378 WeakPolarHBondContact O-CG2 2.85Å; L367-V378 PolarHBondContact O-N 3.2Å; K369-V378 HydrophobicContact CB-CG1 3.73Å; K369-V378 HydrophobicContact CB-CG2 4.04Å; V376-V378 PolarHBondContact O-N 2.79Å; V378-T390 PolarHBondContact O-N 3.29Å; V378-T390 PolarHBondContact O-OG1 3.17Å; V378-M394 HydrophobicContact CG1-CB 4.26Å; V378-F395 HydrophobicContact CB-CD2 4.43Å; V378-F395 HydrophobicContact CG2-CD2 4.18Å; V378-F395 HydrophobicContact CG2-CE2 4.03Å
379	G	90	Very high	86.1	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.7	-177.1	178.7	0	0	0	0	0	112.8	L367 K377 N388	L367-G379 PolarHBondContact N-O 3.41Å; L367-G379 PolarHBondContact O-N 2.92Å; K377-G379 VanDerWaalsContact CE-O 3.3Å; K377-G379 WeakPolarHBondContact CE-O 3.14Å; G379-N388 CarbonylContact C-O 3.51Å; G379-N388 VanDerWaalsContact CA-O 3.22Å; G379-N388 WeakPolarHBondContact CA-O 3.33Å
380	E	92.4	Very high	85.3	Confident	66 Å²	66	56 Å²	56	31%	0.308	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	140.6	-178.6	-176.8	168.1	151.5	0	0	109.5	K364 L365 K377 N388	K364-E380 HydrophobicContact CD-CG 3.93Å; K364-E380 WeakPolarHBondContact CD-OE1 3.42Å; K364-E380 HydrophobicContact CG-CG 3.77Å; K364-E380 WeakPolarHBondContact CG-OE1 3.49Å; L365-E380 CarbonylContact O-C 3.48Å; L365-E380 WeakPolarHBondContact O-CA 3.5Å; K377-E380 IonicContact NZ-OE2 2.74Å; K377-E380 PolarHBondContact NZ-OE2 3.44Å; E380-N388 PolarHBondContact N-O 3.35Å; E380-N388 PolarHBondContact O-N 2.86Å
381	W	94.2	Very high	84.5	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.008	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133.6	176.6	-173.6	94	0	0	0	110.5	L132 A136 D139 F251 F363 L365 P383 H386 L387	L132-W381 HydrophobicContact CB-CH2 4.19Å; L132-W381 WeakPolarHBondContact O-CH2 3.44Å; A136-W381 VanDerWaalsContact CA-CE2 3.49Å; A136-W381 HydrophobicContact CB-CD2 3.4Å; A136-W381 VanDerWaalsContact CB-CD2 3.4Å; A136-W381 VanDerWaalsContact CB-CE2 3.49Å; A136-W381 HydrophobicContact CB-CE3 3.77Å; A136-W381 HydrophobicContact CB-CG 3.77Å; A136-W381 HydrophobicContact CB-CH2 4.23Å; A136-W381 HydrophobicContact CB-CZ2 3.91Å; A136-W381 HydrophobicContact CB-CZ3 4.17Å; D139-W381 PolarHBondContact OD2-NE1 3.35Å; F251-W381 HydrophobicContact CE1-CB 4.05Å; F363-W381 HydrophobicContact CD2-CZ3 4.41Å; F363-W381 HydrophobicContact CE2-CE3 4.15Å; F363-W381 AromaticContact CE2-CZ3 3.52Å; F363-W381 HydrophobicContact CE2-CZ3 3.52Å; F363-W381 HydrophobicContact CZ-CH2 4.34Å; F363-W381 AromaticContact CZ-CZ3 3.7Å; F363-W381 HydrophobicContact CZ-CZ3 3.7Å; L365-W381 HydrophobicContact CB-CB 4.36Å; L365-W381 HydrophobicContact CD1-CE3 4.06Å; L365-W381 HydrophobicContact CG-CE3 4.35Å; L365-W381 PolarHBondContact N-O 3.17Å; L365-W381 PolarHBondContact O-N 3.46Å; W381-P383 HydrophobicContact CH2-CB 4.31Å; W381-P383 HydrophobicContact CH2-CG 4.13Å; W381-P383 HydrophobicContact CZ3-CG 3.9Å; W381-H386 WeakPolarHBondContact CA-O 3.49Å; W381-L387 HydrophobicContact CB-CD1 4.43Å; W381-L387 VanDerWaalsContact CD1-N 3.32Å
382	T	93.1	Very high	83.9	Confident	38 Å²	38	60.6 Å²	60.6	23%	0.233	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	150.8	172.9	59	0	0	0	0	110.2	K364 H384 G385 H386	K364-T382 HydrophobicContact CG-CG2 4.34Å; T382-H384 PolarHBondContact O-N 2.96Å; T382-H384 VanDerWaalsContact O-N 3.13Å; T382-G385 PolarHBondContact O-N 3.46Å; T382-G385 VanDerWaalsContact OG1-CA 3.27Å; T382-G385 WeakPolarHBondContact OG1-CA 3.47Å; T382-G385 PolarHBondContact OG1-N 2.66Å; T382-H386 PolarHBondContact N-O 2.94Å; T382-H386 WeakPolarHBondContact O-CA 3.49Å; T382-H386 PolarHBondContact O-N 2.68Å
383	P	89.9	Confident	83.5	Confident	21 Å²	21	60.9 Å²	60.9	14%	0.136	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-31	-179.3	-28.5	35	0	0	0	114.9	L132 V361 F363 W381	L132-P383 HydrophobicContact CD1-CB 4.36Å; L132-P383 HydrophobicContact CD1-CG 4.31Å; L132-P383 HydrophobicContact CD2-CB 4.49Å; V361-P383 WeakPolarHBondContact O-CG 3.49Å; F363-P383 HydrophobicContact CD1-CG 4.25Å; F363-P383 HydrophobicContact CE1-CG 4.05Å; F363-P383 HydrophobicContact CZ-CG 4.31Å; F363-P383 WeakPolarHBondContact O-CD 3.49Å; W381-P383 HydrophobicContact CH2-CB 4.31Å; W381-P383 HydrophobicContact CH2-CG 4.13Å; W381-P383 HydrophobicContact CZ3-CG 3.9Å
384	H	88.1	Confident	83	Confident	154 Å²	154	55.3 Å²	55.3	71%	0.713	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-32.6	178.7	-62.1	-57.2	0	0	0	113.5	T382	T382-H384 PolarHBondContact O-N 2.96Å; T382-H384 VanDerWaalsContact O-N 3.13Å
385	G	83.3	Confident	82	Confident	48 Å²	48	52.8 Å²	52.8	50%	0.495	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-3.7	-175.6	0	0	0	0	0	114.7	T382	T382-G385 PolarHBondContact O-N 3.46Å; T382-G385 VanDerWaalsContact OG1-CA 3.27Å; T382-G385 WeakPolarHBondContact OG1-CA 3.47Å; T382-G385 PolarHBondContact OG1-N 2.66Å
386	H	89.1	Confident	80.6	Confident	102 Å²	102	57.4 Å²	57.4	47%	0.472	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.6	-157.9	-173.4	-70.1	-82.6	0	0	0	111.9	D139 W381 T382 N388	D139-H386 IonicContact OD1-ND1 2.69Å; D139-H386 IonicContact OD2-CG 2.69Å; D139-H386 IonicContact OD2-ND1 2.73Å; D139-H386 PolarHBondContact OD2-ND1 3.14Å; W381-H386 WeakPolarHBondContact CA-O 3.49Å; T382-H386 PolarHBondContact N-O 2.94Å; T382-H386 WeakPolarHBondContact O-CA 3.49Å; T382-H386 PolarHBondContact O-N 2.68Å; H386-N388 PolarHBondContact O-N 3.04Å
387	L	90.3	Very high	78.9	Confident	33 Å²	33	60.4 Å²	60.4	17%	0.173	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	117.7	178.6	-176.5	62.9	0	0	0	111	D139 V140 Y143 L367 W381 I389	D139-L387 HydrophobicContact CB-CB 3.9Å; V140-L387 HydrophobicContact CG2-CD1 4.39Å; V140-L387 HydrophobicContact CG2-CD2 3.9Å; Y143-L387 HydrophobicContact CG-CD2 4.25Å; L367-L387 HydrophobicContact CD2-CD1 4Å; W381-L387 HydrophobicContact CB-CD1 4.43Å; W381-L387 VanDerWaalsContact CD1-N 3.32Å; L387-I389 HydrophobicContact CD1-CG1 4.39Å; L387-I389 HydrophobicContact CD2-CD1 4.01Å; L387-I389 HydrophobicContact CD2-CG1 4.43Å; L387-I389 HydrophobicContact CG-CD1 4.23Å; L387-I389 HydrophobicContact CG-CG1 4.13Å
388	N	89.6	Confident	76.9	Confident	109 Å²	109	59.7 Å²	59.7	58%	0.583	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.8	173.1	-169.9	6	0	0	0	110.1	G379 E380 H386	G379-N388 CarbonylContact C-O 3.51Å; G379-N388 VanDerWaalsContact CA-O 3.22Å; G379-N388 WeakPolarHBondContact CA-O 3.33Å; E380-N388 PolarHBondContact N-O 3.35Å; E380-N388 PolarHBondContact O-N 2.86Å; H386-N388 PolarHBondContact O-N 3.04Å
389	I	84.2	Confident	75	Confident	24 Å²	24	61 Å²	61	12%	0.123	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.1	-176.1	-70.3	169.6	0	0	0	108.6	Y143 L387	Y143-I389 HydrophobicContact CD1-CD1 3.48Å; Y143-I389 VanDerWaalsContact CD1-CD1 3.48Å; Y143-I389 HydrophobicContact CD2-CD1 3.64Å; Y143-I389 HydrophobicContact CE1-CD1 3.21Å; Y143-I389 HydrophobicContact CE2-CD1 3.38Å; Y143-I389 HydrophobicContact CG-CD1 3.68Å; L387-I389 HydrophobicContact CD1-CG1 4.39Å; L387-I389 HydrophobicContact CD2-CD1 4.01Å; L387-I389 HydrophobicContact CD2-CG1 4.43Å; L387-I389 HydrophobicContact CG-CD1 4.23Å; L387-I389 HydrophobicContact CG-CG1 4.13Å
390	T	72.2	Confident	73.1	Confident	92 Å²	92	67.1 Å²	67.1	56%	0.564	39%	0.386	S	S	*	.	S	Bend	trans	-66.1	-39.3	-174.9	33.8	0	0	0	0	112.2	V378	V378-T390 PolarHBondContact O-N 3.29Å; V378-T390 PolarHBondContact O-OG1 3.17Å
391	E	70.1	Confident	71.2	Confident	97 Å²	97	65.6 Å²	65.6	45%	0.453	38%	0.379	S	S	.	.			trans	-144.7	107	179	-73.6	-175.5	178.9	0	0	111.3	S393 M394	E391-S393 VanDerWaalsContact C-N 3.25Å; E391-S393 PolarHBondContact O-N 3.4Å; E391-M394 HydrophobicContact CB-CB 4.29Å; E391-M394 HydrophobicContact CB-CE 3.98Å; E391-M394 HydrophobicContact CB-CG 3.88Å; E391-M394 HydrophobicContact CG-CE 4.38Å; E391-M394 WeakPolarHBondContact O-CB 3.22Å; E391-M394 PolarHBondContact O-N 2.9Å; E391-M394 VanDerWaalsContact O-N 3.09Å; E391-M394 WeakPolarHBondContact OE2-CG 3.38Å
392	P	67.7	Low	69.6	Low	73 Å²	73	72.7 Å²	72.7	47%	0.474	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-31.8	177.8	-25.1	34.7	0	0	0	113.6	M394 F395 F396	P392-M394 PolarHBondContact O-N 3.36Å; P392-F395 WeakPolarHBondContact O-CB 3.23Å; P392-F395 PolarHBondContact O-N 3.11Å; P392-F396 WeakPolarHBondContact O-CD2 3.44Å; P392-F396 PolarHBondContact O-N 2.71Å
393	S	60.1	Low	68.6	Low	59 Å²	59	72.6 Å²	72.6	41%	0.413	42%	0.416	S	S	.	.	H	α-helix	trans	-57.8	-35.3	174.2	48.3	0	0	0	0	111.8	E391 F395 F396 D397	E391-S393 VanDerWaalsContact C-N 3.25Å; E391-S393 PolarHBondContact O-N 3.4Å; S393-F395 PolarHBondContact O-N 3.42Å; S393-F395 VanDerWaalsContact O-N 3.12Å; S393-F396 PolarHBondContact O-N 2.81Å; S393-D397 VanDerWaalsContact O-CB 3.25Å; S393-D397 WeakPolarHBondContact O-CB 3.36Å; S393-D397 PolarHBondContact O-N 3.05Å
394	M	58	Low	68.3	Low	34 Å²	34	75 Å²	75	17%	0.167	43%	0.431	C	S	.	.	H	α-helix	trans	-66.2	-16.7	176.8	-71.3	-145.8	-86.5	0	0	114.2	K371 V376 V378 E391 P392	K371-M394 WeakPolarHBondContact CE-O 3.44Å; V376-M394 HydrophobicContact CG1-SD 4.33Å; V378-M394 HydrophobicContact CG1-CB 4.26Å; E391-M394 HydrophobicContact CB-CB 4.29Å; E391-M394 HydrophobicContact CB-CE 3.98Å; E391-M394 HydrophobicContact CB-CG 3.88Å; E391-M394 HydrophobicContact CG-CE 4.38Å; E391-M394 WeakPolarHBondContact O-CB 3.22Å; E391-M394 PolarHBondContact O-N 2.9Å; E391-M394 VanDerWaalsContact O-N 3.09Å; E391-M394 WeakPolarHBondContact OE2-CG 3.38Å; P392-M394 PolarHBondContact O-N 3.36Å
395	F	58.9	Low	68.4	Low	8 Å²	8	67.8 Å²	67.8	4%	0.035	40%	0.398	C	S	.	.	H	α-helix	trans	-88.6	-33	177.5	-137.7	-74.9	0	0	0	112.8	Y143 L144 T249 L367 K369 V378 P392 S393	Y143-F395 HydrophobicContact CE1-CD1 4.49Å; Y143-F395 HydrophobicContact CE1-CD2 4.27Å; Y143-F395 HydrophobicContact CE1-CG 4.18Å; L144-F395 HydrophobicContact CD1-CZ 4.5Å; L144-F395 HydrophobicContact CD2-CD1 3.83Å; L144-F395 HydrophobicContact CD2-CE1 3.11Å; L144-F395 HydrophobicContact CD2-CZ 3.56Å; L144-F395 HydrophobicContact CG-CE1 4.38Å; T249-F395 HydrophobicContact CG2-CE2 4.5Å; T249-F395 HydrophobicContact CG2-CZ 3.88Å; L367-F395 HydrophobicContact CD2-CE2 4.11Å; K369-F395 PolarHBondContact NZ-O 2.77Å; V378-F395 HydrophobicContact CB-CD2 4.43Å; V378-F395 HydrophobicContact CG2-CD2 4.18Å; V378-F395 HydrophobicContact CG2-CE2 4.03Å; P392-F395 WeakPolarHBondContact O-CB 3.23Å; P392-F395 PolarHBondContact O-N 3.11Å; S393-F395 PolarHBondContact O-N 3.42Å; S393-F395 VanDerWaalsContact O-N 3.12Å
396	F	57.4	Low	68.9	Low	141 Å²	141	66.9 Å²	66.9	62%	0.618	38%	0.382	S	S	*	.	H	α-helix	trans	-115.5	-8.7	-172	-59.7	-73.5	0	0	0	115.2	Y143 P392 S393 A398	Y143-F396 HydrophobicContact CE1-CE2 4.37Å; Y143-F396 HydrophobicContact CE1-CZ 4.42Å; P392-F396 WeakPolarHBondContact O-CD2 3.44Å; P392-F396 PolarHBondContact O-N 2.71Å; S393-F396 PolarHBondContact O-N 2.81Å; F396-A398 PolarHBondContact O-N 2.93Å
397	D	50.8	Low	69.2	Low	106 Å²	106	62 Å²	62	57%	0.567	36%	0.36	S	S	*	.			trans	-70.6	97.9	172	-91.8	-30.5	0	0	0	110.6	S393 G399	S393-D397 VanDerWaalsContact O-CB 3.25Å; S393-D397 WeakPolarHBondContact O-CB 3.36Å; S393-D397 PolarHBondContact O-N 3.05Å; D397-G399 VanDerWaalsContact C-N 3.34Å; D397-G399 PolarHBondContact O-N 2.92Å; D397-G399 VanDerWaalsContact O-N 3.15Å
398	A	47.6	Very low	69.4	Low	47 Å²	47	60.5 Å²	60.5	39%	0.388	35%	0.352	S	S	.	.			trans	-65.6	101.8	147.9	0	0	0	0	0	105.9	F396	F396-A398 PolarHBondContact O-N 2.93Å
399	G	48.3	Very low	69.7	Low	26 Å²	26	55.4 Å²	55.4	27%	0.268	32%	0.324	S	S	.	.			trans	-47.7	161.1	-167.8	0	0	0	0	0	114.9	D397 M401	D397-G399 VanDerWaalsContact C-N 3.34Å; D397-G399 PolarHBondContact O-N 2.92Å; D397-G399 VanDerWaalsContact O-N 3.15Å; G399-M401 WeakPolarHBondContact O-CB 3.47Å; G399-M401 WeakPolarHBondContact O-CG 3.12Å; G399-M401 PolarHBondContact O-N 3.34Å
400	S	50	Low	70.1	Confident	130 Å²	130	54.9 Å²	54.9	91%	0.909	32%	0.322	S	S	*	.	S	Bend	trans	-49.2	112.4	161.2	159.7	0	0	0	0	108.5
401	M	51.5	Low	71	Confident	33 Å²	33	53.7 Å²	53.7	16%	0.163	31%	0.312	C	S	.	.			trans	-140.2	126.5	-170.7	-76.8	152.6	48.1	0	0	110.2	F245 Q372 G399 V403	F245-M401 HydrophobicContact CD1-CE 3.58Å; F245-M401 HydrophobicContact CD1-SD 3.76Å; F245-M401 HydrophobicContact CD2-CE 3.71Å; F245-M401 HydrophobicContact CE1-CE 3.1Å; F245-M401 HydrophobicContact CE1-CG 4.28Å; F245-M401 HydrophobicContact CE1-SD 3.27Å; F245-M401 WeakPolarHBondContact CE1-SD 3.16Å; F245-M401 HydrophobicContact CE2-CE 3.22Å; F245-M401 HydrophobicContact CE2-SD 4.45Å; F245-M401 HydrophobicContact CG-CE 3.89Å; F245-M401 HydrophobicContact CZ-CE 2.92Å; F245-M401 HydrophobicContact CZ-CG 4.37Å; F245-M401 HydrophobicContact CZ-SD 3.69Å; Q372-M401 PolarHBondContact NE2-SD 2.99Å; G399-M401 WeakPolarHBondContact O-CB 3.47Å; G399-M401 WeakPolarHBondContact O-CG 3.12Å; G399-M401 PolarHBondContact O-N 3.34Å; M401-V403 HydrophobicContact CB-CG2 3.39Å; M401-V403 HydrophobicContact CE-CG2 3.42Å; M401-V403 VanDerWaalsContact CE-CG2 3.42Å; M401-V403 HydrophobicContact CG-CG2 4.42Å; M401-V403 PolarHBondContact O-N 2.86Å
402	N	60.8	Low	71.9	Confident	152 Å²	152	50.1 Å²	50.1	81%	0.813	30%	0.295	S	S	*	.			trans	-65.2	72.2	159.5	-63.6	-8.6	0	0	0	108.6
403	V	71.8	Confident	73	Confident	35 Å²	35	49.2 Å²	49.2	21%	0.212	29%	0.288	C	S	.	.			trans	-92.3	134	174.3	-172.9	0	0	0	0	108.3	M401 L405 D448 W744	M401-V403 HydrophobicContact CB-CG2 3.39Å; M401-V403 HydrophobicContact CE-CG2 3.42Å; M401-V403 VanDerWaalsContact CE-CG2 3.42Å; M401-V403 HydrophobicContact CG-CG2 4.42Å; M401-V403 PolarHBondContact O-N 2.86Å; V403-L405 HydrophobicContact CG1-CD2 3.79Å; V403-D448 PolarHBondContact O-N 2.9Å; V403-D448 VanDerWaalsContact O-O 3.07Å; V403-W744 HydrophobicContact CB-CZ2 4.11Å; V403-W744 HydrophobicContact CG1-CZ2 4.4Å; V403-W744 HydrophobicContact CG2-CH2 4.49Å; V403-W744 HydrophobicContact CG2-CZ2 4.11Å
404	T	85.4	Confident	74.5	Confident	72 Å²	72	46.4 Å²	46.4	44%	0.442	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	111.3	169.8	-46.7	0	0	0	0	110	D448 I450	T404-D448 CarbonylContact C-O 3.54Å; T404-D448 VanDerWaalsContact CA-O 3.25Å; T404-D448 WeakPolarHBondContact CA-O 3.33Å; T404-D448 HydrophobicContact CG2-CB 4.15Å; T404-I450 HydrophobicContact CG2-CD1 3.73Å; T404-I450 HydrophobicContact CG2-CG1 3.66Å
405	L	90.3	Very high	76.2	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	137.3	179.6	-58.9	-178.4	0	0	0	111.6	V403 V407 F447 D448 Y449 I450 D481 L482 W744	V403-L405 HydrophobicContact CG1-CD2 3.79Å; L405-V407 PolarHBondContact O-N 3.22Å; L405-F447 HydrophobicContact CB-CD2 4.45Å; L405-F447 HydrophobicContact CD1-CB 4.28Å; L405-F447 HydrophobicContact CD1-CD1 4.33Å; L405-F447 HydrophobicContact CD1-CD2 3.57Å; L405-F447 HydrophobicContact CD1-CE2 3.92Å; L405-F447 HydrophobicContact CD1-CG 3.81Å; L405-F447 HydrophobicContact CD1-CZ 4.43Å; L405-F447 HydrophobicContact CG-CB 4.48Å; L405-F447 HydrophobicContact CG-CD2 4.03Å; L405-F447 HydrophobicContact CG-CG 4.4Å; L405-D448 PolarHBondContact N-O 2.94Å; L405-Y449 CarbonylContact O-C 3.56Å; L405-Y449 VanDerWaalsContact O-CA 3.22Å; L405-Y449 WeakPolarHBondContact O-CA 3.12Å; L405-I450 PolarHBondContact O-N 2.93Å; L405-D481 HydrophobicContact CB-CB 4.21Å; L405-D481 HydrophobicContact CD2-CB 4.15Å; L405-L482 HydrophobicContact CB-CD1 4.37Å; L405-L482 HydrophobicContact CD1-CD1 3.58Å; L405-L482 HydrophobicContact CD1-CG 4.2Å; L405-W744 HydrophobicContact CD1-CD2 3.98Å; L405-W744 HydrophobicContact CD1-CE3 4.41Å; L405-W744 HydrophobicContact CD1-CG 4.24Å; L405-W744 HydrophobicContact CD1-CZ2 4.37Å; L405-W744 HydrophobicContact CD2-CZ2 4.06Å
406	V	92.1	Very high	77.9	Confident	28 Å²	28	44.6 Å²	44.6	17%	0.17	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	110.9	172.5	-177.5	0	0	0	0	109.2	Y479 D481 L482	V406-Y479 HydrophobicContact CG1-CD1 4.4Å; V406-Y479 HydrophobicContact CG1-CE1 3.77Å; V406-D481 PolarHBondContact N-OD2 3.37Å; V406-D481 PolarHBondContact O-N 2.86Å; V406-L482 PolarHBondContact O-N 3.45Å
407	V	96	Very high	79.6	Confident	0 Å²	0	39 Å²	39	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	113.2	-177.4	-176.4	0	0	0	0	109.5	L405 L438 Y449 I450 L451 D452 L482 V484	L405-V407 PolarHBondContact O-N 3.22Å; V407-L438 HydrophobicContact CB-CD2 4.35Å; V407-L438 HydrophobicContact CG1-CD2 3.9Å; V407-L438 HydrophobicContact CG2-CD1 4.47Å; V407-L438 HydrophobicContact CG2-CD2 4.17Å; V407-Y449 HydrophobicContact CG2-CD2 4.46Å; V407-Y449 HydrophobicContact CG2-CG 4.43Å; V407-I450 PolarHBondContact N-O 3.42Å; V407-L451 HydrophobicContact CB-CD2 4.02Å; V407-L451 HydrophobicContact CG1-CD2 3.84Å; V407-L451 WeakPolarHBondContact O-CA 3.35Å; V407-D452 PolarHBondContact O-N 3.03Å; V407-L482 CarbonylContact C-O 3.48Å; V407-L482 WeakPolarHBondContact CA-O 3.46Å; V407-L482 HydrophobicContact CG1-CB 4.35Å; V407-L482 HydrophobicContact CG2-CB 4.09Å; V407-L482 HydrophobicContact CG2-CD1 4.15Å; V407-V484 HydrophobicContact CG1-CB 3.76Å; V407-V484 HydrophobicContact CG1-CG2 3.54Å
408	I	95.3	Very high	81.4	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	138	174.3	-156.7	73.8	0	0	0	110.4	D452 V454 M472 Q475 A480 L482 A483 V484	I408-D452 CarbonylContact C-O 3.52Å; I408-D452 WeakPolarHBondContact CA-O 3.25Å; I408-D452 HydrophobicContact CD1-CB 4.17Å; I408-V454 HydrophobicContact CG1-CB 4.11Å; I408-M472 HydrophobicContact CG2-CB 4.13Å; I408-M472 HydrophobicContact CG2-CG 4.2Å; I408-Q475 HydrophobicContact CD1-CG 4.5Å; I408-Q475 HydrophobicContact CG1-CB 4.21Å; I408-Q475 HydrophobicContact CG1-CG 4.35Å; I408-Q475 HydrophobicContact CG2-CB 4.46Å; I408-A480 HydrophobicContact CB-CB 3.89Å; I408-A480 HydrophobicContact CG2-CB 3.98Å; I408-L482 PolarHBondContact N-O 2.88Å; I408-A483 HydrophobicContact CG2-CB 3.47Å; I408-A483 VanDerWaalsContact CG2-CB 3.47Å; I408-A483 VanDerWaalsContact O-CA 3.3Å; I408-A483 WeakPolarHBondContact O-CA 3.49Å; I408-V484 PolarHBondContact O-N 3.01Å; I408-V484 VanDerWaalsContact O-N 3.08Å
409	T	94.7	Very high	83.3	Confident	1 Å²	1	37 Å²	37	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	173.1	178.5	-163.4	0	0	0	0	112.5	V416 L451 D452 L453 V454 V484	T409-V416 HydrophobicContact CG2-CG1 4.03Å; T409-V416 WeakPolarHBondContact OG1-CG2 3.41Å; T409-L451 HydrophobicContact CG2-CD2 4.23Å; T409-D452 PolarHBondContact N-O 3.36Å; T409-L453 HydrophobicContact CG2-CD2 3.96Å; T409-V454 PolarHBondContact O-N 3.25Å; T409-V484 VanDerWaalsContact CB-O 3.29Å; T409-V484 WeakPolarHBondContact CB-O 3.37Å; T409-V484 PolarHBondContact OG1-O 3.39Å
410	I	92.4	Very high	84.7	Confident	14 Å²	14	45.7 Å²	45.7	7%	0.072	24%	0.242	C	C	.	.			trans	-128.8	143.6	178.1	-171	169.8	0	0	0	109.2	E412 V416 V454 R457 Y459 M472	I410-E412 PolarHBondContact O-N 3.08Å; I410-V416 WeakPolarHBondContact O-CB 3.36Å; I410-V454 HydrophobicContact CB-CG1 4.05Å; I410-V454 HydrophobicContact CD1-CG1 4.34Å; I410-V454 HydrophobicContact CG1-CG1 4.13Å; I410-R457 WeakPolarHBondContact CD1-O 3.48Å; I410-Y459 HydrophobicContact CD1-CE2 4.37Å; I410-Y459 HydrophobicContact CG2-CD1 4.46Å; I410-Y459 HydrophobicContact CG2-CE1 3.76Å; I410-M472 HydrophobicContact CB-CE 4.17Å; I410-M472 HydrophobicContact CB-SD 4.11Å; I410-M472 HydrophobicContact CG2-CE 3.68Å; I410-M472 HydrophobicContact CG2-SD 4.1Å
411	L	91.8	Very high	85.9	Confident	67 Å²	67	41.6 Å²	41.6	35%	0.351	22%	0.22	S	C	.	.			trans	-75.6	118.4	176.3	-64.7	177.8	0	0	0	110.2	V416 M418 F430 L453	L411-V416 WeakPolarHBondContact CA-O 3.32Å; L411-V416 HydrophobicContact CD2-CG1 4.34Å; L411-M418 HydrophobicContact CD1-CE 4.46Å; L411-M418 HydrophobicContact CD2-CB 3.99Å; L411-M418 HydrophobicContact CD2-CE 4.41Å; L411-F430 HydrophobicContact CD2-CD1 4.26Å; L411-F430 HydrophobicContact CD2-CE1 4.18Å; L411-L453 HydrophobicContact CD1-CD1 4.16Å; L411-L453 HydrophobicContact CD2-CD2 3.97Å; L411-L453 HydrophobicContact CG-CD1 4.22Å; L411-L453 HydrophobicContact CG-CD2 3.82Å
412	E	89.8	Confident	86.7	Confident	21 Å²	21	49.9 Å²	49.9	10%	0.098	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-155.7	127.9	176.2	-167.4	177.9	-116.1	0	0	110.3	I410 Y415 V416 Y459 S486 Y691	I410-E412 PolarHBondContact O-N 3.08Å; E412-Y415 HydrophobicContact CB-CD2 4.34Å; E412-Y415 HydrophobicContact CG-CD2 4.07Å; E412-Y415 PolarHBondContact O-N 2.96Å; E412-Y415 WeakPolarHBondContact OE2-CD2 3.37Å; E412-Y415 WeakPolarHBondContact OE2-CE2 3.21Å; E412-V416 CarbonylContact C-O 3.56Å; E412-V416 PolarHBondContact N-O 2.91Å; E412-V416 CarbonylContact O-C 3.58Å; E412-V416 PolarHBondContact O-N 2.91Å; E412-V416 VanDerWaalsContact O-O 3.1Å; E412-Y459 PolarHBondContact OE1-OH 2.9Å; E412-Y459 PolarHBondContact OE2-OH 2.69Å; E412-S486 WeakPolarHBondContact OE2-CB 3.49Å; E412-S486 PolarHBondContact OE2-OG 3.41Å; E412-Y691 WeakPolarHBondContact OE1-CE2 3.26Å
413	T	89.9	Confident	87.7	Confident	54 Å²	54	49.8 Å²	49.8	33%	0.331	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	131.3	180	54.5	0	0	0	0	110.8	M417 M711	T413-M417 HydrophobicContact CG2-CG 3.82Å; T413-M417 HydrophobicContact CG2-SD 3.91Å; T413-M711 VanDerWaalsContact O-SD 3.38Å
414	P	92.2	Very high	88	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.006	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	cis	-98.7	14.1	1.7	40.2	-39.4	0	0	0	114.8	M417 G432 F433 Y714 W769	P414-M417 HydrophobicContact CB-CE 4.25Å; P414-G432 WeakPolarHBondContact O-CA 2.96Å; P414-F433 PolarHBondContact O-N 3.27Å; P414-Y714 HydrophobicContact CB-CD2 3.99Å; P414-Y714 HydrophobicContact CB-CE2 3.37Å; P414-Y714 HydrophobicContact CG-CD2 3.43Å; P414-Y714 VanDerWaalsContact CG-CD2 3.43Å; P414-Y714 HydrophobicContact CG-CE2 3.39Å; P414-Y714 HydrophobicContact CG-CG 4.14Å; P414-W769 HydrophobicContact CG-CD2 4.28Å; P414-W769 HydrophobicContact CG-CE3 4.07Å; P414-W769 HydrophobicContact CG-CH2 3.38Å; P414-W769 HydrophobicContact CG-CZ2 3.62Å; P414-W769 HydrophobicContact CG-CZ3 3.64Å
415	Y	93.8	Very high	87.8	Confident	1 Å²	1	53.7 Å²	53.7	0%	0.004	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-54.4	-174.9	-58	-77.3	0	0	0	112.5	E412 G432 F433 C434 T710 Y734 W769	E412-Y415 HydrophobicContact CB-CD2 4.34Å; E412-Y415 HydrophobicContact CG-CD2 4.07Å; E412-Y415 PolarHBondContact O-N 2.96Å; E412-Y415 WeakPolarHBondContact OE2-CD2 3.37Å; E412-Y415 WeakPolarHBondContact OE2-CE2 3.21Å; Y415-G432 CarbonylContact O-C 3.41Å; Y415-G432 VanDerWaalsContact O-C 3.26Å; Y415-G432 WeakPolarHBondContact O-CA 2.96Å; Y415-F433 HydrophobicContact CD1-CD1 4.24Å; Y415-F433 PolarHBondContact O-N 3.1Å; Y415-F433 VanDerWaalsContact O-N 3.08Å; Y415-C434 WeakPolarHBondContact O-CB 3.2Å; Y415-C434 PolarHBondContact O-N 3.08Å; Y415-T710 VanDerWaalsContact OH-CB 3.28Å; Y415-T710 WeakPolarHBondContact OH-CB 3.39Å; Y415-T710 PolarHBondContact OH-OG1 3.41Å; Y415-Y734 HydrophobicContact CE1-CD2 4.26Å; Y415-Y734 AromaticContact CE1-CE2 3.75Å; Y415-Y734 HydrophobicContact CE1-CE2 3.75Å; Y415-Y734 AromaticContact CZ-CE2 3.77Å; Y415-W769 HydrophobicContact CD1-CH2 4.05Å; Y415-W769 AromaticContact CE1-CH2 3.53Å; Y415-W769 HydrophobicContact CE1-CH2 3.53Å; Y415-W769 AromaticContact CE1-CZ2 3.98Å; Y415-W769 HydrophobicContact CE1-CZ2 3.98Å; Y415-W769 AromaticContact CZ-CH2 3.87Å; Y415-W769 AromaticContact CZ-CZ2 3.85Å
416	V	94.6	Very high	87.6	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.012	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-143	117.2	178.7	-177	0	0	0	0	109.3	T409 I410 L411 E412 F430 C434 V435	T409-V416 HydrophobicContact CG2-CG1 4.03Å; T409-V416 WeakPolarHBondContact OG1-CG2 3.41Å; I410-V416 WeakPolarHBondContact O-CB 3.36Å; L411-V416 WeakPolarHBondContact CA-O 3.32Å; L411-V416 HydrophobicContact CD2-CG1 4.34Å; E412-V416 CarbonylContact C-O 3.56Å; E412-V416 PolarHBondContact N-O 2.91Å; E412-V416 CarbonylContact O-C 3.58Å; E412-V416 PolarHBondContact O-N 2.91Å; E412-V416 VanDerWaalsContact O-O 3.1Å; V416-F430 HydrophobicContact CG1-CB 4.45Å; V416-F430 HydrophobicContact CG1-CD1 4.11Å; V416-C434 HydrophobicContact CG2-CB 3.79Å; V416-V435 HydrophobicContact CG1-CG2 4.15Å; V416-V435 HydrophobicContact CG2-CG2 4.19Å
417	M	91.8	Very high	87.5	Confident	25 Å²	25	56.4 Å²	56.4	12%	0.123	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	159.3	-179.6	-62.7	176.8	-81.6	0	0	109.2	T413 P414 F430 Y431 W768	T413-M417 HydrophobicContact CG2-CG 3.82Å; T413-M417 HydrophobicContact CG2-SD 3.91Å; P414-M417 HydrophobicContact CB-CE 4.25Å; M417-F430 CarbonylContact O-C 3.5Å; M417-F430 VanDerWaalsContact O-CA 3.27Å; M417-F430 WeakPolarHBondContact O-CA 3.47Å; M417-Y431 WeakPolarHBondContact CA-O 3.11Å; M417-Y431 HydrophobicContact CB-CD1 4.07Å; M417-Y431 HydrophobicContact CB-CD2 4.11Å; M417-Y431 HydrophobicContact CB-CE1 3.64Å; M417-Y431 HydrophobicContact CB-CE2 3.72Å; M417-Y431 HydrophobicContact CB-CG 4.3Å; M417-Y431 VanDerWaalsContact CB-CZ 3.46Å; M417-Y431 WeakPolarHBondContact CB-O 3.4Å; M417-Y431 HydrophobicContact CE-CD2 3.75Å; M417-Y431 HydrophobicContact CE-CE2 3.41Å; M417-Y431 VanDerWaalsContact CE-CE2 3.41Å; M417-Y431 HydrophobicContact CG-CE2 4.35Å; M417-Y431 PolarHBondContact N-O 2.67Å; M417-Y431 PolarHBondContact O-N 2.74Å; M417-Y431 HydrophobicContact SD-CE2 3.77Å; M417-W768 HydrophobicContact CE-CE3 3.8Å; M417-W768 HydrophobicContact CE-CH2 4.31Å; M417-W768 HydrophobicContact CE-CZ3 3.42Å; M417-W768 VanDerWaalsContact CE-CZ3 3.42Å
418	M	89.3	Confident	87.1	Confident	39 Å²	39	62.7 Å²	62.7	19%	0.192	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136	-178.6	-174.4	-175.6	-73.8	0	0	110.9	L411 Y420 R429 F430 L453	L411-M418 HydrophobicContact CD1-CE 4.46Å; L411-M418 HydrophobicContact CD2-CB 3.99Å; L411-M418 HydrophobicContact CD2-CE 4.41Å; M418-Y420 PolarHBondContact O-N 2.91Å; M418-R429 CarbonylContact C-O 3.33Å; M418-R429 WeakPolarHBondContact CA-O 3.07Å; M418-R429 WeakPolarHBondContact CG-O 3.27Å; M418-F430 HydrophobicContact CB-CD1 4.46Å; M418-F430 HydrophobicContact CE-CD1 4.08Å; M418-F430 HydrophobicContact CE-CE1 3.24Å; M418-F430 HydrophobicContact CE-CZ 3.68Å; M418-L453 HydrophobicContact CE-CD1 3.55Å
419	H	87.8	Confident	86.8	Confident	70 Å²	70	67.1 Å²	67.1	32%	0.324	34%	0.341	S	S	.	.			trans	-74.2	120.2	167.2	-70.3	-56.1	0	0	0	110.1	G421 F424 R429 Y431	H419-G421 PolarHBondContact O-N 3.23Å; H419-F424 HydrophobicContact CB-CD2 3.58Å; H419-F424 HydrophobicContact CB-CE2 3.82Å; H419-F424 HydrophobicContact CB-CG 4.25Å; H419-F424 AromaticContact CD2-CE2 3.99Å; H419-F424 AromaticContact CD2-CZ 3.99Å; H419-F424 AromaticContact CG-CE2 3.84Å; H419-R429 PolarHBondContact N-O 2.88Å; H419-Y431 AromaticContact CD2-CD1 3.59Å; H419-Y431 AromaticContact CE1-CD1 3.38Å; H419-Y431 WeakPolarHBondContact CE1-CD1 3.24Å; H419-Y431 AromaticContact CE1-CE1 3.44Å; H419-Y431 VanDerWaalsContact CE1-CE1 3.44Å; H419-Y431 WeakPolarHBondContact CE1-CE1 3.49Å; H419-Y431 AromaticContact CE1-CG 3.97Å; H419-Y431 AromaticContact CG-CD1 3.82Å; H419-Y431 AromaticContact CG-CE1 3.89Å; H419-Y431 AromaticContact ND1-CD1 3.7Å; H419-Y431 AromaticContact ND1-CE1 3.45Å; H419-Y431 WeakPolarHBondContact ND1-CE1 3.29Å; H419-Y431 AromaticContact NE2-CD1 3.32Å; H419-Y431 VanDerWaalsContact NE2-CD1 3.32Å; H419-Y431 WeakPolarHBondContact NE2-CD1 3.35Å; H419-Y431 AromaticContact NE2-CE1 3.88Å; H419-Y431 AromaticContact NE2-CG 3.78Å
420	Y	78.6	Confident	86.7	Confident	210 Å²	210	67.5 Å²	67.5	82%	0.824	34%	0.343	S	S	*	.			trans	-80	3.1	177.7	-61.4	-78.5	0	0	0	113.8	M418	M418-Y420 PolarHBondContact O-N 2.91Å
421	G	74.7	Confident	86.8	Confident	44 Å²	44	70.4 Å²	70.4	45%	0.454	35%	0.354	S	S	.	.	S	Bend	trans	-84.3	149.3	-179.1	0	0	0	0	0	113.7	H419 N423	H419-G421 PolarHBondContact O-N 3.23Å; G421-N423 VanDerWaalsContact C-N 3.26Å; G421-N423 PolarHBondContact O-N 3.2Å
422	K	68.3	Low	86.9	Confident	207 Å²	207	67.2 Å²	67.2	90%	0.9	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-5.4	-174.5	-67.4	-174.8	178.5	-179	0	116
423	N	80.6	Confident	87.1	Confident	149 Å²	149	66.2 Å²	66.2	80%	0.797	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-11.2	-171.5	-68.8	-2.2	0	0	0	114.2	G421	G421-N423 VanDerWaalsContact C-N 3.26Å; G421-N423 PolarHBondContact O-N 3.2Å
424	F	79.3	Confident	87.4	Confident	80 Å²	80	63.8 Å²	63.8	35%	0.351	32%	0.317	S	S	.	.			trans	-98.6	129.8	-175.8	-61.1	-80.1	0	0	0	110.8	H419 E428 R429	H419-F424 HydrophobicContact CB-CD2 3.58Å; H419-F424 HydrophobicContact CB-CE2 3.82Å; H419-F424 HydrophobicContact CB-CG 4.25Å; H419-F424 AromaticContact CD2-CE2 3.99Å; H419-F424 AromaticContact CD2-CZ 3.99Å; H419-F424 AromaticContact CG-CE2 3.84Å; F424-E428 HydrophobicContact CD1-CB 4.09Å; F424-E428 WeakPolarHBondContact CD1-O 3.46Å; F424-R429 HydrophobicContact CB-CB 4.44Å; F424-R429 HydrophobicContact CB-CG 3.84Å; F424-R429 VanDerWaalsContact O-CG 3.23Å; F424-R429 WeakPolarHBondContact O-CG 3.3Å
425	T	81.1	Confident	87.6	Confident	110 Å²	110	64.3 Å²	64.3	68%	0.675	32%	0.321	S	S	*	.			trans	-126.7	147.5	177.7	54.6	0	0	0	0	110.7
426	G	85.9	Confident	87.6	Confident	42 Å²	42	65.4 Å²	65.4	43%	0.433	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	69.5	-134	-179.6	0	0	0	0	0	112.9	R429	G426-R429 WeakPolarHBondContact O-CG 3.44Å; G426-R429 PolarHBondContact O-NE 3.11Å
427	N	88.9	Confident	87.7	Confident	46 Å²	46	65.5 Å²	65.5	25%	0.246	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-71.9	-30.6	-175.9	-66.1	-14.9	0	0	0	113.3	R429 F430 Y449 I450 L451	N427-R429 PolarHBondContact O-N 3.48Å; N427-F430 PolarHBondContact O-N 3Å; N427-Y449 HydrophobicContact CB-CE2 4.43Å; N427-Y449 PolarHBondContact ND2-O 3.01Å; N427-I450 WeakPolarHBondContact OD1-CA 3.22Å; N427-L451 PolarHBondContact OD1-N 3.17Å
428	E	87.4	Confident	87.8	Confident	131 Å²	131	64.4 Å²	64.4	61%	0.612	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-63.5	-10.3	-179.1	-60	-179	168.8	0	0	113.5	F424 F430	F424-E428 HydrophobicContact CD1-CB 4.09Å; F424-E428 WeakPolarHBondContact CD1-O 3.46Å; E428-F430 PolarHBondContact O-N 3.32Å
429	R	90.5	Very high	88.1	Confident	95 Å²	95	68 Å²	68	36%	0.358	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-67.4	-24.3	172.6	-65.1	-177.2	-61.2	163.6	5.4	112.4	M418 H419 F424 G426 N427	M418-R429 CarbonylContact C-O 3.33Å; M418-R429 WeakPolarHBondContact CA-O 3.07Å; M418-R429 WeakPolarHBondContact CG-O 3.27Å; H419-R429 PolarHBondContact N-O 2.88Å; F424-R429 HydrophobicContact CB-CB 4.44Å; F424-R429 HydrophobicContact CB-CG 3.84Å; F424-R429 VanDerWaalsContact O-CG 3.23Å; F424-R429 WeakPolarHBondContact O-CG 3.3Å; G426-R429 WeakPolarHBondContact O-CG 3.44Å; G426-R429 PolarHBondContact O-NE 3.11Å; N427-R429 PolarHBondContact O-N 3.48Å
430	F	92.9	Very high	88.4	Confident	9 Å²	9	65.9 Å²	65.9	4%	0.039	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	141.6	-175.5	-56.7	-80.3	0	0	0	110.6	L411 V416 M417 M418 N427 E428 V435 L451 L453	L411-F430 HydrophobicContact CD2-CD1 4.26Å; L411-F430 HydrophobicContact CD2-CE1 4.18Å; V416-F430 HydrophobicContact CG1-CB 4.45Å; V416-F430 HydrophobicContact CG1-CD1 4.11Å; M417-F430 CarbonylContact O-C 3.5Å; M417-F430 VanDerWaalsContact O-CA 3.27Å; M417-F430 WeakPolarHBondContact O-CA 3.47Å; M418-F430 HydrophobicContact CB-CD1 4.46Å; M418-F430 HydrophobicContact CE-CD1 4.08Å; M418-F430 HydrophobicContact CE-CE1 3.24Å; M418-F430 HydrophobicContact CE-CZ 3.68Å; N427-F430 PolarHBondContact O-N 3Å; E428-F430 PolarHBondContact O-N 3.32Å; F430-V435 HydrophobicContact CB-CG2 4.13Å; F430-L451 HydrophobicContact CB-CD1 3.87Å; F430-L451 HydrophobicContact CD2-CB 3.68Å; F430-L451 HydrophobicContact CD2-CD1 3.84Å; F430-L451 HydrophobicContact CD2-CG 4.42Å; F430-L451 HydrophobicContact CE2-CB 3.79Å; F430-L451 HydrophobicContact CG-CD1 4.13Å; F430-L453 HydrophobicContact CE1-CD1 4.09Å; F430-L453 HydrophobicContact CE1-CD2 3.84Å; F430-L453 HydrophobicContact CE1-CG 3.87Å; F430-L453 HydrophobicContact CZ-CD1 4.3Å; F430-L453 HydrophobicContact CZ-CD2 4.33Å; F430-L453 HydrophobicContact CZ-CG 3.93Å
431	Y	93.4	Very high	89.1	Confident	76 Å²	76	55.9 Å²	55.9	30%	0.298	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	154.4	175.2	69.6	-83.3	0	0	0	109.6	M417 H419 W768	M417-Y431 WeakPolarHBondContact CA-O 3.11Å; M417-Y431 HydrophobicContact CB-CD1 4.07Å; M417-Y431 HydrophobicContact CB-CD2 4.11Å; M417-Y431 HydrophobicContact CB-CE1 3.64Å; M417-Y431 HydrophobicContact CB-CE2 3.72Å; M417-Y431 HydrophobicContact CB-CG 4.3Å; M417-Y431 VanDerWaalsContact CB-CZ 3.46Å; M417-Y431 WeakPolarHBondContact CB-O 3.4Å; M417-Y431 HydrophobicContact CE-CD2 3.75Å; M417-Y431 HydrophobicContact CE-CE2 3.41Å; M417-Y431 VanDerWaalsContact CE-CE2 3.41Å; M417-Y431 HydrophobicContact CG-CE2 4.35Å; M417-Y431 PolarHBondContact N-O 2.67Å; M417-Y431 PolarHBondContact O-N 2.74Å; M417-Y431 HydrophobicContact SD-CE2 3.77Å; H419-Y431 AromaticContact CD2-CD1 3.59Å; H419-Y431 AromaticContact CE1-CD1 3.38Å; H419-Y431 WeakPolarHBondContact CE1-CD1 3.24Å; H419-Y431 AromaticContact CE1-CE1 3.44Å; H419-Y431 VanDerWaalsContact CE1-CE1 3.44Å; H419-Y431 WeakPolarHBondContact CE1-CE1 3.49Å; H419-Y431 AromaticContact CE1-CG 3.97Å; H419-Y431 AromaticContact CG-CD1 3.82Å; H419-Y431 AromaticContact CG-CE1 3.89Å; H419-Y431 AromaticContact ND1-CD1 3.7Å; H419-Y431 AromaticContact ND1-CE1 3.45Å; H419-Y431 WeakPolarHBondContact ND1-CE1 3.29Å; H419-Y431 AromaticContact NE2-CD1 3.32Å; H419-Y431 VanDerWaalsContact NE2-CD1 3.32Å; H419-Y431 WeakPolarHBondContact NE2-CD1 3.35Å; H419-Y431 AromaticContact NE2-CE1 3.88Å; H419-Y431 AromaticContact NE2-CG 3.78Å; Y431-W768 AromaticContact CD2-CH2 3.73Å; Y431-W768 HydrophobicContact CD2-CH2 3.73Å; Y431-W768 AromaticContact CD2-CZ3 3.94Å; Y431-W768 HydrophobicContact CD2-CZ3 3.94Å; Y431-W768 HydrophobicContact CE2-CZ3 4.31Å
432	G	94	Very high	90	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.275	C	S	.	.	S	Bend	trans	145.6	177	179.2	0	0	0	0	0	112.5	P414 Y415 C434 V435 D436 W768	P414-G432 WeakPolarHBondContact O-CA 2.96Å; Y415-G432 CarbonylContact O-C 3.41Å; Y415-G432 VanDerWaalsContact O-C 3.26Å; Y415-G432 WeakPolarHBondContact O-CA 2.96Å; G432-C434 PolarHBondContact O-N 3.48Å; G432-V435 PolarHBondContact O-N 3.3Å; G432-V435 VanDerWaalsContact O-N 3.15Å; G432-D436 PolarHBondContact O-N 3.49Å; G432-W768 VanDerWaalsContact C-CE2 3.44Å; G432-W768 VanDerWaalsContact C-CZ2 3.46Å; G432-W768 VanDerWaalsContact CA-CZ2 3.46Å
433	F	95.1	Very high	91.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-58.4	-44.8	-176.6	176.4	-99.8	0	0	0	113.4	P414 Y415 V435 I437 F503 M504 I761 L764 W768 W769	P414-F433 PolarHBondContact O-N 3.27Å; Y415-F433 HydrophobicContact CD1-CD1 4.24Å; Y415-F433 PolarHBondContact O-N 3.1Å; Y415-F433 VanDerWaalsContact O-N 3.08Å; F433-V435 VanDerWaalsContact C-N 3.31Å; F433-V435 PolarHBondContact O-N 3Å; F433-I437 HydrophobicContact CD1-CD1 3.96Å; F433-I437 HydrophobicContact CE1-CD1 3.29Å; F433-I437 HydrophobicContact CE1-CG1 4.42Å; F433-I437 HydrophobicContact CE2-CD1 3.94Å; F433-I437 HydrophobicContact CZ-CD1 3.29Å; F433-I437 HydrophobicContact CZ-CG1 4.31Å; F433-I437 WeakPolarHBondContact O-CG1 3.15Å; F433-I437 PolarHBondContact O-N 3Å; F433-I437 VanDerWaalsContact O-N 3.11Å; F433-F503 HydrophobicContact CE1-CD2 4.17Å; F433-F503 AromaticContact CE1-CE2 3.86Å; F433-F503 HydrophobicContact CE1-CE2 3.86Å; F433-M504 HydrophobicContact CD1-CE 4.34Å; F433-M504 HydrophobicContact CE1-CE 3.38Å; F433-M504 HydrophobicContact CE2-CE 4.12Å; F433-M504 HydrophobicContact CZ-CE 3.23Å; F433-I761 HydrophobicContact CZ-CG2 4.18Å; F433-L764 HydrophobicContact CD2-CB 3.95Å; F433-L764 HydrophobicContact CE2-CB 3.7Å; F433-W768 HydrophobicContact CB-CB 4.25Å; F433-W768 HydrophobicContact CB-CD2 4.48Å; F433-W768 HydrophobicContact CB-CG 3.88Å; F433-W768 AromaticContact CD2-CD1 3.77Å; F433-W768 HydrophobicContact CD2-CG 4.4Å; F433-W769 HydrophobicContact CB-CH2 4.49Å; F433-W769 HydrophobicContact CB-CZ3 3.93Å; F433-W769 HydrophobicContact CD1-CZ3 4.32Å; F433-W769 HydrophobicContact CD2-CZ3 4.01Å; F433-W769 HydrophobicContact CG-CH2 4.42Å; F433-W769 AromaticContact CG-CZ3 3.83Å; F433-W769 HydrophobicContact CG-CZ3 3.83Å
434	C	95.6	Very high	91.5	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.014	24%	0.242	C	C	.	.	H	α-helix	trans	-72.7	-26.1	179.8	-72.3	0	0	0	0	112.4	Y415 V416 G432 L438 V484	Y415-C434 WeakPolarHBondContact O-CB 3.2Å; Y415-C434 PolarHBondContact O-N 3.08Å; V416-C434 HydrophobicContact CG2-CB 3.79Å; G432-C434 PolarHBondContact O-N 3.48Å; C434-L438 VanDerWaalsContact O-CB 3.3Å; C434-L438 WeakPolarHBondContact O-CB 3.24Å; C434-L438 PolarHBondContact O-N 3.31Å; C434-V484 HydrophobicContact CB-CG1 3.99Å
435	V	95.5	Very high	91.9	Very high	13 Å²	13	47.6 Å²	47.6	8%	0.079	24%	0.236	C	C	.	.	H	α-helix	trans	-71.4	-46.7	175.2	-176	0	0	0	0	110.3	V416 F430 G432 F433 I437 L438 E439 L451	V416-V435 HydrophobicContact CG1-CG2 4.15Å; V416-V435 HydrophobicContact CG2-CG2 4.19Å; F430-V435 HydrophobicContact CB-CG2 4.13Å; G432-V435 PolarHBondContact O-N 3.3Å; G432-V435 VanDerWaalsContact O-N 3.15Å; F433-V435 VanDerWaalsContact C-N 3.31Å; F433-V435 PolarHBondContact O-N 3Å; V435-I437 VanDerWaalsContact C-N 3.33Å; V435-I437 PolarHBondContact O-N 3.24Å; V435-L438 PolarHBondContact O-N 3.07Å; V435-E439 PolarHBondContact O-N 3.34Å; V435-L451 HydrophobicContact CG1-CD1 4.32Å
436	D	95.3	Very high	92.1	Very high	24 Å²	24	44.5 Å²	44.5	13%	0.128	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-40	177	-71.5	4.3	0	0	0	111.9	G432 T440 L764 K767 W768	G432-D436 PolarHBondContact O-N 3.49Å; D436-T440 PolarHBondContact O-N 3.32Å; D436-T440 VanDerWaalsContact O-N 3.1Å; D436-T440 PolarHBondContact O-OG1 2.81Å; D436-L764 HydrophobicContact CB-CD1 4.17Å; D436-L764 HydrophobicContact CB-CD2 3.84Å; D436-K767 IonicContact OD2-NZ 3.08Å; D436-K767 PolarHBondContact OD2-NZ 3.36Å; D436-W768 WeakPolarHBondContact OD2-CZ2 3.12Å; D436-W768 PolarHBondContact OD2-NE1 2.98Å
437	I	95.1	Very high	92.2	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.015	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-47.6	174.5	-76	-178	0	0	0	110.8	F433 V435 E439 T440 I441 F503 I761 L764	F433-I437 HydrophobicContact CD1-CD1 3.96Å; F433-I437 HydrophobicContact CE1-CD1 3.29Å; F433-I437 HydrophobicContact CE1-CG1 4.42Å; F433-I437 HydrophobicContact CE2-CD1 3.94Å; F433-I437 HydrophobicContact CZ-CD1 3.29Å; F433-I437 HydrophobicContact CZ-CG1 4.31Å; F433-I437 WeakPolarHBondContact O-CG1 3.15Å; F433-I437 PolarHBondContact O-N 3Å; F433-I437 VanDerWaalsContact O-N 3.11Å; V435-I437 VanDerWaalsContact C-N 3.33Å; V435-I437 PolarHBondContact O-N 3.24Å; I437-E439 VanDerWaalsContact C-N 3.33Å; I437-E439 PolarHBondContact O-N 2.95Å; I437-T440 PolarHBondContact O-N 2.66Å; I437-I441 HydrophobicContact CG2-CD1 3.54Å; I437-I441 HydrophobicContact CG2-CG1 4.28Å; I437-I441 VanDerWaalsContact O-CG1 3.32Å; I437-I441 WeakPolarHBondContact O-CG1 3.49Å; I437-I441 PolarHBondContact O-N 3.11Å; I437-F503 HydrophobicContact CD1-CD2 3.99Å; I437-F503 HydrophobicContact CD1-CE2 4.41Å; I437-I761 HydrophobicContact CD1-CG1 4.32Å; I437-L764 HydrophobicContact CG1-CD1 3.68Å
438	L	95.4	Very high	92.2	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-60.8	-43.4	-179.8	176.6	59.8	0	0	0	111.7	V407 C434 V435 T440 I441 S442 F447 Y449 L451 V484	V407-L438 HydrophobicContact CB-CD2 4.35Å; V407-L438 HydrophobicContact CG1-CD2 3.9Å; V407-L438 HydrophobicContact CG2-CD1 4.47Å; V407-L438 HydrophobicContact CG2-CD2 4.17Å; C434-L438 VanDerWaalsContact O-CB 3.3Å; C434-L438 WeakPolarHBondContact O-CB 3.24Å; C434-L438 PolarHBondContact O-N 3.31Å; V435-L438 PolarHBondContact O-N 3.07Å; L438-T440 VanDerWaalsContact C-N 3.31Å; L438-T440 PolarHBondContact O-N 3.44Å; L438-I441 PolarHBondContact O-N 2.68Å; L438-S442 WeakPolarHBondContact O-CB 3.33Å; L438-S442 PolarHBondContact O-N 3.36Å; L438-F447 HydrophobicContact CD1-CE2 4.25Å; L438-F447 HydrophobicContact CD1-CZ 4.24Å; L438-Y449 HydrophobicContact CD2-CD2 3.66Å; L438-Y449 HydrophobicContact CD2-CE2 3.61Å; L438-Y449 HydrophobicContact CD2-CG 4.22Å; L438-Y449 HydrophobicContact CG-CD1 4.4Å; L438-Y449 HydrophobicContact CG-CD2 4.22Å; L438-Y449 HydrophobicContact CG-CE1 4.25Å; L438-Y449 HydrophobicContact CG-CE2 4.07Å; L438-Y449 HydrophobicContact CG-CG 4.38Å; L438-L451 HydrophobicContact CD2-CD2 3.79Å; L438-L451 HydrophobicContact CD2-CG 4.41Å; L438-V484 HydrophobicContact CB-CG1 4.35Å; L438-V484 HydrophobicContact CD1-CG2 4.09Å; L438-V484 HydrophobicContact CD2-CG2 4.39Å
439	E	94.7	Very high	92.5	Very high	115 Å²	115	39.8 Å²	39.8	54%	0.537	19%	0.193	S	C	.	.	H	α-helix	trans	-59.8	-43.5	176.2	-175.1	178.7	-173.1	0	0	111.3	V435 I437 S442 R443	V435-E439 PolarHBondContact O-N 3.34Å; I437-E439 VanDerWaalsContact C-N 3.33Å; I437-E439 PolarHBondContact O-N 2.95Å; E439-S442 PolarHBondContact O-N 2.93Å; E439-R443 PolarHBondContact O-N 3.44Å
440	T	93.8	Very high	92.6	Very high	25 Å²	25	39.8 Å²	39.8	15%	0.153	20%	0.199	C	C	.	.	H	α-helix	trans	-65.6	-45.1	179.1	-51.9	0	0	0	0	111.6	D436 I437 L438 R443 E444 L755	D436-T440 PolarHBondContact O-N 3.32Å; D436-T440 VanDerWaalsContact O-N 3.1Å; D436-T440 PolarHBondContact O-OG1 2.81Å; I437-T440 PolarHBondContact O-N 2.66Å; L438-T440 VanDerWaalsContact C-N 3.31Å; L438-T440 PolarHBondContact O-N 3.44Å; T440-R443 PolarHBondContact O-N 3.37Å; T440-E444 PolarHBondContact O-N 3.44Å; T440-E444 VanDerWaalsContact O-N 3.15Å; T440-L755 HydrophobicContact CG2-CD1 4.15Å; T440-L755 HydrophobicContact CG2-CD2 3.5Å; T440-L755 HydrophobicContact CG2-CG 4.48Å
441	I	94.4	Very high	92.6	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-63.3	-44.7	176.6	-69.6	171.3	0	0	0	110.8	I437 L438 R443 E444 V445 F447 I736 I748 I752 L755	I437-I441 HydrophobicContact CG2-CD1 3.54Å; I437-I441 HydrophobicContact CG2-CG1 4.28Å; I437-I441 VanDerWaalsContact O-CG1 3.32Å; I437-I441 WeakPolarHBondContact O-CG1 3.49Å; I437-I441 PolarHBondContact O-N 3.11Å; L438-I441 PolarHBondContact O-N 2.68Å; I441-R443 VanDerWaalsContact C-N 3.28Å; I441-R443 PolarHBondContact O-N 3.26Å; I441-E444 PolarHBondContact O-N 3.03Å; I441-V445 HydrophobicContact CG2-CG2 4.08Å; I441-V445 WeakPolarHBondContact O-CB 3.35Å; I441-V445 WeakPolarHBondContact O-CG2 3.34Å; I441-V445 PolarHBondContact O-N 3.39Å; I441-F447 HydrophobicContact CG2-CE1 4Å; I441-F447 HydrophobicContact CG2-CZ 4.07Å; I441-I736 HydrophobicContact CD1-CD1 3.63Å; I441-I748 HydrophobicContact CD1-CG2 4.26Å; I441-I748 HydrophobicContact CG2-CB 4.45Å; I441-I748 HydrophobicContact CG2-CG1 4.1Å; I441-I748 HydrophobicContact CG2-CG2 3.94Å; I441-I752 HydrophobicContact CD1-CD1 4.3Å; I441-I752 HydrophobicContact CD1-CG1 3.74Å; I441-L755 HydrophobicContact CG1-CD1 3.73Å
442	S	93.1	Very high	92.6	Very high	17 Å²	17	39.4 Å²	39.4	12%	0.119	20%	0.202	C	C	.	.	H	α-helix	trans	-56.4	-43.1	177.6	157.3	0	0	0	0	111.4	L438 E439 G446 F447	L438-S442 WeakPolarHBondContact O-CB 3.33Å; L438-S442 PolarHBondContact O-N 3.36Å; E439-S442 PolarHBondContact O-N 2.93Å; S442-G446 VanDerWaalsContact O-CA 3.3Å; S442-G446 WeakPolarHBondContact O-CA 3.43Å; S442-G446 PolarHBondContact O-N 3.45Å; S442-F447 WeakPolarHBondContact CB-O 3.27Å; S442-F447 PolarHBondContact O-N 3.17Å; S442-F447 PolarHBondContact OG-O 2.98Å
443	R	90.8	Very high	92.6	Very high	191 Å²	191	41.9 Å²	41.9	72%	0.721	22%	0.215	S	C	*	.	H	α-helix	trans	-68.1	-36.5	177.8	-172.1	179	64.1	-177.5	-2.5	113.6	E439 T440 I441	E439-R443 PolarHBondContact O-N 3.44Å; T440-R443 PolarHBondContact O-N 3.37Å; I441-R443 VanDerWaalsContact C-N 3.28Å; I441-R443 PolarHBondContact O-N 3.26Å
444	E	88.6	Confident	92.5	Very high	60 Å²	60	42.1 Å²	42.1	28%	0.28	22%	0.217	S	C	.	.	H	α-helix	trans	-78.6	-40.8	-179.2	-72.6	-176.5	175.8	0	0	112.9	T440 I441 R758	T440-E444 PolarHBondContact O-N 3.44Å; T440-E444 VanDerWaalsContact O-N 3.15Å; I441-E444 PolarHBondContact O-N 3.03Å; E444-R758 IonicContact OE1-CZ 3.95Å; E444-R758 IonicContact OE1-NH1 3.92Å; E444-R758 PolarHBondContact OE1-NH1 3.32Å; E444-R758 IonicContact OE1-NH2 3.97Å; E444-R758 PolarHBondContact OE1-NH2 2.91Å; E444-R758 IonicContact OE2-NH2 2.75Å; E444-R758 PolarHBondContact OE2-NH2 3.27Å
445	V	88.9	Confident	92.2	Very high	37 Å²	37	46.9 Å²	46.9	22%	0.224	25%	0.247	C	C	.	.	H	α-helix	trans	-82.5	-26.7	-179.8	-177.7	0	0	0	0	111.4	I441 F447 W744 K747 A751	I441-V445 HydrophobicContact CG2-CG2 4.08Å; I441-V445 WeakPolarHBondContact O-CB 3.35Å; I441-V445 WeakPolarHBondContact O-CG2 3.34Å; I441-V445 PolarHBondContact O-N 3.39Å; V445-F447 HydrophobicContact CB-CD1 3.78Å; V445-F447 HydrophobicContact CB-CE1 3.83Å; V445-F447 HydrophobicContact CG1-CD1 3.79Å; V445-F447 HydrophobicContact CG1-CE1 4.09Å; V445-F447 HydrophobicContact CG2-CE1 4.39Å; V445-W744 HydrophobicContact CG1-CE3 4.08Å; V445-W744 HydrophobicContact CG1-CZ3 3.86Å; V445-K747 HydrophobicContact CG1-CB 4.03Å; V445-K747 HydrophobicContact CG1-CD 4.4Å; V445-A751 HydrophobicContact CG2-CB 3.72Å
446	G	84.9	Confident	91.8	Very high	45 Å²	45	49.5 Å²	49.5	46%	0.464	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	49.7	175.5	0	0	0	0	0	114.2	S442	S442-G446 VanDerWaalsContact O-CA 3.3Å; S442-G446 WeakPolarHBondContact O-CA 3.43Å; S442-G446 PolarHBondContact O-N 3.45Å
447	F	87.2	Confident	91.4	Very high	3 Å²	3	58 Å²	58	1%	0.013	29%	0.292	C	S	.	.			trans	-126.9	147.6	173.4	64.7	-95.9	0	0	0	111.6	L405 L438 I441 S442 V445 Y449 L482 W744 I748	L405-F447 HydrophobicContact CB-CD2 4.45Å; L405-F447 HydrophobicContact CD1-CB 4.28Å; L405-F447 HydrophobicContact CD1-CD1 4.33Å; L405-F447 HydrophobicContact CD1-CD2 3.57Å; L405-F447 HydrophobicContact CD1-CE2 3.92Å; L405-F447 HydrophobicContact CD1-CG 3.81Å; L405-F447 HydrophobicContact CD1-CZ 4.43Å; L405-F447 HydrophobicContact CG-CB 4.48Å; L405-F447 HydrophobicContact CG-CD2 4.03Å; L405-F447 HydrophobicContact CG-CG 4.4Å; L438-F447 HydrophobicContact CD1-CE2 4.25Å; L438-F447 HydrophobicContact CD1-CZ 4.24Å; I441-F447 HydrophobicContact CG2-CE1 4Å; I441-F447 HydrophobicContact CG2-CZ 4.07Å; S442-F447 WeakPolarHBondContact CB-O 3.27Å; S442-F447 PolarHBondContact O-N 3.17Å; S442-F447 PolarHBondContact OG-O 2.98Å; V445-F447 HydrophobicContact CB-CD1 3.78Å; V445-F447 HydrophobicContact CB-CE1 3.83Å; V445-F447 HydrophobicContact CG1-CD1 3.79Å; V445-F447 HydrophobicContact CG1-CE1 4.09Å; V445-F447 HydrophobicContact CG2-CE1 4.39Å; F447-Y449 HydrophobicContact CE2-CD1 4.38Å; F447-L482 HydrophobicContact CE2-CD1 4.31Å; F447-L482 HydrophobicContact CZ-CD1 4.34Å; F447-W744 HydrophobicContact CB-CH2 3.93Å; F447-W744 HydrophobicContact CB-CZ3 4.03Å; F447-W744 HydrophobicContact CD1-CE3 4.25Å; F447-W744 AromaticContact CD1-CZ3 3.96Å; F447-W744 HydrophobicContact CD1-CZ3 3.96Å; F447-W744 HydrophobicContact CG-CZ3 4.33Å; F447-I748 HydrophobicContact CE1-CG1 4.39Å
448	D	89.6	Confident	91.1	Very high	87 Å²	87	62.3 Å²	62.3	47%	0.465	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	159.5	168.9	-67.1	-47.3	0	0	0	109.8	V403 T404 L405	V403-D448 PolarHBondContact O-N 2.9Å; V403-D448 VanDerWaalsContact O-O 3.07Å; T404-D448 CarbonylContact C-O 3.54Å; T404-D448 VanDerWaalsContact CA-O 3.25Å; T404-D448 WeakPolarHBondContact CA-O 3.33Å; T404-D448 HydrophobicContact CG2-CB 4.15Å; L405-D448 PolarHBondContact N-O 2.94Å
449	Y	93	Very high	90.7	Very high	30 Å²	30	63.6 Å²	63.6	12%	0.118	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	159.2	178.4	63.9	-86.3	0	0	0	113.1	L405 V407 N427 L438 F447 L451	L405-Y449 CarbonylContact O-C 3.56Å; L405-Y449 VanDerWaalsContact O-CA 3.22Å; L405-Y449 WeakPolarHBondContact O-CA 3.12Å; V407-Y449 HydrophobicContact CG2-CD2 4.46Å; V407-Y449 HydrophobicContact CG2-CG 4.43Å; N427-Y449 HydrophobicContact CB-CE2 4.43Å; N427-Y449 PolarHBondContact ND2-O 3.01Å; L438-Y449 HydrophobicContact CD2-CD2 3.66Å; L438-Y449 HydrophobicContact CD2-CE2 3.61Å; L438-Y449 HydrophobicContact CD2-CG 4.22Å; L438-Y449 HydrophobicContact CG-CD1 4.4Å; L438-Y449 HydrophobicContact CG-CD2 4.22Å; L438-Y449 HydrophobicContact CG-CE1 4.25Å; L438-Y449 HydrophobicContact CG-CE2 4.07Å; L438-Y449 HydrophobicContact CG-CG 4.38Å; F447-Y449 HydrophobicContact CE2-CD1 4.38Å; Y449-L451 HydrophobicContact CD2-CG 4.06Å; Y449-L451 HydrophobicContact CE2-CD1 4.06Å; Y449-L451 HydrophobicContact CE2-CG 3.96Å
450	I	93.3	Very high	90.3	Very high	95 Å²	95	58.2 Å²	58.2	49%	0.487	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125.2	169.9	-64.3	165.7	0	0	0	108.2	T404 L405 V407 N427	T404-I450 HydrophobicContact CG2-CD1 3.73Å; T404-I450 HydrophobicContact CG2-CG1 3.66Å; L405-I450 PolarHBondContact O-N 2.93Å; V407-I450 PolarHBondContact N-O 3.42Å; N427-I450 WeakPolarHBondContact OD1-CA 3.22Å
451	L	93.9	Very high	89.9	Confident	7 Å²	7	58.2 Å²	58.2	4%	0.037	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	124.4	175.2	-75.7	169.4	0	0	0	111.3	V407 T409 N427 F430 V435 L438 Y449	V407-L451 HydrophobicContact CB-CD2 4.02Å; V407-L451 HydrophobicContact CG1-CD2 3.84Å; V407-L451 WeakPolarHBondContact O-CA 3.35Å; T409-L451 HydrophobicContact CG2-CD2 4.23Å; N427-L451 PolarHBondContact OD1-N 3.17Å; F430-L451 HydrophobicContact CB-CD1 3.87Å; F430-L451 HydrophobicContact CD2-CB 3.68Å; F430-L451 HydrophobicContact CD2-CD1 3.84Å; F430-L451 HydrophobicContact CD2-CG 4.42Å; F430-L451 HydrophobicContact CE2-CB 3.79Å; F430-L451 HydrophobicContact CG-CD1 4.13Å; V435-L451 HydrophobicContact CG1-CD1 4.32Å; L438-L451 HydrophobicContact CD2-CD2 3.79Å; L438-L451 HydrophobicContact CD2-CG 4.41Å; Y449-L451 HydrophobicContact CD2-CG 4.06Å; Y449-L451 HydrophobicContact CE2-CD1 4.06Å; Y449-L451 HydrophobicContact CE2-CG 3.96Å
452	D	93.1	Very high	89.5	Confident	71 Å²	71	64 Å²	64	38%	0.38	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	153.3	173.3	-157.5	7.3	0	0	0	111.7	V407 I408 T409	V407-D452 PolarHBondContact O-N 3.03Å; I408-D452 CarbonylContact C-O 3.52Å; I408-D452 WeakPolarHBondContact CA-O 3.25Å; I408-D452 HydrophobicContact CD1-CB 4.17Å; T409-D452 PolarHBondContact N-O 3.36Å
453	L	93.2	Very high	89	Confident	51 Å²	51	66 Å²	66	27%	0.267	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	138.4	-177.5	-75	177.8	0	0	0	111.8	T409 L411 M418 F430 P455	T409-L453 HydrophobicContact CG2-CD2 3.96Å; L411-L453 HydrophobicContact CD1-CD1 4.16Å; L411-L453 HydrophobicContact CD2-CD2 3.97Å; L411-L453 HydrophobicContact CG-CD1 4.22Å; L411-L453 HydrophobicContact CG-CD2 3.82Å; M418-L453 HydrophobicContact CE-CD1 3.55Å; F430-L453 HydrophobicContact CE1-CD1 4.09Å; F430-L453 HydrophobicContact CE1-CD2 3.84Å; F430-L453 HydrophobicContact CE1-CG 3.87Å; F430-L453 HydrophobicContact CZ-CD1 4.3Å; F430-L453 HydrophobicContact CZ-CD2 4.33Å; F430-L453 HydrophobicContact CZ-CG 3.93Å; L453-P455 WeakPolarHBondContact O-CD 3.21Å
454	V	93.1	Very high	88.5	Confident	5 Å²	5	62.4 Å²	62.4	3%	0.03	33%	0.329	C	S	.	.			trans	-62.5	125.4	172.5	70.3	0	0	0	0	110.6	I408 T409 I410 D456 R457 M472 Q475	I408-V454 HydrophobicContact CG1-CB 4.11Å; T409-V454 PolarHBondContact O-N 3.25Å; I410-V454 HydrophobicContact CB-CG1 4.05Å; I410-V454 HydrophobicContact CD1-CG1 4.34Å; I410-V454 HydrophobicContact CG1-CG1 4.13Å; V454-D456 VanDerWaalsContact CG2-OD1 3.26Å; V454-D456 WeakPolarHBondContact CG2-OD1 3.39Å; V454-D456 PolarHBondContact O-N 2.95Å; V454-R457 PolarHBondContact O-N 2.78Å; V454-M472 HydrophobicContact CB-CG 3.78Å; V454-M472 HydrophobicContact CG1-CG 4.04Å; V454-M472 HydrophobicContact CG2-CG 3.89Å; V454-Q475 HydrophobicContact CG2-CG 4.3Å
455	P	89.8	Confident	88.3	Confident	102 Å²	102	68.4 Å²	68.4	66%	0.662	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-36	-172.6	-26.9	34.8	0	0	0	114.9	L453	L453-P455 WeakPolarHBondContact O-CD 3.21Å
456	D	87.1	Confident	88.2	Confident	68 Å²	68	70.9 Å²	70.9	36%	0.364	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-0.8	-174.4	67.8	-4.1	0	0	0	113.7	V454 K458 G471	V454-D456 VanDerWaalsContact CG2-OD1 3.26Å; V454-D456 WeakPolarHBondContact CG2-OD1 3.39Å; V454-D456 PolarHBondContact O-N 2.95Å; D456-K458 PolarHBondContact O-N 3.36Å; D456-K458 PolarHBondContact OD1-N 3.33Å; D456-K458 VanDerWaalsContact OD1-N 3.12Å; D456-G471 WeakPolarHBondContact OD1-CA 3.48Å; D456-G471 VanDerWaalsContact OD2-CA 3.31Å; D456-G471 WeakPolarHBondContact OD2-CA 3.3Å; D456-G471 PolarHBondContact OD2-N 3.13Å
457	R	87.5	Confident	88.1	Confident	204 Å²	204	70.4 Å²	70.4	77%	0.77	37%	0.368	S	S	*	.			trans	53.8	33.7	-177.7	-56.1	-177.4	-177.7	-175.8	-0.6	113.8	I410 V454	I410-R457 WeakPolarHBondContact CD1-O 3.48Å; V454-R457 PolarHBondContact O-N 2.78Å
458	K	87.2	Confident	88.2	Confident	92 Å²	92	77 Å²	77	40%	0.4	40%	0.398	S	S	.	.			trans	-116.9	147.6	176.5	-68.2	179.6	-178.4	-172.8	0	111.3	D456 G460 G471 M472	D456-K458 PolarHBondContact O-N 3.36Å; D456-K458 PolarHBondContact OD1-N 3.33Å; D456-K458 VanDerWaalsContact OD1-N 3.12Å; K458-G460 VanDerWaalsContact C-N 3.33Å; K458-G471 CarbonylContact O-C 3.58Å; K458-G471 WeakPolarHBondContact O-CA 3.39Å; K458-M472 PolarHBondContact O-N 2.88Å; K458-M472 VanDerWaalsContact O-N 3.09Å
459	Y	87	Confident	88.2	Confident	29 Å²	29	74.8 Å²	74.8	11%	0.114	38%	0.383	C	S	.	.			trans	-65.8	-37.9	173.3	-72.6	-80.2	0	0	0	112.4	I410 E412 M472 V473 S486	I410-Y459 HydrophobicContact CD1-CE2 4.37Å; I410-Y459 HydrophobicContact CG2-CD1 4.46Å; I410-Y459 HydrophobicContact CG2-CE1 3.76Å; E412-Y459 PolarHBondContact OE1-OH 2.9Å; E412-Y459 PolarHBondContact OE2-OH 2.69Å; Y459-M472 HydrophobicContact CD1-CE 3.28Å; Y459-M472 HydrophobicContact CE1-CE 3.76Å; Y459-M472 HydrophobicContact CG-CE 4.14Å; Y459-M472 PolarHBondContact O-N 2.87Å; Y459-V473 PolarHBondContact O-N 2.87Å; Y459-S486 PolarHBondContact OH-OG 3.21Å
460	G	86.9	Confident	88	Confident	3 Å²	3	75.6 Å²	75.6	3%	0.031	39%	0.39	C	S	.	.			trans	118.8	115.4	-176.1	0	0	0	0	0	111.2	K458 N470 R493	K458-G460 VanDerWaalsContact C-N 3.33Å; G460-N470 WeakPolarHBondContact CA-O 3.48Å; G460-N470 WeakPolarHBondContact CA-OD1 3.48Å; G460-R493 PolarHBondContact O-NE 3.39Å; G460-R493 PolarHBondContact O-NH2 3.49Å
461	A	85.3	Confident	87.9	Confident	25 Å²	25	71.1 Å²	71.1	21%	0.207	37%	0.367	C	S	.	.			trans	-134.3	147.6	174.1	0	0	0	0	0	108.5	N470	A461-N470 PolarHBondContact N-OD1 3.1Å; A461-N470 PolarHBondContact O-OD1 2.96Å; A461-N470 VanDerWaalsContact O-OD1 3.12Å
462	K	85.4	Confident	87.9	Confident	122 Å²	122	70.9 Å²	70.9	53%	0.53	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-76.9	124.3	174.8	-169.9	176.8	-177.7	179.9	0	109	G467 W469	K462-G467 WeakPolarHBondContact CE-O 3.28Å; K462-W469 HydrophobicContact CB-CD2 4.14Å; K462-W469 HydrophobicContact CB-CE3 4.27Å; K462-W469 HydrophobicContact CB-CH2 4.17Å; K462-W469 HydrophobicContact CB-CZ2 4.02Å; K462-W469 HydrophobicContact CB-CZ3 4.29Å; K462-W469 HydrophobicContact CD-CZ2 4.46Å
463	D	83.9	Confident	87.8	Confident	60 Å²	60	67.5 Å²	67.5	32%	0.321	35%	0.348	S	S	.	.			trans	-69.1	123.9	172.7	179.9	-0.2	0	0	0	109.3	E465 T466 G467 E468	D463-E465 VanDerWaalsContact C-N 3.28Å; D463-E465 PolarHBondContact O-N 3.3Å; D463-E465 PolarHBondContact OD1-N 3.09Å; D463-E465 VanDerWaalsContact OD1-N 3.08Å; D463-T466 VanDerWaalsContact CB-OG1 3.26Å; D463-T466 WeakPolarHBondContact CB-OG1 3.38Å; D463-T466 WeakPolarHBondContact OD2-CG2 3.42Å; D463-T466 PolarHBondContact OD2-OG1 3.4Å; D463-G467 VanDerWaalsContact O-CA 3.22Å; D463-G467 WeakPolarHBondContact O-CA 3.39Å; D463-G467 PolarHBondContact O-N 3.02Å; D463-E468 PolarHBondContact N-O 3.32Å
464	P	79.3	Confident	87.8	Confident	115 Å²	115	65.9 Å²	65.9	75%	0.747	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-25.1	-179.3	26	-35	0	0	0	114
465	E	84.6	Confident	87.7	Confident	186 Å²	186	68.2 Å²	68.2	87%	0.869	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-47.2	-177.8	-62.2	-153	158.2	0	0	112.6	D463	D463-E465 VanDerWaalsContact C-N 3.28Å; D463-E465 PolarHBondContact O-N 3.3Å; D463-E465 PolarHBondContact OD1-N 3.09Å; D463-E465 VanDerWaalsContact OD1-N 3.08Å
466	T	86.2	Confident	87.8	Confident	89 Å²	89	63.5 Å²	63.5	55%	0.546	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-23.3	-178.1	61.1	0	0	0	0	113.1	D463 E468	D463-T466 VanDerWaalsContact CB-OG1 3.26Å; D463-T466 WeakPolarHBondContact CB-OG1 3.38Å; D463-T466 WeakPolarHBondContact OD2-CG2 3.42Å; D463-T466 PolarHBondContact OD2-OG1 3.4Å; T466-E468 PolarHBondContact O-N 3.46Å; T466-E468 PolarHBondContact OG1-N 2.96Å
467	G	84.4	Confident	87.8	Confident	35 Å²	35	65.1 Å²	65.1	36%	0.361	33%	0.329	S	S	.	.			trans	73.2	1.8	-173.3	0	0	0	0	0	114.4	K462 D463	K462-G467 WeakPolarHBondContact CE-O 3.28Å; D463-G467 VanDerWaalsContact O-CA 3.22Å; D463-G467 WeakPolarHBondContact O-CA 3.39Å; D463-G467 PolarHBondContact O-N 3.02Å
468	E	88.4	Confident	87.5	Confident	140 Å²	140	64.1 Å²	64.1	65%	0.654	33%	0.33	S	S	*	.			trans	-81.8	153.3	179.4	-64.5	-163.9	156.9	0	0	112.2	D463 T466	D463-E468 PolarHBondContact N-O 3.32Å; T466-E468 PolarHBondContact O-N 3.46Å; T466-E468 PolarHBondContact OG1-N 2.96Å
469	W	89.8	Confident	87.4	Confident	42 Å²	42	66.6 Å²	66.6	16%	0.159	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-93.9	142.9	173.2	-73.3	93.3	0	0	0	110.4	K462 V473 A474 M477 A492 R493 V496	K462-W469 HydrophobicContact CB-CD2 4.14Å; K462-W469 HydrophobicContact CB-CE3 4.27Å; K462-W469 HydrophobicContact CB-CH2 4.17Å; K462-W469 HydrophobicContact CB-CZ2 4.02Å; K462-W469 HydrophobicContact CB-CZ3 4.29Å; K462-W469 HydrophobicContact CD-CZ2 4.46Å; W469-V473 HydrophobicContact CB-CG1 4.24Å; W469-V473 HydrophobicContact CD2-CG1 3.84Å; W469-V473 HydrophobicContact CE3-CB 4.06Å; W469-V473 HydrophobicContact CE3-CG1 3.63Å; W469-V473 HydrophobicContact CE3-CG2 4.26Å; W469-V473 HydrophobicContact CG-CG1 4.13Å; W469-V473 HydrophobicContact CZ3-CG1 4.22Å; W469-V473 HydrophobicContact CZ3-CG2 4.37Å; W469-A474 HydrophobicContact CB-CB 4.48Å; W469-A474 VanDerWaalsContact O-CB 3.24Å; W469-A474 WeakPolarHBondContact O-CB 3.25Å; W469-M477 HydrophobicContact CB-SD 4.36Å; W469-M477 HydrophobicContact CG-SD 4.38Å; W469-A492 HydrophobicContact CH2-CB 4.04Å; W469-A492 WeakPolarHBondContact CH2-O 3.37Å; W469-A492 VanDerWaalsContact CZ2-O 3.3Å; W469-A492 WeakPolarHBondContact CZ2-O 3.43Å; W469-R493 HydrophobicContact CH2-CG 4.14Å; W469-R493 HydrophobicContact CZ3-CG 4.03Å; W469-V496 HydrophobicContact CD2-CG2 4.29Å; W469-V496 HydrophobicContact CH2-CG2 4.48Å; W469-V496 HydrophobicContact CZ2-CG1 4.38Å; W469-V496 HydrophobicContact CZ2-CG2 3.89Å
470	N	89.6	Confident	87.5	Confident	46 Å²	46	65.3 Å²	65.3	25%	0.246	33%	0.333	C	S	.	.			trans	-115	-172.1	171.6	62	25.5	0	0	0	111.6	G460 A461 A474	G460-N470 WeakPolarHBondContact CA-O 3.48Å; G460-N470 WeakPolarHBondContact CA-OD1 3.48Å; A461-N470 PolarHBondContact N-OD1 3.1Å; A461-N470 PolarHBondContact O-OD1 2.96Å; A461-N470 VanDerWaalsContact O-OD1 3.12Å; N470-A474 PolarHBondContact O-N 3.29Å
471	G	90.9	Very high	87.7	Confident	2 Å²	2	67.6 Å²	67.6	2%	0.021	34%	0.344	C	S	.	.	H	α-helix	trans	67.7	-156.9	171.4	0	0	0	0	0	115.6	D456 K458 V473 A474 Q475	D456-G471 WeakPolarHBondContact OD1-CA 3.48Å; D456-G471 VanDerWaalsContact OD2-CA 3.31Å; D456-G471 WeakPolarHBondContact OD2-CA 3.3Å; D456-G471 PolarHBondContact OD2-N 3.13Å; K458-G471 CarbonylContact O-C 3.58Å; K458-G471 WeakPolarHBondContact O-CA 3.39Å; G471-V473 PolarHBondContact O-N 2.86Å; G471-A474 PolarHBondContact O-N 3.38Å; G471-Q475 PolarHBondContact O-N 3.34Å
472	M	92.8	Very high	88.1	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-60.8	-33.1	177	-65.5	-171.8	-72.6	0	0	112.4	I408 I410 V454 K458 Y459 A474 Q475 L476 A483	I408-M472 HydrophobicContact CG2-CB 4.13Å; I408-M472 HydrophobicContact CG2-CG 4.2Å; I410-M472 HydrophobicContact CB-CE 4.17Å; I410-M472 HydrophobicContact CB-SD 4.11Å; I410-M472 HydrophobicContact CG2-CE 3.68Å; I410-M472 HydrophobicContact CG2-SD 4.1Å; V454-M472 HydrophobicContact CB-CG 3.78Å; V454-M472 HydrophobicContact CG1-CG 4.04Å; V454-M472 HydrophobicContact CG2-CG 3.89Å; K458-M472 PolarHBondContact O-N 2.88Å; K458-M472 VanDerWaalsContact O-N 3.09Å; Y459-M472 HydrophobicContact CD1-CE 3.28Å; Y459-M472 HydrophobicContact CE1-CE 3.76Å; Y459-M472 HydrophobicContact CG-CE 4.14Å; Y459-M472 PolarHBondContact O-N 2.87Å; M472-A474 PolarHBondContact O-N 3.5Å; M472-Q475 PolarHBondContact O-N 3.09Å; M472-L476 PolarHBondContact O-N 3.33Å; M472-A483 HydrophobicContact CB-CB 4.34Å
473	V	92.4	Very high	88.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.4	-46.7	174.4	179.1	0	0	0	0	111	Y459 W469 G471 Q475 L476 M477 M487 R493 V496 I497	Y459-V473 PolarHBondContact O-N 2.87Å; W469-V473 HydrophobicContact CB-CG1 4.24Å; W469-V473 HydrophobicContact CD2-CG1 3.84Å; W469-V473 HydrophobicContact CE3-CB 4.06Å; W469-V473 HydrophobicContact CE3-CG1 3.63Å; W469-V473 HydrophobicContact CE3-CG2 4.26Å; W469-V473 HydrophobicContact CG-CG1 4.13Å; W469-V473 HydrophobicContact CZ3-CG1 4.22Å; W469-V473 HydrophobicContact CZ3-CG2 4.37Å; G471-V473 PolarHBondContact O-N 2.86Å; V473-Q475 VanDerWaalsContact C-N 3.32Å; V473-Q475 PolarHBondContact O-N 3.44Å; V473-L476 PolarHBondContact O-N 3.12Å; V473-M477 HydrophobicContact CG1-SD 4.4Å; V473-M477 WeakPolarHBondContact O-CG 3.4Å; V473-M477 PolarHBondContact O-N 2.89Å; V473-M487 HydrophobicContact CG2-CE 3.37Å; V473-R493 HydrophobicContact CG2-CG 4.12Å; V473-V496 HydrophobicContact CG1-CG2 3.77Å; V473-I497 HydrophobicContact CB-CD1 4.43Å; V473-I497 HydrophobicContact CG1-CD1 4.19Å; V473-I497 HydrophobicContact CG1-CG2 4.38Å; V473-I497 HydrophobicContact CG2-CD1 3.96Å
474	A	91.6	Very high	89.2	Confident	18 Å²	18	58 Å²	58	15%	0.149	30%	0.296	C	S	.	.	H	α-helix	trans	-66.3	-34.8	179.9	0	0	0	0	0	112.9	W469 N470 G471 M472 M477	W469-A474 HydrophobicContact CB-CB 4.48Å; W469-A474 VanDerWaalsContact O-CB 3.24Å; W469-A474 WeakPolarHBondContact O-CB 3.25Å; N470-A474 PolarHBondContact O-N 3.29Å; G471-A474 PolarHBondContact O-N 3.38Å; M472-A474 PolarHBondContact O-N 3.5Å; A474-M477 PolarHBondContact O-N 3.47Å
475	Q	92	Very high	89.9	Confident	54 Å²	54	52.6 Å²	52.6	25%	0.252	26%	0.261	S	S	.	.	H	α-helix	trans	-67.9	-41.7	176.4	-68.2	-61.9	-22.7	0	0	111.7	I408 V454 G471 M472 V473 M477 K478 Y479 A480	I408-Q475 HydrophobicContact CD1-CG 4.5Å; I408-Q475 HydrophobicContact CG1-CB 4.21Å; I408-Q475 HydrophobicContact CG1-CG 4.35Å; I408-Q475 HydrophobicContact CG2-CB 4.46Å; V454-Q475 HydrophobicContact CG2-CG 4.3Å; G471-Q475 PolarHBondContact O-N 3.34Å; M472-Q475 PolarHBondContact O-N 3.09Å; V473-Q475 VanDerWaalsContact C-N 3.32Å; V473-Q475 PolarHBondContact O-N 3.44Å; Q475-M477 VanDerWaalsContact C-N 3.26Å; Q475-M477 PolarHBondContact O-N 3.39Å; Q475-K478 PolarHBondContact O-N 3.15Å; Q475-Y479 PolarHBondContact O-N 3.02Å; Q475-A480 HydrophobicContact CB-CB 4.4Å; Q475-A480 PolarHBondContact O-N 2.99Å
476	L	91.7	Very high	90.2	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-31.8	174.3	-82.9	176.3	0	0	0	113.5	M472 V473 K478 A480 A483 I497 A737 P739	M472-L476 PolarHBondContact O-N 3.33Å; V473-L476 PolarHBondContact O-N 3.12Å; L476-K478 VanDerWaalsContact C-N 3.28Å; L476-K478 PolarHBondContact O-N 2.67Å; L476-A480 HydrophobicContact CD2-CB 4.26Å; L476-A483 HydrophobicContact CD1-CB 3.51Å; L476-A483 HydrophobicContact CD2-CB 4.14Å; L476-A483 HydrophobicContact CG-CB 3.83Å; L476-I497 HydrophobicContact CB-CG2 4.05Å; L476-I497 HydrophobicContact CD1-CD1 3.95Å; L476-I497 HydrophobicContact CD1-CG2 4.34Å; L476-A737 HydrophobicContact CD1-CB 3.5Å; L476-P739 HydrophobicContact CD2-CG 4.26Å
477	M	86.1	Confident	90.4	Very high	102 Å²	102	39.6 Å²	39.6	50%	0.502	19%	0.194	S	C	.	.	H	α-helix	trans	-73.7	-19.1	178.3	-69.7	177	69.3	0	0	113.3	W469 V473 A474 Q475 V496 I497	W469-M477 HydrophobicContact CB-SD 4.36Å; W469-M477 HydrophobicContact CG-SD 4.38Å; V473-M477 HydrophobicContact CG1-SD 4.4Å; V473-M477 WeakPolarHBondContact O-CG 3.4Å; V473-M477 PolarHBondContact O-N 2.89Å; A474-M477 PolarHBondContact O-N 3.47Å; Q475-M477 VanDerWaalsContact C-N 3.26Å; Q475-M477 PolarHBondContact O-N 3.39Å; M477-V496 HydrophobicContact SD-CB 4.19Å; M477-V496 HydrophobicContact SD-CG2 4.39Å; M477-I497 HydrophobicContact CG-CG2 4.22Å
478	K	82.9	Confident	90.8	Very high	183 Å²	183	38 Å²	38	80%	0.796	18%	0.178	S	C	*	.	H	α-helix	trans	-122.3	-40.6	-169.4	-67.3	-177.7	179.6	177.7	0	114.6	Q475 L476	Q475-K478 PolarHBondContact O-N 3.15Å; L476-K478 VanDerWaalsContact C-N 3.28Å; L476-K478 PolarHBondContact O-N 2.67Å
479	Y	83.6	Confident	91.1	Very high	143 Å²	143	33.4 Å²	33.4	56%	0.561	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-138.3	-41.4	-162.9	176.8	-104.8	0	0	0	114.6	V406 Q475	V406-Y479 HydrophobicContact CG1-CD1 4.4Å; V406-Y479 HydrophobicContact CG1-CE1 3.77Å; Q475-Y479 PolarHBondContact O-N 3.02Å
480	A	89.8	Confident	91.2	Very high	3 Å²	3	33 Å²	33	3%	0.025	16%	0.159	C	C	.	.			trans	-88.4	145.2	-172.4	0	0	0	0	0	112.6	I408 Q475 L476 P739	I408-A480 HydrophobicContact CB-CB 3.89Å; I408-A480 HydrophobicContact CG2-CB 3.98Å; Q475-A480 HydrophobicContact CB-CB 4.4Å; Q475-A480 PolarHBondContact O-N 2.99Å; L476-A480 HydrophobicContact CD2-CB 4.26Å; A480-P739 WeakPolarHBondContact O-CG 3.46Å
481	D	90.9	Very high	91.2	Very high	50 Å²	50	40.4 Å²	40.4	27%	0.267	19%	0.185	S	C	.	.	S	Bend	trans	-88.6	-29.6	-180	-61.2	-54.8	0	0	0	112.9	L405 V406 P739	L405-D481 HydrophobicContact CB-CB 4.21Å; L405-D481 HydrophobicContact CD2-CB 4.15Å; V406-D481 PolarHBondContact N-OD2 3.37Å; V406-D481 PolarHBondContact O-N 2.86Å; D481-P739 WeakPolarHBondContact O-CD 3.49Å
482	L	94.9	Very high	91.1	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	147.5	179.9	-65.4	176.2	0	0	0	109.6	L405 V406 V407 I408 F447 I736 A737 T738 I748	L405-L482 HydrophobicContact CB-CD1 4.37Å; L405-L482 HydrophobicContact CD1-CD1 3.58Å; L405-L482 HydrophobicContact CD1-CG 4.2Å; V406-L482 PolarHBondContact O-N 3.45Å; V407-L482 CarbonylContact C-O 3.48Å; V407-L482 WeakPolarHBondContact CA-O 3.46Å; V407-L482 HydrophobicContact CG1-CB 4.35Å; V407-L482 HydrophobicContact CG2-CB 4.09Å; V407-L482 HydrophobicContact CG2-CD1 4.15Å; I408-L482 PolarHBondContact N-O 2.88Å; F447-L482 HydrophobicContact CE2-CD1 4.31Å; F447-L482 HydrophobicContact CZ-CD1 4.34Å; L482-I736 HydrophobicContact CD2-CG2 4.39Å; L482-A737 WeakPolarHBondContact CA-O 3.31Å; L482-T738 HydrophobicContact CD2-CG2 3.56Å; L482-I748 HydrophobicContact CD1-CD1 3.96Å; L482-I748 HydrophobicContact CD2-CD1 3.69Å
483	A	96.1	Very high	91	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.008	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	121.8	164.2	0	0	0	0	0	109.8	I408 M472 L476 A737	I408-A483 HydrophobicContact CG2-CB 3.47Å; I408-A483 VanDerWaalsContact CG2-CB 3.47Å; I408-A483 VanDerWaalsContact O-CA 3.3Å; I408-A483 WeakPolarHBondContact O-CA 3.49Å; M472-A483 HydrophobicContact CB-CB 4.34Å; L476-A483 HydrophobicContact CD1-CB 3.51Å; L476-A483 HydrophobicContact CD2-CB 4.14Å; L476-A483 HydrophobicContact CG-CB 3.83Å; A483-A737 HydrophobicContact CB-CB 4.22Å; A483-A737 PolarHBondContact N-O 3.35Å; A483-A737 PolarHBondContact O-N 3.4Å
484	V	95.9	Very high	91	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.024	23%	0.23	C	C	.	.			trans	-120.7	124.3	-175.8	177	0	0	0	0	108.7	V407 I408 T409 C434 L438 I736	V407-V484 HydrophobicContact CG1-CB 3.76Å; V407-V484 HydrophobicContact CG1-CG2 3.54Å; I408-V484 PolarHBondContact O-N 3.01Å; I408-V484 VanDerWaalsContact O-N 3.08Å; T409-V484 VanDerWaalsContact CB-O 3.29Å; T409-V484 WeakPolarHBondContact CB-O 3.37Å; T409-V484 PolarHBondContact OG1-O 3.39Å; C434-V484 HydrophobicContact CB-CG1 3.99Å; L438-V484 HydrophobicContact CB-CG1 4.35Å; L438-V484 HydrophobicContact CD1-CG2 4.09Å; L438-V484 HydrophobicContact CD2-CG2 4.39Å; V484-I736 HydrophobicContact CG2-CD1 4.34Å; V484-I736 HydrophobicContact CG2-CG1 4.38Å; V484-I736 HydrophobicContact CG2-CG2 3.88Å
485	G	92.5	Very high	90.9	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.01	24%	0.242	C	C	.	.	S	Bend	trans	168.3	-168.9	-179.8	0	0	0	0	0	110.8	M487	G485-M487 PolarHBondContact O-N 3.1Å
486	S	91.4	Very high	90.9	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.007	24%	0.241	C	C	.	.	S	Bend	trans	-72.4	48.4	172.4	43.3	0	0	0	0	112.3	E412 Y459 T488 Y734	E412-S486 WeakPolarHBondContact OE2-CB 3.49Å; E412-S486 PolarHBondContact OE2-OG 3.41Å; Y459-S486 PolarHBondContact OH-OG 3.21Å; S486-T488 PolarHBondContact O-N 3.17Å; S486-Y734 VanDerWaalsContact C-CD1 3.46Å; S486-Y734 VanDerWaalsContact O-CE1 3.23Å; S486-Y734 WeakPolarHBondContact O-CE1 3.25Å
487	M	91.2	Very high	91.1	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	24%	0.24	C	C	.	.			trans	-85.7	109.2	-177.3	-168.1	170.8	-174.6	0	0	111	V473 G485 I489 I497 F499 Y734 G735 A737	V473-M487 HydrophobicContact CG2-CE 3.37Å; G485-M487 PolarHBondContact O-N 3.1Å; M487-I489 PolarHBondContact O-N 3.06Å; M487-I497 HydrophobicContact CE-CD1 3.55Å; M487-F499 HydrophobicContact CE-CE1 4.31Å; M487-F499 HydrophobicContact CE-CZ 3.95Å; M487-F499 HydrophobicContact CG-CE1 3.97Å; M487-F499 HydrophobicContact CG-CZ 4.3Å; M487-F499 HydrophobicContact SD-CE1 3.98Å; M487-F499 HydrophobicContact SD-CZ 4.23Å; M487-Y734 WeakPolarHBondContact O-CA 3.42Å; M487-G735 PolarHBondContact O-N 2.96Å; M487-A737 HydrophobicContact CE-CB 4.39Å; M487-A737 HydrophobicContact SD-CB 3.7Å
488	T	93.2	Very high	91.5	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.018	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-64.4	128.6	174.4	-25.8	0	0	0	0	111.2	S486 T490 R493 S659 E708 K732	S486-T488 PolarHBondContact O-N 3.17Å; T488-T490 PolarHBondContact O-N 3.12Å; T488-R493 PolarHBondContact O-NH1 3.32Å; T488-S659 PolarHBondContact OG1-OG 3.04Å; T488-E708 PolarHBondContact OG1-OE1 3.01Å; T488-K732 HydrophobicContact CG2-CB 4.07Å; T488-K732 HydrophobicContact CG2-CD 3.72Å; T488-K732 HydrophobicContact CG2-CG 4.08Å
489	I	94.3	Very high	92.1	Very high	42 Å²	42	37.7 Å²	37.7	22%	0.215	19%	0.188	C	C	.	.			trans	-69.6	124.7	170.7	-54.7	172.6	0	0	0	108.5	M487 F499 P502 G733	M487-I489 PolarHBondContact O-N 3.06Å; I489-F499 HydrophobicContact CB-CG 4.47Å; I489-F499 HydrophobicContact CD1-CB 4.25Å; I489-F499 HydrophobicContact CD1-CG 4.5Å; I489-F499 HydrophobicContact CG1-CB 4.18Å; I489-F499 HydrophobicContact CG1-CD1 3.73Å; I489-F499 HydrophobicContact CG1-CD2 4.49Å; I489-F499 HydrophobicContact CG1-CE1 4.16Å; I489-F499 HydrophobicContact CG1-CG 3.89Å; I489-F499 HydrophobicContact CG2-CB 4.43Å; I489-F499 HydrophobicContact CG2-CD2 3.99Å; I489-F499 HydrophobicContact CG2-CE2 4.41Å; I489-F499 HydrophobicContact CG2-CG 4.14Å; I489-P502 HydrophobicContact CD1-CB 4.04Å; I489-G733 WeakPolarHBondContact CG1-O 3.4Å; I489-G733 PolarHBondContact N-O 3.47Å; I489-G733 VanDerWaalsContact N-O 3.11Å
490	T	91.4	Very high	92.7	Very high	34 Å²	34	31.2 Å²	31.2	21%	0.209	16%	0.163	C	C	.	.			trans	-139.9	150.3	178.2	64.1	0	0	0	0	110.2	T488 A492 R493 E494	T488-T490 PolarHBondContact O-N 3.12Å; T490-A492 VanDerWaalsContact C-N 3.28Å; T490-A492 PolarHBondContact O-N 3.06Å; T490-R493 PolarHBondContact O-N 2.97Å; T490-R493 VanDerWaalsContact O-N 3.11Å; T490-R493 WeakPolarHBondContact OG1-CB 3.27Å; T490-R493 WeakPolarHBondContact OG1-CD 3.44Å; T490-R493 VanDerWaalsContact OG1-CG 3.31Å; T490-R493 WeakPolarHBondContact OG1-CG 3.27Å; T490-R493 PolarHBondContact OG1-N 3.02Å; T490-E494 PolarHBondContact O-N 3.3Å
491	Y	89.3	Confident	92.9	Very high	202 Å²	202	37 Å²	37	79%	0.792	19%	0.187	S	C	*	.	H	α-helix	trans	-54.1	-42.5	178.9	176.6	-99.2	0	0	0	113	R493 E494 S495	Y491-R493 PolarHBondContact O-N 3.35Å; Y491-E494 PolarHBondContact O-N 3.47Å; Y491-S495 PolarHBondContact O-N 3.2Å
492	A	89.1	Confident	93.2	Very high	51 Å²	51	36.4 Å²	36.4	42%	0.421	19%	0.186	S	C	.	.	H	α-helix	trans	-63.1	-40.9	179.8	0	0	0	0	0	112.1	W469 T490 S495	W469-A492 HydrophobicContact CH2-CB 4.04Å; W469-A492 WeakPolarHBondContact CH2-O 3.37Å; W469-A492 VanDerWaalsContact CZ2-O 3.3Å; W469-A492 WeakPolarHBondContact CZ2-O 3.43Å; T490-A492 VanDerWaalsContact C-N 3.28Å; T490-A492 PolarHBondContact O-N 3.06Å; A492-S495 PolarHBondContact O-OG 3.19Å
493	R	91.7	Very high	93.1	Very high	13 Å²	13	36.6 Å²	36.6	5%	0.049	19%	0.187	C	C	.	.	H	α-helix	trans	-71.6	-43.3	177.6	-68.5	172.8	176.6	165.5	-1.2	111.4	G460 W469 V473 T488 T490 Y491 S495 V496 I497 F499	G460-R493 PolarHBondContact O-NE 3.39Å; G460-R493 PolarHBondContact O-NH2 3.49Å; W469-R493 HydrophobicContact CH2-CG 4.14Å; W469-R493 HydrophobicContact CZ3-CG 4.03Å; V473-R493 HydrophobicContact CG2-CG 4.12Å; T488-R493 PolarHBondContact O-NH1 3.32Å; T490-R493 PolarHBondContact O-N 2.97Å; T490-R493 VanDerWaalsContact O-N 3.11Å; T490-R493 WeakPolarHBondContact OG1-CB 3.27Å; T490-R493 WeakPolarHBondContact OG1-CD 3.44Å; T490-R493 VanDerWaalsContact OG1-CG 3.31Å; T490-R493 WeakPolarHBondContact OG1-CG 3.27Å; T490-R493 PolarHBondContact OG1-N 3.02Å; Y491-R493 PolarHBondContact O-N 3.35Å; R493-S495 PolarHBondContact O-N 3.02Å; R493-S495 VanDerWaalsContact O-N 3.1Å; R493-V496 VanDerWaalsContact O-CG2 3.27Å; R493-V496 WeakPolarHBondContact O-CG2 3.43Å; R493-V496 PolarHBondContact O-N 3.19Å; R493-I497 HydrophobicContact CB-CD1 4.42Å; R493-I497 HydrophobicContact CB-CG1 4.42Å; R493-I497 WeakPolarHBondContact O-CG1 3.48Å; R493-I497 PolarHBondContact O-N 3.03Å; R493-F499 HydrophobicContact CB-CE2 3.76Å; R493-F499 HydrophobicContact CB-CZ 3.96Å
494	E	91.3	Very high	93	Very high	105 Å²	105	37.3 Å²	37.3	49%	0.491	19%	0.191	S	C	.	.	H	α-helix	trans	-60.5	-22.5	178.9	-165.4	174.1	-164.5	0	0	113	T490 Y491 V496 I497 F499	T490-E494 PolarHBondContact O-N 3.3Å; Y491-E494 PolarHBondContact O-N 3.47Å; E494-V496 VanDerWaalsContact C-N 3.29Å; E494-V496 PolarHBondContact O-N 3.44Å; E494-I497 CarbonylContact C-O 3.26Å; E494-I497 VanDerWaalsContact CA-O 3.24Å; E494-I497 WeakPolarHBondContact CA-O 3.48Å; E494-F499 HydrophobicContact CB-CD2 4.46Å
495	S	90.8	Very high	92.8	Very high	59 Å²	59	43 Å²	43	41%	0.413	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-28.3	174.5	76.5	0	0	0	0	113.8	Y491 A492 R493 K740	Y491-S495 PolarHBondContact O-N 3.2Å; A492-S495 PolarHBondContact O-OG 3.19Å; R493-S495 PolarHBondContact O-N 3.02Å; R493-S495 VanDerWaalsContact O-N 3.1Å; S495-K740 PolarHBondContact O-NZ 3.49Å
496	V	91.6	Very high	92.9	Very high	36 Å²	36	43.2 Å²	43.2	22%	0.218	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-25.2	-174.2	-65.9	0	0	0	0	114.4	W469 V473 M477 R493 E494	W469-V496 HydrophobicContact CD2-CG2 4.29Å; W469-V496 HydrophobicContact CH2-CG2 4.48Å; W469-V496 HydrophobicContact CZ2-CG1 4.38Å; W469-V496 HydrophobicContact CZ2-CG2 3.89Å; V473-V496 HydrophobicContact CG1-CG2 3.77Å; M477-V496 HydrophobicContact SD-CB 4.19Å; M477-V496 HydrophobicContact SD-CG2 4.39Å; R493-V496 VanDerWaalsContact O-CG2 3.27Å; R493-V496 WeakPolarHBondContact O-CG2 3.43Å; R493-V496 PolarHBondContact O-N 3.19Å; E494-V496 VanDerWaalsContact C-N 3.29Å; E494-V496 PolarHBondContact O-N 3.44Å
497	I	94.6	Very high	92.9	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	156.7	178.5	56.3	175.2	0	0	0	109.6	V473 L476 M477 M487 R493 E494 F499 A737	V473-I497 HydrophobicContact CB-CD1 4.43Å; V473-I497 HydrophobicContact CG1-CD1 4.19Å; V473-I497 HydrophobicContact CG1-CG2 4.38Å; V473-I497 HydrophobicContact CG2-CD1 3.96Å; L476-I497 HydrophobicContact CB-CG2 4.05Å; L476-I497 HydrophobicContact CD1-CD1 3.95Å; L476-I497 HydrophobicContact CD1-CG2 4.34Å; M477-I497 HydrophobicContact CG-CG2 4.22Å; M487-I497 HydrophobicContact CE-CD1 3.55Å; R493-I497 HydrophobicContact CB-CD1 4.42Å; R493-I497 HydrophobicContact CB-CG1 4.42Å; R493-I497 WeakPolarHBondContact O-CG1 3.48Å; R493-I497 PolarHBondContact O-N 3.03Å; E494-I497 CarbonylContact C-O 3.26Å; E494-I497 VanDerWaalsContact CA-O 3.24Å; E494-I497 WeakPolarHBondContact CA-O 3.48Å; I497-F499 HydrophobicContact CD1-CE2 4.23Å; I497-F499 HydrophobicContact CD1-CZ 4.08Å; I497-F499 HydrophobicContact CG1-CE2 4.15Å; I497-A737 HydrophobicContact CD1-CB 3.98Å
498	D	94.3	Very high	93.1	Very high	22 Å²	22	43.1 Å²	43.1	12%	0.118	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	147.6	177.8	-76.4	-6.5	0	0	0	110.7	A737 T738 G741 R745	D498-A737 WeakPolarHBondContact O-CA 3.5Å; D498-T738 PolarHBondContact N-O 3.35Å; D498-T738 PolarHBondContact O-N 3.05Å; D498-T738 VanDerWaalsContact O-O 3.11Å; D498-T738 PolarHBondContact O-OG1 3.13Å; D498-G741 PolarHBondContact OD2-N 3.06Å; D498-R745 IonicContact OD2-NH1 2.7Å; D498-R745 PolarHBondContact OD2-NH1 3.2Å
499	F	96.2	Very high	93.1	Very high	19 Å²	19	43 Å²	43	8%	0.083	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	151.2	174.1	-73.2	-87.9	0	0	0	111.9	M487 I489 R493 E494 I497 I736 A737	M487-F499 HydrophobicContact CE-CE1 4.31Å; M487-F499 HydrophobicContact CE-CZ 3.95Å; M487-F499 HydrophobicContact CG-CE1 3.97Å; M487-F499 HydrophobicContact CG-CZ 4.3Å; M487-F499 HydrophobicContact SD-CE1 3.98Å; M487-F499 HydrophobicContact SD-CZ 4.23Å; I489-F499 HydrophobicContact CB-CG 4.47Å; I489-F499 HydrophobicContact CD1-CB 4.25Å; I489-F499 HydrophobicContact CD1-CG 4.5Å; I489-F499 HydrophobicContact CG1-CB 4.18Å; I489-F499 HydrophobicContact CG1-CD1 3.73Å; I489-F499 HydrophobicContact CG1-CD2 4.49Å; I489-F499 HydrophobicContact CG1-CE1 4.16Å; I489-F499 HydrophobicContact CG1-CG 3.89Å; I489-F499 HydrophobicContact CG2-CB 4.43Å; I489-F499 HydrophobicContact CG2-CD2 3.99Å; I489-F499 HydrophobicContact CG2-CE2 4.41Å; I489-F499 HydrophobicContact CG2-CG 4.14Å; R493-F499 HydrophobicContact CB-CE2 3.76Å; R493-F499 HydrophobicContact CB-CZ 3.96Å; E494-F499 HydrophobicContact CB-CD2 4.46Å; I497-F499 HydrophobicContact CD1-CE2 4.23Å; I497-F499 HydrophobicContact CD1-CZ 4.08Å; I497-F499 HydrophobicContact CG1-CE2 4.15Å; F499-I736 WeakPolarHBondContact CA-O 3.42Å; F499-A737 HydrophobicContact CD1-CB 3.9Å; F499-A737 HydrophobicContact CE1-CB 3.68Å; F499-A737 HydrophobicContact CZ-CB 4.27Å
500	T	96.1	Very high	93	Very high	6 Å²	6	41.1 Å²	41.1	4%	0.037	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-71.6	172.8	164.1	65.9	0	0	0	0	111	I736 I748 S749 I752	T500-I736 HydrophobicContact CG2-CB 3.94Å; T500-I736 HydrophobicContact CG2-CG2 4.47Å; T500-I736 WeakPolarHBondContact CG2-O 3.48Å; T500-I736 PolarHBondContact N-O 3.1Å; T500-I736 PolarHBondContact OG1-N 3.44Å; T500-I736 PolarHBondContact OG1-O 3.28Å; T500-I748 HydrophobicContact CG2-CB 4.09Å; T500-I748 HydrophobicContact CG2-CG2 3.74Å; T500-S749 VanDerWaalsContact CA-OG 3.25Å; T500-S749 WeakPolarHBondContact CA-OG 3.49Å; T500-S749 WeakPolarHBondContact CB-OG 3.48Å; T500-I752 HydrophobicContact CG2-CD1 4.35Å; T500-I752 WeakPolarHBondContact OG1-CD1 3.41Å
501	K	94.9	Very high	93.1	Very high	124 Å²	124	39.5 Å²	39.5	54%	0.539	20%	0.201	S	C	.	.	S	Bend	trans	-55.9	143.3	162.2	-64.6	-58.8	-178.3	-171.3	0	110.3	F503 S749 L753	K501-F503 PolarHBondContact O-N 2.98Å; K501-S749 PolarHBondContact N-OG 2.83Å; K501-L753 HydrophobicContact CB-CD2 4.49Å; K501-L753 HydrophobicContact CG-CD1 4.43Å
502	P	95.6	Very high	93.2	Very high	38 Å²	38	30.5 Å²	30.5	25%	0.247	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-66.5	127.5	-176.4	26.1	-33.1	0	0	0	110.2	I489 M504 Y734 Q756	I489-P502 HydrophobicContact CD1-CB 4.04Å; P502-M504 VanDerWaalsContact C-N 3.34Å; P502-Y734 CarbonylContact C-O 3.58Å; P502-Y734 WeakPolarHBondContact CA-O 3.4Å; P502-Y734 WeakPolarHBondContact CB-O 3.49Å; P502-Q756 PolarHBondContact O-NE2 3.29Å
503	F	94.4	Very high	93.3	Very high	5 Å²	5	31.7 Å²	31.7	2%	0.022	16%	0.162	C	C	.	.	S	Bend	trans	-80.5	-21.2	176.9	62	-98	0	0	0	111.7	F433 I437 K501 Y734 I736 I752 Q756 I761	F433-F503 HydrophobicContact CE1-CD2 4.17Å; F433-F503 AromaticContact CE1-CE2 3.86Å; F433-F503 HydrophobicContact CE1-CE2 3.86Å; I437-F503 HydrophobicContact CD1-CD2 3.99Å; I437-F503 HydrophobicContact CD1-CE2 4.41Å; K501-F503 PolarHBondContact O-N 2.98Å; F503-Y734 WeakPolarHBondContact CD1-O 3.34Å; F503-Y734 HydrophobicContact CE2-CD2 4.4Å; F503-Y734 HydrophobicContact CZ-CD2 4.36Å; F503-Y734 HydrophobicContact CZ-CG 4.32Å; F503-Y734 PolarHBondContact N-O 3.29Å; F503-I736 HydrophobicContact CD1-CG1 4.21Å; F503-I736 HydrophobicContact CE1-CG1 4.24Å; F503-I752 HydrophobicContact CB-CD1 4.46Å; F503-I752 HydrophobicContact CB-CG2 3.78Å; F503-Q756 PolarHBondContact O-NE2 3.39Å; F503-Q756 VanDerWaalsContact O-NE2 3.08Å; F503-I761 HydrophobicContact CB-CD1 4.28Å
504	M	92.8	Very high	93	Very high	17 Å²	17	32.4 Å²	32.4	8%	0.084	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	132.8	-179.7	-176.2	174.7	-74.7	0	0	110.6	F433 P502 T710 G733 Y734 Y765	F433-M504 HydrophobicContact CD1-CE 4.34Å; F433-M504 HydrophobicContact CE1-CE 3.38Å; F433-M504 HydrophobicContact CE2-CE 4.12Å; F433-M504 HydrophobicContact CZ-CE 3.23Å; P502-M504 VanDerWaalsContact C-N 3.34Å; M504-T710 HydrophobicContact CG-CG2 4.14Å; M504-T710 HydrophobicContact SD-CG2 3.53Å; M504-T710 VanDerWaalsContact SD-CG2 3.53Å; M504-G733 CarbonylContact O-C 3.5Å; M504-G733 WeakPolarHBondContact O-CA 3.41Å; M504-Y734 PolarHBondContact O-N 2.66Å; M504-Y734 HydrophobicContact SD-CD2 4.33Å; M504-Y765 HydrophobicContact CE-CD2 3.54Å; M504-Y765 HydrophobicContact CE-CE2 4.09Å
505	N	93	Very high	92	Very high	124 Å²	124	28.5 Å²	28.5	66%	0.663	15%	0.151	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97	140	175.8	-64.2	-29.2	0	0	0	110.3	K732	N505-K732 WeakPolarHBondContact CA-O 3.33Å
506	L	92.9	Very high	90.7	Very high	5 Å²	5	32 Å²	32	3%	0.026	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	176.7	-175.7	62	96.7	0	0	0	111.2	E708 T710 K732 Y734	L506-E708 HydrophobicContact CD1-CB 4Å; L506-E708 HydrophobicContact CD1-CG 3.79Å; L506-T710 HydrophobicContact CB-CG2 3.78Å; L506-T710 HydrophobicContact CD2-CG2 4.34Å; L506-K732 HydrophobicContact CD1-CB 3.85Å; L506-K732 HydrophobicContact CG-CB 4.32Å; L506-K732 PolarHBondContact N-O 3.02Å; L506-K732 CarbonylContact O-C 3.57Å; L506-K732 WeakPolarHBondContact O-CA 3.46Å; L506-K732 PolarHBondContact O-N 3.18Å; L506-Y734 HydrophobicContact CD1-CE1 4.48Å; L506-Y734 HydrophobicContact CD2-CD1 3.5Å; L506-Y734 HydrophobicContact CD2-CD2 3.47Å; L506-Y734 VanDerWaalsContact CD2-CD2 3.47Å; L506-Y734 HydrophobicContact CD2-CE1 3.35Å; L506-Y734 HydrophobicContact CD2-CE2 3.34Å; L506-Y734 HydrophobicContact CD2-CG 3.55Å
507	G	93.1	Very high	89.1	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.185	C	C	.	.			trans	-154.6	172.1	170.3	0	0	0	0	0	111.3	S709 D730	G507-S709 PolarHBondContact N-OG 3.49Å; G507-S709 WeakPolarHBondContact O-CB 3.36Å; G507-S709 PolarHBondContact O-N 3.36Å; G507-S709 PolarHBondContact O-OG 3.15Å; G507-D730 WeakPolarHBondContact CA-O 3.35Å; G507-D730 VanDerWaalsContact CA-OD1 3.22Å; G507-D730 WeakPolarHBondContact CA-OD1 3.5Å
508	I	93.9	Very high	87.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	133.4	171.2	-57.2	163.5	0	0	0	107.9	T660 F663 F664 L706 M707 L729 D730 K732	I508-T660 HydrophobicContact CD1-CG2 3.8Å; I508-T660 HydrophobicContact CG1-CG2 3.91Å; I508-T660 HydrophobicContact CG2-CG2 3.91Å; I508-F663 HydrophobicContact CD1-CB 4.29Å; I508-F663 HydrophobicContact CD1-CD1 3.32Å; I508-F663 HydrophobicContact CD1-CD2 4.49Å; I508-F663 HydrophobicContact CD1-CE1 3.65Å; I508-F663 HydrophobicContact CD1-CG 3.79Å; I508-F663 HydrophobicContact CD1-CZ 4.35Å; I508-F664 HydrophobicContact CD1-CE2 4.2Å; I508-F664 HydrophobicContact CD1-CZ 4.45Å; I508-F664 HydrophobicContact CG2-CE2 4.31Å; I508-F664 HydrophobicContact CG2-CZ 4.4Å; I508-L706 HydrophobicContact CG2-CB 4.36Å; I508-M707 WeakPolarHBondContact CA-O 3.27Å; I508-L729 HydrophobicContact CB-CB 4.3Å; I508-L729 HydrophobicContact CB-CD1 4.48Å; I508-L729 HydrophobicContact CG2-CD1 4.04Å; I508-L729 PolarHBondContact O-N 3.09Å; I508-D730 WeakPolarHBondContact CD1-OD2 3.4Å; I508-D730 PolarHBondContact N-OD1 2.94Å; I508-K732 VanDerWaalsContact CD1-NZ 3.35Å
509	S	93.2	Very high	85.6	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	173.6	172.3	-162.7	0	0	0	0	110.9	M707 Q724 G727	S509-M707 PolarHBondContact N-O 3.29Å; S509-M707 PolarHBondContact O-N 3.38Å; S509-M707 VanDerWaalsContact O-N 3.13Å; S509-Q724 VanDerWaalsContact OG-CG 3.3Å; S509-Q724 WeakPolarHBondContact OG-CG 3.39Å; S509-Q724 PolarHBondContact OG-NE2 3.27Å; S509-G727 PolarHBondContact OG-O 3.49Å
510	I	93.6	Very high	84	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	113.6	-169.1	-45.2	-176.9	0	0	0	108.8	A641 L644 A704 L706 I725	I510-A641 HydrophobicContact CD1-CB 4.41Å; I510-L644 HydrophobicContact CD1-CD2 4.37Å; I510-A704 HydrophobicContact CG2-CB 3.87Å; I510-L706 HydrophobicContact CB-CD2 4.36Å; I510-L706 HydrophobicContact CD1-CD2 4.37Å; I510-L706 HydrophobicContact CG1-CD2 3.73Å; I510-L706 HydrophobicContact CG2-CD2 4.36Å; I510-I725 HydrophobicContact CB-CB 4.3Å; I510-I725 PolarHBondContact O-N 3.07Å
511	L	93.1	Very high	82.5	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	124.9	170.6	-178.4	68.9	0	0	0	109.1	I695 V698 F705 M707 L712 V716 L722	L511-I695 HydrophobicContact CD2-CG1 4.24Å; L511-V698 HydrophobicContact CD2-CG2 4.41Å; L511-V698 HydrophobicContact CG-CG1 4.41Å; L511-F705 HydrophobicContact CB-CB 4.38Å; L511-F705 WeakPolarHBondContact CB-O 3.44Å; L511-F705 PolarHBondContact N-O 3.35Å; L511-F705 PolarHBondContact O-N 2.94Å; L511-M707 HydrophobicContact CB-CG 4.49Å; L511-M707 HydrophobicContact CD2-CE 3.59Å; L511-M707 HydrophobicContact CD2-SD 4.35Å; L511-L712 HydrophobicContact CB-CD1 3.89Å; L511-L712 HydrophobicContact CB-CG 4.15Å; L511-L712 HydrophobicContact CD1-CD2 4.31Å; L511-L712 HydrophobicContact CD1-CG 4.01Å; L511-V716 HydrophobicContact CD1-CG2 3.83Å; L511-L722 HydrophobicContact CD1-CB 3.85Å; L511-L722 HydrophobicContact CD1-CD1 4.26Å; L511-L722 HydrophobicContact CD1-CG 4.49Å; L511-L722 HydrophobicContact CD2-CD1 4.3Å
512	F	92	Very high	81.4	Confident	13 Å²	13	53 Å²	53	6%	0.057	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	159.7	178.7	-163	-114.4	0	0	0	111.5	P637 I638 I650 Y703 A704 L722 T723 I725	F512-P637 HydrophobicContact CE1-CG 3.99Å; F512-P637 HydrophobicContact CZ-CG 4.49Å; F512-I638 HydrophobicContact CD2-CD1 4.27Å; F512-I638 HydrophobicContact CG-CD1 4.24Å; F512-I650 HydrophobicContact CE2-CD1 4.33Å; F512-I650 HydrophobicContact CE2-CG2 3.72Å; F512-I650 HydrophobicContact CZ-CD1 3.98Å; F512-I650 HydrophobicContact CZ-CG1 4.49Å; F512-I650 HydrophobicContact CZ-CG2 4.38Å; F512-Y703 WeakPolarHBondContact CD2-O 3.33Å; F512-A704 HydrophobicContact CD2-CB 3.86Å; F512-A704 HydrophobicContact CE2-CB 4.41Å; F512-L722 CarbonylContact O-C 3.48Å; F512-L722 WeakPolarHBondContact O-CA 2.97Å; F512-T723 PolarHBondContact N-O 3.23Å; F512-T723 PolarHBondContact O-N 2.85Å; F512-T723 VanDerWaalsContact O-O 3.11Å; F512-T723 PolarHBondContact O-OG1 3.32Å; F512-I725 HydrophobicContact CB-CD1 3.41Å; F512-I725 VanDerWaalsContact CB-CD1 3.41Å; F512-I725 HydrophobicContact CB-CG1 3.94Å; F512-I725 HydrophobicContact CD1-CD1 3.57Å; F512-I725 HydrophobicContact CG-CD1 3.74Å
513	K	90	Very high	80.4	Confident	77 Å²	77	57 Å²	57	34%	0.335	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	137.2	174.2	-170.4	174.9	-175.5	167.5	0	110.1	P515 V698 N699 N721	K513-P515 WeakPolarHBondContact O-CD 3.27Å; K513-V698 HydrophobicContact CB-CG1 4.48Å; K513-N699 PolarHBondContact NZ-O 3.07Å; K513-N721 CarbonylContact C-O 3.58Å; K513-N721 WeakPolarHBondContact CA-O 3.48Å; K513-N721 WeakPolarHBondContact CG-O 3.35Å
514	V	84.9	Confident	79.5	Confident	27 Å²	27	57.5 Å²	57.5	16%	0.164	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-52.3	122.8	172.6	170.9	0	0	0	0	108.9	T516 N721 T723	V514-T516 PolarHBondContact O-N 3.45Å; V514-N721 WeakPolarHBondContact CG2-O 3.37Å; V514-N721 PolarHBondContact N-O 3.34Å; V514-T723 HydrophobicContact CG2-CG2 3.42Å; V514-T723 VanDerWaalsContact CG2-CG2 3.42Å
515	P	70.2	Confident	78.9	Confident	24 Å²	24	58.8 Å²	58.8	16%	0.156	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-66.1	129.7	176	22.9	-27.7	0	0	0	109.7	K513 N636	K513-P515 WeakPolarHBondContact O-CD 3.27Å; P515-N636 WeakPolarHBondContact CG-OD1 3.37Å
516	T	64.4	Low	78.5	Confident	131 Å²	131	56.1 Å²	56.1	80%	0.804	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-76.9	138	169.1	48.9	0	0	0	0	108.9	V514 E518	V514-T516 PolarHBondContact O-N 3.45Å; T516-E518 PolarHBondContact O-N 3.1Å
517	S	58.7	Low	78	Confident	76 Å²	76	60.3 Å²	60.3	53%	0.531	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-52.4	139.5	173.1	39.6	0	0	0	0	110.7
518	E	57.3	Low	77.7	Confident	127 Å²	127	61 Å²	61	59%	0.593	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-54.8	136.8	173.8	-78.4	-162.9	-170.3	0	0	109.3	T516 T520 R521	T516-E518 PolarHBondContact O-N 3.1Å; E518-T520 PolarHBondContact O-N 3.15Å; E518-R521 IonicContact OE1-NH2 3.96Å; E518-R521 IonicContact OE2-CZ 3.64Å; E518-R521 IonicContact OE2-NE 3.68Å; E518-R521 IonicContact OE2-NH2 2.81Å; E518-R521 PolarHBondContact OE2-NH2 2.95Å
519	P	57.7	Low	77.4	Confident	113 Å²	113	61.8 Å²	61.8	73%	0.734	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-58.6	131.9	176	24.4	-32.4	0	0	0	109.4	R521	P519-R521 PolarHBondContact O-N 2.97Å; P519-R521 VanDerWaalsContact O-N 3.13Å
520	T	61.1	Low	77.2	Confident	63 Å²	63	64.3 Å²	64.3	39%	0.387	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-58.5	120	-178.6	50.4	0	0	0	0	109.9	E518 E793	E518-T520 PolarHBondContact O-N 3.15Å; T520-E793 VanDerWaalsContact OG1-CB 3.28Å; T520-E793 WeakPolarHBondContact OG1-CB 3.31Å
521	R	66.4	Low	77	Confident	165 Å²	165	69.7 Å²	69.7	62%	0.623	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-74.9	142.4	-179.8	-57.4	-178.3	-169.7	-178.9	4.2	109.7	E518 P519 F523 S524	E518-R521 IonicContact OE1-NH2 3.96Å; E518-R521 IonicContact OE2-CZ 3.64Å; E518-R521 IonicContact OE2-NE 3.68Å; E518-R521 IonicContact OE2-NH2 2.81Å; E518-R521 PolarHBondContact OE2-NH2 2.95Å; P519-R521 PolarHBondContact O-N 2.97Å; P519-R521 VanDerWaalsContact O-N 3.13Å; R521-F523 PolarHBondContact O-N 3.45Å; R521-S524 VanDerWaalsContact O-CB 3.23Å; R521-S524 WeakPolarHBondContact O-CB 3.24Å; R521-S524 PolarHBondContact O-N 3.47Å
522	L	70.7	Confident	76.9	Confident	105 Å²	105	75.7 Å²	75.7	55%	0.55	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-31.9	179.8	-73.8	170.6	0	0	0	113.8	S524 G797	L522-S524 VanDerWaalsContact C-N 3.34Å; L522-G797 VanDerWaalsContact O-CA 3.23Å; L522-G797 WeakPolarHBondContact O-CA 3.45Å; L522-G797 PolarHBondContact O-N 3.3Å
523	F	75.3	Confident	77	Confident	122 Å²	122	78 Å²	78	54%	0.535	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	19.6	178.2	-63.6	-73	0	0	0	114.2	R521 F525 M526	R521-F523 PolarHBondContact O-N 3.45Å; F523-F525 HydrophobicContact CD1-CE1 4.09Å; F523-F525 HydrophobicContact CD1-CZ 4.28Å; F523-F525 PolarHBondContact O-N 3.25Å; F523-M526 HydrophobicContact CD1-SD 4.48Å; F523-M526 PolarHBondContact O-N 3.05Å
524	S	75.2	Confident	77	Confident	16 Å²	16	78 Å²	78	11%	0.112	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-57.9	-23.3	-177.9	-170.1	0	0	0	0	113.9	R521 L522 M526 N527 F628	R521-S524 VanDerWaalsContact O-CB 3.23Å; R521-S524 WeakPolarHBondContact O-CB 3.24Å; R521-S524 PolarHBondContact O-N 3.47Å; L522-S524 VanDerWaalsContact C-N 3.34Å; S524-M526 PolarHBondContact O-N 3.3Å; S524-N527 WeakPolarHBondContact O-CB 3.45Å; S524-N527 PolarHBondContact O-N 3.07Å; S524-F628 WeakPolarHBondContact OG-CE1 3.3Å
525	F	79.7	Confident	77.4	Confident	44 Å²	44	81.1 Å²	81.1	19%	0.193	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-67.6	-17.7	176.1	70.6	-90.6	0	0	0	113.7	F523 P528 Y621 V798 V801	F523-F525 HydrophobicContact CD1-CE1 4.09Å; F523-F525 HydrophobicContact CD1-CZ 4.28Å; F523-F525 PolarHBondContact O-N 3.25Å; F525-P528 WeakPolarHBondContact O-CD 3.35Å; F525-Y621 WeakPolarHBondContact O-CE2 3.01Å; F525-Y621 PolarHBondContact O-OH 3.49Å; F525-V798 HydrophobicContact CB-CG2 4.49Å; F525-V798 HydrophobicContact CD1-CG2 4.05Å; F525-V798 HydrophobicContact CE1-CG2 4.47Å; F525-V798 HydrophobicContact CG-CG2 4.13Å; F525-V801 HydrophobicContact CZ-CG2 4.24Å
526	M	84.3	Confident	78.5	Confident	68 Å²	68	87.4 Å²	87.4	34%	0.335	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-86.3	-18.5	175.9	-68.2	-176.8	64.4	0	0	113.6	F523 S524 W534	F523-M526 HydrophobicContact CD1-SD 4.48Å; F523-M526 PolarHBondContact O-N 3.05Å; S524-M526 PolarHBondContact O-N 3.3Å; M526-W534 PolarHBondContact O-NE1 3.04Å
527	N	82.4	Confident	79.8	Confident	93 Å²	93	81.9 Å²	81.9	50%	0.497	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-25.9	-178.9	-67.2	-12.9	0	0	0	116.6	S524 L529 F628	S524-N527 WeakPolarHBondContact O-CB 3.45Å; S524-N527 PolarHBondContact O-N 3.07Å; N527-L529 PolarHBondContact O-N 3.45Å; N527-L529 VanDerWaalsContact O-N 3.13Å; N527-F628 HydrophobicContact CB-CE2 4.47Å; N527-F628 HydrophobicContact CB-CZ 4.29Å
528	P	86.5	Confident	81.4	Confident	14 Å²	14	82.9 Å²	82.9	9%	0.091	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-17.4	-179.4	-25.3	34.8	0	0	0	115.3	F525 Y621 N624 L625	F525-P528 WeakPolarHBondContact O-CD 3.35Å; P528-Y621 HydrophobicContact CB-CD2 4.28Å; P528-Y621 HydrophobicContact CB-CE2 4.29Å; P528-Y621 HydrophobicContact CG-CE2 4.19Å; P528-N624 HydrophobicContact CB-CB 3.96Å; P528-N624 PolarHBondContact O-ND2 2.9Å; P528-L625 HydrophobicContact CB-CB 4.31Å; P528-L625 HydrophobicContact CG-CB 3.94Å; P528-L625 HydrophobicContact CG-CD1 3.69Å; P528-L625 HydrophobicContact CG-CG 4.42Å
529	L	87.8	Confident	83.1	Confident	17 Å²	17	81.3 Å²	81.3	9%	0.089	41%	0.407	C	S	.	.	S	Bend	trans	-124.1	138.2	171.9	-70	174.7	0	0	0	108.8	N527 I533 W534 Y621	N527-L529 PolarHBondContact O-N 3.45Å; N527-L529 VanDerWaalsContact O-N 3.13Å; L529-I533 HydrophobicContact CD1-CG2 4.35Å; L529-I533 HydrophobicContact CD2-CD1 3.98Å; L529-I533 HydrophobicContact CD2-CG2 4.36Å; L529-W534 HydrophobicContact CD1-CZ2 4.32Å; L529-W534 PolarHBondContact O-NE1 3.19Å; L529-Y621 HydrophobicContact CD1-CD2 4.02Å; L529-Y621 HydrophobicContact CG-CD2 4.24Å
530	A	89.5	Confident	84.8	Confident	54 Å²	54	77.2 Å²	77.2	45%	0.446	38%	0.382	S	S	.	.			trans	-59.6	147.9	174.4	0	0	0	0	0	110.8	E532 I533 W534	A530-E532 PolarHBondContact O-N 2.9Å; A530-E532 VanDerWaalsContact O-N 3.1Å; A530-I533 HydrophobicContact CB-CD1 4.44Å; A530-I533 HydrophobicContact CB-CG1 4.46Å; A530-I533 WeakPolarHBondContact O-CB 3.37Å; A530-I533 PolarHBondContact O-N 3.43Å; A530-W534 PolarHBondContact O-N 3.29Å
531	I	88.9	Confident	86.3	Confident	114 Å²	114	76.5 Å²	76.5	59%	0.585	37%	0.373	S	S	*	.	H	α-helix	trans	-55.2	-31.6	178.9	-168.9	62.4	0	0	0	112.5	I533 W534 I535	I531-I533 PolarHBondContact O-N 3.32Å; I531-W534 WeakPolarHBondContact O-CB 3.43Å; I531-W534 PolarHBondContact O-N 3.37Å; I531-I535 WeakPolarHBondContact O-CG1 3.15Å; I531-I535 PolarHBondContact O-N 3.4Å
532	E	92.6	Very high	87.6	Confident	126 Å²	126	73.8 Å²	73.8	59%	0.589	37%	0.366	S	S	*	.	H	α-helix	trans	-60	-42.8	175.7	-61.6	170.1	-174.4	0	0	112.2	A530 W534 I535 Y536	A530-E532 PolarHBondContact O-N 2.9Å; A530-E532 VanDerWaalsContact O-N 3.1Å; E532-W534 VanDerWaalsContact C-N 3.34Å; E532-W534 PolarHBondContact O-N 3.22Å; E532-I535 PolarHBondContact O-N 3.38Å; E532-Y536 HydrophobicContact CB-CE2 4.35Å; E532-Y536 WeakPolarHBondContact O-CD2 3.41Å; E532-Y536 PolarHBondContact O-N 3.03Å
533	I	92.4	Very high	88.7	Confident	63 Å²	63	73.8 Å²	73.8	32%	0.323	37%	0.366	S	S	.	.	H	α-helix	trans	-65.8	-40.2	179.6	-60.1	174	0	0	0	110.1	L529 A530 I531 I535 Y536 V537	L529-I533 HydrophobicContact CD1-CG2 4.35Å; L529-I533 HydrophobicContact CD2-CD1 3.98Å; L529-I533 HydrophobicContact CD2-CG2 4.36Å; A530-I533 HydrophobicContact CB-CD1 4.44Å; A530-I533 HydrophobicContact CB-CG1 4.46Å; A530-I533 WeakPolarHBondContact O-CB 3.37Å; A530-I533 PolarHBondContact O-N 3.43Å; I531-I533 PolarHBondContact O-N 3.32Å; I533-I535 VanDerWaalsContact C-N 3.3Å; I533-I535 PolarHBondContact O-N 2.85Å; I533-Y536 PolarHBondContact O-N 2.91Å; I533-V537 HydrophobicContact CG2-CG2 4.36Å; I533-V537 WeakPolarHBondContact O-CG2 3.41Å; I533-V537 PolarHBondContact O-N 2.89Å
534	W	90.7	Very high	89.5	Confident	76 Å²	76	69.1 Å²	69.1	29%	0.288	35%	0.347	S	S	.	.	H	α-helix	trans	-59.1	-41.4	175.4	-73	109.3	0	0	0	112.2	M526 L529 A530 I531 E532 V537 L538 Y621	M526-W534 PolarHBondContact O-NE1 3.04Å; L529-W534 HydrophobicContact CD1-CZ2 4.32Å; L529-W534 PolarHBondContact O-NE1 3.19Å; A530-W534 PolarHBondContact O-N 3.29Å; I531-W534 WeakPolarHBondContact O-CB 3.43Å; I531-W534 PolarHBondContact O-N 3.37Å; E532-W534 VanDerWaalsContact C-N 3.34Å; E532-W534 PolarHBondContact O-N 3.22Å; W534-V537 PolarHBondContact O-N 3.32Å; W534-L538 PolarHBondContact O-N 2.93Å; W534-Y621 HydrophobicContact CZ2-CD2 4.32Å; W534-Y621 HydrophobicContact CZ2-CE2 4.13Å
535	I	92.9	Very high	90.3	Very high	92 Å²	92	68.3 Å²	68.3	47%	0.472	34%	0.342	S	S	.	.	H	α-helix	trans	-65.1	-44.1	175.9	-65.4	168.4	0	0	0	110.6	I531 E532 I533 V537 L538 I539	I531-I535 WeakPolarHBondContact O-CG1 3.15Å; I531-I535 PolarHBondContact O-N 3.4Å; E532-I535 PolarHBondContact O-N 3.38Å; I533-I535 VanDerWaalsContact C-N 3.3Å; I533-I535 PolarHBondContact O-N 2.85Å; I535-V537 PolarHBondContact O-N 2.94Å; I535-L538 PolarHBondContact O-N 3.22Å; I535-I539 HydrophobicContact CG2-CD1 3.9Å; I535-I539 WeakPolarHBondContact O-CG1 3.28Å; I535-I539 PolarHBondContact O-N 3.43Å
536	Y	93.7	Very high	90.9	Very high	157 Å²	157	70.2 Å²	70.2	62%	0.616	35%	0.354	S	S	*	.	H	α-helix	trans	-63.5	-39.2	177.3	-67.9	-49.4	0	0	0	113.1	E532 I533 L538 I539 A540	E532-Y536 HydrophobicContact CB-CE2 4.35Å; E532-Y536 WeakPolarHBondContact O-CD2 3.41Å; E532-Y536 PolarHBondContact O-N 3.03Å; I533-Y536 PolarHBondContact O-N 2.91Å; Y536-L538 VanDerWaalsContact C-N 3.34Å; Y536-I539 PolarHBondContact O-N 3.15Å; Y536-A540 WeakPolarHBondContact O-CB 3.47Å; Y536-A540 PolarHBondContact O-N 3.23Å
537	V	92.4	Very high	91.1	Very high	14 Å²	14	69.2 Å²	69.2	9%	0.085	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-42	175.1	170.5	0	0	0	0	110.9	I533 W534 I535 A540 Y541 F589 I617	I533-V537 HydrophobicContact CG2-CG2 4.36Å; I533-V537 WeakPolarHBondContact O-CG2 3.41Å; I533-V537 PolarHBondContact O-N 2.89Å; W534-V537 PolarHBondContact O-N 3.32Å; I535-V537 PolarHBondContact O-N 2.94Å; V537-A540 PolarHBondContact O-N 3.4Å; V537-Y541 WeakPolarHBondContact O-CB 3.45Å; V537-Y541 PolarHBondContact O-N 3.13Å; V537-F589 HydrophobicContact CG1-CE2 3.68Å; V537-F589 HydrophobicContact CG1-CZ 3.62Å; V537-I617 HydrophobicContact CG2-CG2 4.22Å
538	L	91.4	Very high	91.4	Very high	98 Å²	98	64.9 Å²	64.9	51%	0.513	33%	0.329	S	S	.	.	H	α-helix	trans	-63.2	-45.4	176.3	-176	148.5	0	0	0	111.5	W534 I535 Y536 A540 Y541 F542	W534-L538 PolarHBondContact O-N 2.93Å; I535-L538 PolarHBondContact O-N 3.22Å; Y536-L538 VanDerWaalsContact C-N 3.34Å; L538-A540 PolarHBondContact O-N 2.81Å; L538-Y541 WeakPolarHBondContact O-CB 3.21Å; L538-Y541 PolarHBondContact O-N 2.93Å; L538-F542 HydrophobicContact CD2-CD2 3.75Å; L538-F542 HydrophobicContact CD2-CE2 3.65Å; L538-F542 HydrophobicContact CG-CD2 4.23Å; L538-F542 HydrophobicContact CG-CE2 4Å; L538-F542 VanDerWaalsContact O-CD2 3.25Å; L538-F542 WeakPolarHBondContact O-CD2 3.39Å; L538-F542 PolarHBondContact O-N 3.35Å; L538-F542 VanDerWaalsContact O-N 3.13Å
539	I	93.7	Very high	91.5	Very high	93 Å²	93	67.7 Å²	67.7	48%	0.477	34%	0.339	S	S	.	.	H	α-helix	trans	-61.8	-45.5	176.4	-67.2	167.9	0	0	0	110.9	I535 Y536 Y541 F542 L543	I535-I539 HydrophobicContact CG2-CD1 3.9Å; I535-I539 WeakPolarHBondContact O-CG1 3.28Å; I535-I539 PolarHBondContact O-N 3.43Å; Y536-I539 PolarHBondContact O-N 3.15Å; I539-Y541 VanDerWaalsContact C-N 3.33Å; I539-Y541 PolarHBondContact O-N 3.21Å; I539-F542 PolarHBondContact O-N 3.44Å; I539-L543 PolarHBondContact O-N 3.35Å
540	A	92.8	Very high	91.5	Very high	27 Å²	27	70.5 Å²	70.5	22%	0.223	35%	0.353	C	S	.	.	H	α-helix	trans	-61.7	-40.2	177.7	0	0	0	0	0	111.9	Y536 V537 L538 L543 V544 W610 F613	Y536-A540 WeakPolarHBondContact O-CB 3.47Å; Y536-A540 PolarHBondContact O-N 3.23Å; V537-A540 PolarHBondContact O-N 3.4Å; L538-A540 PolarHBondContact O-N 2.81Å; A540-L543 PolarHBondContact O-N 3.26Å; A540-V544 WeakPolarHBondContact O-CB 3.17Å; A540-V544 VanDerWaalsContact O-CG2 3.29Å; A540-V544 WeakPolarHBondContact O-CG2 3.16Å; A540-V544 PolarHBondContact O-N 3.13Å; A540-W610 HydrophobicContact CB-CZ3 4.33Å; A540-F613 HydrophobicContact CB-CE1 4.42Å
541	Y	93.2	Very high	91.4	Very high	48 Å²	48	69.7 Å²	69.7	19%	0.188	34%	0.342	C	S	.	.	H	α-helix	trans	-57.9	-48	174.7	166.5	-103.7	0	0	0	112.2	V537 L538 I539 S545 F582 T585 I586 W610	V537-Y541 WeakPolarHBondContact O-CB 3.45Å; V537-Y541 PolarHBondContact O-N 3.13Å; L538-Y541 WeakPolarHBondContact O-CB 3.21Å; L538-Y541 PolarHBondContact O-N 2.93Å; I539-Y541 VanDerWaalsContact C-N 3.33Å; I539-Y541 PolarHBondContact O-N 3.21Å; Y541-S545 WeakPolarHBondContact O-CB 3.24Å; Y541-S545 PolarHBondContact O-N 3.13Å; Y541-S545 VanDerWaalsContact O-N 3.08Å; Y541-S545 PolarHBondContact O-OG 2.73Å; Y541-F582 AromaticContact CE1-CD1 3.71Å; Y541-F582 HydrophobicContact CE1-CD1 3.71Å; Y541-F582 HydrophobicContact CE1-CE1 4.11Å; Y541-F582 HydrophobicContact CE2-CD1 4.5Å; Y541-F582 AromaticContact CZ-CD1 3.66Å; Y541-F582 WeakPolarHBondContact OH-CD1 3.35Å; Y541-F582 PolarHBondContact OH-O 3.49Å; Y541-T585 WeakPolarHBondContact CE2-OG1 3.28Å; Y541-I586 HydrophobicContact CE2-CB 3.83Å; Y541-I586 HydrophobicContact CE2-CD1 4.32Å; Y541-W610 HydrophobicContact CD2-CZ2 4.36Å
542	F	93.4	Very high	91.2	Very high	109 Å²	109	64.2 Å²	64.2	48%	0.478	31%	0.314	S	S	.	.	H	α-helix	trans	-62.5	-45.4	176.9	-83.8	-76.6	0	0	0	112.1	L538 I539 S545 L546 F582	L538-F542 HydrophobicContact CD2-CD2 3.75Å; L538-F542 HydrophobicContact CD2-CE2 3.65Å; L538-F542 HydrophobicContact CG-CD2 4.23Å; L538-F542 HydrophobicContact CG-CE2 4Å; L538-F542 VanDerWaalsContact O-CD2 3.25Å; L538-F542 WeakPolarHBondContact O-CD2 3.39Å; L538-F542 PolarHBondContact O-N 3.35Å; L538-F542 VanDerWaalsContact O-N 3.13Å; I539-F542 PolarHBondContact O-N 3.44Å; F542-S545 PolarHBondContact O-N 2.92Å; F542-L546 PolarHBondContact O-N 2.84Å; F542-L546 VanDerWaalsContact O-N 3.08Å; F542-F582 AromaticContact CD1-CE1 3.46Å; F542-F582 HydrophobicContact CD1-CE1 3.46Å; F542-F582 VanDerWaalsContact CD1-CE1 3.46Å; F542-F582 AromaticContact CD1-CZ 3.73Å; F542-F582 HydrophobicContact CD1-CZ 3.73Å; F542-F582 AromaticContact CE1-CE1 3.77Å; F542-F582 HydrophobicContact CE1-CE1 3.77Å; F542-F582 HydrophobicContact CE1-CZ 4.05Å; F542-F582 HydrophobicContact CG-CE1 4.31Å
543	L	93.4	Very high	90.7	Very high	105 Å²	105	62 Å²	62	55%	0.55	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-48.4	-178.3	-170.1	155.4	0	0	0	111.5	I539 A540 S545 L546 C547	I539-L543 PolarHBondContact O-N 3.35Å; A540-L543 PolarHBondContact O-N 3.26Å; L543-S545 PolarHBondContact O-N 2.96Å; L543-L546 PolarHBondContact O-N 3.24Å; L543-C547 WeakPolarHBondContact O-CB 3.34Å; L543-C547 PolarHBondContact O-N 2.99Å; L543-C547 PolarHBondContact O-SG 2.82Å
544	V	92.6	Very high	90.2	Very high	23 Å²	23	65.4 Å²	65.4	14%	0.139	32%	0.321	C	S	.	.	H	α-helix	trans	-65.6	-39.8	-179.2	174	0	0	0	0	111.3	A540 L546 C547 I548 T585 I606 W610	A540-V544 WeakPolarHBondContact O-CB 3.17Å; A540-V544 VanDerWaalsContact O-CG2 3.29Å; A540-V544 WeakPolarHBondContact O-CG2 3.16Å; A540-V544 PolarHBondContact O-N 3.13Å; V544-L546 VanDerWaalsContact C-N 3.33Å; V544-L546 PolarHBondContact O-N 3.44Å; V544-C547 PolarHBondContact O-N 3.3Å; V544-I548 HydrophobicContact CG1-CD1 3.97Å; V544-I548 HydrophobicContact CG1-CG1 4.41Å; V544-I548 WeakPolarHBondContact O-CG1 3.48Å; V544-I548 PolarHBondContact O-N 3.09Å; V544-T585 HydrophobicContact CG1-CG2 3.92Å; V544-I606 HydrophobicContact CG1-CG2 4.27Å; V544-W610 HydrophobicContact CB-CD2 4.4Å; V544-W610 HydrophobicContact CB-CE3 4.11Å; V544-W610 HydrophobicContact CB-CZ3 4.47Å; V544-W610 HydrophobicContact CG1-CB 3.97Å; V544-W610 HydrophobicContact CG1-CD2 3.93Å; V544-W610 HydrophobicContact CG1-CE3 4.09Å; V544-W610 HydrophobicContact CG1-CG 3.9Å; V544-W610 HydrophobicContact CG2-CD2 4.44Å; V544-W610 HydrophobicContact CG2-CE3 3.74Å; V544-W610 HydrophobicContact CG2-CZ3 4.14Å
545	S	91.7	Very high	89.8	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.4	-42.9	177	-55.5	0	0	0	0	111.7	Y541 F542 L543 Y549 S581 F582 T585	Y541-S545 WeakPolarHBondContact O-CB 3.24Å; Y541-S545 PolarHBondContact O-N 3.13Å; Y541-S545 VanDerWaalsContact O-N 3.08Å; Y541-S545 PolarHBondContact O-OG 2.73Å; F542-S545 PolarHBondContact O-N 2.92Å; L543-S545 PolarHBondContact O-N 2.96Å; S545-Y549 WeakPolarHBondContact O-CB 3.35Å; S545-Y549 PolarHBondContact O-N 3.47Å; S545-S581 WeakPolarHBondContact O-CB 3.44Å; S545-F582 VanDerWaalsContact CB-CD1 3.41Å; S545-F582 VanDerWaalsContact CB-CE1 3.47Å; S545-F582 WeakPolarHBondContact OG-CD1 3.5Å; S545-T585 WeakPolarHBondContact OG-CB 3.05Å; S545-T585 WeakPolarHBondContact OG-CG2 3.42Å; S545-T585 PolarHBondContact OG-OG1 2.83Å
546	L	91.5	Very high	88.9	Confident	84 Å²	84	63.1 Å²	63.1	44%	0.44	32%	0.322	S	S	.	.	H	α-helix	trans	-67.1	-41.4	176	-174.4	67	0	0	0	111.8	F542 L543 V544 Y549 I550	F542-L546 PolarHBondContact O-N 2.84Å; F542-L546 VanDerWaalsContact O-N 3.08Å; L543-L546 PolarHBondContact O-N 3.24Å; V544-L546 VanDerWaalsContact C-N 3.33Å; V544-L546 PolarHBondContact O-N 3.44Å; L546-Y549 HydrophobicContact CD1-CD1 4.43Å; L546-Y549 PolarHBondContact O-N 3.12Å; L546-I550 HydrophobicContact CD1-CD1 4.2Å; L546-I550 HydrophobicContact CD1-CG1 4.46Å; L546-I550 HydrophobicContact CD2-CD1 4.42Å; L546-I550 HydrophobicContact CG-CD1 3.86Å; L546-I550 HydrophobicContact CG-CG1 4.47Å; L546-I550 VanDerWaalsContact O-CG1 3.31Å; L546-I550 WeakPolarHBondContact O-CG1 3.27Å; L546-I550 PolarHBondContact O-N 2.73Å
547	C	90.1	Very high	88.1	Confident	46 Å²	46	61 Å²	61	31%	0.311	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-43.3	176.7	-73.7	0	0	0	0	112.2	L543 V544 Y549 I550 V551	L543-C547 WeakPolarHBondContact O-CB 3.34Å; L543-C547 PolarHBondContact O-N 2.99Å; L543-C547 PolarHBondContact O-SG 2.82Å; V544-C547 PolarHBondContact O-N 3.3Å; C547-Y549 VanDerWaalsContact C-N 3.35Å; C547-I550 PolarHBondContact O-N 2.79Å; C547-V551 WeakPolarHBondContact O-CB 3.43Å; C547-V551 VanDerWaalsContact O-CG2 3.28Å; C547-V551 WeakPolarHBondContact O-CG2 3.44Å; C547-V551 PolarHBondContact O-N 2.72Å
548	I	88.6	Confident	87.5	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.015	32%	0.317	C	S	.	.	H	α-helix	trans	-63.3	-42.4	175.6	-69.9	175.8	0	0	0	110.5	V544 G552 F576 F584 T585 I606	V544-I548 HydrophobicContact CG1-CD1 3.97Å; V544-I548 HydrophobicContact CG1-CG1 4.41Å; V544-I548 WeakPolarHBondContact O-CG1 3.48Å; V544-I548 PolarHBondContact O-N 3.09Å; I548-G552 WeakPolarHBondContact O-CA 3.35Å; I548-G552 PolarHBondContact O-N 3.45Å; I548-F576 HydrophobicContact CG2-CD1 3.77Å; I548-F576 HydrophobicContact CG2-CE1 3.85Å; I548-F576 HydrophobicContact CG2-CG 4.41Å; I548-F584 HydrophobicContact CD1-CD1 3.78Å; I548-F584 HydrophobicContact CD1-CE1 3.79Å; I548-T585 HydrophobicContact CD1-CG2 3.8Å; I548-I606 HydrophobicContact CD1-CG2 4.22Å; I548-I606 HydrophobicContact CG1-CG2 3.67Å
549	Y	88.9	Confident	86.7	Confident	72 Å²	72	60.9 Å²	60.9	28%	0.282	31%	0.312	S	S	.	.	H	α-helix	trans	-59.8	-50	175.7	172.2	-107.8	0	0	0	112.4	S545 L546 C547 K553 L578	S545-Y549 WeakPolarHBondContact O-CB 3.35Å; S545-Y549 PolarHBondContact O-N 3.47Å; L546-Y549 HydrophobicContact CD1-CD1 4.43Å; L546-Y549 PolarHBondContact O-N 3.12Å; C547-Y549 VanDerWaalsContact C-N 3.35Å; Y549-K553 HydrophobicContact CD2-CG 4.33Å; Y549-K553 HydrophobicContact CE2-CG 3.95Å; Y549-K553 WeakPolarHBondContact O-CB 3.38Å; Y549-K553 WeakPolarHBondContact O-CG 3.48Å; Y549-K553 PolarHBondContact O-N 3.04Å; Y549-L578 HydrophobicContact CD1-CD1 4.09Å; Y549-L578 HydrophobicContact CD2-CB 4.05Å; Y549-L578 HydrophobicContact CE1-CD1 4.2Å; Y549-L578 HydrophobicContact CE2-CB 4.05Å; Y549-L578 HydrophobicContact CG-CB 4.48Å; Y549-L578 HydrophobicContact CG-CD1 4.32Å
550	I	88.1	Confident	85.5	Confident	77 Å²	77	61.6 Å²	61.6	40%	0.395	31%	0.311	S	S	.	.	H	α-helix	trans	-64.4	-50.3	-178.5	-67.9	169.3	0	0	0	110.6	L546 C547 G552 K553 L554	L546-I550 HydrophobicContact CD1-CD1 4.2Å; L546-I550 HydrophobicContact CD1-CG1 4.46Å; L546-I550 HydrophobicContact CD2-CD1 4.42Å; L546-I550 HydrophobicContact CG-CD1 3.86Å; L546-I550 HydrophobicContact CG-CG1 4.47Å; L546-I550 VanDerWaalsContact O-CG1 3.31Å; L546-I550 WeakPolarHBondContact O-CG1 3.27Å; L546-I550 PolarHBondContact O-N 2.73Å; C547-I550 PolarHBondContact O-N 2.79Å; I550-G552 VanDerWaalsContact C-N 3.35Å; I550-G552 PolarHBondContact O-N 2.8Å; I550-K553 PolarHBondContact O-N 2.69Å; I550-L554 HydrophobicContact CG2-CD1 3.72Å; I550-L554 HydrophobicContact CG2-CG 4.43Å; I550-L554 WeakPolarHBondContact O-CB 3.42Å; I550-L554 VanDerWaalsContact O-CG 3.28Å; I550-L554 WeakPolarHBondContact O-CG 3.46Å; I550-L554 PolarHBondContact O-N 3.25Å
551	V	86.9	Confident	83.9	Confident	36 Å²	36	63 Å²	63	22%	0.218	32%	0.319	C	S	.	.	H	α-helix	trans	-69	-36	-177.9	177.2	0	0	0	0	111.2	C547 L554 S555 S602 T603 I606	C547-V551 WeakPolarHBondContact O-CB 3.43Å; C547-V551 VanDerWaalsContact O-CG2 3.28Å; C547-V551 WeakPolarHBondContact O-CG2 3.44Å; C547-V551 PolarHBondContact O-N 2.72Å; V551-L554 PolarHBondContact O-N 2.83Å; V551-S555 WeakPolarHBondContact O-CB 3.42Å; V551-S555 PolarHBondContact O-N 3.3Å; V551-S602 WeakPolarHBondContact CG1-OG 3.43Å; V551-T603 HydrophobicContact CB-CG2 4.4Å; V551-T603 HydrophobicContact CG1-CG2 3.86Å; V551-I606 HydrophobicContact CB-CD1 4.18Å; V551-I606 HydrophobicContact CG1-CD1 4.29Å; V551-I606 HydrophobicContact CG2-CD1 3.84Å
552	G	84.2	Confident	82.3	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-40.6	173.3	0	0	0	0	0	112.2	I548 I550 N574	I548-G552 WeakPolarHBondContact O-CA 3.35Å; I548-G552 PolarHBondContact O-N 3.45Å; I550-G552 VanDerWaalsContact C-N 3.35Å; I550-G552 PolarHBondContact O-N 2.8Å; G552-N574 PolarHBondContact O-ND2 3.4Å
553	K	82.7	Confident	80.6	Confident	80 Å²	80	64.6 Å²	64.6	35%	0.348	34%	0.335	S	S	.	.	H	α-helix	trans	-69.3	-40.4	175	-77.4	-71.7	-178.7	-179.3	0	113.5	Y549 I550 W559 N574	Y549-K553 HydrophobicContact CD2-CG 4.33Å; Y549-K553 HydrophobicContact CE2-CG 3.95Å; Y549-K553 WeakPolarHBondContact O-CB 3.38Å; Y549-K553 WeakPolarHBondContact O-CG 3.48Å; Y549-K553 PolarHBondContact O-N 3.04Å; I550-K553 PolarHBondContact O-N 2.69Å; K553-W559 HydrophobicContact CD-CZ2 4.4Å; K553-W559 PolarHBondContact O-NE1 3.25Å; K553-W559 VanDerWaalsContact O-NE1 3.14Å; K553-N574 WeakPolarHBondContact CA-ND2 3.37Å; K553-N574 HydrophobicContact CD-CB 4.3Å
554	L	81.9	Confident	78.7	Confident	134 Å²	134	64.2 Å²	64.2	70%	0.702	35%	0.346	S	S	*	.	H	α-helix	trans	-76.4	-27.2	-177.6	-69.7	173.1	0	0	0	113.5	I550 V551 P556	I550-L554 HydrophobicContact CG2-CD1 3.72Å; I550-L554 HydrophobicContact CG2-CG 4.43Å; I550-L554 WeakPolarHBondContact O-CB 3.42Å; I550-L554 VanDerWaalsContact O-CG 3.28Å; I550-L554 WeakPolarHBondContact O-CG 3.46Å; I550-L554 PolarHBondContact O-N 3.25Å; V551-L554 PolarHBondContact O-N 2.83Å; L554-P556 WeakPolarHBondContact O-CD 3.46Å
555	S	82.8	Confident	76.9	Confident	16 Å²	16	69.2 Å²	69.2	11%	0.112	38%	0.381	C	S	.	.			trans	-81.7	116.4	-176.4	-172.4	0	0	0	0	111.9	V551 I557 E558 W559 A600	V551-S555 WeakPolarHBondContact O-CB 3.42Å; V551-S555 PolarHBondContact O-N 3.3Å; S555-I557 PolarHBondContact O-N 2.89Å; S555-E558 PolarHBondContact O-N 3.08Å; S555-W559 VanDerWaalsContact O-CD1 3.28Å; S555-A600 WeakPolarHBondContact OG-CB 2.79Å
556	P	73.6	Confident	75.2	Confident	104 Å²	104	73.6 Å²	73.6	68%	0.675	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-63.2	-25	-177.8	-22.6	34	0	0	0	114	L554 E558 W559	L554-P556 WeakPolarHBondContact O-CD 3.46Å; P556-E558 VanDerWaalsContact C-N 3.26Å; P556-E558 PolarHBondContact O-N 3.08Å; P556-W559 PolarHBondContact O-N 3.29Å
557	I	77.1	Confident	73.6	Confident	113 Å²	113	77.6 Å²	77.6	58%	0.579	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-72	-20.7	-176.5	-61.3	168	0	0	0	112	S555 W559 R599 A600	S555-I557 PolarHBondContact O-N 2.89Å; I557-W559 VanDerWaalsContact C-N 3.34Å; I557-R599 HydrophobicContact CG2-CB 4.25Å; I557-A600 HydrophobicContact CB-CB 4.2Å; I557-A600 HydrophobicContact CG2-CB 4.43Å
558	E	78.6	Confident	71.9	Confident	2 Å²	2	84 Å²	84	1%	0.009	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-85.5	-6.5	179	-62.6	-68.1	-174.7	0	0	113.4	S555 P556 R599 A600 T603	S555-E558 PolarHBondContact O-N 3.08Å; P556-E558 VanDerWaalsContact C-N 3.26Å; P556-E558 PolarHBondContact O-N 3.08Å; E558-R599 PolarHBondContact OE1-N 2.75Å; E558-R599 WeakPolarHBondContact OE2-CB 3.34Å; E558-R599 PolarHBondContact OE2-N 3.36Å; E558-R599 VanDerWaalsContact OE2-N 3.09Å; E558-A600 HydrophobicContact CG-CB 3.83Å; E558-A600 WeakPolarHBondContact OE1-CB 3.31Å; E558-A600 PolarHBondContact OE1-N 3.19Å; E558-T603 HydrophobicContact CG-CG2 4.27Å; E558-T603 WeakPolarHBondContact OE1-CB 3.36Å; E558-T603 PolarHBondContact OE1-OG1 2.87Å
559	W	75.4	Confident	70.4	Confident	107 Å²	107	89.7 Å²	89.7	41%	0.405	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	125.3	176.2	-68.2	77.4	0	0	0	110.1	K553 S555 P556 I557 I572 N574	K553-W559 HydrophobicContact CD-CZ2 4.4Å; K553-W559 PolarHBondContact O-NE1 3.25Å; K553-W559 VanDerWaalsContact O-NE1 3.14Å; S555-W559 VanDerWaalsContact O-CD1 3.28Å; P556-W559 PolarHBondContact O-N 3.29Å; I557-W559 VanDerWaalsContact C-N 3.34Å; W559-I572 HydrophobicContact CB-CG2 3.77Å; W559-I572 HydrophobicContact CD2-CG2 4.47Å; W559-I572 HydrophobicContact CE3-CG2 3.87Å; W559-I572 HydrophobicContact CG-CG2 4.5Å; W559-N574 HydrophobicContact CD2-CB 4.01Å; W559-N574 HydrophobicContact CE3-CB 4.06Å; W559-N574 HydrophobicContact CH2-CB 4.31Å; W559-N574 HydrophobicContact CZ2-CB 4.23Å; W559-N574 HydrophobicContact CZ3-CB 4.22Å; W559-N574 PolarHBondContact NE1-ND2 2.65Å; W559-N574 VanDerWaalsContact NE1-ND2 3.19Å
560	K	68.5	Low	68.8	Low	108 Å²	108	92 Å²	92	47%	0.47	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.3	-178.7	-170.3	-168.1	168.2	-170.1	0	110.4	I562 G573	K560-I562 PolarHBondContact O-N 2.8Å; K560-G573 PolarHBondContact N-O 2.88Å; K560-G573 PolarHBondContact O-N 3.22Å; K560-G573 VanDerWaalsContact O-O 3.07Å
561	C	59.6	Low	67.5	Low	56 Å²	56	91 Å²	91	38%	0.378	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	119.1	164.3	-63.7	0	0	0	0	109.9
562	I	59	Low	66.3	Low	112 Å²	112	94.5 Å²	94.5	57%	0.574	51%	0.513	S	S	*	.	S	Bend	trans	-68.8	-37.4	-176.5	-64.2	164.6	0	0	0	110.4	K560 S571	K560-I562 PolarHBondContact O-N 2.8Å; I562-S571 PolarHBondContact N-O 2.83Å; I562-S571 VanDerWaalsContact N-O 3.11Å
563	N	57	Low	65.4	Low	79 Å²	79	95.1 Å²	95.1	42%	0.422	52%	0.52	S	S	.	.			trans	-115.4	101	-179.9	-65.1	-18.2	0	0	0	110.7	C565	N563-C565 VanDerWaalsContact C-N 3.32Å
564	A	54.2	Low	65	Low	96 Å²	96	92.5 Å²	92.5	79%	0.793	51%	0.51	S	S	*	.	S	Bend	trans	-81.9	-8.4	178.8	0	0	0	0	0	114
565	C	55.1	Low	64.6	Low	129 Å²	129	88.4 Å²	88.4	87%	0.872	49%	0.487	S	S	*	.	S	Bend	trans	-112.6	2.4	-172.1	-62.1	0	0	0	0	114.6	N563	N563-C565 VanDerWaalsContact C-N 3.32Å
566	D	55.1	Low	64.4	Low	91 Å²	91	87.7 Å²	87.7	49%	0.487	48%	0.482	S	S	.	.			trans	-121.8	100.2	-179.1	-152	3	0	0	0	109.2	E568	D566-E568 PolarHBondContact O-N 2.9Å
567	L	58.4	Low	64.9	Low	168 Å²	168	84.5 Å²	84.5	88%	0.88	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-10.8	-171.5	-93.3	112	0	0	0	113.9
568	E	55.5	Low	65.2	Low	181 Å²	181	82.9 Å²	82.9	85%	0.846	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-17.5	-177	-75.6	-175.8	160.4	0	0	114.2	D566	D566-E568 PolarHBondContact O-N 2.9Å
569	N	56.3	Low	65.6	Low	123 Å²	123	87.4 Å²	87.4	66%	0.658	48%	0.482	S	S	*	.			trans	-138.5	80.7	179.6	-85.8	-34.2	0	0	0	112.5	S571	N569-S571 PolarHBondContact O-N 2.87Å
570	I	55.9	Low	66	Low	121 Å²	121	85 Å²	85	62%	0.621	48%	0.477	S	S	*	.			trans	-74.3	96.1	173.4	-56.5	172	0	0	0	109.2	I572	I570-I572 HydrophobicContact CG2-CG1 4.42Å
571	S	59.8	Low	67	Low	54 Å²	54	79.9 Å²	79.9	38%	0.378	46%	0.455	S	S	.	.			trans	-91.6	115.7	168.8	53.3	0	0	0	0	110.5	I562 N569	I562-S571 PolarHBondContact N-O 2.83Å; I562-S571 VanDerWaalsContact N-O 3.11Å; N569-S571 PolarHBondContact O-N 2.87Å
572	I	60.8	Low	68.4	Low	110 Å²	110	79.5 Å²	79.5	56%	0.564	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	111.3	174.2	-50.2	177.3	0	0	0	107.6	W559 I570	W559-I572 HydrophobicContact CB-CG2 3.77Å; W559-I572 HydrophobicContact CD2-CG2 4.47Å; W559-I572 HydrophobicContact CE3-CG2 3.87Å; W559-I572 HydrophobicContact CG-CG2 4.5Å; I570-I572 HydrophobicContact CG2-CG1 4.42Å
573	G	66.2	Low	69.8	Low	14 Å²	14	83 Å²	83	14%	0.144	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	143.1	178.3	0	0	0	0	0	112	K560	K560-G573 PolarHBondContact N-O 2.88Å; K560-G573 PolarHBondContact O-N 3.22Å; K560-G573 VanDerWaalsContact O-O 3.07Å
574	N	75.1	Confident	71.3	Confident	25 Å²	25	79.5 Å²	79.5	13%	0.134	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	132.9	168	-163.3	-55.7	0	0	0	109.3	G552 K553 W559 F576	G552-N574 PolarHBondContact O-ND2 3.4Å; K553-N574 WeakPolarHBondContact CA-ND2 3.37Å; K553-N574 HydrophobicContact CD-CB 4.3Å; W559-N574 HydrophobicContact CD2-CB 4.01Å; W559-N574 HydrophobicContact CE3-CB 4.06Å; W559-N574 HydrophobicContact CH2-CB 4.31Å; W559-N574 HydrophobicContact CZ2-CB 4.23Å; W559-N574 HydrophobicContact CZ3-CB 4.22Å; W559-N574 PolarHBondContact NE1-ND2 2.65Å; W559-N574 VanDerWaalsContact NE1-ND2 3.19Å; N574-F576 VanDerWaalsContact C-N 3.31Å; N574-F576 PolarHBondContact O-N 2.96Å; N574-F576 PolarHBondContact OD1-N 3.32Å
575	Q	72.3	Confident	73	Confident	48 Å²	48	74.9 Å²	74.9	22%	0.224	40%	0.396	C	S	.	.	S	Bend	trans	-72.4	-22	-179.2	-170.6	173	-1	0	0	113.3	I596	Q575-I596 HydrophobicContact CG-CB 4.45Å; Q575-I596 HydrophobicContact CG-CG1 4.16Å; Q575-I596 HydrophobicContact CG-CG2 3.69Å
576	F	78.9	Confident	74.6	Confident	1 Å²	1	71.4 Å²	71.4	0%	0.004	37%	0.368	C	S	.	.			trans	-99.7	98.5	179.2	-67.9	-79.1	0	0	0	111	I548 N574 F584 I596 P598	I548-F576 HydrophobicContact CG2-CD1 3.77Å; I548-F576 HydrophobicContact CG2-CE1 3.85Å; I548-F576 HydrophobicContact CG2-CG 4.41Å; N574-F576 VanDerWaalsContact C-N 3.31Å; N574-F576 PolarHBondContact O-N 2.96Å; N574-F576 PolarHBondContact OD1-N 3.32Å; F576-F584 HydrophobicContact CE1-CD2 4.41Å; F576-F584 HydrophobicContact CE1-CG 4.37Å; F576-I596 HydrophobicContact CD1-CG2 4.15Å; F576-I596 HydrophobicContact CE1-CG2 3.56Å; F576-I596 HydrophobicContact CE2-CG2 4.34Å; F576-I596 HydrophobicContact CZ-CG2 3.67Å; F576-P598 HydrophobicContact CE2-CB 4.5Å; F576-P598 HydrophobicContact CZ-CB 4.13Å
577	S	83.4	Confident	76.2	Confident	36 Å²	36	67.6 Å²	67.6	25%	0.252	35%	0.351	S	S	.	.			trans	-82.2	169.3	159.1	76.5	0	0	0	0	110.8	T579 D580 S581	S577-T579 VanDerWaalsContact C-N 3.32Å; S577-T579 PolarHBondContact O-N 3.01Å; S577-T579 PolarHBondContact OG-OG1 3.3Å; S577-D580 VanDerWaalsContact CB-OD2 3.23Å; S577-D580 WeakPolarHBondContact CB-OD2 3.43Å; S577-D580 PolarHBondContact N-OD2 2.88Å; S577-D580 PolarHBondContact O-N 3.49Å; S577-D580 WeakPolarHBondContact OG-CB 2.89Å; S577-D580 PolarHBondContact OG-N 3.12Å; S577-D580 PolarHBondContact OG-OD2 3.06Å; S577-S581 WeakPolarHBondContact O-CB 3.41Å; S577-S581 PolarHBondContact O-N 3.28Å; S577-S581 PolarHBondContact O-OG 3.36Å
578	L	84.8	Confident	77.6	Confident	79 Å²	79	60.8 Å²	60.8	41%	0.414	32%	0.316	S	S	.	.	H	α-helix	trans	-61.2	-44.4	177.8	-173.5	118.9	0	0	0	110.4	Y549 S581 F582	Y549-L578 HydrophobicContact CD1-CD1 4.09Å; Y549-L578 HydrophobicContact CD2-CB 4.05Å; Y549-L578 HydrophobicContact CE1-CD1 4.2Å; Y549-L578 HydrophobicContact CE2-CB 4.05Å; Y549-L578 HydrophobicContact CG-CB 4.48Å; Y549-L578 HydrophobicContact CG-CD1 4.32Å; L578-S581 PolarHBondContact O-N 3.2Å; L578-F582 HydrophobicContact CD1-CE2 4.48Å; L578-F582 HydrophobicContact CD2-CD2 4.08Å; L578-F582 HydrophobicContact CD2-CE2 3.81Å; L578-F582 HydrophobicContact CG-CD2 4.12Å; L578-F582 HydrophobicContact CG-CE2 3.88Å; L578-F582 WeakPolarHBondContact O-CD2 3.28Å; L578-F582 PolarHBondContact O-N 3.27Å; L578-F582 VanDerWaalsContact O-N 3.11Å
579	T	85.6	Confident	79.3	Confident	98 Å²	98	54 Å²	54	60%	0.601	28%	0.284	S	S	*	.	H	α-helix	trans	-64.5	-42.3	175.9	46.2	0	0	0	0	112.1	S577 S581 F582 W583	S577-T579 VanDerWaalsContact C-N 3.32Å; S577-T579 PolarHBondContact O-N 3.01Å; S577-T579 PolarHBondContact OG-OG1 3.3Å; T579-S581 VanDerWaalsContact C-N 3.25Å; T579-S581 PolarHBondContact O-N 2.94Å; T579-F582 PolarHBondContact O-N 3.31Å; T579-W583 WeakPolarHBondContact O-CB 3.38Å; T579-W583 PolarHBondContact O-N 3.28Å
580	D	85.4	Confident	80.8	Confident	56 Å²	56	53.9 Å²	53.9	30%	0.299	28%	0.281	S	S	.	.	H	α-helix	trans	-65.9	-31.6	177.5	-62	-34.1	0	0	0	111.8	S577 W583 F584 I596	S577-D580 VanDerWaalsContact CB-OD2 3.23Å; S577-D580 WeakPolarHBondContact CB-OD2 3.43Å; S577-D580 PolarHBondContact N-OD2 2.88Å; S577-D580 PolarHBondContact O-N 3.49Å; S577-D580 WeakPolarHBondContact OG-CB 2.89Å; S577-D580 PolarHBondContact OG-N 3.12Å; S577-D580 PolarHBondContact OG-OD2 3.06Å; D580-W583 PolarHBondContact O-N 3.04Å; D580-F584 WeakPolarHBondContact O-CB 3.47Å; D580-F584 PolarHBondContact O-N 3.47Å; D580-I596 HydrophobicContact CB-CD1 3.69Å
581	S	88.4	Confident	82.2	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.007	28%	0.278	C	S	.	.	H	α-helix	trans	-70.4	-42.7	176.9	-56.4	0	0	0	0	111.4	S545 S577 L578 T579 W583 F584 T585	S545-S581 WeakPolarHBondContact O-CB 3.44Å; S577-S581 WeakPolarHBondContact O-CB 3.41Å; S577-S581 PolarHBondContact O-N 3.28Å; S577-S581 PolarHBondContact O-OG 3.36Å; L578-S581 PolarHBondContact O-N 3.2Å; T579-S581 VanDerWaalsContact C-N 3.25Å; T579-S581 PolarHBondContact O-N 2.94Å; S581-W583 VanDerWaalsContact C-N 3.33Å; S581-F584 PolarHBondContact O-N 3.28Å; S581-T585 WeakPolarHBondContact O-CG2 3.39Å; S581-T585 PolarHBondContact O-N 3.05Å; S581-T585 PolarHBondContact O-OG1 3.14Å
582	F	89.8	Confident	83.5	Confident	47 Å²	47	57.3 Å²	57.3	21%	0.206	29%	0.288	C	S	.	.	H	α-helix	trans	-65.4	-35.5	172.2	-81.2	-69.7	0	0	0	112.6	Y541 F542 S545 L578 T579 T585 I586	Y541-F582 AromaticContact CE1-CD1 3.71Å; Y541-F582 HydrophobicContact CE1-CD1 3.71Å; Y541-F582 HydrophobicContact CE1-CE1 4.11Å; Y541-F582 HydrophobicContact CE2-CD1 4.5Å; Y541-F582 AromaticContact CZ-CD1 3.66Å; Y541-F582 WeakPolarHBondContact OH-CD1 3.35Å; Y541-F582 PolarHBondContact OH-O 3.49Å; F542-F582 AromaticContact CD1-CE1 3.46Å; F542-F582 HydrophobicContact CD1-CE1 3.46Å; F542-F582 VanDerWaalsContact CD1-CE1 3.46Å; F542-F582 AromaticContact CD1-CZ 3.73Å; F542-F582 HydrophobicContact CD1-CZ 3.73Å; F542-F582 AromaticContact CE1-CE1 3.77Å; F542-F582 HydrophobicContact CE1-CE1 3.77Å; F542-F582 HydrophobicContact CE1-CZ 4.05Å; F542-F582 HydrophobicContact CG-CE1 4.31Å; S545-F582 VanDerWaalsContact CB-CD1 3.41Å; S545-F582 VanDerWaalsContact CB-CE1 3.47Å; S545-F582 WeakPolarHBondContact OG-CD1 3.5Å; L578-F582 HydrophobicContact CD1-CE2 4.48Å; L578-F582 HydrophobicContact CD2-CD2 4.08Å; L578-F582 HydrophobicContact CD2-CE2 3.81Å; L578-F582 HydrophobicContact CG-CD2 4.12Å; L578-F582 HydrophobicContact CG-CE2 3.88Å; L578-F582 WeakPolarHBondContact O-CD2 3.28Å; L578-F582 PolarHBondContact O-N 3.27Å; L578-F582 VanDerWaalsContact O-N 3.11Å; T579-F582 PolarHBondContact O-N 3.31Å; F582-T585 WeakPolarHBondContact CA-OG1 3.39Å; F582-T585 PolarHBondContact O-OG1 3.47Å; F582-I586 WeakPolarHBondContact O-CG2 3.46Å; F582-I586 PolarHBondContact O-N 3.47Å
583	W	88.4	Confident	84.3	Confident	185 Å²	185	57.7 Å²	57.7	70%	0.701	30%	0.301	S	S	*	.	H	α-helix	trans	-71	-39.5	176.1	-167.1	-109.4	0	0	0	112.1	T579 D580 S581 I586 G587	T579-W583 WeakPolarHBondContact O-CB 3.38Å; T579-W583 PolarHBondContact O-N 3.28Å; D580-W583 PolarHBondContact O-N 3.04Å; S581-W583 VanDerWaalsContact C-N 3.33Å; W583-I586 HydrophobicContact CE3-CG2 4.17Å; W583-I586 VanDerWaalsContact O-CG2 3.3Å; W583-I586 WeakPolarHBondContact O-CG2 3.47Å; W583-G587 PolarHBondContact O-N 3.48Å
584	F	87.9	Confident	84.9	Confident	6 Å²	6	59.1 Å²	59.1	3%	0.026	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-46.3	175.4	177.1	-91.3	0	0	0	112	I548 F576 D580 S581 G587 T588 P594 I596 P598 S607	I548-F584 HydrophobicContact CD1-CD1 3.78Å; I548-F584 HydrophobicContact CD1-CE1 3.79Å; F576-F584 HydrophobicContact CE1-CD2 4.41Å; F576-F584 HydrophobicContact CE1-CG 4.37Å; D580-F584 WeakPolarHBondContact O-CB 3.47Å; D580-F584 PolarHBondContact O-N 3.47Å; S581-F584 PolarHBondContact O-N 3.28Å; F584-G587 PolarHBondContact O-N 2.92Å; F584-T588 HydrophobicContact CE1-CG2 4.13Å; F584-T588 HydrophobicContact CE2-CG2 4.32Å; F584-T588 HydrophobicContact CZ-CG2 4.02Å; F584-T588 WeakPolarHBondContact O-CB 2.92Å; F584-T588 WeakPolarHBondContact O-CG2 3.48Å; F584-T588 PolarHBondContact O-N 3.08Å; F584-T588 PolarHBondContact O-OG1 3.39Å; F584-P594 HydrophobicContact CD2-CB 3.64Å; F584-P594 HydrophobicContact CD2-CG 3.52Å; F584-P594 HydrophobicContact CE2-CB 4.08Å; F584-P594 HydrophobicContact CE2-CG 3.41Å; F584-P594 VanDerWaalsContact CE2-CG 3.41Å; F584-P594 HydrophobicContact CZ-CG 4.39Å; F584-I596 WeakPolarHBondContact CD2-O 3.3Å; F584-I596 WeakPolarHBondContact CE2-O 3.06Å; F584-P598 HydrophobicContact CZ-CG 4.39Å; F584-S607 VanDerWaalsContact CZ-OG 3.3Å; F584-S607 WeakPolarHBondContact CZ-OG 3.46Å
585	T	89.3	Confident	84.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-68.5	-36.3	-179.8	48.7	0	0	0	0	112.8	Y541 V544 S545 I548 S581 F582 T588 F589 W610	Y541-T585 WeakPolarHBondContact CE2-OG1 3.28Å; V544-T585 HydrophobicContact CG1-CG2 3.92Å; S545-T585 WeakPolarHBondContact OG-CB 3.05Å; S545-T585 WeakPolarHBondContact OG-CG2 3.42Å; S545-T585 PolarHBondContact OG-OG1 2.83Å; I548-T585 HydrophobicContact CD1-CG2 3.8Å; S581-T585 WeakPolarHBondContact O-CG2 3.39Å; S581-T585 PolarHBondContact O-N 3.05Å; S581-T585 PolarHBondContact O-OG1 3.14Å; F582-T585 WeakPolarHBondContact CA-OG1 3.39Å; F582-T585 PolarHBondContact O-OG1 3.47Å; T585-T588 WeakPolarHBondContact CA-OG1 3.32Å; T585-T588 PolarHBondContact O-OG1 2.92Å; T585-F589 VanDerWaalsContact O-CB 3.3Å; T585-F589 WeakPolarHBondContact O-CB 3.3Å; T585-F589 PolarHBondContact O-N 3.41Å; T585-W610 PolarHBondContact O-NE1 3.44Å; T585-W610 VanDerWaalsContact O-NE1 3.08Å
586	I	89.8	Confident	85.1	Confident	55 Å²	55	64.7 Å²	64.7	28%	0.282	34%	0.338	S	S	.	.	H	α-helix	trans	-73.4	-39.3	176.2	-165.7	63.8	0	0	0	111.4	Y541 F582 W583 T588 F589 M590	Y541-I586 HydrophobicContact CE2-CB 3.83Å; Y541-I586 HydrophobicContact CE2-CD1 4.32Å; F582-I586 WeakPolarHBondContact O-CG2 3.46Å; F582-I586 PolarHBondContact O-N 3.47Å; W583-I586 HydrophobicContact CE3-CG2 4.17Å; W583-I586 VanDerWaalsContact O-CG2 3.3Å; W583-I586 WeakPolarHBondContact O-CG2 3.47Å; I586-T588 PolarHBondContact O-N 3.11Å; I586-F589 HydrophobicContact CD1-CD1 4.4Å; I586-F589 PolarHBondContact O-N 3.17Å; I586-M590 HydrophobicContact CG1-CG 4.49Å; I586-M590 HydrophobicContact CG1-SD 4.49Å; I586-M590 WeakPolarHBondContact O-CG 3.37Å; I586-M590 PolarHBondContact O-N 3.31Å
587	G	88.1	Confident	85.2	Confident	12 Å²	12	71 Å²	71	12%	0.124	36%	0.363	C	S	.	.	H	α-helix	trans	-60.1	-47.5	175.7	0	0	0	0	0	111.9	W583 F584 F589 M590 Q591 Q592	W583-G587 PolarHBondContact O-N 3.48Å; F584-G587 PolarHBondContact O-N 2.92Å; G587-F589 VanDerWaalsContact C-N 3.33Å; G587-F589 PolarHBondContact O-N 3.37Å; G587-M590 PolarHBondContact O-N 3.04Å; G587-Q591 PolarHBondContact O-N 2.93Å; G587-Q592 CarbonylContact C-O 3.56Å; G587-Q592 PolarHBondContact O-N 2.9Å
588	T	88.4	Confident	85.3	Confident	25 Å²	25	70.1 Å²	70.1	15%	0.153	36%	0.356	C	S	.	.	H	α-helix	trans	-66.6	-30.5	175.3	50.1	0	0	0	0	113.4	F584 T585 I586 Q591 P594 W610 S614	F584-T588 HydrophobicContact CE1-CG2 4.13Å; F584-T588 HydrophobicContact CE2-CG2 4.32Å; F584-T588 HydrophobicContact CZ-CG2 4.02Å; F584-T588 WeakPolarHBondContact O-CB 2.92Å; F584-T588 WeakPolarHBondContact O-CG2 3.48Å; F584-T588 PolarHBondContact O-N 3.08Å; F584-T588 PolarHBondContact O-OG1 3.39Å; T585-T588 WeakPolarHBondContact CA-OG1 3.32Å; T585-T588 PolarHBondContact O-OG1 2.92Å; I586-T588 PolarHBondContact O-N 3.11Å; T588-Q591 PolarHBondContact O-N 2.84Å; T588-P594 HydrophobicContact CG2-CG 4Å; T588-W610 PolarHBondContact OG1-NE1 3.26Å; T588-S614 PolarHBondContact O-OG 2.76Å
589	F	90.2	Very high	85	Confident	38 Å²	38	70.4 Å²	70.4	17%	0.167	35%	0.352	C	S	.	.	H	α-helix	trans	-69.6	-41.3	173.5	-175	-99.9	0	0	0	112.4	V537 T585 I586 G587 Q591 W610 I617	V537-F589 HydrophobicContact CG1-CE2 3.68Å; V537-F589 HydrophobicContact CG1-CZ 3.62Å; T585-F589 VanDerWaalsContact O-CB 3.3Å; T585-F589 WeakPolarHBondContact O-CB 3.3Å; T585-F589 PolarHBondContact O-N 3.41Å; I586-F589 HydrophobicContact CD1-CD1 4.4Å; I586-F589 PolarHBondContact O-N 3.17Å; G587-F589 VanDerWaalsContact C-N 3.33Å; G587-F589 PolarHBondContact O-N 3.37Å; F589-Q591 PolarHBondContact O-N 3.03Å; F589-W610 HydrophobicContact CB-CZ2 3.92Å; F589-W610 HydrophobicContact CD2-CH2 4.1Å; F589-W610 AromaticContact CD2-CZ2 3.87Å; F589-W610 HydrophobicContact CD2-CZ2 3.87Å; F589-W610 HydrophobicContact CG-CZ2 4.27Å; F589-I617 HydrophobicContact CE2-CG2 4.31Å; F589-I617 HydrophobicContact CZ-CG2 4.37Å
590	M	89.4	Confident	85	Confident	120 Å²	120	65.8 Å²	65.8	59%	0.591	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	9.2	175.7	-65.5	-167.5	75	0	0	113.7	I586 G587 Q592	I586-M590 HydrophobicContact CG1-CG 4.49Å; I586-M590 HydrophobicContact CG1-SD 4.49Å; I586-M590 WeakPolarHBondContact O-CG 3.37Å; I586-M590 PolarHBondContact O-N 3.31Å; G587-M590 PolarHBondContact O-N 3.04Å; M590-Q592 HydrophobicContact CB-CG 4.42Å; M590-Q592 PolarHBondContact O-N 2.88Å
591	Q	85.3	Confident	85	Confident	122 Å²	122	69.4 Å²	69.4	57%	0.57	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	28.2	-177.2	-56.2	-178.3	-4.8	0	0	113.6	G587 T588 F589	G587-Q591 PolarHBondContact O-N 2.93Å; T588-Q591 PolarHBondContact O-N 2.84Å; F589-Q591 PolarHBondContact O-N 3.03Å
592	Q	85.5	Confident	84.9	Confident	126 Å²	126	71.7 Å²	71.7	59%	0.589	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-100	143.8	173.5	-64.6	-174.2	-2.2	0	0	110.1	G587 M590 P594	G587-Q592 CarbonylContact C-O 3.56Å; G587-Q592 PolarHBondContact O-N 2.9Å; M590-Q592 HydrophobicContact CB-CG 4.42Å; M590-Q592 PolarHBondContact O-N 2.88Å; Q592-P594 WeakPolarHBondContact O-CD 3.34Å
593	S	77.8	Confident	84.7	Confident	118 Å²	118	69.5 Å²	69.5	83%	0.825	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-72.6	121.1	177.7	-60.9	0	0	0	0	110.3
594	P	79.7	Confident	84.8	Confident	43 Å²	43	66.5 Å²	66.5	28%	0.279	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-76.2	147.2	174	30.6	-33.1	0	0	0	111.2	F584 T588 Q592 I596	F584-P594 HydrophobicContact CD2-CB 3.64Å; F584-P594 HydrophobicContact CD2-CG 3.52Å; F584-P594 HydrophobicContact CE2-CB 4.08Å; F584-P594 HydrophobicContact CE2-CG 3.41Å; F584-P594 VanDerWaalsContact CE2-CG 3.41Å; F584-P594 HydrophobicContact CZ-CG 4.39Å; T588-P594 HydrophobicContact CG2-CG 4Å; Q592-P594 WeakPolarHBondContact O-CD 3.34Å; P594-I596 PolarHBondContact O-N 2.83Å
595	D	74.2	Confident	84.9	Confident	162 Å²	162	70.6 Å²	70.6	87%	0.866	36%	0.357	S	S	*	.	S	Bend	trans	-67	-18.2	175	-72.8	-32.7	0	0	0	113
596	I	77.9	Confident	85	Confident	28 Å²	28	72.7 Å²	72.7	14%	0.144	37%	0.367	C	S	.	.			trans	-103	125.9	-178.6	-63.8	167.4	0	0	0	109	Q575 F576 D580 F584 P594	Q575-I596 HydrophobicContact CG-CB 4.45Å; Q575-I596 HydrophobicContact CG-CG1 4.16Å; Q575-I596 HydrophobicContact CG-CG2 3.69Å; F576-I596 HydrophobicContact CD1-CG2 4.15Å; F576-I596 HydrophobicContact CE1-CG2 3.56Å; F576-I596 HydrophobicContact CE2-CG2 4.34Å; F576-I596 HydrophobicContact CZ-CG2 3.67Å; D580-I596 HydrophobicContact CB-CD1 3.69Å; F584-I596 WeakPolarHBondContact CD2-O 3.3Å; F584-I596 WeakPolarHBondContact CE2-O 3.06Å; P594-I596 PolarHBondContact O-N 2.83Å
597	Y	80.7	Confident	84.9	Confident	134 Å²	134	71 Å²	71	53%	0.525	36%	0.361	S	S	.	.			trans	-118.3	131.3	178.3	58.3	-90.8	0	0	0	111.4	R599	Y597-R599 HydrophobicContact CD2-CG 4.25Å; Y597-R599 HydrophobicContact CE2-CG 4.03Å; Y597-R599 PolarHBondContact OH-NH2 2.86Å
598	P	84.4	Confident	85	Confident	17 Å²	17	74.3 Å²	74.3	11%	0.11	38%	0.382	C	S	.	.			trans	-69.1	134	179.5	26.4	-32.8	0	0	0	111.8	F576 F584 T603 R604	F576-P598 HydrophobicContact CE2-CB 4.5Å; F576-P598 HydrophobicContact CZ-CB 4.13Å; F584-P598 HydrophobicContact CZ-CG 4.39Å; P598-T603 WeakPolarHBondContact CB-OG1 3.11Å; P598-R604 HydrophobicContact CB-CG 4.11Å; P598-R604 HydrophobicContact CG-CG 4.04Å; P598-R604 WeakPolarHBondContact O-CG 2.98Å; P598-R604 PolarHBondContact O-NE 3.24Å
599	R	78.9	Confident	85.1	Confident	85 Å²	85	77.6 Å²	77.6	32%	0.321	40%	0.402	S	S	.	.			trans	-100.2	-38.8	179.6	-66.4	178.7	171	-162.1	-8.8	112.8	I557 E558 Y597 R604	I557-R599 HydrophobicContact CG2-CB 4.25Å; E558-R599 PolarHBondContact OE1-N 2.75Å; E558-R599 WeakPolarHBondContact OE2-CB 3.34Å; E558-R599 PolarHBondContact OE2-N 3.36Å; E558-R599 VanDerWaalsContact OE2-N 3.09Å; Y597-R599 HydrophobicContact CD2-CG 4.25Å; Y597-R599 HydrophobicContact CE2-CG 4.03Å; Y597-R599 PolarHBondContact OH-NH2 2.86Å; R599-R604 PolarHBondContact O-NE 2.86Å
600	A	85.8	Confident	85.2	Confident	2 Å²	2	76.1 Å²	76.1	2%	0.017	40%	0.395	C	S	.	.	S	Bend	trans	-69.6	149.5	179.6	0	0	0	0	0	111.3	S555 I557 E558 S602 T603 R604	S555-A600 WeakPolarHBondContact OG-CB 2.79Å; I557-A600 HydrophobicContact CB-CB 4.2Å; I557-A600 HydrophobicContact CG2-CB 4.43Å; E558-A600 HydrophobicContact CG-CB 3.83Å; E558-A600 WeakPolarHBondContact OE1-CB 3.31Å; E558-A600 PolarHBondContact OE1-N 3.19Å; A600-S602 VanDerWaalsContact C-N 3.3Å; A600-S602 PolarHBondContact O-N 2.77Å; A600-T603 WeakPolarHBondContact CB-OG1 3.31Å; A600-T603 PolarHBondContact O-OG1 3.45Å; A600-R604 WeakPolarHBondContact O-CB 3.28Å; A600-R604 VanDerWaalsContact O-CG 3.22Å; A600-R604 WeakPolarHBondContact O-CG 3.01Å; A600-R604 PolarHBondContact O-N 3.12Å; A600-R604 VanDerWaalsContact O-N 3.08Å
601	M	84.9	Confident	85.3	Confident	132 Å²	132	71.7 Å²	71.7	65%	0.65	38%	0.38	S	S	*	.	H	α-helix	trans	-65.6	-36.4	179.8	-169.8	61.7	-174.5	0	0	111.8	R604 I605	M601-R604 PolarHBondContact O-N 3.3Å; M601-I605 HydrophobicContact CE-CD1 4.19Å; M601-I605 HydrophobicContact CE-CG1 4.18Å; M601-I605 HydrophobicContact CG-CD1 4.19Å; M601-I605 VanDerWaalsContact O-CG1 3.29Å; M601-I605 WeakPolarHBondContact O-CG1 2.91Å; M601-I605 PolarHBondContact O-N 3.02Å
602	S	87.6	Confident	85.6	Confident	49 Å²	49	72.5 Å²	72.5	34%	0.343	38%	0.382	S	S	.	.	H	α-helix	trans	-64.3	-46.9	179.6	50.8	0	0	0	0	112.9	V551 A600 I605 I606	V551-S602 WeakPolarHBondContact CG1-OG 3.43Å; A600-S602 VanDerWaalsContact C-N 3.3Å; A600-S602 PolarHBondContact O-N 2.77Å; S602-I605 PolarHBondContact O-N 3.04Å; S602-I606 WeakPolarHBondContact O-CG1 2.78Å; S602-I606 PolarHBondContact O-N 3.17Å
603	T	85.4	Confident	85.9	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.006	37%	0.37	C	S	.	.	H	α-helix	trans	-67	-36.3	176.1	47.6	0	0	0	0	111.6	V551 E558 P598 A600 I606 S607	V551-T603 HydrophobicContact CB-CG2 4.4Å; V551-T603 HydrophobicContact CG1-CG2 3.86Å; E558-T603 HydrophobicContact CG-CG2 4.27Å; E558-T603 WeakPolarHBondContact OE1-CB 3.36Å; E558-T603 PolarHBondContact OE1-OG1 2.87Å; P598-T603 WeakPolarHBondContact CB-OG1 3.11Å; A600-T603 WeakPolarHBondContact CB-OG1 3.31Å; A600-T603 PolarHBondContact O-OG1 3.45Å; T603-I606 PolarHBondContact O-N 2.96Å; T603-S607 VanDerWaalsContact O-CB 3.25Å; T603-S607 WeakPolarHBondContact O-CB 3.02Å; T603-S607 PolarHBondContact O-N 3.46Å
604	R	89.3	Confident	86.6	Confident	122 Å²	122	64.7 Å²	64.7	46%	0.46	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-37.8	173.3	-76.8	175.6	177.1	-169.2	0.7	113.5	P598 R599 A600 M601 S608	P598-R604 HydrophobicContact CB-CG 4.11Å; P598-R604 HydrophobicContact CG-CG 4.04Å; P598-R604 WeakPolarHBondContact O-CG 2.98Å; P598-R604 PolarHBondContact O-NE 3.24Å; R599-R604 PolarHBondContact O-NE 2.86Å; A600-R604 WeakPolarHBondContact O-CB 3.28Å; A600-R604 VanDerWaalsContact O-CG 3.22Å; A600-R604 WeakPolarHBondContact O-CG 3.01Å; A600-R604 PolarHBondContact O-N 3.12Å; A600-R604 VanDerWaalsContact O-N 3.08Å; M601-R604 PolarHBondContact O-N 3.3Å; R604-S608 WeakPolarHBondContact O-CB 3.4Å; R604-S608 PolarHBondContact O-N 3.48Å; R604-S608 PolarHBondContact O-OG 3.28Å
605	I	90.8	Very high	87.1	Confident	91 Å²	91	67.3 Å²	67.3	47%	0.467	34%	0.343	S	S	.	.	H	α-helix	trans	-65.6	-50.6	175.9	-69.5	164.5	0	0	0	109.5	M601 S602 S607 S608 T609	M601-I605 HydrophobicContact CE-CD1 4.19Å; M601-I605 HydrophobicContact CE-CG1 4.18Å; M601-I605 HydrophobicContact CG-CD1 4.19Å; M601-I605 VanDerWaalsContact O-CG1 3.29Å; M601-I605 WeakPolarHBondContact O-CG1 2.91Å; M601-I605 PolarHBondContact O-N 3.02Å; S602-I605 PolarHBondContact O-N 3.04Å; I605-S607 VanDerWaalsContact C-N 3.33Å; I605-S607 PolarHBondContact O-N 3.03Å; I605-S608 PolarHBondContact O-N 2.87Å; I605-S608 VanDerWaalsContact O-N 3.16Å; I605-T609 PolarHBondContact O-N 3.15Å; I605-T609 PolarHBondContact O-OG1 3.26Å; I605-T609 VanDerWaalsContact O-OG1 3.08Å
606	I	91.1	Very high	88	Confident	44 Å²	44	63.1 Å²	63.1	23%	0.226	32%	0.32	C	S	.	.	H	α-helix	trans	-58.8	-45.7	178.6	-64	168.4	0	0	0	110.9	V544 I548 V551 S602 T603 S608 T609 W610	V544-I606 HydrophobicContact CG1-CG2 4.27Å; I548-I606 HydrophobicContact CD1-CG2 4.22Å; I548-I606 HydrophobicContact CG1-CG2 3.67Å; V551-I606 HydrophobicContact CB-CD1 4.18Å; V551-I606 HydrophobicContact CG1-CD1 4.29Å; V551-I606 HydrophobicContact CG2-CD1 3.84Å; S602-I606 WeakPolarHBondContact O-CG1 2.78Å; S602-I606 PolarHBondContact O-N 3.17Å; T603-I606 PolarHBondContact O-N 2.96Å; I606-S608 PolarHBondContact O-N 2.92Å; I606-T609 PolarHBondContact O-N 2.76Å; I606-W610 WeakPolarHBondContact O-CB 3.46Å; I606-W610 PolarHBondContact O-N 2.74Å
607	S	87.8	Confident	88.7	Confident	21 Å²	21	63.2 Å²	63.2	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-39.9	176.8	179	0	0	0	0	112.7	F584 T603 I605 G611	F584-S607 VanDerWaalsContact CZ-OG 3.3Å; F584-S607 WeakPolarHBondContact CZ-OG 3.46Å; T603-S607 VanDerWaalsContact O-CB 3.25Å; T603-S607 WeakPolarHBondContact O-CB 3.02Å; T603-S607 PolarHBondContact O-N 3.46Å; I605-S607 VanDerWaalsContact C-N 3.33Å; I605-S607 PolarHBondContact O-N 3.03Å; S607-G611 PolarHBondContact O-N 3.15Å
608	S	89.3	Confident	89.2	Confident	81 Å²	81	58.5 Å²	58.5	57%	0.566	31%	0.306	S	S	*	.	H	α-helix	trans	-68.1	-41.8	177.9	-62.6	0	0	0	0	111.5	R604 I605 I606 G611 F612	R604-S608 WeakPolarHBondContact O-CB 3.4Å; R604-S608 PolarHBondContact O-N 3.48Å; R604-S608 PolarHBondContact O-OG 3.28Å; I605-S608 PolarHBondContact O-N 2.87Å; I605-S608 VanDerWaalsContact O-N 3.16Å; I606-S608 PolarHBondContact O-N 2.92Å; S608-G611 PolarHBondContact O-N 3.31Å; S608-F612 PolarHBondContact O-N 3.3Å
609	T	91.9	Very high	89.5	Confident	93 Å²	93	60 Å²	60	57%	0.571	32%	0.319	S	S	*	.	H	α-helix	trans	-65.1	-43.1	176.3	-57	0	0	0	0	111.3	I605 I606 F612 F613	I605-T609 PolarHBondContact O-N 3.15Å; I605-T609 PolarHBondContact O-OG1 3.26Å; I605-T609 VanDerWaalsContact O-OG1 3.08Å; I606-T609 PolarHBondContact O-N 2.76Å; T609-F612 PolarHBondContact O-N 3.33Å; T609-F613 PolarHBondContact O-N 2.97Å
610	W	92.4	Very high	90.1	Very high	7 Å²	7	58.4 Å²	58.4	3%	0.027	32%	0.321	C	S	.	.	H	α-helix	trans	-61.3	-44.1	173.2	175.7	-113.7	0	0	0	112.1	A540 Y541 V544 T585 T588 F589 I606 F612 F613 S614	A540-W610 HydrophobicContact CB-CZ3 4.33Å; Y541-W610 HydrophobicContact CD2-CZ2 4.36Å; V544-W610 HydrophobicContact CB-CD2 4.4Å; V544-W610 HydrophobicContact CB-CE3 4.11Å; V544-W610 HydrophobicContact CB-CZ3 4.47Å; V544-W610 HydrophobicContact CG1-CB 3.97Å; V544-W610 HydrophobicContact CG1-CD2 3.93Å; V544-W610 HydrophobicContact CG1-CE3 4.09Å; V544-W610 HydrophobicContact CG1-CG 3.9Å; V544-W610 HydrophobicContact CG2-CD2 4.44Å; V544-W610 HydrophobicContact CG2-CE3 3.74Å; V544-W610 HydrophobicContact CG2-CZ3 4.14Å; T585-W610 PolarHBondContact O-NE1 3.44Å; T585-W610 VanDerWaalsContact O-NE1 3.08Å; T588-W610 PolarHBondContact OG1-NE1 3.26Å; F589-W610 HydrophobicContact CB-CZ2 3.92Å; F589-W610 HydrophobicContact CD2-CH2 4.1Å; F589-W610 AromaticContact CD2-CZ2 3.87Å; F589-W610 HydrophobicContact CD2-CZ2 3.87Å; F589-W610 HydrophobicContact CG-CZ2 4.27Å; I606-W610 WeakPolarHBondContact O-CB 3.46Å; I606-W610 PolarHBondContact O-N 2.74Å; W610-F612 VanDerWaalsContact C-N 3.33Å; W610-F612 PolarHBondContact O-N 3.13Å; W610-F613 AromaticContact CE3-CD1 3.84Å; W610-F613 HydrophobicContact CE3-CD1 3.84Å; W610-F613 HydrophobicContact CE3-CE1 4.49Å; W610-F613 HydrophobicContact CH2-CD1 4.47Å; W610-F613 HydrophobicContact CH2-CE1 4.5Å; W610-F613 AromaticContact CZ3-CD1 3.63Å; W610-F613 HydrophobicContact CZ3-CD1 3.63Å; W610-F613 AromaticContact CZ3-CE1 3.84Å; W610-F613 HydrophobicContact CZ3-CE1 3.84Å; W610-F613 PolarHBondContact O-N 3.42Å; W610-S614 PolarHBondContact O-N 3.43Å; W610-S614 PolarHBondContact O-OG 3.33Å
611	G	90.1	Very high	90.3	Very high	27 Å²	27	60.7 Å²	60.7	28%	0.278	33%	0.33	S	S	.	.	H	α-helix	trans	-62.4	-37	177.1	0	0	0	0	0	113.3	S607 S608 S614 L615	S607-G611 PolarHBondContact O-N 3.15Å; S608-G611 PolarHBondContact O-N 3.31Å; G611-S614 PolarHBondContact O-OG 2.86Å; G611-S614 VanDerWaalsContact O-OG 3.09Å; G611-L615 VanDerWaalsContact O-CB 3.31Å; G611-L615 WeakPolarHBondContact O-CB 3.3Å; G611-L615 PolarHBondContact O-N 3.21Å; G611-L615 VanDerWaalsContact O-N 3.08Å
612	F	91.7	Very high	90.6	Very high	140 Å²	140	58.1 Å²	58.1	61%	0.614	32%	0.322	S	S	*	.	H	α-helix	trans	-68.4	-43.2	173.8	-175.5	-110.1	0	0	0	112	S608 T609 W610 L615 I616	S608-F612 PolarHBondContact O-N 3.3Å; T609-F612 PolarHBondContact O-N 3.33Å; W610-F612 VanDerWaalsContact C-N 3.33Å; W610-F612 PolarHBondContact O-N 3.13Å; F612-L615 PolarHBondContact O-N 3Å; F612-I616 HydrophobicContact CD1-CD1 3.84Å; F612-I616 HydrophobicContact CE1-CD1 3.38Å; F612-I616 HydrophobicContact CE2-CD1 4.22Å; F612-I616 HydrophobicContact CG-CD1 4.45Å; F612-I616 HydrophobicContact CZ-CD1 3.6Å; F612-I616 HydrophobicContact CZ-CG1 4.43Å; F612-I616 WeakPolarHBondContact O-CG1 3.37Å; F612-I616 PolarHBondContact O-N 2.96Å; F612-I616 VanDerWaalsContact O-N 3.15Å
613	F	92.6	Very high	90.6	Very high	75 Å²	75	58.5 Å²	58.5	33%	0.329	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-47.3	175.8	174.7	-98.4	0	0	0	112	A540 T609 W610 L615 I616 I617	A540-F613 HydrophobicContact CB-CE1 4.42Å; T609-F613 PolarHBondContact O-N 2.97Å; W610-F613 AromaticContact CE3-CD1 3.84Å; W610-F613 HydrophobicContact CE3-CD1 3.84Å; W610-F613 HydrophobicContact CE3-CE1 4.49Å; W610-F613 HydrophobicContact CH2-CD1 4.47Å; W610-F613 HydrophobicContact CH2-CE1 4.5Å; W610-F613 AromaticContact CZ3-CD1 3.63Å; W610-F613 HydrophobicContact CZ3-CD1 3.63Å; W610-F613 AromaticContact CZ3-CE1 3.84Å; W610-F613 HydrophobicContact CZ3-CE1 3.84Å; W610-F613 PolarHBondContact O-N 3.42Å; F613-L615 VanDerWaalsContact C-N 3.35Å; F613-L615 PolarHBondContact O-N 3.35Å; F613-I616 PolarHBondContact O-N 3.22Å; F613-I617 HydrophobicContact CD1-CG1 4.43Å; F613-I617 HydrophobicContact CD2-CG1 4.46Å; F613-I617 HydrophobicContact CE1-CG1 4Å; F613-I617 HydrophobicContact CE2-CD1 4.29Å; F613-I617 HydrophobicContact CE2-CG1 4.04Å; F613-I617 HydrophobicContact CZ-CD1 4.19Å; F613-I617 HydrophobicContact CZ-CG1 3.79Å; F613-I617 WeakPolarHBondContact O-CG1 3.39Å; F613-I617 PolarHBondContact O-N 3.21Å
614	S	91.3	Very high	90.7	Very high	4 Å²	4	62.1 Å²	62.1	3%	0.028	35%	0.347	C	S	.	.	H	α-helix	trans	-63.9	-39.5	179.2	67.5	0	0	0	0	112	T588 W610 G611 I616 I617 V618	T588-S614 PolarHBondContact O-OG 2.76Å; W610-S614 PolarHBondContact O-N 3.43Å; W610-S614 PolarHBondContact O-OG 3.33Å; G611-S614 PolarHBondContact O-OG 2.86Å; G611-S614 VanDerWaalsContact O-OG 3.09Å; S614-I616 PolarHBondContact O-N 3.11Å; S614-I617 PolarHBondContact O-N 3.44Å; S614-V618 WeakPolarHBondContact O-CB 3.09Å; S614-V618 WeakPolarHBondContact O-CG2 3.47Å; S614-V618 PolarHBondContact O-N 3.35Å
615	L	91	Very high	90.4	Very high	98 Å²	98	58.3 Å²	58.3	51%	0.513	34%	0.336	S	S	.	.	H	α-helix	trans	-58.8	-46.8	175.3	-173.8	156.3	0	0	0	111.6	G611 F612 F613 A619	G611-L615 VanDerWaalsContact O-CB 3.31Å; G611-L615 WeakPolarHBondContact O-CB 3.3Å; G611-L615 PolarHBondContact O-N 3.21Å; G611-L615 VanDerWaalsContact O-N 3.08Å; F612-L615 PolarHBondContact O-N 3Å; F613-L615 VanDerWaalsContact C-N 3.35Å; F613-L615 PolarHBondContact O-N 3.35Å; L615-A619 WeakPolarHBondContact O-CB 3.23Å; L615-A619 PolarHBondContact O-N 2.93Å
616	I	92.7	Very high	89.8	Confident	74 Å²	74	56.6 Å²	56.6	38%	0.379	34%	0.335	S	S	.	.	H	α-helix	trans	-62.6	-45.8	178.8	-68.9	170	0	0	0	111.2	F612 F613 S614 A619 S620	F612-I616 HydrophobicContact CD1-CD1 3.84Å; F612-I616 HydrophobicContact CE1-CD1 3.38Å; F612-I616 HydrophobicContact CE2-CD1 4.22Å; F612-I616 HydrophobicContact CG-CD1 4.45Å; F612-I616 HydrophobicContact CZ-CD1 3.6Å; F612-I616 HydrophobicContact CZ-CG1 4.43Å; F612-I616 WeakPolarHBondContact O-CG1 3.37Å; F612-I616 PolarHBondContact O-N 2.96Å; F612-I616 VanDerWaalsContact O-N 3.15Å; F613-I616 PolarHBondContact O-N 3.22Å; S614-I616 PolarHBondContact O-N 3.11Å; I616-A619 PolarHBondContact O-N 2.88Å; I616-S620 WeakPolarHBondContact O-CB 3.48Å; I616-S620 PolarHBondContact O-N 2.86Å; I616-S620 PolarHBondContact O-OG 3.5Å
617	I	92.4	Very high	89.3	Confident	31 Å²	31	57 Å²	57	16%	0.159	35%	0.345	C	S	.	.	H	α-helix	trans	-64.8	-46.9	-178.5	-68	-64.5	0	0	0	111.1	V537 F589 F613 S614 S620 Y621	V537-I617 HydrophobicContact CG2-CG2 4.22Å; F589-I617 HydrophobicContact CE2-CG2 4.31Å; F589-I617 HydrophobicContact CZ-CG2 4.37Å; F613-I617 HydrophobicContact CD1-CG1 4.43Å; F613-I617 HydrophobicContact CD2-CG1 4.46Å; F613-I617 HydrophobicContact CE1-CG1 4Å; F613-I617 HydrophobicContact CE2-CD1 4.29Å; F613-I617 HydrophobicContact CE2-CG1 4.04Å; F613-I617 HydrophobicContact CZ-CD1 4.19Å; F613-I617 HydrophobicContact CZ-CG1 3.79Å; F613-I617 WeakPolarHBondContact O-CG1 3.39Å; F613-I617 PolarHBondContact O-N 3.21Å; S614-I617 PolarHBondContact O-N 3.44Å; I617-S620 PolarHBondContact O-N 3.2Å; I617-Y621 WeakPolarHBondContact O-CB 3.26Å; I617-Y621 PolarHBondContact O-N 2.77Å
618	V	91.2	Very high	88.7	Confident	35 Å²	35	60 Å²	60	21%	0.212	36%	0.355	C	S	.	.	H	α-helix	trans	-64.8	-42.2	178.5	175.7	0	0	0	0	111	S614 S620 Y621 T622	S614-V618 WeakPolarHBondContact O-CB 3.09Å; S614-V618 WeakPolarHBondContact O-CG2 3.47Å; S614-V618 PolarHBondContact O-N 3.35Å; V618-S620 VanDerWaalsContact C-N 3.34Å; V618-S620 PolarHBondContact O-N 3.42Å; V618-Y621 PolarHBondContact O-N 2.89Å; V618-T622 HydrophobicContact CG1-CG2 4.43Å; V618-T622 WeakPolarHBondContact O-CG2 3.48Å; V618-T622 PolarHBondContact O-N 3.29Å; V618-T622 PolarHBondContact O-OG1 3.18Å
619	A	91	Very high	87.9	Confident	48 Å²	48	59.3 Å²	59.3	40%	0.397	35%	0.345	S	S	.	.	H	α-helix	trans	-63.7	-37.8	176.6	0	0	0	0	0	112.7	L615 I616 T622 A623	L615-A619 WeakPolarHBondContact O-CB 3.23Å; L615-A619 PolarHBondContact O-N 2.93Å; I616-A619 PolarHBondContact O-N 2.88Å; A619-T622 WeakPolarHBondContact CA-OG1 3.29Å; A619-T622 PolarHBondContact O-OG1 3.32Å; A619-A623 WeakPolarHBondContact O-CB 3.37Å; A619-A623 PolarHBondContact O-N 2.86Å
620	S	91.7	Very high	86.9	Confident	51 Å²	51	60.4 Å²	60.4	36%	0.357	35%	0.352	S	S	.	.	H	α-helix	trans	-70.2	-39.4	177	-57.2	0	0	0	0	111.5	I616 I617 V618 A623 N624	I616-S620 WeakPolarHBondContact O-CB 3.48Å; I616-S620 PolarHBondContact O-N 2.86Å; I616-S620 PolarHBondContact O-OG 3.5Å; I617-S620 PolarHBondContact O-N 3.2Å; V618-S620 VanDerWaalsContact C-N 3.34Å; V618-S620 PolarHBondContact O-N 3.42Å; S620-A623 PolarHBondContact O-N 3.24Å; S620-N624 WeakPolarHBondContact O-CB 3.26Å; S620-N624 PolarHBondContact O-N 3.41Å
621	Y	91.3	Very high	85.5	Confident	50 Å²	50	63.5 Å²	63.5	20%	0.196	37%	0.372	C	S	.	.	H	α-helix	trans	-62.1	-46.9	174.2	172.9	-99.4	0	0	0	111.6	F525 P528 L529 W534 I617 V618 A623 N624 L625	F525-Y621 WeakPolarHBondContact O-CE2 3.01Å; F525-Y621 PolarHBondContact O-OH 3.49Å; P528-Y621 HydrophobicContact CB-CD2 4.28Å; P528-Y621 HydrophobicContact CB-CE2 4.29Å; P528-Y621 HydrophobicContact CG-CE2 4.19Å; L529-Y621 HydrophobicContact CD1-CD2 4.02Å; L529-Y621 HydrophobicContact CG-CD2 4.24Å; W534-Y621 HydrophobicContact CZ2-CD2 4.32Å; W534-Y621 HydrophobicContact CZ2-CE2 4.13Å; I617-Y621 WeakPolarHBondContact O-CB 3.26Å; I617-Y621 PolarHBondContact O-N 2.77Å; V618-Y621 PolarHBondContact O-N 2.89Å; Y621-A623 VanDerWaalsContact C-N 3.35Å; Y621-A623 PolarHBondContact O-N 2.96Å; Y621-N624 PolarHBondContact O-N 2.83Å; Y621-L625 HydrophobicContact CE1-CD2 3.97Å; Y621-L625 WeakPolarHBondContact O-CB 3.05Å; Y621-L625 PolarHBondContact O-N 3.1Å
622	T	89.7	Confident	84.1	Confident	78 Å²	78	69.2 Å²	69.2	48%	0.479	39%	0.391	S	S	.	.	H	α-helix	trans	-65.7	-37.4	179.7	55	0	0	0	0	112.1	V618 A619 A626	V618-T622 HydrophobicContact CG1-CG2 4.43Å; V618-T622 WeakPolarHBondContact O-CG2 3.48Å; V618-T622 PolarHBondContact O-N 3.29Å; V618-T622 PolarHBondContact O-OG1 3.18Å; A619-T622 WeakPolarHBondContact CA-OG1 3.29Å; A619-T622 PolarHBondContact O-OG1 3.32Å; T622-A626 WeakPolarHBondContact O-CB 3.36Å; T622-A626 PolarHBondContact O-N 3.3Å; T622-A626 VanDerWaalsContact O-N 3.12Å
623	A	89	Confident	82.5	Confident	57 Å²	57	72.6 Å²	72.6	47%	0.471	40%	0.4	S	S	.	.	H	α-helix	trans	-64.8	-48.8	174.4	0	0	0	0	0	112.4	A619 S620 Y621 A626 A627	A619-A623 WeakPolarHBondContact O-CB 3.37Å; A619-A623 PolarHBondContact O-N 2.86Å; S620-A623 PolarHBondContact O-N 3.24Å; Y621-A623 VanDerWaalsContact C-N 3.35Å; Y621-A623 PolarHBondContact O-N 2.96Å; A623-A626 PolarHBondContact O-N 3.41Å; A623-A627 PolarHBondContact O-N 3.07Å; A623-A627 VanDerWaalsContact O-N 3.07Å
624	N	86.8	Confident	80.9	Confident	78 Å²	78	74.7 Å²	74.7	42%	0.417	41%	0.412	S	S	.	.	H	α-helix	trans	-69	-36.4	-179.8	-75.1	-5.4	0	0	0	112.4	P528 S620 Y621 A626 A627 F628	P528-N624 HydrophobicContact CB-CB 3.96Å; P528-N624 PolarHBondContact O-ND2 2.9Å; S620-N624 WeakPolarHBondContact O-CB 3.26Å; S620-N624 PolarHBondContact O-N 3.41Å; Y621-N624 PolarHBondContact O-N 2.83Å; N624-A626 VanDerWaalsContact C-N 3.35Å; N624-A627 PolarHBondContact O-N 3.41Å; N624-F628 VanDerWaalsContact O-CB 3.31Å; N624-F628 WeakPolarHBondContact O-CB 3.28Å; N624-F628 PolarHBondContact O-N 3.2Å
625	L	83.3	Confident	79.7	Confident	42 Å²	42	80.9 Å²	80.9	22%	0.22	44%	0.443	C	S	.	.	H	α-helix	trans	-61.5	-44.8	174.8	178.4	64.5	0	0	0	110.7	P528 Y621 A627 F628 L629	P528-L625 HydrophobicContact CB-CB 4.31Å; P528-L625 HydrophobicContact CG-CB 3.94Å; P528-L625 HydrophobicContact CG-CD1 3.69Å; P528-L625 HydrophobicContact CG-CG 4.42Å; Y621-L625 HydrophobicContact CE1-CD2 3.97Å; Y621-L625 WeakPolarHBondContact O-CB 3.05Å; Y621-L625 PolarHBondContact O-N 3.1Å; L625-A627 VanDerWaalsContact C-N 3.34Å; L625-A627 PolarHBondContact O-N 3.34Å; L625-F628 PolarHBondContact O-N 3Å; L625-L629 HydrophobicContact CD1-CD1 3.88Å; L625-L629 HydrophobicContact CD1-CG 4.19Å; L625-L629 HydrophobicContact CG-CD1 3.82Å; L625-L629 WeakPolarHBondContact O-CB 3.4Å; L625-L629 WeakPolarHBondContact O-CD1 3.38Å; L625-L629 VanDerWaalsContact O-CG 3.24Å; L625-L629 WeakPolarHBondContact O-CG 3.22Å; L625-L629 PolarHBondContact O-N 2.94Å
626	A	77.4	Confident	78.7	Confident	55 Å²	55	80 Å²	80	46%	0.455	44%	0.439	S	S	.	.	H	α-helix	trans	-62.6	-39.4	176.1	0	0	0	0	0	112.5	T622 A623 N624 T630	T622-A626 WeakPolarHBondContact O-CB 3.36Å; T622-A626 PolarHBondContact O-N 3.3Å; T622-A626 VanDerWaalsContact O-N 3.12Å; A623-A626 PolarHBondContact O-N 3.41Å; N624-A626 VanDerWaalsContact C-N 3.35Å; A626-T630 WeakPolarHBondContact O-CG2 3.29Å; A626-T630 PolarHBondContact O-N 2.89Å; A626-T630 PolarHBondContact O-OG1 2.81Å
627	A	80	Confident	78	Confident	51 Å²	51	80.2 Å²	80.2	42%	0.421	45%	0.445	S	S	.	.	H	α-helix	trans	-67.9	-39.9	175.5	0	0	0	0	0	112.5	A623 N624 L625 T630 T631	A623-A627 PolarHBondContact O-N 3.07Å; A623-A627 VanDerWaalsContact O-N 3.07Å; N624-A627 PolarHBondContact O-N 3.41Å; L625-A627 VanDerWaalsContact C-N 3.34Å; L625-A627 PolarHBondContact O-N 3.34Å; A627-T630 WeakPolarHBondContact CA-OG1 3.37Å; A627-T630 PolarHBondContact O-N 2.75Å; A627-T630 PolarHBondContact O-OG1 3.2Å; A627-T631 PolarHBondContact O-N 3.32Å; A627-T631 PolarHBondContact O-OG1 3.04Å
628	F	75.4	Confident	77.6	Confident	84 Å²	84	78.9 Å²	78.9	37%	0.368	44%	0.438	S	S	.	.	H	α-helix	trans	-66	-44.5	178.9	-173	-94.3	0	0	0	111.5	S524 N527 N624 L625 T630 T631	S524-F628 WeakPolarHBondContact OG-CE1 3.3Å; N527-F628 HydrophobicContact CB-CE2 4.47Å; N527-F628 HydrophobicContact CB-CZ 4.29Å; N624-F628 VanDerWaalsContact O-CB 3.31Å; N624-F628 WeakPolarHBondContact O-CB 3.28Å; N624-F628 PolarHBondContact O-N 3.2Å; L625-F628 PolarHBondContact O-N 3Å; F628-T630 PolarHBondContact O-N 3.24Å; F628-T631 PolarHBondContact O-N 2.83Å
629	L	73.6	Confident	77.2	Confident	68 Å²	68	83.2 Å²	83.2	36%	0.356	46%	0.456	S	S	.	.	H	α-helix	trans	-67.3	-21.5	178.7	-70.4	164.2	0	0	0	113.7	L625 L790	L625-L629 HydrophobicContact CD1-CD1 3.88Å; L625-L629 HydrophobicContact CD1-CG 4.19Å; L625-L629 HydrophobicContact CG-CD1 3.82Å; L625-L629 WeakPolarHBondContact O-CB 3.4Å; L625-L629 WeakPolarHBondContact O-CD1 3.38Å; L625-L629 VanDerWaalsContact O-CG 3.24Å; L625-L629 WeakPolarHBondContact O-CG 3.22Å; L625-L629 PolarHBondContact O-N 2.94Å; L629-L790 HydrophobicContact CD1-CD2 3.84Å; L629-L790 HydrophobicContact CD2-CD2 4.03Å; L629-L790 HydrophobicContact CG-CD2 4.47Å
630	T	70	Confident	77.1	Confident	115 Å²	115	84.9 Å²	84.9	71%	0.706	46%	0.459	S	S	*	.	H	α-helix	trans	-90.7	-11.3	177.5	49.1	0	0	0	0	113	A626 A627 F628	A626-T630 WeakPolarHBondContact O-CG2 3.29Å; A626-T630 PolarHBondContact O-N 2.89Å; A626-T630 PolarHBondContact O-OG1 2.81Å; A627-T630 WeakPolarHBondContact CA-OG1 3.37Å; A627-T630 PolarHBondContact O-N 2.75Å; A627-T630 PolarHBondContact O-OG1 3.2Å; F628-T630 PolarHBondContact O-N 3.24Å
631	T	63.8	Low	76.9	Confident	73 Å²	73	82.9 Å²	82.9	45%	0.448	45%	0.445	S	S	.	.			trans	-125.4	81.4	-174.9	55.1	0	0	0	0	112.6	A627 F628 R633	A627-T631 PolarHBondContact O-N 3.32Å; A627-T631 PolarHBondContact O-OG1 3.04Å; F628-T631 PolarHBondContact O-N 2.83Å; T631-R633 PolarHBondContact O-N 3.4Å; T631-R633 VanDerWaalsContact O-N 3.14Å
632	E	60.6	Low	76.8	Confident	146 Å²	146	86.8 Å²	86.8	68%	0.682	47%	0.465	S	S	*	.			trans	-74.4	98.4	162.6	-70.9	179.5	-171.6	0	0	109.1
633	R	57.6	Low	76.8	Confident	212 Å²	212	86 Å²	86	80%	0.8	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-84	119	173.3	-67.6	-173.7	-178.2	-175.4	0.6	109.3	T631 I635	T631-R633 PolarHBondContact O-N 3.4Å; T631-R633 VanDerWaalsContact O-N 3.14Å; R633-I635 PolarHBondContact O-N 2.94Å
634	M	58.8	Low	76.8	Confident	119 Å²	119	83.3 Å²	83.3	59%	0.586	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-67.3	117.6	162.5	-67.3	-172.1	-71.2	0	0	107.7
635	I	66.4	Low	76.9	Confident	134 Å²	134	80.6 Å²	80.6	69%	0.687	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-91.1	117.9	175.6	-57.1	173.3	0	0	0	106.9	R633	R633-I635 PolarHBondContact O-N 2.94Å
636	N	70.6	Confident	77.1	Confident	79 Å²	79	83.3 Å²	83.3	42%	0.422	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-81.9	128.7	173.2	-68	-17.4	0	0	0	108.6	P515 I638	P515-N636 WeakPolarHBondContact CG-OD1 3.37Å; N636-I638 VanDerWaalsContact C-N 3.25Å; N636-I638 PolarHBondContact O-N 3.47Å
637	P	76.9	Confident	77.6	Confident	79 Å²	79	82.6 Å²	82.6	51%	0.513	43%	0.434	S	S	.	.	S	Bend	trans	-72.1	-19.9	-178.9	27.8	-34.1	0	0	0	113.4	F512 I650	F512-P637 HydrophobicContact CE1-CG 3.99Å; F512-P637 HydrophobicContact CZ-CG 4.49Å; P637-I650 HydrophobicContact CB-CD1 4.41Å; P637-I650 HydrophobicContact CG-CD1 4.4Å
638	I	83.9	Confident	77.9	Confident	2 Å²	2	86 Å²	86	1%	0.01	45%	0.45	C	S	.	.			trans	-137.2	136.5	177.9	47.5	166.5	0	0	0	109.1	F512 N636 D643 L644 I650 I725	F512-I638 HydrophobicContact CD2-CD1 4.27Å; F512-I638 HydrophobicContact CG-CD1 4.24Å; N636-I638 VanDerWaalsContact C-N 3.25Å; N636-I638 PolarHBondContact O-N 3.47Å; I638-D643 HydrophobicContact CG2-CB 4.26Å; I638-L644 HydrophobicContact CD1-CD1 4.15Å; I638-L644 HydrophobicContact CG2-CD1 4.5Å; I638-I650 HydrophobicContact CG2-CD1 3.95Å; I638-I725 HydrophobicContact CD1-CD1 3.78Å; I638-I725 HydrophobicContact CD1-CG2 4.37Å; I638-I725 HydrophobicContact CG1-CD1 3.63Å; I638-I725 HydrophobicContact CG1-CG2 4.19Å; I638-I725 VanDerWaalsContact O-CG2 3.25Å; I638-I725 WeakPolarHBondContact O-CG2 3.39Å
639	E	84.4	Confident	78.4	Confident	127 Å²	127	89.7 Å²	89.7	59%	0.593	47%	0.468	S	S	*	.	S	Bend	trans	-110.9	-38	173.9	-64.8	-171.8	168.8	0	0	111.1	D643 I725 G726	E639-D643 PolarHBondContact N-OD2 3.08Å; E639-D643 VanDerWaalsContact N-OD2 3.08Å; E639-I725 WeakPolarHBondContact O-CG2 3.29Å; E639-G726 VanDerWaalsContact O-CA 3.26Å; E639-G726 WeakPolarHBondContact O-CA 3.42Å; E639-G726 PolarHBondContact O-N 3.43Å
640	N	87.7	Confident	79.2	Confident	83 Å²	83	87.1 Å²	87.1	44%	0.444	46%	0.455	S	S	.	.	S	Bend	trans	-134.4	170.5	-174.6	-60.9	-57.1	0	0	0	113.4	E642 D643 L644	N640-E642 PolarHBondContact O-N 2.76Å; N640-D643 PolarHBondContact N-OD2 3.26Å; N640-D643 VanDerWaalsContact N-OD2 3.11Å; N640-D643 PolarHBondContact O-N 2.75Å; N640-L644 PolarHBondContact O-N 2.92Å
641	A	87.6	Confident	80.1	Confident	8 Å²	8	83.1 Å²	83.1	7%	0.066	43%	0.431	C	S	.	.	H	α-helix	trans	-64.8	-25.1	176.5	0	0	0	0	0	113.6	I510 L644 A645 Y672 I675 L729	I510-A641 HydrophobicContact CD1-CB 4.41Å; A641-L644 PolarHBondContact O-N 3.24Å; A641-A645 WeakPolarHBondContact O-CB 3.13Å; A641-A645 PolarHBondContact O-N 2.62Å; A641-Y672 HydrophobicContact CB-CE1 4.36Å; A641-I675 HydrophobicContact CB-CD1 4.3Å; A641-L729 HydrophobicContact CB-CD1 4.2Å; A641-L729 HydrophobicContact CB-CD2 3.64Å
642	E	89.2	Confident	81.5	Confident	133 Å²	133	80.1 Å²	80.1	62%	0.621	41%	0.411	S	S	*	.	H	α-helix	trans	-67.3	-43.4	175.5	-71.3	-180	177	0	0	111.8	N640 L644 A645 S646 T671	N640-E642 PolarHBondContact O-N 2.76Å; E642-L644 VanDerWaalsContact C-N 3.28Å; E642-L644 PolarHBondContact O-N 3.01Å; E642-A645 PolarHBondContact O-N 2.82Å; E642-A645 VanDerWaalsContact O-N 3.14Å; E642-S646 WeakPolarHBondContact O-CB 3.44Å; E642-S646 PolarHBondContact O-N 3.17Å; E642-T671 HydrophobicContact CB-CG2 4.47Å; E642-T671 HydrophobicContact CG-CG2 3.81Å
643	D	89.6	Confident	83.1	Confident	61 Å²	61	73.1 Å²	73.1	33%	0.326	38%	0.379	S	S	.	.	H	α-helix	trans	-58.4	-47.3	175	-55.5	-30.4	0	0	0	109.4	I638 E639 N640 A645 S646 Q647	I638-D643 HydrophobicContact CG2-CB 4.26Å; E639-D643 PolarHBondContact N-OD2 3.08Å; E639-D643 VanDerWaalsContact N-OD2 3.08Å; N640-D643 PolarHBondContact N-OD2 3.26Å; N640-D643 VanDerWaalsContact N-OD2 3.11Å; N640-D643 PolarHBondContact O-N 2.75Å; D643-A645 VanDerWaalsContact C-N 3.28Å; D643-A645 PolarHBondContact O-N 3.44Å; D643-S646 PolarHBondContact O-N 2.99Å; D643-S646 VanDerWaalsContact O-N 3.12Å; D643-S646 PolarHBondContact O-OG 3.32Å; D643-Q647 WeakPolarHBondContact O-CG 3.35Å; D643-Q647 PolarHBondContact O-N 2.86Å
644	L	88.6	Confident	84.8	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-58.9	-37.8	178	-168	71.8	0	0	0	112.5	I510 I638 N640 A641 E642 Q647 I650 Y652 A704	I510-L644 HydrophobicContact CD1-CD2 4.37Å; I638-L644 HydrophobicContact CD1-CD1 4.15Å; I638-L644 HydrophobicContact CG2-CD1 4.5Å; N640-L644 PolarHBondContact O-N 2.92Å; A641-L644 PolarHBondContact O-N 3.24Å; E642-L644 VanDerWaalsContact C-N 3.28Å; E642-L644 PolarHBondContact O-N 3.01Å; L644-Q647 PolarHBondContact O-NE2 3.4Å; L644-I650 HydrophobicContact CD1-CG2 4.23Å; L644-Y652 HydrophobicContact CD1-CD1 3.65Å; L644-Y652 HydrophobicContact CD1-CE1 4.3Å; L644-Y652 HydrophobicContact CD1-CG 4.31Å; L644-Y652 HydrophobicContact CD2-CD1 3.86Å; L644-Y652 HydrophobicContact CD2-CD2 4.45Å; L644-Y652 HydrophobicContact CD2-CE1 4.48Å; L644-Y652 HydrophobicContact CD2-CG 3.81Å; L644-Y652 HydrophobicContact CG-CD1 3.47Å; L644-Y652 VanDerWaalsContact CG-CD1 3.47Å; L644-Y652 HydrophobicContact CG-CE1 3.84Å; L644-Y652 HydrophobicContact CG-CG 3.98Å; L644-Y652 VanDerWaalsContact O-CE1 3.24Å; L644-Y652 WeakPolarHBondContact O-CE1 3.33Å; L644-A704 HydrophobicContact CD1-CB 4.16Å
645	A	89.3	Confident	86.2	Confident	22 Å²	22	58.4 Å²	58.4	18%	0.182	32%	0.318	C	S	.	.	H	α-helix	trans	-75.8	-29.1	177.8	0	0	0	0	0	113.4	A641 E642 D643 T671 I675	A641-A645 WeakPolarHBondContact O-CB 3.13Å; A641-A645 PolarHBondContact O-N 2.62Å; E642-A645 PolarHBondContact O-N 2.82Å; E642-A645 VanDerWaalsContact O-N 3.14Å; D643-A645 VanDerWaalsContact C-N 3.28Å; D643-A645 PolarHBondContact O-N 3.44Å; A645-T671 HydrophobicContact CB-CG2 3.89Å; A645-I675 HydrophobicContact CB-CD1 4.17Å; A645-I675 HydrophobicContact CB-CG1 3.74Å
646	S	88.4	Confident	87	Confident	98 Å²	98	55.5 Å²	55.5	69%	0.685	30%	0.304	S	S	*	.	H	α-helix	trans	-79.6	-30	-179.3	75.5	0	0	0	0	113	E642 D643	E642-S646 WeakPolarHBondContact O-CB 3.44Å; E642-S646 PolarHBondContact O-N 3.17Å; D643-S646 PolarHBondContact O-N 2.99Å; D643-S646 VanDerWaalsContact O-N 3.12Å; D643-S646 PolarHBondContact O-OG 3.32Å
647	Q	87.6	Confident	87.4	Confident	40 Å²	40	54.4 Å²	54.4	19%	0.187	30%	0.303	C	S	.	.			trans	-94.4	161.5	-178.6	70.2	77.1	38.7	0	0	112.3	D643 L644 I650	D643-Q647 WeakPolarHBondContact O-CG 3.35Å; D643-Q647 PolarHBondContact O-N 2.86Å; L644-Q647 PolarHBondContact O-NE2 3.4Å; Q647-I650 PolarHBondContact NE2-O 3.15Å
648	T	85.7	Confident	87.6	Confident	124 Å²	124	51 Å²	51	76%	0.761	28%	0.282	S	S	*	.	S	Bend	trans	-128.6	-2.7	-179.4	56.3	0	0	0	0	114.6
649	E	86.9	Confident	87.8	Confident	161 Å²	161	51.5 Å²	51.5	75%	0.752	29%	0.286	S	S	*	.	S	Bend	trans	-75.4	-46.6	-177	-173.7	174.8	-175.8	0	0	111.6
650	I	89.1	Confident	88	Confident	14 Å²	14	45.8 Å²	45.8	7%	0.072	26%	0.259	C	S	.	.	S	Bend	trans	-85.9	119.3	176.4	-56.8	168.2	0	0	0	108.4	F512 P637 I638 L644 Q647 A704	F512-I650 HydrophobicContact CE2-CD1 4.33Å; F512-I650 HydrophobicContact CE2-CG2 3.72Å; F512-I650 HydrophobicContact CZ-CD1 3.98Å; F512-I650 HydrophobicContact CZ-CG1 4.49Å; F512-I650 HydrophobicContact CZ-CG2 4.38Å; P637-I650 HydrophobicContact CB-CD1 4.41Å; P637-I650 HydrophobicContact CG-CD1 4.4Å; I638-I650 HydrophobicContact CG2-CD1 3.95Å; L644-I650 HydrophobicContact CD1-CG2 4.23Å; Q647-I650 PolarHBondContact NE2-O 3.15Å; I650-A704 HydrophobicContact CG2-CB 4.19Å
651	S	90.4	Very high	88.1	Confident	30 Å²	30	43.4 Å²	43.4	21%	0.21	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	152.8	173.3	-63.9	0	0	0	0	110.4	N702 Y703 A704	S651-N702 PolarHBondContact N-O 3.36Å; S651-Y703 CarbonylContact O-C 3.57Å; S651-Y703 WeakPolarHBondContact O-CA 3.33Å; S651-Y703 WeakPolarHBondContact O-CD2 3.23Å; S651-A704 PolarHBondContact O-N 3.24Å
652	Y	92.7	Very high	88.1	Confident	10 Å²	10	44.7 Å²	44.7	4%	0.039	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	153.9	179	47.1	-94.9	0	0	0	111.9	L644 I675 S678 M679 A686 A704	L644-Y652 HydrophobicContact CD1-CD1 3.65Å; L644-Y652 HydrophobicContact CD1-CE1 4.3Å; L644-Y652 HydrophobicContact CD1-CG 4.31Å; L644-Y652 HydrophobicContact CD2-CD1 3.86Å; L644-Y652 HydrophobicContact CD2-CD2 4.45Å; L644-Y652 HydrophobicContact CD2-CE1 4.48Å; L644-Y652 HydrophobicContact CD2-CG 3.81Å; L644-Y652 HydrophobicContact CG-CD1 3.47Å; L644-Y652 VanDerWaalsContact CG-CD1 3.47Å; L644-Y652 HydrophobicContact CG-CE1 3.84Å; L644-Y652 HydrophobicContact CG-CG 3.98Å; L644-Y652 VanDerWaalsContact O-CE1 3.24Å; L644-Y652 WeakPolarHBondContact O-CE1 3.33Å; Y652-I675 HydrophobicContact CD2-CG2 4Å; Y652-I675 HydrophobicContact CE2-CB 4.09Å; Y652-I675 HydrophobicContact CE2-CG1 4.24Å; Y652-I675 HydrophobicContact CE2-CG2 3.64Å; Y652-S678 WeakPolarHBondContact OH-CB 3.38Å; Y652-S678 PolarHBondContact OH-OG 3.2Å; Y652-S678 VanDerWaalsContact OH-OG 3.06Å; Y652-M679 HydrophobicContact CD2-CG 3.69Å; Y652-M679 HydrophobicContact CD2-SD 4.16Å; Y652-M679 HydrophobicContact CE2-CG 3.85Å; Y652-M679 WeakPolarHBondContact O-CG 3.05Å; Y652-A686 WeakPolarHBondContact O-CB 3.42Å; Y652-A704 WeakPolarHBondContact CA-O 3.49Å; Y652-A704 WeakPolarHBondContact CB-O 3.2Å
653	G	93.4	Very high	88.2	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165	175.9	-176.7	0	0	0	0	0	113.9	A686 Y703 A704 F705 L706	G653-A686 WeakPolarHBondContact CA-O 3.43Å; G653-Y703 VanDerWaalsContact CA-OH 3.23Å; G653-Y703 WeakPolarHBondContact CA-OH 3.16Å; G653-Y703 PolarHBondContact N-OH 3.13Å; G653-A704 PolarHBondContact N-O 2.63Å; G653-F705 WeakPolarHBondContact O-CD2 3.35Å; G653-L706 PolarHBondContact O-N 2.94Å
654	T	93.2	Very high	88.3	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.219	C	C	.	.			trans	-131.4	172.2	-176.7	54.6	0	0	0	0	110.6	T660 F664 M679 F687 T688 L706	T654-T660 HydrophobicContact CG2-CG2 3.55Å; T654-F664 HydrophobicContact CG2-CD2 4.09Å; T654-F664 HydrophobicContact CG2-CE2 4.19Å; T654-M679 HydrophobicContact CG2-SD 4.25Å; T654-F687 WeakPolarHBondContact O-CA 3.48Å; T654-F687 WeakPolarHBondContact OG1-CD1 3.35Å; T654-F687 WeakPolarHBondContact OG1-CE1 3.36Å; T654-T688 PolarHBondContact O-N 3.33Å; T654-L706 HydrophobicContact CG2-CB 3.6Å; T654-L706 HydrophobicContact CG2-CD1 4.14Å; T654-L706 HydrophobicContact CG2-CG 4.48Å
655	L	88.9	Confident	88.4	Confident	21 Å²	21	43.1 Å²	43.1	11%	0.11	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-66.9	132.3	169	-171.1	77.6	0	0	0	110.8	G658 T688 T689 Y691 F705	L655-G658 PolarHBondContact O-N 3.46Å; L655-T688 CarbonylContact C-O 3.57Å; L655-T688 WeakPolarHBondContact CA-O 3.37Å; L655-T689 WeakPolarHBondContact CD1-O 3.43Å; L655-Y691 HydrophobicContact CB-CE1 4.46Å; L655-Y691 HydrophobicContact CD2-CD2 4.34Å; L655-Y691 HydrophobicContact CD2-CE1 4.46Å; L655-Y691 HydrophobicContact CD2-CE2 3.72Å; L655-F705 HydrophobicContact CB-CZ 4.42Å
656	D	83.8	Confident	88.4	Confident	74 Å²	74	47.1 Å²	47.1	40%	0.396	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	139.9	174.3	-172.1	10.8	0	0	0	111	G658 F687 T688	D656-G658 PolarHBondContact O-N 3.4Å; D656-G658 VanDerWaalsContact O-N 3.08Å; D656-F687 HydrophobicContact CB-CB 4.42Å; D656-T688 PolarHBondContact N-O 3.31Å
657	S	77.2	Confident	88.5	Confident	56 Å²	56	43.2 Å²	43.2	39%	0.392	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	19.2	-177.5	-57.3	0	0	0	0	114.9	M661	S657-M661 PolarHBondContact N-SD 3.42Å; S657-M661 VanDerWaalsContact N-SD 3.4Å
658	G	82.6	Confident	88.7	Confident	8 Å²	8	47 Å²	47	8%	0.082	26%	0.255	C	S	.	.	S	Bend	trans	-87.7	163.2	177.1	0	0	0	0	0	114.4	L655 D656 T660 M661 T662	L655-G658 PolarHBondContact O-N 3.46Å; D656-G658 PolarHBondContact O-N 3.4Å; D656-G658 VanDerWaalsContact O-N 3.08Å; G658-T660 VanDerWaalsContact C-N 3.27Å; G658-T660 PolarHBondContact O-N 3.34Å; G658-M661 WeakPolarHBondContact O-CB 3.14Å; G658-M661 PolarHBondContact O-N 2.96Å; G658-T662 PolarHBondContact O-N 3.3Å; G658-T662 PolarHBondContact O-OG1 2.87Å
659	S	86.6	Confident	89	Confident	12 Å²	12	45.6 Å²	45.6	8%	0.084	24%	0.242	C	C	.	.	H	α-helix	trans	-61.5	-35.2	175.5	59.6	0	0	0	0	112	T488 T662 F663	T488-S659 PolarHBondContact OG1-OG 3.04Å; S659-T662 WeakPolarHBondContact CA-OG1 3.49Å; S659-T662 PolarHBondContact O-N 3.48Å; S659-T662 PolarHBondContact O-OG1 3.34Å; S659-F663 WeakPolarHBondContact O-CB 3.36Å; S659-F663 PolarHBondContact O-N 3.25Å
660	T	90.6	Very high	89.2	Confident	6 Å²	6	42.6 Å²	42.6	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-40.5	175.2	-54	0	0	0	0	112.3	I508 T654 G658 F663 F664 L706	I508-T660 HydrophobicContact CD1-CG2 3.8Å; I508-T660 HydrophobicContact CG1-CG2 3.91Å; I508-T660 HydrophobicContact CG2-CG2 3.91Å; T654-T660 HydrophobicContact CG2-CG2 3.55Å; G658-T660 VanDerWaalsContact C-N 3.27Å; G658-T660 PolarHBondContact O-N 3.34Å; T660-F663 WeakPolarHBondContact O-CB 3.34Å; T660-F663 PolarHBondContact O-N 2.98Å; T660-F664 HydrophobicContact CG2-CD2 4.05Å; T660-F664 HydrophobicContact CG2-CE2 3.71Å; T660-F664 WeakPolarHBondContact O-CD2 3.34Å; T660-F664 PolarHBondContact O-N 3.2Å; T660-L706 HydrophobicContact CG2-CB 4.47Å
661	M	88.8	Confident	89.4	Confident	33 Å²	33	43.5 Å²	43.5	16%	0.163	23%	0.234	C	C	.	.	H	α-helix	trans	-63.6	-49	175.7	-177.8	-170.3	-179.8	0	0	110.8	S657 G658 F663 F664 R665 W676 F687	S657-M661 PolarHBondContact N-SD 3.42Å; S657-M661 VanDerWaalsContact N-SD 3.4Å; G658-M661 WeakPolarHBondContact O-CB 3.14Å; G658-M661 PolarHBondContact O-N 2.96Å; M661-F663 VanDerWaalsContact C-N 3.26Å; M661-F663 PolarHBondContact O-N 3.02Å; M661-F664 PolarHBondContact O-N 3.42Å; M661-R665 PolarHBondContact O-N 3.26Å; M661-R665 VanDerWaalsContact O-N 3.09Å; M661-W676 HydrophobicContact CE-CH2 3.82Å; M661-W676 HydrophobicContact CE-CZ3 4.39Å; M661-W676 HydrophobicContact CG-CH2 3.98Å; M661-W676 HydrophobicContact CG-CZ3 3.68Å; M661-W676 WeakPolarHBondContact O-CZ3 3.38Å; M661-F687 HydrophobicContact CE-CD1 4.48Å; M661-F687 HydrophobicContact CE-CE1 4.23Å; M661-F687 HydrophobicContact CE-CE2 4.38Å; M661-F687 HydrophobicContact CE-CZ 4.18Å; M661-F687 HydrophobicContact CG-CD1 4.34Å; M661-F687 HydrophobicContact CG-CE1 3.94Å; M661-F687 HydrophobicContact SD-CD1 4.45Å; M661-F687 HydrophobicContact SD-CE1 4.46Å
662	T	88.1	Confident	89.6	Confident	35 Å²	35	43.5 Å²	43.5	22%	0.215	23%	0.23	C	C	.	.	H	α-helix	trans	-61.9	-35.1	176.9	53.2	0	0	0	0	112.3	G658 S659 R665 D666	G658-T662 PolarHBondContact O-N 3.3Å; G658-T662 PolarHBondContact O-OG1 2.87Å; S659-T662 WeakPolarHBondContact CA-OG1 3.49Å; S659-T662 PolarHBondContact O-N 3.48Å; S659-T662 PolarHBondContact O-OG1 3.34Å; T662-R665 PolarHBondContact O-N 3.48Å; T662-D666 WeakPolarHBondContact O-CB 3.09Å; T662-D666 VanDerWaalsContact O-CG 3.31Å; T662-D666 PolarHBondContact O-N 3.35Å
663	F	91.3	Very high	89.6	Confident	52 Å²	52	46.2 Å²	46.2	23%	0.228	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-49	176.2	170.5	-93.3	0	0	0	111.9	I508 S659 T660 M661 S667 Y672 D730	I508-F663 HydrophobicContact CD1-CB 4.29Å; I508-F663 HydrophobicContact CD1-CD1 3.32Å; I508-F663 HydrophobicContact CD1-CD2 4.49Å; I508-F663 HydrophobicContact CD1-CE1 3.65Å; I508-F663 HydrophobicContact CD1-CG 3.79Å; I508-F663 HydrophobicContact CD1-CZ 4.35Å; S659-F663 WeakPolarHBondContact O-CB 3.36Å; S659-F663 PolarHBondContact O-N 3.25Å; T660-F663 WeakPolarHBondContact O-CB 3.34Å; T660-F663 PolarHBondContact O-N 2.98Å; M661-F663 VanDerWaalsContact C-N 3.26Å; M661-F663 PolarHBondContact O-N 3.02Å; F663-S667 VanDerWaalsContact O-CB 3.24Å; F663-S667 WeakPolarHBondContact O-CB 3.22Å; F663-S667 PolarHBondContact O-N 3.3Å; F663-Y672 HydrophobicContact CE1-CD2 4.05Å; F663-Y672 HydrophobicContact CE1-CE2 4.16Å; F663-Y672 HydrophobicContact CZ-CD2 4.11Å; F663-Y672 HydrophobicContact CZ-CE2 4Å; F663-D730 HydrophobicContact CE2-CB 4.18Å; F663-D730 HydrophobicContact CZ-CB 4.1Å
664	F	92.2	Very high	89.5	Confident	1 Å²	1	51.6 Å²	51.6	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-68.9	-35.8	179.4	-75.2	-69.3	0	0	0	112.6	I508 T654 T660 M661 Y672 I675 W676 M679 L706 L729	I508-F664 HydrophobicContact CD1-CE2 4.2Å; I508-F664 HydrophobicContact CD1-CZ 4.45Å; I508-F664 HydrophobicContact CG2-CE2 4.31Å; I508-F664 HydrophobicContact CG2-CZ 4.4Å; T654-F664 HydrophobicContact CG2-CD2 4.09Å; T654-F664 HydrophobicContact CG2-CE2 4.19Å; T660-F664 HydrophobicContact CG2-CD2 4.05Å; T660-F664 HydrophobicContact CG2-CE2 3.71Å; T660-F664 WeakPolarHBondContact O-CD2 3.34Å; T660-F664 PolarHBondContact O-N 3.2Å; M661-F664 PolarHBondContact O-N 3.42Å; F664-Y672 HydrophobicContact CD1-CD1 4.47Å; F664-Y672 HydrophobicContact CD1-CG 4.27Å; F664-Y672 AromaticContact CE1-CD1 3.87Å; F664-Y672 HydrophobicContact CE1-CD1 3.87Å; F664-Y672 HydrophobicContact CE1-CE1 4.46Å; F664-Y672 HydrophobicContact CE1-CG 4.04Å; F664-I675 HydrophobicContact CD1-CG2 4.03Å; F664-I675 HydrophobicContact CE1-CG2 4.1Å; F664-W676 HydrophobicContact CB-CB 4.31Å; F664-W676 HydrophobicContact CB-CE3 3.91Å; F664-W676 WeakPolarHBondContact O-CB 3.38Å; F664-M679 HydrophobicContact CB-CE 3.9Å; F664-M679 HydrophobicContact CD2-CE 4.17Å; F664-M679 HydrophobicContact CG-CE 4.03Å; F664-L706 HydrophobicContact CE2-CB 4.36Å; F664-L706 HydrophobicContact CE2-CD1 3.77Å; F664-L706 HydrophobicContact CZ-CD1 3.9Å; F664-L729 HydrophobicContact CZ-CD1 4.31Å
665	R	89.3	Confident	89.5	Confident	109 Å²	109	51.6 Å²	51.6	41%	0.411	27%	0.265	S	S	.	.	H	α-helix	trans	-62.8	-45.8	176.1	-173.7	-174.8	67.6	-163	-4.6	112.5	M661 T662 S667 W676	M661-R665 PolarHBondContact O-N 3.26Å; M661-R665 VanDerWaalsContact O-N 3.09Å; T662-R665 PolarHBondContact O-N 3.48Å; R665-S667 VanDerWaalsContact C-N 3.35Å; R665-W676 VanDerWaalsContact CA-CD2 3.5Å; R665-W676 HydrophobicContact CB-CD2 3.87Å; R665-W676 HydrophobicContact CB-CE3 3.94Å; R665-W676 HydrophobicContact CB-CH2 3.77Å; R665-W676 HydrophobicContact CB-CZ2 3.68Å; R665-W676 HydrophobicContact CB-CZ3 3.89Å; R665-W676 HydrophobicContact CG-CD2 4.35Å; R665-W676 HydrophobicContact CG-CH2 4.07Å; R665-W676 HydrophobicContact CG-CZ2 3.55Å
666	D	88.9	Confident	89.7	Confident	106 Å²	106	52.4 Å²	52.4	57%	0.567	27%	0.267	S	S	*	.	H	α-helix	trans	-93.8	2.4	-172.4	-54.8	-18.2	0	0	0	111.8	T662	T662-D666 WeakPolarHBondContact O-CB 3.09Å; T662-D666 VanDerWaalsContact O-CG 3.31Å; T662-D666 PolarHBondContact O-N 3.35Å
667	S	91.1	Very high	90.1	Very high	15 Å²	15	55.6 Å²	55.6	11%	0.105	27%	0.273	C	S	.	.			trans	-66.7	141	-178.1	-174.5	0	0	0	0	113	F663 R665 I669 Y672 K673	F663-S667 VanDerWaalsContact O-CB 3.24Å; F663-S667 WeakPolarHBondContact O-CB 3.22Å; F663-S667 PolarHBondContact O-N 3.3Å; R665-S667 VanDerWaalsContact C-N 3.35Å; S667-I669 PolarHBondContact OG-N 2.9Å; S667-Y672 WeakPolarHBondContact OG-CB 3.29Å; S667-K673 WeakPolarHBondContact O-CE 3.3Å; S667-K673 WeakPolarHBondContact O-CG 3.39Å
668	V	91.8	Very high	90.8	Very high	119 Å²	119	55.3 Å²	55.3	72%	0.721	27%	0.271	S	S	*	.			trans	-90.4	-22.2	177.2	-174.2	0	0	0	0	112.2	K673	V668-K673 VanDerWaalsContact O-CE 3.28Å; V668-K673 WeakPolarHBondContact O-CE 3.32Å; V668-K673 PolarHBondContact O-NZ 2.93Å
669	I	92.2	Very high	91.2	Very high	95 Å²	95	55 Å²	55	49%	0.487	27%	0.268	S	S	.	.	S	Bend	trans	-73.2	132	-173.6	-61.1	170.8	0	0	0	110.6	S667 T671 Y672 K673	S667-I669 PolarHBondContact OG-N 2.9Å; I669-T671 PolarHBondContact O-N 2.88Å; I669-Y672 HydrophobicContact CB-CD2 3.85Å; I669-Y672 HydrophobicContact CB-CE2 4.5Å; I669-Y672 HydrophobicContact CB-CG 4.28Å; I669-Y672 HydrophobicContact CD1-CD2 3.79Å; I669-Y672 HydrophobicContact CD1-CE2 3.69Å; I669-Y672 HydrophobicContact CG1-CD2 4.33Å; I669-Y672 HydrophobicContact CG2-CD2 4.18Å; I669-Y672 HydrophobicContact CG2-CG 4.39Å; I669-Y672 PolarHBondContact O-N 3.21Å; I669-K673 WeakPolarHBondContact O-CG 3.48Å; I669-K673 PolarHBondContact O-N 3.31Å
670	E	91.8	Very high	91.4	Very high	99 Å²	99	59.1 Å²	59.1	46%	0.463	29%	0.289	S	S	.	.	H	α-helix	trans	-61.1	-41.4	-173.5	-171.6	59.9	-154.4	0	0	113.1	Y672 K673 K674	E670-Y672 VanDerWaalsContact C-N 3.35Å; E670-Y672 PolarHBondContact O-N 3.43Å; E670-K673 PolarHBondContact O-N 3.37Å; E670-K674 WeakPolarHBondContact O-CG 3.49Å; E670-K674 PolarHBondContact O-N 2.9Å
671	T	92.6	Very high	91.3	Very high	33 Å²	33	64.8 Å²	64.8	20%	0.202	32%	0.319	C	S	.	.	H	α-helix	trans	-58.3	-46.3	175.6	-51.4	0	0	0	0	111.4	E642 A645 I669 K674 I675	E642-T671 HydrophobicContact CB-CG2 4.47Å; E642-T671 HydrophobicContact CG-CG2 3.81Å; A645-T671 HydrophobicContact CB-CG2 3.89Å; I669-T671 PolarHBondContact O-N 2.88Å; T671-K674 WeakPolarHBondContact O-CB 3.32Å; T671-K674 PolarHBondContact O-N 2.77Å; T671-I675 WeakPolarHBondContact O-CG1 3.3Å; T671-I675 PolarHBondContact O-N 2.93Å
672	Y	94	Very high	91.1	Very high	29 Å²	29	67.5 Å²	67.5	11%	0.114	33%	0.33	C	S	.	.	H	α-helix	trans	-72.2	-33.8	-179.2	-62.8	-19.4	0	0	0	112.6	A641 F663 F664 S667 I669 E670 K674 I675 W676 L729	A641-Y672 HydrophobicContact CB-CE1 4.36Å; F663-Y672 HydrophobicContact CE1-CD2 4.05Å; F663-Y672 HydrophobicContact CE1-CE2 4.16Å; F663-Y672 HydrophobicContact CZ-CD2 4.11Å; F663-Y672 HydrophobicContact CZ-CE2 4Å; F664-Y672 HydrophobicContact CD1-CD1 4.47Å; F664-Y672 HydrophobicContact CD1-CG 4.27Å; F664-Y672 AromaticContact CE1-CD1 3.87Å; F664-Y672 HydrophobicContact CE1-CD1 3.87Å; F664-Y672 HydrophobicContact CE1-CE1 4.46Å; F664-Y672 HydrophobicContact CE1-CG 4.04Å; S667-Y672 WeakPolarHBondContact OG-CB 3.29Å; I669-Y672 HydrophobicContact CB-CD2 3.85Å; I669-Y672 HydrophobicContact CB-CE2 4.5Å; I669-Y672 HydrophobicContact CB-CG 4.28Å; I669-Y672 HydrophobicContact CD1-CD2 3.79Å; I669-Y672 HydrophobicContact CD1-CE2 3.69Å; I669-Y672 HydrophobicContact CG1-CD2 4.33Å; I669-Y672 HydrophobicContact CG2-CD2 4.18Å; I669-Y672 HydrophobicContact CG2-CG 4.39Å; I669-Y672 PolarHBondContact O-N 3.21Å; E670-Y672 VanDerWaalsContact C-N 3.35Å; E670-Y672 PolarHBondContact O-N 3.43Å; Y672-K674 VanDerWaalsContact C-N 3.35Å; Y672-I675 HydrophobicContact CD1-CD1 4.22Å; Y672-I675 WeakPolarHBondContact O-CB 3.31Å; Y672-I675 PolarHBondContact O-N 3.4Å; Y672-W676 PolarHBondContact O-N 3.48Å; Y672-L729 PolarHBondContact OH-O 2.85Å; Y672-L729 VanDerWaalsContact OH-O 3.14Å
673	K	92.9	Very high	90.8	Very high	68 Å²	68	75 Å²	75	30%	0.296	36%	0.36	S	S	.	.	H	α-helix	trans	-62.3	-40.2	170	-76	173.9	173.4	161.7	0	112.3	S667 V668 I669 E670 W676 R677	S667-K673 WeakPolarHBondContact O-CE 3.3Å; S667-K673 WeakPolarHBondContact O-CG 3.39Å; V668-K673 VanDerWaalsContact O-CE 3.28Å; V668-K673 WeakPolarHBondContact O-CE 3.32Å; V668-K673 PolarHBondContact O-NZ 2.93Å; I669-K673 WeakPolarHBondContact O-CG 3.48Å; I669-K673 PolarHBondContact O-N 3.31Å; E670-K673 PolarHBondContact O-N 3.37Å; K673-W676 PolarHBondContact O-N 3.11Å; K673-R677 WeakPolarHBondContact O-CG 3.37Å; K673-R677 PolarHBondContact O-N 2.88Å
674	K	92.1	Very high	90.3	Very high	112 Å²	112	77.5 Å²	77.5	49%	0.487	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-44.6	174.6	-73.5	176.1	-179.4	178.2	0	111.3	E670 T671 Y672 W676 R677 S678	E670-K674 WeakPolarHBondContact O-CG 3.49Å; E670-K674 PolarHBondContact O-N 2.9Å; T671-K674 WeakPolarHBondContact O-CB 3.32Å; T671-K674 PolarHBondContact O-N 2.77Å; Y672-K674 VanDerWaalsContact C-N 3.35Å; K674-W676 PolarHBondContact O-N 2.81Å; K674-R677 PolarHBondContact O-N 3.07Å; K674-S678 WeakPolarHBondContact O-CB 3.37Å; K674-S678 PolarHBondContact O-N 2.82Å
675	I	93.3	Very high	90.1	Very high	1 Å²	1	80.7 Å²	80.7	1%	0.005	40%	0.403	C	S	.	.	H	α-helix	trans	-57.5	-48.6	173.9	-70.5	174.2	0	0	0	110.5	A641 A645 Y652 F664 T671 Y672 S678 M679 L706	A641-I675 HydrophobicContact CB-CD1 4.3Å; A645-I675 HydrophobicContact CB-CD1 4.17Å; A645-I675 HydrophobicContact CB-CG1 3.74Å; Y652-I675 HydrophobicContact CD2-CG2 4Å; Y652-I675 HydrophobicContact CE2-CB 4.09Å; Y652-I675 HydrophobicContact CE2-CG1 4.24Å; Y652-I675 HydrophobicContact CE2-CG2 3.64Å; F664-I675 HydrophobicContact CD1-CG2 4.03Å; F664-I675 HydrophobicContact CE1-CG2 4.1Å; T671-I675 WeakPolarHBondContact O-CG1 3.3Å; T671-I675 PolarHBondContact O-N 2.93Å; Y672-I675 HydrophobicContact CD1-CD1 4.22Å; Y672-I675 WeakPolarHBondContact O-CB 3.31Å; Y672-I675 PolarHBondContact O-N 3.4Å; I675-S678 WeakPolarHBondContact O-CB 3.48Å; I675-S678 PolarHBondContact O-N 3.22Å; I675-M679 HydrophobicContact CG2-CE 3.79Å; I675-M679 HydrophobicContact CG2-SD 4.28Å; I675-M679 WeakPolarHBondContact O-CG 3.43Å; I675-M679 PolarHBondContact O-N 3.12Å; I675-L706 HydrophobicContact CG2-CD1 4.22Å
676	W	93.3	Very high	90	Very high	37 Å²	37	75.6 Å²	75.6	14%	0.14	38%	0.384	C	S	.	.	H	α-helix	trans	-57.8	-51.4	176.8	177.2	-104.6	0	0	0	112.7	M661 F664 R665 Y672 K673 K674 S678 M679 D680 F687	M661-W676 HydrophobicContact CE-CH2 3.82Å; M661-W676 HydrophobicContact CE-CZ3 4.39Å; M661-W676 HydrophobicContact CG-CH2 3.98Å; M661-W676 HydrophobicContact CG-CZ3 3.68Å; M661-W676 WeakPolarHBondContact O-CZ3 3.38Å; F664-W676 HydrophobicContact CB-CB 4.31Å; F664-W676 HydrophobicContact CB-CE3 3.91Å; F664-W676 WeakPolarHBondContact O-CB 3.38Å; R665-W676 VanDerWaalsContact CA-CD2 3.5Å; R665-W676 HydrophobicContact CB-CD2 3.87Å; R665-W676 HydrophobicContact CB-CE3 3.94Å; R665-W676 HydrophobicContact CB-CH2 3.77Å; R665-W676 HydrophobicContact CB-CZ2 3.68Å; R665-W676 HydrophobicContact CB-CZ3 3.89Å; R665-W676 HydrophobicContact CG-CD2 4.35Å; R665-W676 HydrophobicContact CG-CH2 4.07Å; R665-W676 HydrophobicContact CG-CZ2 3.55Å; Y672-W676 PolarHBondContact O-N 3.48Å; K673-W676 PolarHBondContact O-N 3.11Å; K674-W676 PolarHBondContact O-N 2.81Å; W676-S678 PolarHBondContact O-N 3.47Å; W676-M679 HydrophobicContact CE3-CE 3.94Å; W676-M679 PolarHBondContact O-N 3.13Å; W676-M679 VanDerWaalsContact O-N 3.14Å; W676-D680 WeakPolarHBondContact O-CB 3.27Å; W676-D680 PolarHBondContact O-N 2.79Å; W676-F687 HydrophobicContact CE3-CZ 4.47Å; W676-F687 AromaticContact CH2-CZ 3.99Å; W676-F687 HydrophobicContact CH2-CZ 3.99Å; W676-F687 AromaticContact CZ3-CE1 3.98Å; W676-F687 HydrophobicContact CZ3-CE1 3.98Å; W676-F687 AromaticContact CZ3-CZ 3.76Å; W676-F687 HydrophobicContact CZ3-CZ 3.76Å
677	R	91.4	Very high	90.1	Very high	141 Å²	141	72.1 Å²	72.1	53%	0.532	36%	0.364	S	S	.	.	H	α-helix	trans	-59.3	-35.8	178.1	-72.4	173.7	-179.2	158.3	1.6	112.2	K673 K674 N681	K673-R677 WeakPolarHBondContact O-CG 3.37Å; K673-R677 PolarHBondContact O-N 2.88Å; K674-R677 PolarHBondContact O-N 3.07Å; R677-N681 VanDerWaalsContact O-CB 3.29Å; R677-N681 WeakPolarHBondContact O-CB 3Å; R677-N681 VanDerWaalsContact O-CG 3.32Å; R677-N681 PolarHBondContact O-N 3.02Å; R677-N681 VanDerWaalsContact O-N 3.15Å; R677-N681 PolarHBondContact O-ND2 3.02Å
678	S	91.1	Very high	90.1	Very high	50 Å²	50	72 Å²	72	35%	0.35	36%	0.363	S	S	.	.	H	α-helix	trans	-68	-44.8	176.5	-174.3	0	0	0	0	111.5	Y652 K674 I675 W676 K682	Y652-S678 WeakPolarHBondContact OH-CB 3.38Å; Y652-S678 PolarHBondContact OH-OG 3.2Å; Y652-S678 VanDerWaalsContact OH-OG 3.06Å; K674-S678 WeakPolarHBondContact O-CB 3.37Å; K674-S678 PolarHBondContact O-N 2.82Å; I675-S678 WeakPolarHBondContact O-CB 3.48Å; I675-S678 PolarHBondContact O-N 3.22Å; W676-S678 PolarHBondContact O-N 3.47Å; S678-K682 WeakPolarHBondContact O-CB 3.43Å; S678-K682 PolarHBondContact O-N 3.38Å
679	M	92.5	Very high	89.8	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-63.5	-45	177.2	-69.2	-173.6	-61.8	0	0	112.1	Y652 T654 F664 I675 W676 K682 A686 F687 L706	Y652-M679 HydrophobicContact CD2-CG 3.69Å; Y652-M679 HydrophobicContact CD2-SD 4.16Å; Y652-M679 HydrophobicContact CE2-CG 3.85Å; Y652-M679 WeakPolarHBondContact O-CG 3.05Å; T654-M679 HydrophobicContact CG2-SD 4.25Å; F664-M679 HydrophobicContact CB-CE 3.9Å; F664-M679 HydrophobicContact CD2-CE 4.17Å; F664-M679 HydrophobicContact CG-CE 4.03Å; I675-M679 HydrophobicContact CG2-CE 3.79Å; I675-M679 HydrophobicContact CG2-SD 4.28Å; I675-M679 WeakPolarHBondContact O-CG 3.43Å; I675-M679 PolarHBondContact O-N 3.12Å; W676-M679 HydrophobicContact CE3-CE 3.94Å; W676-M679 PolarHBondContact O-N 3.13Å; W676-M679 VanDerWaalsContact O-N 3.14Å; M679-K682 PolarHBondContact O-N 3.28Å; M679-A686 HydrophobicContact CB-CB 3.99Å; M679-A686 HydrophobicContact CG-CB 4.22Å; M679-A686 WeakPolarHBondContact O-CB 3.41Å; M679-F687 HydrophobicContact CB-CE1 4.22Å; M679-F687 HydrophobicContact CB-CZ 3.85Å; M679-F687 HydrophobicContact SD-CE1 4.34Å; M679-L706 HydrophobicContact SD-CD1 4.31Å
680	D	89.8	Confident	89.6	Confident	99 Å²	99	69.1 Å²	69.1	53%	0.529	35%	0.35	S	S	.	.	H	α-helix	trans	-68.2	-37.8	-176.8	-166.5	39.5	0	0	0	112.5	W676	W676-D680 WeakPolarHBondContact O-CB 3.27Å; W676-D680 PolarHBondContact O-N 2.79Å
681	N	88.4	Confident	89.4	Confident	125 Å²	125	65.4 Å²	65.4	67%	0.668	33%	0.332	S	S	*	.	H	α-helix	trans	-82.4	-9	-179.7	-71.6	-50.3	0	0	0	114.4	R677	R677-N681 VanDerWaalsContact O-CB 3.29Å; R677-N681 WeakPolarHBondContact O-CB 3Å; R677-N681 VanDerWaalsContact O-CG 3.32Å; R677-N681 PolarHBondContact O-N 3.02Å; R677-N681 VanDerWaalsContact O-N 3.15Å; R677-N681 PolarHBondContact O-ND2 3.02Å
682	K	84.9	Confident	89.2	Confident	89 Å²	89	68.4 Å²	68.4	39%	0.387	34%	0.344	S	S	.	.			trans	-77.9	132.7	-173.4	-162.4	73.2	173.7	-170.9	0	111.9	S678 M679 P684 A686	S678-K682 WeakPolarHBondContact O-CB 3.43Å; S678-K682 PolarHBondContact O-N 3.38Å; M679-K682 PolarHBondContact O-N 3.28Å; K682-P684 CarbonylContact C-O 3.58Å; K682-A686 HydrophobicContact CB-CB 4.37Å
683	K	80.9	Confident	89.1	Confident	194 Å²	194	70.2 Å²	70.2	84%	0.843	36%	0.355	S	S	*	.	S	Bend	trans	-124.3	125.1	169.9	-65.7	-174.5	-179.9	-179.6	0	109.7
684	P	81.9	Confident	89	Confident	104 Å²	104	67 Å²	67	68%	0.675	34%	0.341	S	S	*	.	S	Bend	cis	-66.5	163.5	-0.9	30.4	-36.3	0	0	0	113.1	K682 A686	K682-P684 CarbonylContact C-O 3.58Å; P684-A686 PolarHBondContact O-N 3.49Å
685	S	86.9	Confident	89	Confident	68 Å²	68	63 Å²	63	48%	0.476	33%	0.325	S	S	.	.			trans	-47.7	133.4	-174	-176.8	0	0	0	0	112.4	F687 R697	S685-F687 VanDerWaalsContact C-N 3.31Å; S685-F687 PolarHBondContact OG-N 3.27Å; S685-F687 VanDerWaalsContact OG-N 3.15Å; S685-R697 PolarHBondContact O-NH1 3.37Å; S685-R697 PolarHBondContact O-NH2 3.3Å
686	A	88.6	Confident	89	Confident	2 Å²	2	68.9 Å²	68.9	2%	0.017	35%	0.35	C	S	.	.	S	Bend	trans	-68.9	-31.6	170.1	0	0	0	0	0	111.6	Y652 G653 M679 K682 P684 R697 Y703	Y652-A686 WeakPolarHBondContact O-CB 3.42Å; G653-A686 WeakPolarHBondContact CA-O 3.43Å; M679-A686 HydrophobicContact CB-CB 3.99Å; M679-A686 HydrophobicContact CG-CB 4.22Å; M679-A686 WeakPolarHBondContact O-CB 3.41Å; K682-A686 HydrophobicContact CB-CB 4.37Å; P684-A686 PolarHBondContact O-N 3.49Å; A686-R697 PolarHBondContact O-NH1 3.33Å; A686-Y703 PolarHBondContact O-OH 3.36Å
687	F	91.1	Very high	88.9	Confident	33 Å²	33	70 Å²	70	15%	0.145	36%	0.355	C	S	.	.			trans	-77.9	151.7	-174	-52.7	-74.6	0	0	0	113	T654 D656 M661 W676 M679 S685	T654-F687 WeakPolarHBondContact O-CA 3.48Å; T654-F687 WeakPolarHBondContact OG1-CD1 3.35Å; T654-F687 WeakPolarHBondContact OG1-CE1 3.36Å; D656-F687 HydrophobicContact CB-CB 4.42Å; M661-F687 HydrophobicContact CE-CD1 4.48Å; M661-F687 HydrophobicContact CE-CE1 4.23Å; M661-F687 HydrophobicContact CE-CE2 4.38Å; M661-F687 HydrophobicContact CE-CZ 4.18Å; M661-F687 HydrophobicContact CG-CD1 4.34Å; M661-F687 HydrophobicContact CG-CE1 3.94Å; M661-F687 HydrophobicContact SD-CD1 4.45Å; M661-F687 HydrophobicContact SD-CE1 4.46Å; W676-F687 HydrophobicContact CE3-CZ 4.47Å; W676-F687 AromaticContact CH2-CZ 3.99Å; W676-F687 HydrophobicContact CH2-CZ 3.99Å; W676-F687 AromaticContact CZ3-CE1 3.98Å; W676-F687 HydrophobicContact CZ3-CE1 3.98Å; W676-F687 AromaticContact CZ3-CZ 3.76Å; W676-F687 HydrophobicContact CZ3-CZ 3.76Å; M679-F687 HydrophobicContact CB-CE1 4.22Å; M679-F687 HydrophobicContact CB-CZ 3.85Å; M679-F687 HydrophobicContact SD-CE1 4.34Å; S685-F687 VanDerWaalsContact C-N 3.31Å; S685-F687 PolarHBondContact OG-N 3.27Å; S685-F687 VanDerWaalsContact OG-N 3.15Å
688	T	89.9	Confident	89	Confident	11 Å²	11	63.2 Å²	63.2	7%	0.067	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-118.5	148.5	173.5	65.5	0	0	0	0	111.4	T654 L655 D656 T690 F705	T654-T688 PolarHBondContact O-N 3.33Å; L655-T688 CarbonylContact C-O 3.57Å; L655-T688 WeakPolarHBondContact CA-O 3.37Å; D656-T688 PolarHBondContact N-O 3.31Å; T688-T690 PolarHBondContact OG1-O 3.37Å; T688-F705 HydrophobicContact CG2-CE2 4.18Å; T688-F705 WeakPolarHBondContact OG1-CE2 3.39Å; T688-F705 WeakPolarHBondContact OG1-CZ 3.39Å
689	T	85.9	Confident	89	Confident	103 Å²	103	62.9 Å²	62.9	63%	0.632	32%	0.324	S	S	*	.	S	Bend	trans	-80.6	-29.7	-178.7	42.4	0	0	0	0	113.5	L655 D693	L655-T689 WeakPolarHBondContact CD1-O 3.43Å; T689-D693 PolarHBondContact OG1-OD2 2.92Å
690	T	87.2	Confident	88.8	Confident	51 Å²	51	70.4 Å²	70.4	31%	0.313	36%	0.359	S	S	.	.	S	Bend	trans	-130.7	160.7	179.2	67.3	0	0	0	0	110.5	T688 E692 D693 G694	T688-T690 PolarHBondContact OG1-O 3.37Å; T690-E692 VanDerWaalsContact C-N 3.34Å; T690-E692 WeakPolarHBondContact CB-OE2 3.45Å; T690-D693 WeakPolarHBondContact OG1-CB 3.46Å; T690-D693 PolarHBondContact OG1-N 3.46Å; T690-D693 PolarHBondContact OG1-OD2 3.33Å; T690-G694 PolarHBondContact O-N 3.31Å
691	Y	88.1	Confident	88.5	Confident	22 Å²	22	66.9 Å²	66.9	9%	0.086	35%	0.345	C	S	.	.	H	α-helix	trans	-66.6	-38.5	174.3	-77.5	-70.1	0	0	0	111.2	E412 L655 D693 G694 I695 F705 M707 M711	E412-Y691 WeakPolarHBondContact OE1-CE2 3.26Å; L655-Y691 HydrophobicContact CB-CE1 4.46Å; L655-Y691 HydrophobicContact CD2-CD2 4.34Å; L655-Y691 HydrophobicContact CD2-CE1 4.46Å; L655-Y691 HydrophobicContact CD2-CE2 3.72Å; Y691-D693 VanDerWaalsContact C-N 3.33Å; Y691-D693 PolarHBondContact O-N 2.97Å; Y691-G694 WeakPolarHBondContact O-CA 3.46Å; Y691-G694 PolarHBondContact O-N 2.88Å; Y691-G694 VanDerWaalsContact O-N 3.12Å; Y691-I695 WeakPolarHBondContact O-CD1 3.4Å; Y691-I695 VanDerWaalsContact O-CG1 3.24Å; Y691-I695 WeakPolarHBondContact O-CG1 3.42Å; Y691-I695 PolarHBondContact O-N 2.91Å; Y691-F705 AromaticContact CD1-CE1 3.85Å; Y691-F705 HydrophobicContact CD1-CE1 3.85Å; Y691-F705 HydrophobicContact CD1-CZ 4.34Å; Y691-F705 HydrophobicContact CE1-CE1 4.17Å; Y691-M707 HydrophobicContact CD1-CE 4.22Å; Y691-M707 HydrophobicContact CE1-CB 4.14Å; Y691-M711 HydrophobicContact CD1-CG 4.49Å; Y691-M711 HydrophobicContact CG-CE 4.35Å
692	E	89.8	Confident	88.4	Confident	96 Å²	96	66.1 Å²	66.1	45%	0.449	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-39.7	179.6	-63.8	78.7	-174.3	0	0	112.2	T690 G694 I695 K696	T690-E692 VanDerWaalsContact C-N 3.34Å; T690-E692 WeakPolarHBondContact CB-OE2 3.45Å; E692-G694 VanDerWaalsContact C-N 3.35Å; E692-I695 PolarHBondContact O-N 3.04Å; E692-K696 WeakPolarHBondContact O-CB 3.41Å; E692-K696 VanDerWaalsContact O-CG 3.29Å; E692-K696 WeakPolarHBondContact O-CG 3.49Å; E692-K696 PolarHBondContact O-N 3.32Å
693	D	91	Very high	88.8	Confident	66 Å²	66	62.1 Å²	62.1	35%	0.353	32%	0.324	S	S	.	.	H	α-helix	trans	-66.4	-38.9	175.5	-65.5	-31.2	0	0	0	111.5	T689 T690 Y691 R697	T689-D693 PolarHBondContact OG1-OD2 2.92Å; T690-D693 WeakPolarHBondContact OG1-CB 3.46Å; T690-D693 PolarHBondContact OG1-N 3.46Å; T690-D693 PolarHBondContact OG1-OD2 3.33Å; Y691-D693 VanDerWaalsContact C-N 3.33Å; Y691-D693 PolarHBondContact O-N 2.97Å; D693-R697 WeakPolarHBondContact O-CB 3.25Å; D693-R697 PolarHBondContact O-N 3Å
694	G	91.6	Very high	89.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-59.3	-49.2	172.9	0	0	0	0	0	112.5	T690 Y691 E692 R697 V698	T690-G694 PolarHBondContact O-N 3.31Å; Y691-G694 WeakPolarHBondContact O-CA 3.46Å; Y691-G694 PolarHBondContact O-N 2.88Å; Y691-G694 VanDerWaalsContact O-N 3.12Å; E692-G694 VanDerWaalsContact C-N 3.35Å; G694-R697 WeakPolarHBondContact O-CB 3.17Å; G694-R697 PolarHBondContact O-N 3.19Å; G694-V698 WeakPolarHBondContact O-CG2 3.48Å; G694-V698 PolarHBondContact O-N 3.16Å
695	I	91.9	Very high	90	Very high	29 Å²	29	47.9 Å²	47.9	15%	0.149	25%	0.251	C	S	.	.	H	α-helix	trans	-62.5	-45.6	179.8	-62.8	160.2	0	0	0	111	L511 Y691 E692 R697 V698 N699 M707 I715 L722	L511-I695 HydrophobicContact CD2-CG1 4.24Å; Y691-I695 WeakPolarHBondContact O-CD1 3.4Å; Y691-I695 VanDerWaalsContact O-CG1 3.24Å; Y691-I695 WeakPolarHBondContact O-CG1 3.42Å; Y691-I695 PolarHBondContact O-N 2.91Å; E692-I695 PolarHBondContact O-N 3.04Å; I695-R697 VanDerWaalsContact C-N 3.27Å; I695-R697 PolarHBondContact O-N 3.33Å; I695-V698 PolarHBondContact O-N 3.26Å; I695-N699 PolarHBondContact O-N 3.2Å; I695-M707 HydrophobicContact CG1-CE 4.21Å; I695-I715 HydrophobicContact CD1-CD1 3.35Å; I695-I715 HydrophobicContact CD1-CG1 3.81Å; I695-I715 HydrophobicContact CD1-CG2 4.25Å; I695-I715 HydrophobicContact CG1-CD1 3.79Å; I695-I715 HydrophobicContact CG1-CG2 4.35Å; I695-I715 HydrophobicContact CG2-CG2 4.19Å; I695-L722 HydrophobicContact CG2-CD1 3.83Å
696	K	92.3	Very high	90.3	Very high	124 Å²	124	44.8 Å²	44.8	54%	0.539	23%	0.229	S	C	.	.	H	α-helix	trans	-58.2	-41	176.2	-74.7	171.2	-172.2	166.9	0	111.7	E692 N699 Q700	E692-K696 WeakPolarHBondContact O-CB 3.41Å; E692-K696 VanDerWaalsContact O-CG 3.29Å; E692-K696 WeakPolarHBondContact O-CG 3.49Å; E692-K696 PolarHBondContact O-N 3.32Å; K696-N699 PolarHBondContact O-N 3.13Å; K696-Q700 WeakPolarHBondContact O-CG 3.15Å; K696-Q700 PolarHBondContact O-N 3.13Å; K696-Q700 VanDerWaalsContact O-N 3.15Å
697	R	92.2	Very high	90.5	Very high	60 Å²	60	44.7 Å²	44.7	23%	0.226	23%	0.229	C	C	.	.	H	α-helix	trans	-66.8	-39.3	178.7	-166.5	176.8	177.5	170.9	2.3	112.2	S685 A686 D693 G694 I695 Q700 Y703	S685-R697 PolarHBondContact O-NH1 3.37Å; S685-R697 PolarHBondContact O-NH2 3.3Å; A686-R697 PolarHBondContact O-NH1 3.33Å; D693-R697 WeakPolarHBondContact O-CB 3.25Å; D693-R697 PolarHBondContact O-N 3Å; G694-R697 WeakPolarHBondContact O-CB 3.17Å; G694-R697 PolarHBondContact O-N 3.19Å; I695-R697 VanDerWaalsContact C-N 3.27Å; I695-R697 PolarHBondContact O-N 3.33Å; R697-Q700 PolarHBondContact O-N 3.34Å; R697-Y703 HydrophobicContact CB-CD1 3.82Å; R697-Y703 HydrophobicContact CB-CE1 4.07Å; R697-Y703 HydrophobicContact CB-CG 4.47Å; R697-Y703 HydrophobicContact CG-CD1 3.54Å; R697-Y703 HydrophobicContact CG-CD2 4.28Å; R697-Y703 HydrophobicContact CG-CE1 3.96Å; R697-Y703 HydrophobicContact CG-CG 3.71Å
698	V	93.1	Very high	90.5	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.5	-42.4	173.7	179.3	0	0	0	0	111	L511 K513 G694 I695 Q700 G701 Y703 F705 L722	L511-V698 HydrophobicContact CD2-CG2 4.41Å; L511-V698 HydrophobicContact CG-CG1 4.41Å; K513-V698 HydrophobicContact CB-CG1 4.48Å; G694-V698 WeakPolarHBondContact O-CG2 3.48Å; G694-V698 PolarHBondContact O-N 3.16Å; I695-V698 PolarHBondContact O-N 3.26Å; V698-Q700 VanDerWaalsContact C-N 3.27Å; V698-Q700 PolarHBondContact O-N 3.37Å; V698-G701 WeakPolarHBondContact O-CA 3.46Å; V698-G701 PolarHBondContact O-N 3Å; V698-Y703 HydrophobicContact CG2-CD1 3.75Å; V698-Y703 HydrophobicContact CG2-CE1 4.22Å; V698-F705 HydrophobicContact CG2-CB 3.43Å; V698-F705 VanDerWaalsContact CG2-CB 3.43Å; V698-L722 HydrophobicContact CB-CD2 4.23Å; V698-L722 HydrophobicContact CG1-CD2 3.56Å
699	N	90.5	Very high	90.7	Very high	43 Å²	43	43.2 Å²	43.2	23%	0.23	22%	0.222	C	C	.	.	H	α-helix	trans	-63.5	-30.1	179.1	-94.3	-30.3	0	0	0	113.7	K513 I695 K696 G701 D719 L722	K513-N699 PolarHBondContact NZ-O 3.07Å; I695-N699 PolarHBondContact O-N 3.2Å; K696-N699 PolarHBondContact O-N 3.13Å; N699-G701 PolarHBondContact O-N 3.48Å; N699-D719 PolarHBondContact ND2-OD2 2.92Å; N699-L722 VanDerWaalsContact OD1-CD2 3.29Å; N699-L722 WeakPolarHBondContact OD1-CD2 3.38Å
700	Q	88.9	Confident	91	Very high	160 Å²	160	38.5 Å²	38.5	75%	0.748	19%	0.194	S	C	*	.	H	α-helix	trans	-66	-18.9	172.2	-70.8	170.6	0.1	0	0	112.9	K696 R697 V698	K696-Q700 WeakPolarHBondContact O-CG 3.15Å; K696-Q700 PolarHBondContact O-N 3.13Å; K696-Q700 VanDerWaalsContact O-N 3.15Å; R697-Q700 PolarHBondContact O-N 3.34Å; V698-Q700 VanDerWaalsContact C-N 3.27Å; V698-Q700 PolarHBondContact O-N 3.37Å
701	G	84	Confident	91.1	Very high	24 Å²	24	36.4 Å²	36.4	25%	0.247	18%	0.18	C	C	.	.	S	Bend	trans	95.3	167.6	177.8	0	0	0	0	0	114	V698 N699 Y703	V698-G701 WeakPolarHBondContact O-CA 3.46Å; V698-G701 PolarHBondContact O-N 3Å; N699-G701 PolarHBondContact O-N 3.48Å; G701-Y703 PolarHBondContact O-N 3.34Å
702	N	86.4	Confident	91.3	Very high	109 Å²	109	35.3 Å²	35.3	58%	0.583	18%	0.176	S	C	*	.	S	Bend	trans	53.3	22.8	178.6	-62.9	-8.3	0	0	0	115.7	S651	S651-N702 PolarHBondContact N-O 3.36Å
703	Y	92.3	Very high	91.3	Very high	5 Å²	5	33 Å²	33	2%	0.02	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	132.4	177.2	-178	-103.2	0	0	0	110.6	F512 S651 G653 A686 R697 V698 G701 F705	F512-Y703 WeakPolarHBondContact CD2-O 3.33Å; S651-Y703 CarbonylContact O-C 3.57Å; S651-Y703 WeakPolarHBondContact O-CA 3.33Å; S651-Y703 WeakPolarHBondContact O-CD2 3.23Å; G653-Y703 VanDerWaalsContact CA-OH 3.23Å; G653-Y703 WeakPolarHBondContact CA-OH 3.16Å; G653-Y703 PolarHBondContact N-OH 3.13Å; A686-Y703 PolarHBondContact O-OH 3.36Å; R697-Y703 HydrophobicContact CB-CD1 3.82Å; R697-Y703 HydrophobicContact CB-CE1 4.07Å; R697-Y703 HydrophobicContact CB-CG 4.47Å; R697-Y703 HydrophobicContact CG-CD1 3.54Å; R697-Y703 HydrophobicContact CG-CD2 4.28Å; R697-Y703 HydrophobicContact CG-CE1 3.96Å; R697-Y703 HydrophobicContact CG-CG 3.71Å; V698-Y703 HydrophobicContact CG2-CD1 3.75Å; V698-Y703 HydrophobicContact CG2-CE1 4.22Å; G701-Y703 PolarHBondContact O-N 3.34Å; Y703-F705 HydrophobicContact CE1-CB 3.97Å; Y703-F705 AromaticContact CE1-CD2 3.8Å; Y703-F705 HydrophobicContact CE1-CD2 3.8Å; Y703-F705 HydrophobicContact CE1-CG 4.35Å
704	A	93	Very high	91.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	133.4	174.3	0	0	0	0	0	110.1	I510 F512 L644 I650 S651 Y652 G653	I510-A704 HydrophobicContact CG2-CB 3.87Å; F512-A704 HydrophobicContact CD2-CB 3.86Å; F512-A704 HydrophobicContact CE2-CB 4.41Å; L644-A704 HydrophobicContact CD1-CB 4.16Å; I650-A704 HydrophobicContact CG2-CB 4.19Å; S651-A704 PolarHBondContact O-N 3.24Å; Y652-A704 WeakPolarHBondContact CA-O 3.49Å; Y652-A704 WeakPolarHBondContact CB-O 3.2Å; G653-A704 PolarHBondContact N-O 2.63Å
705	F	94.7	Very high	91.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	122.9	-178.9	-167.9	-107.6	0	0	0	111.1	L511 G653 L655 T688 Y691 V698 Y703 M707	L511-F705 HydrophobicContact CB-CB 4.38Å; L511-F705 WeakPolarHBondContact CB-O 3.44Å; L511-F705 PolarHBondContact N-O 3.35Å; L511-F705 PolarHBondContact O-N 2.94Å; G653-F705 WeakPolarHBondContact O-CD2 3.35Å; L655-F705 HydrophobicContact CB-CZ 4.42Å; T688-F705 HydrophobicContact CG2-CE2 4.18Å; T688-F705 WeakPolarHBondContact OG1-CE2 3.39Å; T688-F705 WeakPolarHBondContact OG1-CZ 3.39Å; Y691-F705 AromaticContact CD1-CE1 3.85Å; Y691-F705 HydrophobicContact CD1-CE1 3.85Å; Y691-F705 HydrophobicContact CD1-CZ 4.34Å; Y691-F705 HydrophobicContact CE1-CE1 4.17Å; V698-F705 HydrophobicContact CG2-CB 3.43Å; V698-F705 VanDerWaalsContact CG2-CB 3.43Å; Y703-F705 HydrophobicContact CE1-CB 3.97Å; Y703-F705 AromaticContact CE1-CD2 3.8Å; Y703-F705 HydrophobicContact CE1-CD2 3.8Å; Y703-F705 HydrophobicContact CE1-CG 4.35Å; F705-M707 HydrophobicContact CD1-CB 3.86Å; F705-M707 HydrophobicContact CD1-CE 3.29Å; F705-M707 HydrophobicContact CD1-CG 4.11Å; F705-M707 HydrophobicContact CE1-CB 3.81Å; F705-M707 HydrophobicContact CE1-CE 3.55Å; F705-M707 HydrophobicContact CE1-CG 4.47Å
706	L	94.3	Very high	91	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	110.8	-179.5	-63.7	168.5	0	0	0	108.4	I508 I510 G653 T654 T660 F664 I675 M679 L729	I508-L706 HydrophobicContact CG2-CB 4.36Å; I510-L706 HydrophobicContact CB-CD2 4.36Å; I510-L706 HydrophobicContact CD1-CD2 4.37Å; I510-L706 HydrophobicContact CG1-CD2 3.73Å; I510-L706 HydrophobicContact CG2-CD2 4.36Å; G653-L706 PolarHBondContact O-N 2.94Å; T654-L706 HydrophobicContact CG2-CB 3.6Å; T654-L706 HydrophobicContact CG2-CD1 4.14Å; T654-L706 HydrophobicContact CG2-CG 4.48Å; T660-L706 HydrophobicContact CG2-CB 4.47Å; F664-L706 HydrophobicContact CE2-CB 4.36Å; F664-L706 HydrophobicContact CE2-CD1 3.77Å; F664-L706 HydrophobicContact CZ-CD1 3.9Å; I675-L706 HydrophobicContact CG2-CD1 4.22Å; M679-L706 HydrophobicContact SD-CD1 4.31Å; L706-L729 HydrophobicContact CD2-CD1 4.39Å
707	M	92.1	Very high	90.7	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	170.8	-177.5	63.2	160.9	69.4	0	0	111.7	I508 S509 L511 Y691 I695 F705 M711 L712 I715	I508-M707 WeakPolarHBondContact CA-O 3.27Å; S509-M707 PolarHBondContact N-O 3.29Å; S509-M707 PolarHBondContact O-N 3.38Å; S509-M707 VanDerWaalsContact O-N 3.13Å; L511-M707 HydrophobicContact CB-CG 4.49Å; L511-M707 HydrophobicContact CD2-CE 3.59Å; L511-M707 HydrophobicContact CD2-SD 4.35Å; Y691-M707 HydrophobicContact CD1-CE 4.22Å; Y691-M707 HydrophobicContact CE1-CB 4.14Å; I695-M707 HydrophobicContact CG1-CE 4.21Å; F705-M707 HydrophobicContact CD1-CB 3.86Å; F705-M707 HydrophobicContact CD1-CE 3.29Å; F705-M707 HydrophobicContact CD1-CG 4.11Å; F705-M707 HydrophobicContact CE1-CB 3.81Å; F705-M707 HydrophobicContact CE1-CE 3.55Å; F705-M707 HydrophobicContact CE1-CG 4.47Å; M707-M711 HydrophobicContact SD-CB 4.24Å; M707-M711 HydrophobicContact SD-CG 4.13Å; M707-L712 HydrophobicContact CG-CB 4.04Å; M707-L712 HydrophobicContact CG-CD1 4.23Å; M707-L712 HydrophobicContact CG-CG 4.41Å; M707-L712 VanDerWaalsContact SD-CA 3.57Å; M707-L712 HydrophobicContact SD-CB 3.78Å; M707-L712 HydrophobicContact SD-CG 4.29Å; M707-I715 HydrophobicContact CE-CD1 3.56Å; M707-I715 HydrophobicContact SD-CD1 3.75Å
708	E	92.1	Very high	90.5	Very high	3 Å²	3	28.7 Å²	28.7	1%	0.014	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	138	175.1	-70.7	170.4	140.5	0	0	110.7	T488 L506 T710 M711 L712 Y734	T488-E708 PolarHBondContact OG1-OE1 3.01Å; L506-E708 HydrophobicContact CD1-CB 4Å; L506-E708 HydrophobicContact CD1-CG 3.79Å; E708-T710 VanDerWaalsContact C-N 3.27Å; E708-T710 PolarHBondContact O-N 2.87Å; E708-M711 PolarHBondContact O-N 3.37Å; E708-L712 PolarHBondContact O-N 3.18Å; E708-Y734 PolarHBondContact OE2-OH 3.5Å
709	S	93.5	Very high	90.2	Very high	9 Å²	9	30.4 Å²	30.4	6%	0.063	16%	0.156	C	C	.	.	H	α-helix	trans	-61.4	-32.6	-170.4	60.3	0	0	0	0	113.7	G507 L712 D713	G507-S709 PolarHBondContact N-OG 3.49Å; G507-S709 WeakPolarHBondContact O-CB 3.36Å; G507-S709 PolarHBondContact O-N 3.36Å; G507-S709 PolarHBondContact O-OG 3.15Å; S709-L712 WeakPolarHBondContact O-CB 3.31Å; S709-L712 PolarHBondContact O-N 3.46Å; S709-D713 WeakPolarHBondContact O-CB 3.42Å; S709-D713 PolarHBondContact O-N 3.13Å
710	T	91.8	Very high	90	Very high	5 Å²	5	30.1 Å²	30.1	3%	0.031	16%	0.157	C	C	.	.	H	α-helix	trans	-67	-42.3	179.9	47.3	0	0	0	0	111.6	Y415 M504 L506 E708 Y714 Y734 W769	Y415-T710 VanDerWaalsContact OH-CB 3.28Å; Y415-T710 WeakPolarHBondContact OH-CB 3.39Å; Y415-T710 PolarHBondContact OH-OG1 3.41Å; M504-T710 HydrophobicContact CG-CG2 4.14Å; M504-T710 HydrophobicContact SD-CG2 3.53Å; M504-T710 VanDerWaalsContact SD-CG2 3.53Å; L506-T710 HydrophobicContact CB-CG2 3.78Å; L506-T710 HydrophobicContact CD2-CG2 4.34Å; E708-T710 VanDerWaalsContact C-N 3.27Å; E708-T710 PolarHBondContact O-N 2.87Å; T710-Y714 PolarHBondContact O-N 3.4Å; T710-Y734 PolarHBondContact OG1-OH 3.19Å; T710-W769 PolarHBondContact O-NE1 3.44Å
711	M	90.1	Very high	89.9	Confident	6 Å²	6	27 Å²	27	3%	0.03	15%	0.146	C	C	.	.	H	α-helix	trans	-68.1	-39	172.7	-173.2	58.4	170.4	0	0	111.1	T413 Y691 M707 E708 Y714 I715	T413-M711 VanDerWaalsContact O-SD 3.38Å; Y691-M711 HydrophobicContact CD1-CG 4.49Å; Y691-M711 HydrophobicContact CG-CE 4.35Å; M707-M711 HydrophobicContact SD-CB 4.24Å; M707-M711 HydrophobicContact SD-CG 4.13Å; E708-M711 PolarHBondContact O-N 3.37Å; M711-Y714 WeakPolarHBondContact O-CB 3.25Å; M711-Y714 PolarHBondContact O-N 3.27Å; M711-I715 HydrophobicContact CE-CD1 4.26Å; M711-I715 HydrophobicContact CG-CD1 3.94Å; M711-I715 VanDerWaalsContact O-CD1 3.29Å; M711-I715 WeakPolarHBondContact O-CD1 3.35Å; M711-I715 VanDerWaalsContact O-CG1 3.29Å; M711-I715 WeakPolarHBondContact O-CG1 3.36Å; M711-I715 PolarHBondContact O-N 3.15Å; M711-I715 VanDerWaalsContact O-N 3.14Å; M711-I715 HydrophobicContact SD-CD1 4.43Å
712	L	91.2	Very high	90.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.7	-50.5	176	-165.7	158.8	0	0	0	111.4	L511 M707 E708 S709 Y714 I715 V716 Q724	L511-L712 HydrophobicContact CB-CD1 3.89Å; L511-L712 HydrophobicContact CB-CG 4.15Å; L511-L712 HydrophobicContact CD1-CD2 4.31Å; L511-L712 HydrophobicContact CD1-CG 4.01Å; M707-L712 HydrophobicContact CG-CB 4.04Å; M707-L712 HydrophobicContact CG-CD1 4.23Å; M707-L712 HydrophobicContact CG-CG 4.41Å; M707-L712 VanDerWaalsContact SD-CA 3.57Å; M707-L712 HydrophobicContact SD-CB 3.78Å; M707-L712 HydrophobicContact SD-CG 4.29Å; E708-L712 PolarHBondContact O-N 3.18Å; S709-L712 WeakPolarHBondContact O-CB 3.31Å; S709-L712 PolarHBondContact O-N 3.46Å; L712-Y714 VanDerWaalsContact C-N 3.25Å; L712-Y714 PolarHBondContact O-N 3.36Å; L712-I715 PolarHBondContact O-N 3.45Å; L712-I715 VanDerWaalsContact O-N 3.09Å; L712-V716 HydrophobicContact CD2-CG2 3.57Å; L712-V716 HydrophobicContact CG-CG2 4.49Å; L712-V716 WeakPolarHBondContact O-CG2 3.5Å; L712-V716 PolarHBondContact O-N 2.86Å; L712-Q724 HydrophobicContact CD1-CG 4.07Å; L712-Q724 HydrophobicContact CD2-CB 3.5Å; L712-Q724 VanDerWaalsContact CD2-CB 3.5Å; L712-Q724 HydrophobicContact CD2-CG 3.73Å
713	D	89.7	Confident	90.4	Very high	48 Å²	48	22 Å²	22	26%	0.257	12%	0.115	S	C	.	.	H	α-helix	trans	-57.8	-40.2	178.9	-74.4	-14.2	0	0	0	111.5	S709 I715 Q717	S709-D713 WeakPolarHBondContact O-CB 3.42Å; S709-D713 PolarHBondContact O-N 3.13Å; D713-I715 VanDerWaalsContact C-N 3.33Å; D713-I715 PolarHBondContact O-N 2.92Å; D713-Q717 WeakPolarHBondContact O-CB 3.35Å; D713-Q717 WeakPolarHBondContact O-CG 3.4Å; D713-Q717 PolarHBondContact O-N 3.43Å; D713-Q717 VanDerWaalsContact O-N 3.13Å
714	Y	90.3	Very high	90.3	Very high	28 Å²	28	25.3 Å²	25.3	11%	0.11	13%	0.13	C	C	.	.	H	α-helix	trans	-60.2	-42.4	176.5	-176.9	-100	0	0	0	112.4	P414 T710 M711 L712 R718 W769	P414-Y714 HydrophobicContact CB-CD2 3.99Å; P414-Y714 HydrophobicContact CB-CE2 3.37Å; P414-Y714 HydrophobicContact CG-CD2 3.43Å; P414-Y714 VanDerWaalsContact CG-CD2 3.43Å; P414-Y714 HydrophobicContact CG-CE2 3.39Å; P414-Y714 HydrophobicContact CG-CG 4.14Å; T710-Y714 PolarHBondContact O-N 3.4Å; M711-Y714 WeakPolarHBondContact O-CB 3.25Å; M711-Y714 PolarHBondContact O-N 3.27Å; L712-Y714 VanDerWaalsContact C-N 3.25Å; L712-Y714 PolarHBondContact O-N 3.36Å; Y714-R718 VanDerWaalsContact CZ-NH1 3.26Å; Y714-R718 PolarHBondContact O-NH1 2.96Å; Y714-R718 VanDerWaalsContact OH-CZ 3.28Å; Y714-R718 PolarHBondContact OH-NE 2.98Å; Y714-R718 PolarHBondContact OH-NH2 2.98Å; Y714-W769 HydrophobicContact CD2-CD2 4.35Å; Y714-W769 HydrophobicContact CD2-CG 4.32Å
715	I	90.1	Very high	90	Very high	13 Å²	13	25.8 Å²	25.8	7%	0.067	13%	0.133	C	C	.	.	H	α-helix	trans	-75.4	-47.1	-177.2	-64.3	156.5	0	0	0	110.7	I695 M707 M711 L712 D713 Q717 R718 D719 L722	I695-I715 HydrophobicContact CD1-CD1 3.35Å; I695-I715 HydrophobicContact CD1-CG1 3.81Å; I695-I715 HydrophobicContact CD1-CG2 4.25Å; I695-I715 HydrophobicContact CG1-CD1 3.79Å; I695-I715 HydrophobicContact CG1-CG2 4.35Å; I695-I715 HydrophobicContact CG2-CG2 4.19Å; M707-I715 HydrophobicContact CE-CD1 3.56Å; M707-I715 HydrophobicContact SD-CD1 3.75Å; M711-I715 HydrophobicContact CE-CD1 4.26Å; M711-I715 HydrophobicContact CG-CD1 3.94Å; M711-I715 VanDerWaalsContact O-CD1 3.29Å; M711-I715 WeakPolarHBondContact O-CD1 3.35Å; M711-I715 VanDerWaalsContact O-CG1 3.29Å; M711-I715 WeakPolarHBondContact O-CG1 3.36Å; M711-I715 PolarHBondContact O-N 3.15Å; M711-I715 VanDerWaalsContact O-N 3.14Å; M711-I715 HydrophobicContact SD-CD1 4.43Å; L712-I715 PolarHBondContact O-N 3.45Å; L712-I715 VanDerWaalsContact O-N 3.09Å; D713-I715 VanDerWaalsContact C-N 3.33Å; D713-I715 PolarHBondContact O-N 2.92Å; I715-Q717 PolarHBondContact O-N 3.27Å; I715-R718 PolarHBondContact O-N 2.63Å; I715-D719 PolarHBondContact O-N 2.79Å; I715-L722 HydrophobicContact CG2-CD1 3.67Å
716	V	89.3	Confident	89.6	Confident	37 Å²	37	27.6 Å²	27.6	22%	0.224	15%	0.151	C	C	.	.	H	α-helix	trans	-61.5	-33.3	-179.9	169	0	0	0	0	111.5	L511 L712 R718 L722	L511-V716 HydrophobicContact CD1-CG2 3.83Å; L712-V716 HydrophobicContact CD2-CG2 3.57Å; L712-V716 HydrophobicContact CG-CG2 4.49Å; L712-V716 WeakPolarHBondContact O-CG2 3.5Å; L712-V716 PolarHBondContact O-N 2.86Å; V716-R718 PolarHBondContact O-N 2.79Å; V716-L722 HydrophobicContact CG2-CB 4.37Å
717	Q	85.4	Confident	89.2	Confident	48 Å²	48	29.7 Å²	29.7	22%	0.224	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-22.2	174.6	-77	179.2	38.7	0	0	113.5	D713 I715 W769 T775 C776	D713-Q717 WeakPolarHBondContact O-CB 3.35Å; D713-Q717 WeakPolarHBondContact O-CG 3.4Å; D713-Q717 PolarHBondContact O-N 3.43Å; D713-Q717 VanDerWaalsContact O-N 3.13Å; I715-Q717 PolarHBondContact O-N 3.27Å; Q717-W769 VanDerWaalsContact OE1-C 3.31Å; Q717-W769 PolarHBondContact OE1-O 3.39Å; Q717-T775 HydrophobicContact CB-CG2 4.28Å; Q717-T775 CarbonylContact O-C 3.6Å; Q717-T775 WeakPolarHBondContact O-CA 3.1Å; Q717-C776 PolarHBondContact O-N 3.47Å; Q717-C776 PolarHBondContact O-SG 3.26Å
718	R	87.1	Confident	89.2	Confident	61 Å²	61	34 Å²	34	23%	0.23	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-37.4	180	-72.9	177.2	174.5	67	1.2	113	Y714 I715 V716 E774 C776	Y714-R718 VanDerWaalsContact CZ-NH1 3.26Å; Y714-R718 PolarHBondContact O-NH1 2.96Å; Y714-R718 VanDerWaalsContact OH-CZ 3.28Å; Y714-R718 PolarHBondContact OH-NE 2.98Å; Y714-R718 PolarHBondContact OH-NH2 2.98Å; I715-R718 PolarHBondContact O-N 2.63Å; V716-R718 PolarHBondContact O-N 2.79Å; R718-E774 IonicContact CZ-OE2 3.29Å; R718-E774 VanDerWaalsContact CZ-OE2 3.29Å; R718-E774 IonicContact NE-OE2 3Å; R718-E774 PolarHBondContact NE-OE2 3.28Å; R718-E774 IonicContact NH2-OE2 2.72Å; R718-E774 PolarHBondContact NH2-OE2 2.95Å; R718-C776 WeakPolarHBondContact O-CB 3.42Å
719	D	86.9	Confident	89.1	Confident	36 Å²	36	35.5 Å²	35.5	19%	0.193	20%	0.204	C	C	.	.			trans	-111.6	99.9	178.9	-168.9	-8.1	0	0	0	111.1	N699 I715 N721 L722	N699-D719 PolarHBondContact ND2-OD2 2.92Å; I715-D719 PolarHBondContact O-N 2.79Å; D719-N721 PolarHBondContact O-N 2.86Å; D719-N721 VanDerWaalsContact O-N 3.13Å; D719-N721 WeakPolarHBondContact OD1-CB 3.39Å; D719-N721 PolarHBondContact OD1-N 3.13Å; D719-N721 PolarHBondContact OD1-ND2 2.85Å; D719-L722 HydrophobicContact CB-CD1 4.03Å; D719-L722 HydrophobicContact CB-CG 4.34Å; D719-L722 PolarHBondContact O-N 3.05Å; D719-L722 VanDerWaalsContact O-N 3.09Å
720	C	85.9	Confident	89	Confident	37 Å²	37	36.2 Å²	36.2	25%	0.25	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-5.9	-178.1	-84.1	0	0	0	0	113.9	C776 R778	C720-C776 WeakPolarHBondContact CA-SG 3.25Å; C720-C776 HydrophobicContact CB-CB 4.02Å; C720-C776 WeakPolarHBondContact CB-SG 3.39Å; C720-C776 PolarHBondContact N-SG 3.28Å; C720-C776 WeakPolarHBondContact SG-CB 3.49Å; C720-C776 PolarHBondContact SG-O 3.35Å; C720-C776 VanDerWaalsContact SG-O 3.36Å; C720-C776 CovalentContact SG-SG 2.04Å; C720-C776 PolarHBondContact SG-SG 3.44Å; C720-R778 PolarHBondContact SG-N 2.86Å
721	N	87.9	Confident	88.9	Confident	94 Å²	94	42.5 Å²	42.5	50%	0.503	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-9.5	171.9	-58	-54.7	0	0	0	112.5	K513 V514 D719	K513-N721 CarbonylContact C-O 3.58Å; K513-N721 WeakPolarHBondContact CA-O 3.48Å; K513-N721 WeakPolarHBondContact CG-O 3.35Å; V514-N721 WeakPolarHBondContact CG2-O 3.37Å; V514-N721 PolarHBondContact N-O 3.34Å; D719-N721 PolarHBondContact O-N 2.86Å; D719-N721 VanDerWaalsContact O-N 3.13Å; D719-N721 WeakPolarHBondContact OD1-CB 3.39Å; D719-N721 PolarHBondContact OD1-N 3.13Å; D719-N721 PolarHBondContact OD1-ND2 2.85Å
722	L	90.3	Very high	89	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	150.6	-176.7	-59.9	175.6	0	0	0	110.8	L511 F512 I695 V698 N699 I715 V716 D719	L511-L722 HydrophobicContact CD1-CB 3.85Å; L511-L722 HydrophobicContact CD1-CD1 4.26Å; L511-L722 HydrophobicContact CD1-CG 4.49Å; L511-L722 HydrophobicContact CD2-CD1 4.3Å; F512-L722 CarbonylContact O-C 3.48Å; F512-L722 WeakPolarHBondContact O-CA 2.97Å; I695-L722 HydrophobicContact CG2-CD1 3.83Å; V698-L722 HydrophobicContact CB-CD2 4.23Å; V698-L722 HydrophobicContact CG1-CD2 3.56Å; N699-L722 VanDerWaalsContact OD1-CD2 3.29Å; N699-L722 WeakPolarHBondContact OD1-CD2 3.38Å; I715-L722 HydrophobicContact CG2-CD1 3.67Å; V716-L722 HydrophobicContact CG2-CB 4.37Å; D719-L722 HydrophobicContact CB-CD1 4.03Å; D719-L722 HydrophobicContact CB-CG 4.34Å; D719-L722 PolarHBondContact O-N 3.05Å; D719-L722 VanDerWaalsContact O-N 3.09Å
723	T	89.5	Confident	89.1	Confident	28 Å²	28	44 Å²	44	17%	0.172	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	148.8	179.2	34.3	0	0	0	0	111.1	F512 V514 R778	F512-T723 PolarHBondContact N-O 3.23Å; F512-T723 PolarHBondContact O-N 2.85Å; F512-T723 VanDerWaalsContact O-O 3.11Å; F512-T723 PolarHBondContact O-OG1 3.32Å; V514-T723 HydrophobicContact CG2-CG2 3.42Å; V514-T723 VanDerWaalsContact CG2-CG2 3.42Å; T723-R778 VanDerWaalsContact CG2-NH1 3.25Å
724	Q	90.2	Very high	89.3	Confident	75 Å²	75	41.8 Å²	41.8	35%	0.35	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	136.8	164.9	-167.3	178	2.7	0	0	110.1	S509 L712	S509-Q724 VanDerWaalsContact OG-CG 3.3Å; S509-Q724 WeakPolarHBondContact OG-CG 3.39Å; S509-Q724 PolarHBondContact OG-NE2 3.27Å; L712-Q724 HydrophobicContact CD1-CG 4.07Å; L712-Q724 HydrophobicContact CD2-CB 3.5Å; L712-Q724 VanDerWaalsContact CD2-CB 3.5Å; L712-Q724 HydrophobicContact CD2-CG 3.73Å
725	I	87.9	Confident	89.6	Confident	9 Å²	9	40.5 Å²	40.5	5%	0.046	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.2	173.6	-61.9	-169.6	0	0	0	109.8	I510 F512 I638 E639	I510-I725 HydrophobicContact CB-CB 4.3Å; I510-I725 PolarHBondContact O-N 3.07Å; F512-I725 HydrophobicContact CB-CD1 3.41Å; F512-I725 VanDerWaalsContact CB-CD1 3.41Å; F512-I725 HydrophobicContact CB-CG1 3.94Å; F512-I725 HydrophobicContact CD1-CD1 3.57Å; F512-I725 HydrophobicContact CG-CD1 3.74Å; I638-I725 HydrophobicContact CD1-CD1 3.78Å; I638-I725 HydrophobicContact CD1-CG2 4.37Å; I638-I725 HydrophobicContact CG1-CD1 3.63Å; I638-I725 HydrophobicContact CG1-CG2 4.19Å; I638-I725 VanDerWaalsContact O-CG2 3.25Å; I638-I725 WeakPolarHBondContact O-CG2 3.39Å; E639-I725 WeakPolarHBondContact O-CG2 3.29Å
726	G	85.1	Confident	89.9	Confident	38 Å²	38	40 Å²	40	39%	0.392	23%	0.234	S	C	.	.	S	Bend	trans	71.3	-168.8	-178.6	0	0	0	0	0	113.4	E639	E639-G726 VanDerWaalsContact O-CA 3.26Å; E639-G726 WeakPolarHBondContact O-CA 3.42Å; E639-G726 PolarHBondContact O-N 3.43Å
727	G	87.5	Confident	90.2	Very high	46 Å²	46	38.2 Å²	38.2	47%	0.474	22%	0.223	S	C	.	.	S	Bend	trans	-91.6	-159	173.8	0	0	0	0	0	113.2	S509	S509-G727 PolarHBondContact OG-O 3.49Å
728	L	90.9	Very high	90.7	Very high	91 Å²	91	35.9 Å²	35.9	48%	0.476	21%	0.213	S	C	.	.			trans	-80.5	128.1	168.5	-56.2	178.4	0	0	0	109.2	D730	L728-D730 VanDerWaalsContact C-N 3.32Å
729	L	90.9	Very high	90.9	Very high	35 Å²	35	34 Å²	34	18%	0.183	21%	0.208	C	C	.	.	S	Bend	trans	-78	-20.1	-180	-60.8	179.5	0	0	0	113	I508 A641 F664 Y672 L706	I508-L729 HydrophobicContact CB-CB 4.3Å; I508-L729 HydrophobicContact CB-CD1 4.48Å; I508-L729 HydrophobicContact CG2-CD1 4.04Å; I508-L729 PolarHBondContact O-N 3.09Å; A641-L729 HydrophobicContact CB-CD1 4.2Å; A641-L729 HydrophobicContact CB-CD2 3.64Å; F664-L729 HydrophobicContact CZ-CD1 4.31Å; Y672-L729 PolarHBondContact OH-O 2.85Å; Y672-L729 VanDerWaalsContact OH-O 3.14Å; L706-L729 HydrophobicContact CD2-CD1 4.39Å
730	D	90.6	Very high	90.8	Very high	24 Å²	24	38.8 Å²	38.8	13%	0.128	23%	0.227	C	C	.	.	S	Bend	trans	-149.5	173.4	176.7	65.3	-4.4	0	0	0	110.7	G507 I508 F663 L728 K732	G507-D730 WeakPolarHBondContact CA-O 3.35Å; G507-D730 VanDerWaalsContact CA-OD1 3.22Å; G507-D730 WeakPolarHBondContact CA-OD1 3.5Å; I508-D730 WeakPolarHBondContact CD1-OD2 3.4Å; I508-D730 PolarHBondContact N-OD1 2.94Å; F663-D730 HydrophobicContact CE2-CB 4.18Å; F663-D730 HydrophobicContact CZ-CB 4.1Å; L728-D730 VanDerWaalsContact C-N 3.32Å; D730-K732 WeakPolarHBondContact OD2-CD 3.28Å; D730-K732 WeakPolarHBondContact OD2-CE 3.44Å; D730-K732 IonicContact OD2-NZ 2.73Å; D730-K732 PolarHBondContact OD2-NZ 3.43Å
731	T	90.2	Very high	90.5	Very high	137 Å²	137	39.7 Å²	39.7	84%	0.84	24%	0.243	S	C	*	.			trans	-118.8	116.4	174.1	49.6	0	0	0	0	109.4
732	K	91.3	Very high	90.3	Very high	33 Å²	33	35.6 Å²	35.6	14%	0.143	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	171.1	-177.4	-77.7	168.5	165.5	155.9	0	109.8	T488 N505 L506 I508 D730	T488-K732 HydrophobicContact CG2-CB 4.07Å; T488-K732 HydrophobicContact CG2-CD 3.72Å; T488-K732 HydrophobicContact CG2-CG 4.08Å; N505-K732 WeakPolarHBondContact CA-O 3.33Å; L506-K732 HydrophobicContact CD1-CB 3.85Å; L506-K732 HydrophobicContact CG-CB 4.32Å; L506-K732 PolarHBondContact N-O 3.02Å; L506-K732 CarbonylContact O-C 3.57Å; L506-K732 WeakPolarHBondContact O-CA 3.46Å; L506-K732 PolarHBondContact O-N 3.18Å; I508-K732 VanDerWaalsContact CD1-NZ 3.35Å; D730-K732 WeakPolarHBondContact OD2-CD 3.28Å; D730-K732 WeakPolarHBondContact OD2-CE 3.44Å; D730-K732 IonicContact OD2-NZ 2.73Å; D730-K732 PolarHBondContact OD2-NZ 3.43Å
733	G	93.6	Very high	89.9	Confident	6 Å²	6	38.6 Å²	38.6	6%	0.062	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	152.6	170.6	0	0	0	0	0	112	I489 M504	I489-G733 WeakPolarHBondContact CG1-O 3.4Å; I489-G733 PolarHBondContact N-O 3.47Å; I489-G733 VanDerWaalsContact N-O 3.11Å; M504-G733 CarbonylContact O-C 3.5Å; M504-G733 WeakPolarHBondContact O-CA 3.41Å
734	Y	95.1	Very high	89.8	Confident	1 Å²	1	39.1 Å²	39.1	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.3	165.4	-64.4	-34.4	0	0	0	109.5	Y415 S486 M487 P502 F503 M504 L506 E708 T710	Y415-Y734 HydrophobicContact CE1-CD2 4.26Å; Y415-Y734 AromaticContact CE1-CE2 3.75Å; Y415-Y734 HydrophobicContact CE1-CE2 3.75Å; Y415-Y734 AromaticContact CZ-CE2 3.77Å; S486-Y734 VanDerWaalsContact C-CD1 3.46Å; S486-Y734 VanDerWaalsContact O-CE1 3.23Å; S486-Y734 WeakPolarHBondContact O-CE1 3.25Å; M487-Y734 WeakPolarHBondContact O-CA 3.42Å; P502-Y734 CarbonylContact C-O 3.58Å; P502-Y734 WeakPolarHBondContact CA-O 3.4Å; P502-Y734 WeakPolarHBondContact CB-O 3.49Å; F503-Y734 WeakPolarHBondContact CD1-O 3.34Å; F503-Y734 HydrophobicContact CE2-CD2 4.4Å; F503-Y734 HydrophobicContact CZ-CD2 4.36Å; F503-Y734 HydrophobicContact CZ-CG 4.32Å; F503-Y734 PolarHBondContact N-O 3.29Å; M504-Y734 PolarHBondContact O-N 2.66Å; M504-Y734 HydrophobicContact SD-CD2 4.33Å; L506-Y734 HydrophobicContact CD1-CE1 4.48Å; L506-Y734 HydrophobicContact CD2-CD1 3.5Å; L506-Y734 HydrophobicContact CD2-CD2 3.47Å; L506-Y734 VanDerWaalsContact CD2-CD2 3.47Å; L506-Y734 HydrophobicContact CD2-CE1 3.35Å; L506-Y734 HydrophobicContact CD2-CE2 3.34Å; L506-Y734 HydrophobicContact CD2-CG 3.55Å; E708-Y734 PolarHBondContact OE2-OH 3.5Å; T710-Y734 PolarHBondContact OG1-OH 3.19Å
735	G	95.3	Very high	89.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.237	C	C	.	.			trans	-128.5	155.6	174.7	0	0	0	0	0	110.4	M487	M487-G735 PolarHBondContact O-N 2.96Å
736	I	96.6	Very high	89.8	Confident	2 Å²	2	43 Å²	43	1%	0.01	26%	0.257	C	S	.	.			trans	-77.5	131.2	168.9	-62.1	178.9	0	0	0	106.9	I441 L482 V484 F499 T500 F503 I748 I752	I441-I736 HydrophobicContact CD1-CD1 3.63Å; L482-I736 HydrophobicContact CD2-CG2 4.39Å; V484-I736 HydrophobicContact CG2-CD1 4.34Å; V484-I736 HydrophobicContact CG2-CG1 4.38Å; V484-I736 HydrophobicContact CG2-CG2 3.88Å; F499-I736 WeakPolarHBondContact CA-O 3.42Å; T500-I736 HydrophobicContact CG2-CB 3.94Å; T500-I736 HydrophobicContact CG2-CG2 4.47Å; T500-I736 WeakPolarHBondContact CG2-O 3.48Å; T500-I736 PolarHBondContact N-O 3.1Å; T500-I736 PolarHBondContact OG1-N 3.44Å; T500-I736 PolarHBondContact OG1-O 3.28Å; F503-I736 HydrophobicContact CD1-CG1 4.21Å; F503-I736 HydrophobicContact CE1-CG1 4.24Å; I736-I748 HydrophobicContact CD1-CG2 4.06Å; I736-I752 HydrophobicContact CD1-CD1 4.11Å; I736-I752 HydrophobicContact CG1-CD1 4.43Å
737	A	96.2	Very high	89.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	144	179.9	0	0	0	0	0	111.2	L476 L482 A483 M487 I497 D498 F499	L476-A737 HydrophobicContact CD1-CB 3.5Å; L482-A737 WeakPolarHBondContact CA-O 3.31Å; A483-A737 HydrophobicContact CB-CB 4.22Å; A483-A737 PolarHBondContact N-O 3.35Å; A483-A737 PolarHBondContact O-N 3.4Å; M487-A737 HydrophobicContact CE-CB 4.39Å; M487-A737 HydrophobicContact SD-CB 3.7Å; I497-A737 HydrophobicContact CD1-CB 3.98Å; D498-A737 WeakPolarHBondContact O-CA 3.5Å; F499-A737 HydrophobicContact CD1-CB 3.9Å; F499-A737 HydrophobicContact CE1-CB 3.68Å; F499-A737 HydrophobicContact CZ-CB 4.27Å
738	T	95.3	Very high	90.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	153.7	-177.7	67.3	0	0	0	0	109.6	L482 D498 R745	L482-T738 HydrophobicContact CD2-CG2 3.56Å; D498-T738 PolarHBondContact N-O 3.35Å; D498-T738 PolarHBondContact O-N 3.05Å; D498-T738 VanDerWaalsContact O-O 3.11Å; D498-T738 PolarHBondContact O-OG1 3.13Å; T738-R745 HydrophobicContact CG2-CB 4.36Å
739	P	92	Very high	90.4	Very high	22 Å²	22	39.5 Å²	39.5	14%	0.143	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	147.4	169	-23.6	33.9	0	0	0	110.5	L476 A480 D481 G741 S742	L476-P739 HydrophobicContact CD2-CG 4.26Å; A480-P739 WeakPolarHBondContact O-CG 3.46Å; D481-P739 WeakPolarHBondContact O-CD 3.49Å; P739-G741 PolarHBondContact O-N 2.69Å; P739-S742 WeakPolarHBondContact O-CB 3.25Å; P739-S742 PolarHBondContact O-N 2.93Å
740	K	84.8	Confident	90.6	Very high	135 Å²	135	43 Å²	43	59%	0.587	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	126.7	-176.2	-161.7	169.1	-168.6	169.3	0	111	S495 S742	S495-K740 PolarHBondContact O-NZ 3.49Å; K740-S742 VanDerWaalsContact C-N 3.34Å
741	G	79.6	Confident	90.7	Very high	57 Å²	57	42.1 Å²	42.1	59%	0.588	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.8	15.7	-176.8	0	0	0	0	0	115	D498 P739	D498-G741 PolarHBondContact OD2-N 3.06Å; P739-G741 PolarHBondContact O-N 2.69Å
742	S	83.8	Confident	91	Very high	8 Å²	8	35.6 Å²	35.6	6%	0.056	19%	0.191	C	C	.	.			trans	-62.1	131.3	176.5	177.4	0	0	0	0	111.8	P739 K740 W744 R745	P739-S742 WeakPolarHBondContact O-CB 3.25Å; P739-S742 PolarHBondContact O-N 2.93Å; K740-S742 VanDerWaalsContact C-N 3.34Å; S742-W744 PolarHBondContact O-N 3.23Å; S742-W744 PolarHBondContact OG-N 3.32Å; S742-R745 WeakPolarHBondContact O-CB 3.48Å; S742-R745 PolarHBondContact O-N 3.23Å
743	P	82	Confident	91.2	Very high	63 Å²	63	37.7 Å²	37.7	41%	0.409	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-16.6	177.4	29.3	-35.7	0	0	0	112.9
744	W	86.7	Confident	91.2	Very high	39 Å²	39	42.2 Å²	42.2	15%	0.148	22%	0.223	C	C	.	.	H	α-helix	trans	-76.8	-23.3	179.8	-62.9	106.9	0	0	0	113.2	V403 L405 V445 F447 S742 D746 K747 I748	V403-W744 HydrophobicContact CB-CZ2 4.11Å; V403-W744 HydrophobicContact CG1-CZ2 4.4Å; V403-W744 HydrophobicContact CG2-CH2 4.49Å; V403-W744 HydrophobicContact CG2-CZ2 4.11Å; L405-W744 HydrophobicContact CD1-CD2 3.98Å; L405-W744 HydrophobicContact CD1-CE3 4.41Å; L405-W744 HydrophobicContact CD1-CG 4.24Å; L405-W744 HydrophobicContact CD1-CZ2 4.37Å; L405-W744 HydrophobicContact CD2-CZ2 4.06Å; V445-W744 HydrophobicContact CG1-CE3 4.08Å; V445-W744 HydrophobicContact CG1-CZ3 3.86Å; F447-W744 HydrophobicContact CB-CH2 3.93Å; F447-W744 HydrophobicContact CB-CZ3 4.03Å; F447-W744 HydrophobicContact CD1-CE3 4.25Å; F447-W744 AromaticContact CD1-CZ3 3.96Å; F447-W744 HydrophobicContact CD1-CZ3 3.96Å; F447-W744 HydrophobicContact CG-CZ3 4.33Å; S742-W744 PolarHBondContact O-N 3.23Å; S742-W744 PolarHBondContact OG-N 3.32Å; W744-D746 VanDerWaalsContact C-N 3.35Å; W744-D746 PolarHBondContact O-N 3.22Å; W744-K747 HydrophobicContact CE3-CD 4.48Å; W744-K747 PolarHBondContact O-N 3.1Å; W744-I748 HydrophobicContact CB-CD1 3.89Å; W744-I748 HydrophobicContact CB-CG1 4.49Å; W744-I748 WeakPolarHBondContact O-CB 3.36Å; W744-I748 VanDerWaalsContact O-CG1 3.23Å; W744-I748 WeakPolarHBondContact O-CG1 3.33Å; W744-I748 PolarHBondContact O-N 3.17Å
745	R	90.5	Very high	91.2	Very high	76 Å²	76	42.3 Å²	42.3	29%	0.287	22%	0.223	S	C	.	.	H	α-helix	trans	-55	-49.1	-175.4	-175.4	-163.1	70.8	-161.5	-1.1	112.2	D498 T738 S742 S749	D498-R745 IonicContact OD2-NH1 2.7Å; D498-R745 PolarHBondContact OD2-NH1 3.2Å; T738-R745 HydrophobicContact CG2-CB 4.36Å; S742-R745 WeakPolarHBondContact O-CB 3.48Å; S742-R745 PolarHBondContact O-N 3.23Å; R745-S749 VanDerWaalsContact O-CB 3.22Å; R745-S749 WeakPolarHBondContact O-CB 3.42Å; R745-S749 PolarHBondContact O-N 2.8Å; R745-S749 PolarHBondContact O-OG 3.41Å
746	D	88.2	Confident	91.2	Very high	89 Å²	89	45.9 Å²	45.9	48%	0.476	24%	0.24	S	C	.	.	H	α-helix	trans	-75.1	-39.7	-174.5	-64.7	-17.6	0	0	0	111	W744 S749 L750	W744-D746 VanDerWaalsContact C-N 3.35Å; W744-D746 PolarHBondContact O-N 3.22Å; D746-S749 PolarHBondContact O-N 3.12Å; D746-L750 WeakPolarHBondContact O-CG 3.45Å; D746-L750 PolarHBondContact O-N 2.62Å
747	K	88	Confident	91	Very high	89 Å²	89	54.2 Å²	54.2	39%	0.387	28%	0.279	S	S	.	.	H	α-helix	trans	-61.2	-47.7	174.9	-64.7	-174.1	179.3	-176.1	0	111.8	V445 W744 L750 A751	V445-K747 HydrophobicContact CG1-CB 4.03Å; V445-K747 HydrophobicContact CG1-CD 4.4Å; W744-K747 HydrophobicContact CE3-CD 4.48Å; W744-K747 PolarHBondContact O-N 3.1Å; K747-L750 PolarHBondContact O-N 3.16Å; K747-A751 PolarHBondContact O-N 2.93Å; K747-A751 VanDerWaalsContact O-N 3.09Å
748	I	94	Very high	91	Very high	1 Å²	1	60 Å²	60	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-67.3	-38.2	177.6	-65.3	170	0	0	0	110.6	I441 F447 L482 T500 I736 W744 L750 A751 I752	I441-I748 HydrophobicContact CD1-CG2 4.26Å; I441-I748 HydrophobicContact CG2-CB 4.45Å; I441-I748 HydrophobicContact CG2-CG1 4.1Å; I441-I748 HydrophobicContact CG2-CG2 3.94Å; F447-I748 HydrophobicContact CE1-CG1 4.39Å; L482-I748 HydrophobicContact CD1-CD1 3.96Å; L482-I748 HydrophobicContact CD2-CD1 3.69Å; T500-I748 HydrophobicContact CG2-CB 4.09Å; T500-I748 HydrophobicContact CG2-CG2 3.74Å; I736-I748 HydrophobicContact CD1-CG2 4.06Å; W744-I748 HydrophobicContact CB-CD1 3.89Å; W744-I748 HydrophobicContact CB-CG1 4.49Å; W744-I748 WeakPolarHBondContact O-CB 3.36Å; W744-I748 VanDerWaalsContact O-CG1 3.23Å; W744-I748 WeakPolarHBondContact O-CG1 3.33Å; W744-I748 PolarHBondContact O-N 3.17Å; I748-L750 VanDerWaalsContact C-N 3.34Å; I748-L750 PolarHBondContact O-N 2.83Å; I748-A751 PolarHBondContact O-N 2.97Å; I748-I752 HydrophobicContact CG2-CD1 3.87Å; I748-I752 HydrophobicContact CG2-CG1 4.3Å; I748-I752 VanDerWaalsContact O-CG1 3.32Å; I748-I752 WeakPolarHBondContact O-CG1 3.31Å; I748-I752 PolarHBondContact O-N 3.04Å
749	S	94.7	Very high	90.9	Very high	13 Å²	13	61.2 Å²	61.2	9%	0.091	31%	0.313	C	S	.	.	H	α-helix	trans	-62.2	-41.2	176.6	-65.8	0	0	0	0	112.2	T500 K501 R745 D746 I752 L753	T500-S749 VanDerWaalsContact CA-OG 3.25Å; T500-S749 WeakPolarHBondContact CA-OG 3.49Å; T500-S749 WeakPolarHBondContact CB-OG 3.48Å; K501-S749 PolarHBondContact N-OG 2.83Å; R745-S749 VanDerWaalsContact O-CB 3.22Å; R745-S749 WeakPolarHBondContact O-CB 3.42Å; R745-S749 PolarHBondContact O-N 2.8Å; R745-S749 PolarHBondContact O-OG 3.41Å; D746-S749 PolarHBondContact O-N 3.12Å; S749-I752 PolarHBondContact O-N 3.29Å; S749-L753 VanDerWaalsContact O-CG 3.3Å; S749-L753 WeakPolarHBondContact O-CG 3.38Å; S749-L753 PolarHBondContact O-N 3.26Å; S749-L753 VanDerWaalsContact O-N 3.1Å
750	L	93.7	Very high	91	Very high	108 Å²	108	62 Å²	62	57%	0.565	32%	0.316	S	S	*	.	H	α-helix	trans	-63.1	-46.5	174.4	-72.1	168.9	0	0	0	111.2	D746 K747 I748 I752 L753 E754	D746-L750 WeakPolarHBondContact O-CG 3.45Å; D746-L750 PolarHBondContact O-N 2.62Å; K747-L750 PolarHBondContact O-N 3.16Å; I748-L750 VanDerWaalsContact C-N 3.34Å; I748-L750 PolarHBondContact O-N 2.83Å; L750-I752 VanDerWaalsContact C-N 3.35Å; L750-I752 PolarHBondContact O-N 3Å; L750-L753 PolarHBondContact O-N 2.9Å; L750-L753 VanDerWaalsContact O-N 3.13Å; L750-E754 WeakPolarHBondContact O-CG 3.49Å; L750-E754 PolarHBondContact O-N 2.77Å
751	A	94.3	Very high	91.4	Very high	5 Å²	5	56.3 Å²	56.3	4%	0.041	29%	0.292	C	S	.	.	H	α-helix	trans	-59.2	-42.7	176.2	0	0	0	0	0	112.4	V445 K747 I748 L753 E754 L755	V445-A751 HydrophobicContact CG2-CB 3.72Å; K747-A751 PolarHBondContact O-N 2.93Å; K747-A751 VanDerWaalsContact O-N 3.09Å; I748-A751 PolarHBondContact O-N 2.97Å; A751-L753 VanDerWaalsContact C-N 3.33Å; A751-L753 PolarHBondContact O-N 2.92Å; A751-E754 PolarHBondContact O-N 3.26Å; A751-L755 WeakPolarHBondContact O-CB 3.33Å; A751-L755 VanDerWaalsContact O-CG 3.26Å; A751-L755 WeakPolarHBondContact O-CG 2.91Å; A751-L755 PolarHBondContact O-N 3.43Å
752	I	96	Very high	92	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.8	-43.5	175.4	-71	167.4	0	0	0	111.1	I441 T500 F503 I736 I748 S749 L750 L755 Q756 I761	I441-I752 HydrophobicContact CD1-CD1 4.3Å; I441-I752 HydrophobicContact CD1-CG1 3.74Å; T500-I752 HydrophobicContact CG2-CD1 4.35Å; T500-I752 WeakPolarHBondContact OG1-CD1 3.41Å; F503-I752 HydrophobicContact CB-CD1 4.46Å; F503-I752 HydrophobicContact CB-CG2 3.78Å; I736-I752 HydrophobicContact CD1-CD1 4.11Å; I736-I752 HydrophobicContact CG1-CD1 4.43Å; I748-I752 HydrophobicContact CG2-CD1 3.87Å; I748-I752 HydrophobicContact CG2-CG1 4.3Å; I748-I752 VanDerWaalsContact O-CG1 3.32Å; I748-I752 WeakPolarHBondContact O-CG1 3.31Å; I748-I752 PolarHBondContact O-N 3.04Å; S749-I752 PolarHBondContact O-N 3.29Å; L750-I752 VanDerWaalsContact C-N 3.35Å; L750-I752 PolarHBondContact O-N 3Å; I752-L755 PolarHBondContact O-N 3.22Å; I752-Q756 WeakPolarHBondContact O-CG 2.96Å; I752-Q756 PolarHBondContact O-N 3.02Å; I752-I761 HydrophobicContact CG2-CD1 4.38Å
753	L	95.1	Very high	92.5	Very high	77 Å²	77	63.7 Å²	63.7	40%	0.403	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-41.7	178.4	-69	170.8	0	0	0	111.5	K501 S749 L750 A751 L755 Q756 E757	K501-L753 HydrophobicContact CB-CD2 4.49Å; K501-L753 HydrophobicContact CG-CD1 4.43Å; S749-L753 VanDerWaalsContact O-CG 3.3Å; S749-L753 WeakPolarHBondContact O-CG 3.38Å; S749-L753 PolarHBondContact O-N 3.26Å; S749-L753 VanDerWaalsContact O-N 3.1Å; L750-L753 PolarHBondContact O-N 2.9Å; L750-L753 VanDerWaalsContact O-N 3.13Å; A751-L753 VanDerWaalsContact C-N 3.33Å; A751-L753 PolarHBondContact O-N 2.92Å; L753-L755 VanDerWaalsContact C-N 3.34Å; L753-L755 PolarHBondContact O-N 3.19Å; L753-Q756 PolarHBondContact O-N 3.28Å; L753-E757 WeakPolarHBondContact O-CB 3.39Å; L753-E757 PolarHBondContact O-N 3.06Å
754	E	94.3	Very high	93	Very high	102 Å²	102	62.1 Å²	62.1	48%	0.477	30%	0.3	S	S	.	.	H	α-helix	trans	-64.2	-37	175.3	-71	178.3	-174.4	0	0	112.5	L750 A751 R758	L750-E754 WeakPolarHBondContact O-CG 3.49Å; L750-E754 PolarHBondContact O-N 2.77Å; A751-E754 PolarHBondContact O-N 3.26Å; E754-R758 PolarHBondContact O-N 3.46Å; E754-R758 VanDerWaalsContact O-N 3.08Å; E754-R758 PolarHBondContact O-NE 3.35Å; E754-R758 VanDerWaalsContact O-NE 3.1Å
755	L	94.9	Very high	93.3	Very high	3 Å²	3	61.8 Å²	61.8	2%	0.016	30%	0.299	C	S	.	.	H	α-helix	trans	-69.2	-34.8	174	-69.9	171.5	0	0	0	112.2	T440 I441 A751 I752 L753 G759 D760 I761	T440-L755 HydrophobicContact CG2-CD1 4.15Å; T440-L755 HydrophobicContact CG2-CD2 3.5Å; T440-L755 HydrophobicContact CG2-CG 4.48Å; I441-L755 HydrophobicContact CG1-CD1 3.73Å; A751-L755 WeakPolarHBondContact O-CB 3.33Å; A751-L755 VanDerWaalsContact O-CG 3.26Å; A751-L755 WeakPolarHBondContact O-CG 2.91Å; A751-L755 PolarHBondContact O-N 3.43Å; I752-L755 PolarHBondContact O-N 3.22Å; L753-L755 VanDerWaalsContact C-N 3.34Å; L753-L755 PolarHBondContact O-N 3.19Å; L755-G759 PolarHBondContact O-N 3.13Å; L755-D760 HydrophobicContact CD2-CB 3.9Å; L755-D760 WeakPolarHBondContact CD2-OD2 3.42Å; L755-D760 PolarHBondContact O-N 3.12Å; L755-I761 HydrophobicContact CB-CD1 3.84Å; L755-I761 HydrophobicContact CB-CG1 4.09Å
756	Q	93.9	Very high	93.3	Very high	74 Å²	74	60.9 Å²	60.9	35%	0.346	30%	0.3	S	S	.	.	H	α-helix	trans	-68.8	-42.9	173.2	-74.6	-178.6	-23.9	0	0	111.5	P502 F503 I752 L753 R758 G759 I761	P502-Q756 PolarHBondContact O-NE2 3.29Å; F503-Q756 PolarHBondContact O-NE2 3.39Å; F503-Q756 VanDerWaalsContact O-NE2 3.08Å; I752-Q756 WeakPolarHBondContact O-CG 2.96Å; I752-Q756 PolarHBondContact O-N 3.02Å; L753-Q756 PolarHBondContact O-N 3.28Å; Q756-R758 PolarHBondContact O-N 2.9Å; Q756-G759 PolarHBondContact O-N 2.82Å; Q756-G759 VanDerWaalsContact O-N 3.11Å; Q756-I761 HydrophobicContact CG-CD1 3.53Å
757	E	94.1	Very high	93.4	Very high	177 Å²	177	62 Å²	62	83%	0.827	30%	0.3	S	S	*	.	H	α-helix	trans	-64.3	-38.7	179.3	-172.1	174.6	-175.8	0	0	112.1	L753 G759	L753-E757 WeakPolarHBondContact O-CB 3.39Å; L753-E757 PolarHBondContact O-N 3.06Å; E757-G759 VanDerWaalsContact C-N 3.29Å; E757-G759 PolarHBondContact O-N 3.38Å
758	R	94.5	Very high	93.5	Very high	122 Å²	122	59.8 Å²	59.8	46%	0.46	29%	0.289	S	S	.	.	H	α-helix	trans	-72.9	-18.6	173.2	-76.7	178.6	-74.1	171.1	-8.5	114.2	E444 E754 Q756 D760	E444-R758 IonicContact OE1-CZ 3.95Å; E444-R758 IonicContact OE1-NH1 3.92Å; E444-R758 PolarHBondContact OE1-NH1 3.32Å; E444-R758 IonicContact OE1-NH2 3.97Å; E444-R758 PolarHBondContact OE1-NH2 2.91Å; E444-R758 IonicContact OE2-NH2 2.75Å; E444-R758 PolarHBondContact OE2-NH2 3.27Å; E754-R758 PolarHBondContact O-N 3.46Å; E754-R758 VanDerWaalsContact O-N 3.08Å; E754-R758 PolarHBondContact O-NE 3.35Å; E754-R758 VanDerWaalsContact O-NE 3.1Å; Q756-R758 PolarHBondContact O-N 2.9Å; R758-D760 VanDerWaalsContact C-N 3.34Å; R758-D760 IonicContact CZ-OD2 3.58Å; R758-D760 IonicContact NE-OD2 3.08Å; R758-D760 IonicContact NH1-OD2 3.71Å
759	G	93.4	Very high	93.3	Very high	26 Å²	26	59.7 Å²	59.7	27%	0.268	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	12.4	-175.1	0	0	0	0	0	114.4	L755 Q756 E757 I761 Q762 M763	L755-G759 PolarHBondContact O-N 3.13Å; Q756-G759 PolarHBondContact O-N 2.82Å; Q756-G759 VanDerWaalsContact O-N 3.11Å; E757-G759 VanDerWaalsContact C-N 3.29Å; E757-G759 PolarHBondContact O-N 3.38Å; G759-I761 VanDerWaalsContact C-N 3.33Å; G759-I761 PolarHBondContact O-N 3.42Å; G759-Q762 WeakPolarHBondContact O-CB 3.37Å; G759-Q762 PolarHBondContact O-N 2.82Å; G759-Q762 VanDerWaalsContact O-N 3.12Å; G759-M763 PolarHBondContact O-N 3.25Å; G759-M763 VanDerWaalsContact O-N 3.12Å
760	D	94.5	Very high	92.7	Very high	39 Å²	39	64 Å²	64	21%	0.209	31%	0.306	C	S	.	.	H	α-helix	trans	-62.3	-40.1	-178.6	-69.4	-23.8	0	0	0	111.7	L755 R758 Q762 M763 L764	L755-D760 HydrophobicContact CD2-CB 3.9Å; L755-D760 WeakPolarHBondContact CD2-OD2 3.42Å; L755-D760 PolarHBondContact O-N 3.12Å; R758-D760 VanDerWaalsContact C-N 3.34Å; R758-D760 IonicContact CZ-OD2 3.58Å; R758-D760 IonicContact NE-OD2 3.08Å; R758-D760 IonicContact NH1-OD2 3.71Å; D760-Q762 VanDerWaalsContact C-N 3.28Å; D760-Q762 PolarHBondContact O-N 2.98Å; D760-M763 HydrophobicContact CB-CE 4.3Å; D760-M763 WeakPolarHBondContact O-CB 3.47Å; D760-M763 PolarHBondContact O-N 3.44Å; D760-M763 WeakPolarHBondContact OD1-CE 3.45Å; D760-L764 PolarHBondContact O-N 3.2Å
761	I	93.7	Very high	91.8	Very high	14 Å²	14	62.4 Å²	62.4	7%	0.072	30%	0.298	C	S	.	.	H	α-helix	trans	-62.5	-36.3	176.2	-72.4	161.2	0	0	0	111.5	F433 I437 F503 I752 L755 Q756 G759 L764 Y765	F433-I761 HydrophobicContact CZ-CG2 4.18Å; I437-I761 HydrophobicContact CD1-CG1 4.32Å; F503-I761 HydrophobicContact CB-CD1 4.28Å; I752-I761 HydrophobicContact CG2-CD1 4.38Å; L755-I761 HydrophobicContact CB-CD1 3.84Å; L755-I761 HydrophobicContact CB-CG1 4.09Å; Q756-I761 HydrophobicContact CG-CD1 3.53Å; G759-I761 VanDerWaalsContact C-N 3.33Å; G759-I761 PolarHBondContact O-N 3.42Å; I761-L764 PolarHBondContact O-N 2.94Å; I761-Y765 WeakPolarHBondContact O-CB 3.46Å; I761-Y765 PolarHBondContact O-N 3.13Å
762	Q	92.6	Very high	90.1	Very high	102 Å²	102	67.6 Å²	67.6	48%	0.477	33%	0.329	S	S	.	.	H	α-helix	trans	-69.7	-37.9	176.8	-175.3	60.5	42.8	0	0	111.4	G759 D760 Y765 D766	G759-Q762 WeakPolarHBondContact O-CB 3.37Å; G759-Q762 PolarHBondContact O-N 2.82Å; G759-Q762 VanDerWaalsContact O-N 3.12Å; D760-Q762 VanDerWaalsContact C-N 3.28Å; D760-Q762 PolarHBondContact O-N 2.98Å; Q762-Y765 WeakPolarHBondContact O-CB 3.3Å; Q762-Y765 PolarHBondContact O-N 2.97Å; Q762-D766 PolarHBondContact NE2-OD1 2.76Å; Q762-D766 VanDerWaalsContact NE2-OD1 3.16Å; Q762-D766 PolarHBondContact O-N 2.89Å
763	M	93.2	Very high	88.5	Confident	119 Å²	119	74.7 Å²	74.7	59%	0.586	37%	0.367	S	S	*	.	H	α-helix	trans	-63.2	-43.2	174	-67.5	-167.9	-71.5	0	0	111.6	G759 D760 Y765 D766 K767	G759-M763 PolarHBondContact O-N 3.25Å; G759-M763 VanDerWaalsContact O-N 3.12Å; D760-M763 HydrophobicContact CB-CE 4.3Å; D760-M763 WeakPolarHBondContact O-CB 3.47Å; D760-M763 PolarHBondContact O-N 3.44Å; D760-M763 WeakPolarHBondContact OD1-CE 3.45Å; M763-Y765 VanDerWaalsContact C-N 3.34Å; M763-D766 PolarHBondContact O-N 2.93Å; M763-K767 WeakPolarHBondContact O-CB 3.35Å; M763-K767 PolarHBondContact O-N 2.94Å
764	L	93.4	Very high	87	Confident	30 Å²	30	76.2 Å²	76.2	16%	0.157	37%	0.372	C	S	.	.	H	α-helix	trans	-63.2	-40.7	173.4	-69.8	176.8	0	0	0	111.3	F433 D436 I437 D760 I761 D766 K767 W768	F433-L764 HydrophobicContact CD2-CB 3.95Å; F433-L764 HydrophobicContact CE2-CB 3.7Å; D436-L764 HydrophobicContact CB-CD1 4.17Å; D436-L764 HydrophobicContact CB-CD2 3.84Å; I437-L764 HydrophobicContact CG1-CD1 3.68Å; D760-L764 PolarHBondContact O-N 3.2Å; I761-L764 PolarHBondContact O-N 2.94Å; L764-D766 PolarHBondContact O-N 3.37Å; L764-K767 HydrophobicContact CD2-CD 4.43Å; L764-K767 WeakPolarHBondContact O-CB 3.43Å; L764-K767 PolarHBondContact O-N 3Å; L764-W768 PolarHBondContact O-N 3.42Å; L764-W768 VanDerWaalsContact O-N 3.1Å
765	Y	91.9	Very high	85.8	Confident	32 Å²	32	73.2 Å²	73.2	13%	0.125	36%	0.361	C	S	.	.	H	α-helix	trans	-59.7	-48.1	177	-179	-97.5	0	0	0	111.2	M504 I761 Q762 M763 K767 W768 W769	M504-Y765 HydrophobicContact CE-CD2 3.54Å; M504-Y765 HydrophobicContact CE-CE2 4.09Å; I761-Y765 WeakPolarHBondContact O-CB 3.46Å; I761-Y765 PolarHBondContact O-N 3.13Å; Q762-Y765 WeakPolarHBondContact O-CB 3.3Å; Q762-Y765 PolarHBondContact O-N 2.97Å; M763-Y765 VanDerWaalsContact C-N 3.34Å; Y765-K767 VanDerWaalsContact C-N 3.31Å; Y765-K767 PolarHBondContact O-N 3.18Å; Y765-W768 PolarHBondContact O-N 3.38Å; Y765-W769 AromaticContact CD2-CD2 3.8Å; Y765-W769 HydrophobicContact CD2-CD2 3.8Å; Y765-W769 AromaticContact CD2-CE3 3.64Å; Y765-W769 HydrophobicContact CD2-CE3 3.64Å; Y765-W769 HydrophobicContact CD2-CG 4.27Å; Y765-W769 HydrophobicContact CD2-CZ3 4.08Å; Y765-W769 HydrophobicContact CE1-CB 4.21Å; Y765-W769 HydrophobicContact CE1-CG 4.27Å; Y765-W769 HydrophobicContact CE2-CB 4.43Å; Y765-W769 AromaticContact CE2-CD1 3.95Å; Y765-W769 AromaticContact CE2-CD2 3.45Å; Y765-W769 HydrophobicContact CE2-CD2 3.45Å; Y765-W769 VanDerWaalsContact CE2-CD2 3.45Å; Y765-W769 AromaticContact CE2-CE2 3.66Å; Y765-W769 AromaticContact CE2-CE3 3.81Å; Y765-W769 HydrophobicContact CE2-CE3 3.81Å; Y765-W769 AromaticContact CE2-CG 3.71Å; Y765-W769 HydrophobicContact CE2-CG 3.71Å; Y765-W769 HydrophobicContact CE2-CZ2 4.24Å; Y765-W769 HydrophobicContact CE2-CZ3 4.35Å; Y765-W769 AromaticContact CE2-NE1 3.87Å; Y765-W769 HydrophobicContact CG-CE3 4.37Å; Y765-W769 AromaticContact CZ-CD1 3.79Å; Y765-W769 AromaticContact CZ-CD2 3.99Å; Y765-W769 AromaticContact CZ-CG 3.71Å; Y765-W769 WeakPolarHBondContact O-CB 3.44Å; Y765-W769 PolarHBondContact O-N 3.36Å
766	D	90.6	Very high	84.8	Confident	57 Å²	57	75 Å²	75	31%	0.305	37%	0.373	S	S	.	.	H	α-helix	trans	-62.9	-37.6	178.9	-73	-14.5	0	0	0	112	Q762 M763 L764 K770	Q762-D766 PolarHBondContact NE2-OD1 2.76Å; Q762-D766 VanDerWaalsContact NE2-OD1 3.16Å; Q762-D766 PolarHBondContact O-N 2.89Å; M763-D766 PolarHBondContact O-N 2.93Å; L764-D766 PolarHBondContact O-N 3.37Å; D766-K770 HydrophobicContact CB-CD 4.37Å; D766-K770 WeakPolarHBondContact O-CB 3.47Å; D766-K770 PolarHBondContact O-N 3.33Å; D766-K770 WeakPolarHBondContact OD1-CD 3.17Å; D766-K770 VanDerWaalsContact OD1-CE 3.23Å; D766-K770 WeakPolarHBondContact OD1-CE 3.45Å; D766-K770 IonicContact OD1-NZ 3.65Å; D766-K770 PolarHBondContact OD1-NZ 3.39Å; D766-K770 IonicContact OD2-NZ 2.74Å
767	K	90.6	Very high	83.4	Confident	113 Å²	113	77.4 Å²	77.4	49%	0.491	39%	0.393	S	S	.	.	H	α-helix	trans	-58.9	-45.8	174.2	177.5	-171.7	173.7	-167.1	0	112.4	D436 M763 L764 Y765	D436-K767 IonicContact OD2-NZ 3.08Å; D436-K767 PolarHBondContact OD2-NZ 3.36Å; M763-K767 WeakPolarHBondContact O-CB 3.35Å; M763-K767 PolarHBondContact O-N 2.94Å; L764-K767 HydrophobicContact CD2-CD 4.43Å; L764-K767 WeakPolarHBondContact O-CB 3.43Å; L764-K767 PolarHBondContact O-N 3Å; Y765-K767 VanDerWaalsContact C-N 3.31Å; Y765-K767 PolarHBondContact O-N 3.18Å
768	W	90.9	Very high	81.7	Confident	41 Å²	41	73.9 Å²	73.9	16%	0.155	37%	0.372	C	S	.	.	H	α-helix	trans	-88.8	-30.7	-172.8	-71.5	102.7	0	0	0	113.9	M417 Y431 G432 F433 D436 L764 Y765	M417-W768 HydrophobicContact CE-CE3 3.8Å; M417-W768 HydrophobicContact CE-CH2 4.31Å; M417-W768 HydrophobicContact CE-CZ3 3.42Å; M417-W768 VanDerWaalsContact CE-CZ3 3.42Å; Y431-W768 AromaticContact CD2-CH2 3.73Å; Y431-W768 HydrophobicContact CD2-CH2 3.73Å; Y431-W768 AromaticContact CD2-CZ3 3.94Å; Y431-W768 HydrophobicContact CD2-CZ3 3.94Å; Y431-W768 HydrophobicContact CE2-CZ3 4.31Å; G432-W768 VanDerWaalsContact C-CE2 3.44Å; G432-W768 VanDerWaalsContact C-CZ2 3.46Å; G432-W768 VanDerWaalsContact CA-CZ2 3.46Å; F433-W768 HydrophobicContact CB-CB 4.25Å; F433-W768 HydrophobicContact CB-CD2 4.48Å; F433-W768 HydrophobicContact CB-CG 3.88Å; F433-W768 AromaticContact CD2-CD1 3.77Å; F433-W768 HydrophobicContact CD2-CG 4.4Å; D436-W768 WeakPolarHBondContact OD2-CZ2 3.12Å; D436-W768 PolarHBondContact OD2-NE1 2.98Å; L764-W768 PolarHBondContact O-N 3.42Å; L764-W768 VanDerWaalsContact O-N 3.1Å; Y765-W768 PolarHBondContact O-N 3.38Å
769	W	89.1	Confident	79.5	Confident	0 Å²	0	77 Å²	77	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-90.9	-51.1	178.9	-88	-111.1	0	0	0	112.8	P414 Y415 F433 T710 Y714 Q717 Y765 N771	P414-W769 HydrophobicContact CG-CD2 4.28Å; P414-W769 HydrophobicContact CG-CE3 4.07Å; P414-W769 HydrophobicContact CG-CH2 3.38Å; P414-W769 HydrophobicContact CG-CZ2 3.62Å; P414-W769 HydrophobicContact CG-CZ3 3.64Å; Y415-W769 HydrophobicContact CD1-CH2 4.05Å; Y415-W769 AromaticContact CE1-CH2 3.53Å; Y415-W769 HydrophobicContact CE1-CH2 3.53Å; Y415-W769 AromaticContact CE1-CZ2 3.98Å; Y415-W769 HydrophobicContact CE1-CZ2 3.98Å; Y415-W769 AromaticContact CZ-CH2 3.87Å; Y415-W769 AromaticContact CZ-CZ2 3.85Å; F433-W769 HydrophobicContact CB-CH2 4.49Å; F433-W769 HydrophobicContact CB-CZ3 3.93Å; F433-W769 HydrophobicContact CD1-CZ3 4.32Å; F433-W769 HydrophobicContact CD2-CZ3 4.01Å; F433-W769 HydrophobicContact CG-CH2 4.42Å; F433-W769 AromaticContact CG-CZ3 3.83Å; F433-W769 HydrophobicContact CG-CZ3 3.83Å; T710-W769 PolarHBondContact O-NE1 3.44Å; Y714-W769 HydrophobicContact CD2-CD2 4.35Å; Y714-W769 HydrophobicContact CD2-CG 4.32Å; Q717-W769 VanDerWaalsContact OE1-C 3.31Å; Q717-W769 PolarHBondContact OE1-O 3.39Å; Y765-W769 AromaticContact CD2-CD2 3.8Å; Y765-W769 HydrophobicContact CD2-CD2 3.8Å; Y765-W769 AromaticContact CD2-CE3 3.64Å; Y765-W769 HydrophobicContact CD2-CE3 3.64Å; Y765-W769 HydrophobicContact CD2-CG 4.27Å; Y765-W769 HydrophobicContact CD2-CZ3 4.08Å; Y765-W769 HydrophobicContact CE1-CB 4.21Å; Y765-W769 HydrophobicContact CE1-CG 4.27Å; Y765-W769 HydrophobicContact CE2-CB 4.43Å; Y765-W769 AromaticContact CE2-CD1 3.95Å; Y765-W769 AromaticContact CE2-CD2 3.45Å; Y765-W769 HydrophobicContact CE2-CD2 3.45Å; Y765-W769 VanDerWaalsContact CE2-CD2 3.45Å; Y765-W769 AromaticContact CE2-CE2 3.66Å; Y765-W769 AromaticContact CE2-CE3 3.81Å; Y765-W769 HydrophobicContact CE2-CE3 3.81Å; Y765-W769 AromaticContact CE2-CG 3.71Å; Y765-W769 HydrophobicContact CE2-CG 3.71Å; Y765-W769 HydrophobicContact CE2-CZ2 4.24Å; Y765-W769 HydrophobicContact CE2-CZ3 4.35Å; Y765-W769 AromaticContact CE2-NE1 3.87Å; Y765-W769 HydrophobicContact CG-CE3 4.37Å; Y765-W769 AromaticContact CZ-CD1 3.79Å; Y765-W769 AromaticContact CZ-CD2 3.99Å; Y765-W769 AromaticContact CZ-CG 3.71Å; Y765-W769 WeakPolarHBondContact O-CB 3.44Å; Y765-W769 PolarHBondContact O-N 3.36Å; W769-N771 PolarHBondContact O-N 3.01Å
770	K	82.3	Confident	77.1	Confident	104 Å²	104	80.5 Å²	80.5	45%	0.452	40%	0.402	S	S	.	.	S	Bend	trans	-93.1	18.4	-167	-60.5	178.9	-177.8	156	0	114.4	D766 T772	D766-K770 HydrophobicContact CB-CD 4.37Å; D766-K770 WeakPolarHBondContact O-CB 3.47Å; D766-K770 PolarHBondContact O-N 3.33Å; D766-K770 WeakPolarHBondContact OD1-CD 3.17Å; D766-K770 VanDerWaalsContact OD1-CE 3.23Å; D766-K770 WeakPolarHBondContact OD1-CE 3.45Å; D766-K770 IonicContact OD1-NZ 3.65Å; D766-K770 PolarHBondContact OD1-NZ 3.39Å; D766-K770 IonicContact OD2-NZ 2.74Å; K770-T772 PolarHBondContact O-N 3.02Å
771	N	74.1	Confident	74.7	Confident	74 Å²	74	84 Å²	84	40%	0.396	43%	0.425	S	S	.	.			trans	-59.3	125.1	-176	-161.2	1.1	0	0	0	111.3	W769 D773 E774 T775	W769-N771 PolarHBondContact O-N 3.01Å; N771-D773 VanDerWaalsContact C-N 3.26Å; N771-D773 PolarHBondContact O-N 3.45Å; N771-E774 PolarHBondContact O-N 2.04Å; N771-T775 VanDerWaalsContact O-CG2 3.28Å; N771-T775 WeakPolarHBondContact O-CG2 3.26Å; N771-T775 PolarHBondContact O-N 3.18Å; N771-T775 PolarHBondContact O-OG1 3.29Å
772	T	59.4	Low	72.4	Confident	113 Å²	113	88 Å²	88	69%	0.693	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-21.9	-165.6	36.2	0	0	0	0	114.6	K770	K770-T772 PolarHBondContact O-N 3.02Å
773	D	62.9	Low	69.8	Low	149 Å²	149	92.1 Å²	92.1	80%	0.797	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-21.6	-175.8	-63.7	-19	0	0	0	113	N771	N771-D773 VanDerWaalsContact C-N 3.26Å; N771-D773 PolarHBondContact O-N 3.45Å
774	E	63.6	Low	67.2	Low	109 Å²	109	92.8 Å²	92.8	51%	0.509	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-10.5	-176.7	-64.4	-173.1	174.5	0	0	113.7	R718 N771	R718-E774 IonicContact CZ-OE2 3.29Å; R718-E774 VanDerWaalsContact CZ-OE2 3.29Å; R718-E774 IonicContact NE-OE2 3Å; R718-E774 PolarHBondContact NE-OE2 3.28Å; R718-E774 IonicContact NH2-OE2 2.72Å; R718-E774 PolarHBondContact NH2-OE2 2.95Å; N771-E774 PolarHBondContact O-N 2.04Å
775	T	69.3	Low	64.9	Low	39 Å²	39	97.4 Å²	97.4	24%	0.239	51%	0.507	C	S	.	.			trans	-80.3	125.3	-176.7	46.5	0	0	0	0	111	Q717 N771 T777	Q717-T775 HydrophobicContact CB-CG2 4.28Å; Q717-T775 CarbonylContact O-C 3.6Å; Q717-T775 WeakPolarHBondContact O-CA 3.1Å; N771-T775 VanDerWaalsContact O-CG2 3.28Å; N771-T775 WeakPolarHBondContact O-CG2 3.26Å; N771-T775 PolarHBondContact O-N 3.18Å; N771-T775 PolarHBondContact O-OG1 3.29Å; T775-T777 PolarHBondContact O-N 3Å
776	C	73.5	Confident	62.5	Low	41 Å²	41	103.4 Å²	103.4	28%	0.277	53%	0.534	S	S	.	.			trans	-72.5	113.2	173.5	78.4	0	0	0	0	108.1	Q717 R718 C720 R778	Q717-C776 PolarHBondContact O-N 3.47Å; Q717-C776 PolarHBondContact O-SG 3.26Å; R718-C776 WeakPolarHBondContact O-CB 3.42Å; C720-C776 WeakPolarHBondContact CA-SG 3.25Å; C720-C776 HydrophobicContact CB-CB 4.02Å; C720-C776 WeakPolarHBondContact CB-SG 3.39Å; C720-C776 PolarHBondContact N-SG 3.28Å; C720-C776 WeakPolarHBondContact SG-CB 3.49Å; C720-C776 PolarHBondContact SG-O 3.35Å; C720-C776 VanDerWaalsContact SG-O 3.36Å; C720-C776 CovalentContact SG-SG 2.04Å; C720-C776 PolarHBondContact SG-SG 3.44Å; C776-R778 PolarHBondContact O-N 3.27Å
777	T	63.9	Low	60.5	Low	125 Å²	125	105.5 Å²	105.5	77%	0.767	56%	0.559	S	S	*	*			trans	-74.4	98.3	167.3	36.1	0	0	0	0	107.1	T775 K779	T775-T777 PolarHBondContact O-N 3Å; T777-K779 PolarHBondContact O-N 3.15Å
778	R	58.3	Low	58.8	Low	102 Å²	102	105.9 Å²	105.9	39%	0.385	57%	0.566	S	S	.	*			trans	-53.6	112.2	162.5	-161.7	170.6	-174.8	162.3	-2.6	105	C720 T723 C776 N780	C720-R778 PolarHBondContact SG-N 2.86Å; T723-R778 VanDerWaalsContact CG2-NH1 3.25Å; C776-R778 PolarHBondContact O-N 3.27Å; R778-N780 PolarHBondContact O-N 2.91Å
779	K	47.7	Very low	57.3	Low	189 Å²	189	109.3 Å²	109.3	82%	0.822	60%	0.596	S	S	*	*			trans	-61.1	90.9	169.9	-77.3	-177.4	-179.3	175.4	0	105	T777 T781	T777-K779 PolarHBondContact O-N 3.15Å; K779-T781 PolarHBondContact O-N 3.37Å; K779-T781 PolarHBondContact O-OG1 3.44Å
780	N	42.6	Very low	56.1	Low	98 Å²	98	114.3 Å²	114.3	52%	0.524	62%	0.622	S	S	.	*			trans	-66.8	80.7	170	-88.5	-18	0	0	0	105.9	R778 S782 K783	R778-N780 PolarHBondContact O-N 2.91Å; N780-S782 WeakPolarHBondContact CB-OG 3.39Å; N780-S782 PolarHBondContact O-N 3.46Å; N780-K783 PolarHBondContact O-N 3.09Å
781	T	44.1	Very low	55.4	Low	113 Å²	113	111.2 Å²	111.2	69%	0.693	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-7.7	159	14.7	0	0	0	0	111.2	K779 K783	K779-T781 PolarHBondContact O-N 3.37Å; K779-T781 PolarHBondContact O-OG1 3.44Å; T781-K783 VanDerWaalsContact C-N 3.33Å; T781-K783 PolarHBondContact O-N 3.22Å
782	S	45.7	Very low	55.2	Low	97 Å²	97	114 Å²	114	68%	0.678	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-14.6	168.7	57.4	0	0	0	0	115.2	N780	N780-S782 WeakPolarHBondContact CB-OG 3.39Å; N780-S782 PolarHBondContact O-N 3.46Å
783	K	38.4	Very low	55.6	Low	189 Å²	189	115.5 Å²	115.5	82%	0.822	63%	0.634	S	S	*	*	S	Bend	trans	-110.5	1	175.6	-91.3	-172.9	179.5	179.2	0	115.4	N780 T781	N780-K783 PolarHBondContact O-N 3.09Å; T781-K783 VanDerWaalsContact C-N 3.33Å; T781-K783 PolarHBondContact O-N 3.22Å
784	Q	39	Very low	55.8	Low	133 Å²	133	109.5 Å²	109.5	62%	0.621	60%	0.604	S	S	*	*			trans	-104.7	101.7	163.4	-83	-174.6	0.9	0	0	109	K786	Q784-K786 PolarHBondContact O-N 3Å
785	S	44.5	Very low	56.5	Low	128 Å²	128	107.5 Å²	107.5	90%	0.895	60%	0.595	S	S	*	*			trans	-61.6	42.7	163.2	57	0	0	0	0	113	A787	S785-A787 PolarHBondContact O-N 2.67Å
786	K	42.7	Very low	57	Low	158 Å²	158	106.1 Å²	106.1	69%	0.687	59%	0.589	S	S	*	*			trans	-86.3	108.2	161.9	-79.1	-174.4	176.6	179.8	0	105.6	Q784 N788	Q784-K786 PolarHBondContact O-N 3Å; K786-N788 PolarHBondContact O-N 3.15Å
787	A	47	Very low	57.5	Low	100 Å²	100	104.2 Å²	104.2	83%	0.826	58%	0.577	S	S	*	*			trans	-47.2	115	168	0	0	0	0	0	108.2	S785 S789	S785-A787 PolarHBondContact O-N 2.67Å; A787-S789 PolarHBondContact O-N 3.32Å
788	N	55.8	Low	58.6	Low	122 Å²	122	101.8 Å²	101.8	65%	0.652	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-57.6	131.1	174.7	-76.4	-16.4	0	0	0	107.5	K786 L790	K786-N788 PolarHBondContact O-N 3.15Å; N788-L790 PolarHBondContact O-N 3.22Å
789	S	59.5	Low	60	Low	112 Å²	112	102.2 Å²	102.2	78%	0.783	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-60.1	132.1	172.9	51.8	0	0	0	0	108.9	A787 G791	A787-S789 PolarHBondContact O-N 3.32Å; S789-G791 PolarHBondContact O-N 2.77Å; S789-G791 VanDerWaalsContact O-N 3.09Å
790	L	64.4	Low	62	Low	105 Å²	105	97 Å²	97	55%	0.55	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-60.6	116.5	178	-72.9	91.8	0	0	0	109.9	L629 N788 I795	L629-L790 HydrophobicContact CD1-CD2 3.84Å; L629-L790 HydrophobicContact CD2-CD2 4.03Å; L629-L790 HydrophobicContact CG-CD2 4.47Å; N788-L790 PolarHBondContact O-N 3.22Å; L790-I795 HydrophobicContact CB-CD1 4.08Å; L790-I795 HydrophobicContact CD2-CD1 3.78Å; L790-I795 HydrophobicContact CD2-CG1 4.4Å
791	G	66.3	Low	64.2	Low	40 Å²	40	96.1 Å²	96.1	41%	0.412	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-76.4	162.5	177.2	0	0	0	0	0	112.8	S789 E793 S794	S789-G791 PolarHBondContact O-N 2.77Å; S789-G791 VanDerWaalsContact O-N 3.09Å; G791-E793 PolarHBondContact O-N 2.82Å; G791-S794 PolarHBondContact O-N 2.79Å; G791-S794 PolarHBondContact O-OG 2.92Å
792	L	70.1	Confident	66.4	Low	132 Å²	132	95.8 Å²	95.8	69%	0.691	54%	0.542	S	S	*	.	H	α-helix	trans	-59.4	-25.2	173.6	-175.1	65.4	0	0	0	112	S794 G796 F799	L792-S794 PolarHBondContact O-N 3.29Å; L792-G796 WeakPolarHBondContact O-CA 3.44Å; L792-G796 PolarHBondContact O-N 3.01Å; L792-F799 HydrophobicContact CD1-CD2 4.29Å; L792-F799 HydrophobicContact CD1-CE2 4.21Å
793	E	67.3	Low	68.6	Low	144 Å²	144	96 Å²	96	67%	0.673	53%	0.534	S	S	*	.	H	α-helix	trans	-69	-29.5	-176.5	-53.6	-175.3	167.1	0	0	113.2	T520 G791	T520-E793 VanDerWaalsContact OG1-CB 3.28Å; T520-E793 WeakPolarHBondContact OG1-CB 3.31Å; G791-E793 PolarHBondContact O-N 2.82Å
794	S	69.1	Low	71.2	Confident	24 Å²	24	89.4 Å²	89.4	17%	0.168	52%	0.515	C	S	.	.	H	α-helix	trans	-88	-27.1	179.1	61.5	0	0	0	0	113.8	G791 L792	G791-S794 PolarHBondContact O-N 2.79Å; G791-S794 PolarHBondContact O-OG 2.92Å; L792-S794 PolarHBondContact O-N 3.29Å
795	I	77.1	Confident	73.7	Confident	66 Å²	66	85.1 Å²	85.1	34%	0.338	51%	0.506	S	S	.	.	H	α-helix	trans	-104.6	-11.1	-179.3	-62.4	173.9	0	0	0	112.4	L790 G797 V798 F799	L790-I795 HydrophobicContact CB-CD1 4.08Å; L790-I795 HydrophobicContact CD2-CD1 3.78Å; L790-I795 HydrophobicContact CD2-CG1 4.4Å; I795-G797 PolarHBondContact O-N 3.02Å; I795-G797 VanDerWaalsContact O-N 3.08Å; I795-V798 HydrophobicContact CG2-CB 4.33Å; I795-V798 HydrophobicContact CG2-CG2 4.3Å; I795-V798 WeakPolarHBondContact O-CB 3.43Å; I795-V798 PolarHBondContact O-N 3.03Å; I795-F799 HydrophobicContact CG2-CD2 4.41Å; I795-F799 HydrophobicContact CG2-CE2 3.92Å
796	G	80.4	Confident	76.1	Confident	11 Å²	11	84.1 Å²	84.1	11%	0.113	49%	0.489	C	S	.	.	H	α-helix	trans	-52.4	-37.1	-173.5	0	0	0	0	0	114.6	L792 V798 F799 V800	L792-G796 WeakPolarHBondContact O-CA 3.44Å; L792-G796 PolarHBondContact O-N 3.01Å; G796-V798 VanDerWaalsContact C-N 3.26Å; G796-V798 PolarHBondContact O-N 2.86Å; G796-F799 PolarHBondContact O-N 2.85Å; G796-V800 PolarHBondContact O-N 2.79Å
797	G	84.5	Confident	78.5	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.01	48%	0.481	C	S	.	.	H	α-helix	trans	-61	-30	177.1	0	0	0	0	0	114.6	L522 I795 F799 V800 V801	L522-G797 VanDerWaalsContact O-CA 3.23Å; L522-G797 WeakPolarHBondContact O-CA 3.45Å; L522-G797 PolarHBondContact O-N 3.3Å; I795-G797 PolarHBondContact O-N 3.02Å; I795-G797 VanDerWaalsContact O-N 3.08Å; G797-F799 VanDerWaalsContact C-N 3.34Å; G797-F799 PolarHBondContact O-N 2.95Å; G797-V800 PolarHBondContact O-N 2.93Å; G797-V801 WeakPolarHBondContact O-CG2 3.46Å; G797-V801 PolarHBondContact O-N 3.35Å
798	V	87.1	Confident	80.7	Confident	73 Å²	73	80.9 Å²	80.9	44%	0.442	47%	0.468	S	S	.	.	H	α-helix	trans	-65.7	-39.9	177.8	-176.5	0	0	0	0	110.6	F525 I795 G796 V801 L802	F525-V798 HydrophobicContact CB-CG2 4.49Å; F525-V798 HydrophobicContact CD1-CG2 4.05Å; F525-V798 HydrophobicContact CE1-CG2 4.47Å; F525-V798 HydrophobicContact CG-CG2 4.13Å; I795-V798 HydrophobicContact CG2-CB 4.33Å; I795-V798 HydrophobicContact CG2-CG2 4.3Å; I795-V798 WeakPolarHBondContact O-CB 3.43Å; I795-V798 PolarHBondContact O-N 3.03Å; G796-V798 VanDerWaalsContact C-N 3.26Å; G796-V798 PolarHBondContact O-N 2.86Å; V798-V801 PolarHBondContact O-N 3.02Å; V798-L802 PolarHBondContact O-N 3.43Å
799	F	87.5	Confident	82.5	Confident	111 Å²	111	77.9 Å²	77.9	49%	0.487	46%	0.46	S	S	.	.	H	α-helix	trans	-67.3	-37.3	175.7	-66.6	-76	0	0	0	112.1	L792 I795 G796 G797 L802 I803	L792-F799 HydrophobicContact CD1-CD2 4.29Å; L792-F799 HydrophobicContact CD1-CE2 4.21Å; I795-F799 HydrophobicContact CG2-CD2 4.41Å; I795-F799 HydrophobicContact CG2-CE2 3.92Å; G796-F799 PolarHBondContact O-N 2.85Å; G797-F799 VanDerWaalsContact C-N 3.34Å; G797-F799 PolarHBondContact O-N 2.95Å; F799-L802 PolarHBondContact O-N 2.85Å; F799-I803 WeakPolarHBondContact O-CG1 2.85Å; F799-I803 PolarHBondContact O-N 3.18Å
800	V	88.1	Confident	84	Confident	80 Å²	80	75.4 Å²	75.4	49%	0.485	45%	0.446	S	S	.	.	H	α-helix	trans	-63	-45.2	175.7	176.8	0	0	0	0	110.9	G796 G797 L802 I803 A804	G796-V800 PolarHBondContact O-N 2.79Å; G797-V800 PolarHBondContact O-N 2.93Å; V800-L802 VanDerWaalsContact C-N 3.34Å; V800-L802 PolarHBondContact O-N 3.29Å; V800-I803 PolarHBondContact O-N 3.09Å; V800-A804 WeakPolarHBondContact O-CB 3.21Å; V800-A804 PolarHBondContact O-N 3.02Å
801	V	89.4	Confident	85.3	Confident	80 Å²	80	73.8 Å²	73.8	49%	0.485	44%	0.44	S	S	.	.	H	α-helix	trans	-62.6	-40.9	177.1	173	0	0	0	0	111.5	F525 G797 V798 A804 G805	F525-V801 HydrophobicContact CZ-CG2 4.24Å; G797-V801 WeakPolarHBondContact O-CG2 3.46Å; G797-V801 PolarHBondContact O-N 3.35Å; V798-V801 PolarHBondContact O-N 3.02Å; V801-A804 PolarHBondContact O-N 3.34Å; V801-G805 PolarHBondContact O-N 2.85Å
802	L	90.1	Very high	86.5	Confident	106 Å²	106	75.1 Å²	75.1	56%	0.555	44%	0.441	S	S	*	.	H	α-helix	trans	-60.6	-49	176.7	178.9	65.1	0	0	0	112	V798 F799 V800 A804 G805 I806	V798-L802 PolarHBondContact O-N 3.43Å; F799-L802 PolarHBondContact O-N 2.85Å; V800-L802 VanDerWaalsContact C-N 3.34Å; V800-L802 PolarHBondContact O-N 3.29Å; L802-A804 PolarHBondContact O-N 2.88Å; L802-G805 PolarHBondContact O-N 3.36Å; L802-I806 HydrophobicContact CD1-CD1 4.31Å; L802-I806 HydrophobicContact CG-CD1 4.2Å; L802-I806 WeakPolarHBondContact O-CG1 3.4Å; L802-I806 PolarHBondContact O-N 2.97Å
803	I	92.2	Very high	87.6	Confident	102 Å²	102	71.4 Å²	71.4	52%	0.523	43%	0.429	S	S	.	.	H	α-helix	trans	-62.3	-45.2	179.2	-67.8	167.1	0	0	0	110.3	F799 V800 G805 I806 I807	F799-I803 WeakPolarHBondContact O-CG1 2.85Å; F799-I803 PolarHBondContact O-N 3.18Å; V800-I803 PolarHBondContact O-N 3.09Å; I803-G805 VanDerWaalsContact C-N 3.32Å; I803-G805 PolarHBondContact O-N 3.27Å; I803-I806 PolarHBondContact O-N 3.36Å; I803-I807 HydrophobicContact CG2-CD1 3.87Å; I803-I807 WeakPolarHBondContact O-CG1 3.47Å; I803-I807 PolarHBondContact O-N 3.15Å
804	A	92.4	Very high	88.6	Confident	50 Å²	50	69.8 Å²	69.8	41%	0.413	42%	0.42	S	S	.	.	H	α-helix	trans	-59.1	-43.2	176.5	0	0	0	0	0	111.7	V800 V801 L802 I806 I807 V808	V800-A804 WeakPolarHBondContact O-CB 3.21Å; V800-A804 PolarHBondContact O-N 3.02Å; V801-A804 PolarHBondContact O-N 3.34Å; L802-A804 PolarHBondContact O-N 2.88Å; A804-I806 PolarHBondContact O-N 2.74Å; A804-I807 PolarHBondContact O-N 3.43Å; A804-V808 WeakPolarHBondContact O-CG2 3.34Å; A804-V808 PolarHBondContact O-N 2.84Å
805	G	92.5	Very high	89.5	Confident	42 Å²	42	74.8 Å²	74.8	43%	0.433	44%	0.439	S	S	.	.	H	α-helix	trans	-60.7	-42.6	176.8	0	0	0	0	0	113.4	V801 L802 I803 V808 A809	V801-G805 PolarHBondContact O-N 2.85Å; L802-G805 PolarHBondContact O-N 3.36Å; I803-G805 VanDerWaalsContact C-N 3.32Å; I803-G805 PolarHBondContact O-N 3.27Å; G805-V808 PolarHBondContact O-N 3.29Å; G805-A809 WeakPolarHBondContact O-CB 3.46Å; G805-A809 PolarHBondContact O-N 2.82Å
806	I	94.4	Very high	90.2	Very high	107 Å²	107	77.4 Å²	77.4	55%	0.549	45%	0.449	S	S	.	.	H	α-helix	trans	-64.9	-41.9	177	-65.8	166.1	0	0	0	111	L802 I803 A804 A809 A810	L802-I806 HydrophobicContact CD1-CD1 4.31Å; L802-I806 HydrophobicContact CG-CD1 4.2Å; L802-I806 WeakPolarHBondContact O-CG1 3.4Å; L802-I806 PolarHBondContact O-N 2.97Å; I803-I806 PolarHBondContact O-N 3.36Å; A804-I806 PolarHBondContact O-N 2.74Å; I806-A809 PolarHBondContact O-N 3.13Å; I806-A810 WeakPolarHBondContact O-CB 3.29Å; I806-A810 PolarHBondContact O-N 3.29Å
807	I	93.3	Very high	90.4	Very high	100 Å²	100	83.6 Å²	83.6	51%	0.513	47%	0.474	S	S	.	.	H	α-helix	trans	-63	-46.4	177.5	-67.7	167.7	0	0	0	110.4	I803 A804 A809 A810 V811	I803-I807 HydrophobicContact CG2-CD1 3.87Å; I803-I807 WeakPolarHBondContact O-CG1 3.47Å; I803-I807 PolarHBondContact O-N 3.15Å; A804-I807 PolarHBondContact O-N 3.43Å; I807-A809 VanDerWaalsContact C-N 3.34Å; I807-A809 PolarHBondContact O-N 3.19Å; I807-A810 PolarHBondContact O-N 3.38Å; I807-V811 HydrophobicContact CG2-CG2 4.45Å; I807-V811 WeakPolarHBondContact O-CG2 3.46Å; I807-V811 PolarHBondContact O-N 2.85Å
808	V	93.4	Very high	90.4	Very high	91 Å²	91	90.3 Å²	90.3	55%	0.552	50%	0.499	S	S	*	.	H	α-helix	trans	-60.4	-44.9	177.2	172.2	0	0	0	0	110.7	A804 G805 A810 V811 V812	A804-V808 WeakPolarHBondContact O-CG2 3.34Å; A804-V808 PolarHBondContact O-N 2.84Å; G805-V808 PolarHBondContact O-N 3.29Å; V808-A810 VanDerWaalsContact C-N 3.34Å; V808-A810 PolarHBondContact O-N 3.45Å; V808-V811 PolarHBondContact O-N 2.78Å; V808-V812 HydrophobicContact CG1-CG2 4.36Å; V808-V812 WeakPolarHBondContact O-CG2 3.17Å; V808-V812 PolarHBondContact O-N 3.16Å
809	A	93.1	Very high	90.2	Very high	59 Å²	59	94.3 Å²	94.3	49%	0.488	51%	0.507	S	S	.	.	H	α-helix	trans	-60.7	-42	176.7	0	0	0	0	0	112.4	G805 I806 I807 V812 A813	G805-A809 WeakPolarHBondContact O-CB 3.46Å; G805-A809 PolarHBondContact O-N 2.82Å; I806-A809 PolarHBondContact O-N 3.13Å; I807-A809 VanDerWaalsContact C-N 3.34Å; I807-A809 PolarHBondContact O-N 3.19Å; A809-V812 PolarHBondContact O-N 2.91Å; A809-A813 WeakPolarHBondContact O-CB 3.47Å; A809-A813 PolarHBondContact O-N 3.08Å
810	A	92.1	Very high	89.9	Confident	60 Å²	60	93.1 Å²	93.1	50%	0.496	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-39.5	176.2	0	0	0	0	0	112.3	I806 I807 V808 F814	I806-A810 WeakPolarHBondContact O-CB 3.29Å; I806-A810 PolarHBondContact O-N 3.29Å; I807-A810 PolarHBondContact O-N 3.38Å; V808-A810 VanDerWaalsContact C-N 3.34Å; V808-A810 PolarHBondContact O-N 3.45Å; A810-F814 WeakPolarHBondContact O-CB 3.33Å; A810-F814 PolarHBondContact O-N 3.2Å
811	V	91.4	Very high	89.3	Confident	70 Å²	70	95.7 Å²	95.7	42%	0.424	51%	0.511	S	S	.	.	H	α-helix	trans	-65.9	-44.7	175.5	170.3	0	0	0	0	111	I807 V808 F814 F815	I807-V811 HydrophobicContact CG2-CG2 4.45Å; I807-V811 WeakPolarHBondContact O-CG2 3.46Å; I807-V811 PolarHBondContact O-N 2.85Å; V808-V811 PolarHBondContact O-N 2.78Å; V811-F814 WeakPolarHBondContact O-CB 3.14Å; V811-F814 PolarHBondContact O-N 2.84Å; V811-F815 HydrophobicContact CG1-CD2 3.6Å; V811-F815 HydrophobicContact CG1-CE2 3.47Å; V811-F815 VanDerWaalsContact CG1-CE2 3.47Å; V811-F815 WeakPolarHBondContact O-CD2 3.44Å; V811-F815 PolarHBondContact O-N 3.12Å
812	V	91.6	Very high	88.4	Confident	69 Å²	69	100.5 Å²	100.5	42%	0.418	52%	0.52	S	S	.	.	H	α-helix	trans	-61.5	-47.4	175.6	172.6	0	0	0	0	110.6	V808 A809 F814 F815 E816	V808-V812 HydrophobicContact CG1-CG2 4.36Å; V808-V812 WeakPolarHBondContact O-CG2 3.17Å; V808-V812 PolarHBondContact O-N 3.16Å; A809-V812 PolarHBondContact O-N 2.91Å; V812-F814 VanDerWaalsContact C-N 3.28Å; V812-F814 PolarHBondContact O-N 3.32Å; V812-F815 CarbonylContact O-C 3.52Å; V812-F815 PolarHBondContact O-N 2.96Å; V812-F815 VanDerWaalsContact O-N 3.08Å; V812-E816 HydrophobicContact CG1-CG 4.28Å; V812-E816 WeakPolarHBondContact O-CG 3.37Å; V812-E816 PolarHBondContact O-N 3.37Å
813	A	91.7	Very high	87.2	Confident	53 Å²	53	101.9 Å²	101.9	44%	0.438	52%	0.519	S	S	.	.	H	α-helix	trans	-60.2	-37.9	176.4	0	0	0	0	0	112.2	A809 E816 F817	A809-A813 WeakPolarHBondContact O-CB 3.47Å; A809-A813 PolarHBondContact O-N 3.08Å; A813-E816 PolarHBondContact O-N 3.27Å; A813-F817 VanDerWaalsContact O-CB 3.27Å; A813-F817 WeakPolarHBondContact O-CB 3.42Å; A813-F817 PolarHBondContact O-N 2.92Å
814	F	89.9	Confident	85.5	Confident	111 Å²	111	102 Å²	102	49%	0.487	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-43.5	173.4	179.4	-95.7	0	0	0	111.8	A810 V811 V812 F817 W818	A810-F814 WeakPolarHBondContact O-CB 3.33Å; A810-F814 PolarHBondContact O-N 3.2Å; V811-F814 WeakPolarHBondContact O-CB 3.14Å; V811-F814 PolarHBondContact O-N 2.84Å; V812-F814 VanDerWaalsContact C-N 3.28Å; V812-F814 PolarHBondContact O-N 3.32Å; F814-F817 PolarHBondContact O-N 3.35Å; F814-W818 AromaticContact CE1-CE3 3.81Å; F814-W818 HydrophobicContact CE1-CE3 3.81Å; F814-W818 HydrophobicContact CE1-CZ3 4.35Å; F814-W818 AromaticContact CZ-CE3 3.61Å; F814-W818 HydrophobicContact CZ-CE3 3.61Å; F814-W818 AromaticContact CZ-CZ3 3.94Å; F814-W818 HydrophobicContact CZ-CZ3 3.94Å; F814-W818 VanDerWaalsContact O-CB 3.27Å; F814-W818 WeakPolarHBondContact O-CB 3.16Å; F814-W818 PolarHBondContact O-N 3.48Å
815	F	87.9	Confident	83.5	Confident	129 Å²	129	108.7 Å²	108.7	57%	0.566	54%	0.536	S	S	*	.	H	α-helix	trans	-67.3	-39.7	175.6	-82.6	-65.6	0	0	0	112.7	V811 V812 W818 Y819	V811-F815 HydrophobicContact CG1-CD2 3.6Å; V811-F815 HydrophobicContact CG1-CE2 3.47Å; V811-F815 VanDerWaalsContact CG1-CE2 3.47Å; V811-F815 WeakPolarHBondContact O-CD2 3.44Å; V811-F815 PolarHBondContact O-N 3.12Å; V812-F815 CarbonylContact O-C 3.52Å; V812-F815 PolarHBondContact O-N 2.96Å; V812-F815 VanDerWaalsContact O-N 3.08Å; F815-W818 PolarHBondContact O-N 2.92Å; F815-Y819 WeakPolarHBondContact O-CB 3.26Å; F815-Y819 PolarHBondContact O-N 3.45Å
816	E	90.2	Very high	81.6	Confident	120 Å²	120	114.7 Å²	114.7	56%	0.561	55%	0.553	S	S	*	*	H	α-helix	trans	-62	-44.6	174	-75.5	-179.7	173.3	0	0	111	V812 A813 Y819 N820	V812-E816 HydrophobicContact CG1-CG 4.28Å; V812-E816 WeakPolarHBondContact O-CG 3.37Å; V812-E816 PolarHBondContact O-N 3.37Å; A813-E816 PolarHBondContact O-N 3.27Å; E816-Y819 PolarHBondContact O-N 3.09Å; E816-N820 VanDerWaalsContact O-CB 3.31Å; E816-N820 WeakPolarHBondContact O-CB 3.49Å; E816-N820 PolarHBondContact O-N 3.42Å
817	F	85.2	Confident	79.4	Confident	142 Å²	142	112.4 Å²	112.4	62%	0.623	55%	0.55	S	S	*	*	H	α-helix	trans	-62	-46.6	174.4	-179.8	-99.3	0	0	0	111.2	A813 F814 Y819 F821	A813-F817 VanDerWaalsContact O-CB 3.27Å; A813-F817 WeakPolarHBondContact O-CB 3.42Å; A813-F817 PolarHBondContact O-N 2.92Å; F814-F817 PolarHBondContact O-N 3.35Å; F817-Y819 PolarHBondContact O-N 2.9Å; F817-F821 WeakPolarHBondContact O-CB 3.48Å; F817-F821 PolarHBondContact O-N 3.38Å
818	W	84.6	Confident	76.7	Confident	141 Å²	141	113.5 Å²	113.5	53%	0.534	56%	0.562	S	S	.	*	H	α-helix	trans	-62.2	-43.9	177.8	-173.3	-69.9	0	0	0	112.1	F814 F815 F821 R822	F814-W818 AromaticContact CE1-CE3 3.81Å; F814-W818 HydrophobicContact CE1-CE3 3.81Å; F814-W818 HydrophobicContact CE1-CZ3 4.35Å; F814-W818 AromaticContact CZ-CE3 3.61Å; F814-W818 HydrophobicContact CZ-CE3 3.61Å; F814-W818 AromaticContact CZ-CZ3 3.94Å; F814-W818 HydrophobicContact CZ-CZ3 3.94Å; F814-W818 VanDerWaalsContact O-CB 3.27Å; F814-W818 WeakPolarHBondContact O-CB 3.16Å; F814-W818 PolarHBondContact O-N 3.48Å; F815-W818 PolarHBondContact O-N 2.92Å; W818-F821 PolarHBondContact O-N 3.14Å; W818-R822 PolarHBondContact O-N 3.44Å
819	Y	83.7	Confident	74	Confident	157 Å²	157	114.1 Å²	114.1	62%	0.616	57%	0.568	S	S	*	*	H	α-helix	trans	-66.7	-48.1	179.8	-174.4	-94.4	0	0	0	111.2	F815 E816 F817 F821 R822 Y823	F815-Y819 WeakPolarHBondContact O-CB 3.26Å; F815-Y819 PolarHBondContact O-N 3.45Å; E816-Y819 PolarHBondContact O-N 3.09Å; F817-Y819 PolarHBondContact O-N 2.9Å; Y819-F821 VanDerWaalsContact C-N 3.34Å; Y819-F821 PolarHBondContact O-N 3.49Å; Y819-R822 PolarHBondContact O-N 3.24Å; Y819-Y823 WeakPolarHBondContact O-CB 3.49Å; Y819-Y823 PolarHBondContact O-N 2.6Å
820	N	80.1	Confident	71.5	Confident	87 Å²	87	117.2 Å²	117.2	47%	0.465	59%	0.586	S	S	.	*	H	α-helix	trans	-65.9	-34.5	175.3	-89.2	-33.6	0	0	0	112.7	E816 Y823 N824	E816-N820 VanDerWaalsContact O-CB 3.31Å; E816-N820 WeakPolarHBondContact O-CB 3.49Å; E816-N820 PolarHBondContact O-N 3.42Å; N820-Y823 PolarHBondContact O-N 3.26Å; N820-N824 VanDerWaalsContact O-CB 3.26Å; N820-N824 WeakPolarHBondContact O-CB 3.49Å; N820-N824 PolarHBondContact O-N 2.88Å; N820-N824 PolarHBondContact O-ND2 3.13Å
821	F	75.1	Confident	68.6	Low	134 Å²	134	122.4 Å²	122.4	59%	0.588	60%	0.6	S	S	*	*	H	α-helix	trans	-65.3	-40.5	175.4	-174.5	-96.9	0	0	0	111.5	F817 W818 Y819 Y825	F817-F821 WeakPolarHBondContact O-CB 3.48Å; F817-F821 PolarHBondContact O-N 3.38Å; W818-F821 PolarHBondContact O-N 3.14Å; Y819-F821 VanDerWaalsContact C-N 3.34Å; Y819-F821 PolarHBondContact O-N 3.49Å; F821-Y825 PolarHBondContact O-N 3.16Å
822	R	70.9	Confident	66	Low	180 Å²	180	124.6 Å²	124.6	68%	0.679	62%	0.618	S	S	*	*	H	α-helix	trans	-69.5	-44.3	172.9	-101.4	-165.1	173.7	-171.5	-1.7	112.9	W818 Y819 Y825	W818-R822 PolarHBondContact O-N 3.44Å; Y819-R822 PolarHBondContact O-N 3.24Å; R822-Y825 WeakPolarHBondContact O-CB 3.34Å; R822-Y825 PolarHBondContact O-N 2.74Å
823	Y	65.6	Low	63.3	Low	136 Å²	136	126.8 Å²	126.8	53%	0.533	63%	0.631	S	S	.	*	H	α-helix	trans	-68.2	-40.4	-176.6	-166.1	-95.1	0	0	0	112.4	Y819 N820 Y825 E826 A827	Y819-Y823 WeakPolarHBondContact O-CB 3.49Å; Y819-Y823 PolarHBondContact O-N 2.6Å; N820-Y823 PolarHBondContact O-N 3.26Å; Y823-Y825 VanDerWaalsContact C-N 3.26Å; Y823-Y825 PolarHBondContact O-N 3.36Å; Y823-E826 PolarHBondContact O-N 3.29Å; Y823-A827 PolarHBondContact O-N 3.19Å
824	N	56.2	Low	60.7	Low	103 Å²	103	129.5 Å²	129.5	55%	0.551	64%	0.642	S	S	*	*	H	α-helix	trans	-73.6	-14.6	175.6	-72	-33.6	0	0	0	113.7	N820 E826	N820-N824 VanDerWaalsContact O-CB 3.26Å; N820-N824 WeakPolarHBondContact O-CB 3.49Å; N820-N824 PolarHBondContact O-N 2.88Å; N820-N824 PolarHBondContact O-ND2 3.13Å; N824-E826 VanDerWaalsContact C-N 3.34Å
825	Y	51.3	Low	57.9	Low	191 Å²	191	131.6 Å²	131.6	75%	0.749	66%	0.659	S	S	*	*	H	α-helix	trans	-74.6	-26.3	170.1	-152	-92	0	0	0	112	F821 R822 Y823	F821-Y825 PolarHBondContact O-N 3.16Å; R822-Y825 WeakPolarHBondContact O-CB 3.34Å; R822-Y825 PolarHBondContact O-N 2.74Å; Y823-Y825 VanDerWaalsContact C-N 3.26Å; Y823-Y825 PolarHBondContact O-N 3.36Å
826	E	51.1	Low	55.1	Low	169 Å²	169	132.2 Å²	132.2	79%	0.79	67%	0.668	S	S	*	*	H	α-helix	trans	-89.1	-15.8	176.6	-73	179	168.3	0	0	113.3	Y823 N824	Y823-E826 PolarHBondContact O-N 3.29Å; N824-E826 VanDerWaalsContact C-N 3.34Å
827	A	48.9	Very low	52.4	Low	59 Å²	59	136.5 Å²	136.5	49%	0.488	69%	0.685	S	S	.	*	S	Bend	trans	-101.2	28.3	-175.2	0	0	0	0	0	115.5	Y823 P829	Y823-A827 PolarHBondContact O-N 3.19Å; A827-P829 WeakPolarHBondContact O-CD 3.14Å
828	T	35.8	Very low	49.6	Very low	122 Å²	122	140.2 Å²	140.2	75%	0.748	70%	0.696	S	S	*	*			trans	-110	89.8	164.9	19.8	0	0	0	0	111.3
829	P	37.8	Very low	47.2	Very low	105 Å²	105	141.1 Å²	141.1	68%	0.682	71%	0.711	S	S	*	*			trans	-78.8	117.3	155.3	30	-24.1	0	0	0	108	A827 Q831	A827-P829 WeakPolarHBondContact O-CD 3.14Å; P829-Q831 PolarHBondContact O-N 3.29Å
830	S	39.7	Very low	44.8	Very low	124 Å²	124	141.8 Å²	141.8	87%	0.867	72%	0.72	S	S	*	*			trans	-57.3	100.1	166.7	49.8	0	0	0	0	110
831	Q	32.6	Very low	42.5	Very low	168 Å²	168	145.2 Å²	145.2	79%	0.785	74%	0.738	S	S	*	*			trans	-115	103.7	166.6	-106.4	-179.6	-7.6	0	0	110	P829 V833	P829-Q831 PolarHBondContact O-N 3.29Å; Q831-V833 PolarHBondContact O-N 2.76Å
832	S	35.6	Very low	40.5	Very low	116 Å²	116	142.2 Å²	142.2	81%	0.811	75%	0.745	S	S	*	*			trans	-57.7	116	160.6	50.6	0	0	0	0	109.8
833	V	36	Very low	38.8	Very low	115 Å²	115	141.6 Å²	141.6	70%	0.697	75%	0.754	S	S	*	*			trans	-122.9	105.1	164.2	-178.4	0	0	0	0	108.6	Q831	Q831-V833 PolarHBondContact O-N 2.76Å
834	V	35.8	Very low	37	Very low	111 Å²	111	143.2 Å²	143.2	67%	0.673	77%	0.771	S	S	*	*			trans	-56.9	131.5	163.6	171.8	0	0	0	0	108.7
835	N	32.8	Very low	35.8	Very low	154 Å²	154	147.3 Å²	147.3	82%	0.824	79%	0.787	S	S	*	*			trans	-136.7	102.2	156.6	-94.5	-27.9	0	0	0	109.8
836	N	29.2	Very low	34.6	Very low	142 Å²	142	143.7 Å²	143.7	76%	0.759	79%	0.789	S	S	*	*			trans	-69.6	132.9	164.3	-76.8	-28.8	0	0	0	109.5
837	K	32.2	Very low	33.7	Very low	211 Å²	211	144.2 Å²	144.2	92%	0.917	79%	0.791	S	S	*	*			trans	-143.6	129.7	147.5	-107.6	178.2	-176.2	177.6	0	109.9
838	Y	27.7	Very low	32.6	Very low	220 Å²	220	153 Å²	153	86%	0.863	81%	0.812	S	S	*	*			trans	-55.7	145.2	-173.6	-83.9	-101.9	0	0	0	114.2
839	N	32.4	Very low	32.3	Very low	159 Å²	159	154 Å²	154	85%	0.85	81%	0.813	S	S	*	*			trans	-150.4	149.6	130.9	-105.5	-11	0	0	0	111.9
840	Q	33.3	Very low	31.8	Very low	171 Å²	171	159.5 Å²	159.5	80%	0.799	82%	0.821	S	S	*	*			trans	-62.5	157.4	-172.9	-94.6	154.5	-63.1	0	0	114.7
841	D	32.9	Very low	31.5	Very low	159 Å²	159	159.6 Å²	159.6	85%	0.85	82%	0.817	S	S	*	*			trans	90	106.9	167.2	-55.2	-22	0	0	0	115.8
842	G	33.2	Very low	31.7	Very low	71 Å²	71	156.4 Å²	156.4	73%	0.732	81%	0.811	S	S	*	*			trans	-74.1	146.6	-176.9	0	0	0	0	0	113.2
843	I	34.2	Very low	31.9	Very low	168 Å²	168	156.8 Å²	156.8	86%	0.862	81%	0.811	S	S	*	*				-172.8	134.7	114.2	-87.5	150.8	0	0	0	105.9
844	L	27.4	Very low	32	Very low	170 Å²	170	159.5 Å²	159.5	89%	0.89	82%	0.821	S	S	*	*			trans	-80.9	111.2	-178.8	-122.9	130.3	0	0	0	109
845	E	31.6	Very low	32.4	Very low	189 Å²	189	165 Å²	165	88%	0.883	83%	0.83	S	S	*	*			trans	-133.8	124.2	155.9	-98.3	-176.7	167.3	0	0	109.3
846	S	27	Very low	33.3	Very low	115 Å²	115	161.1 Å²	161.1	80%	0.804	82%	0.815	S	S	*	*			trans	-88.3	112.1	-176.1	60.6	0	0	0	0	110.8
847	E	31.2	Very low	34.2	Very low	179 Å²	179	160.9 Å²	160.9	84%	0.836	81%	0.807	S	S	*	*			trans	-111.3	113.4	162.7	-101.9	-173.9	158.1	0	0	110.4	N849	E847-N849 PolarHBondContact O-N 3.13Å
848	R	27	Very low	34.8	Very low	245 Å²	245	160.1 Å²	160.1	93%	0.925	80%	0.799	S	S	*	*			trans	-78.9	106	170.4	-94	-175.7	-90.5	-175	-7.9	108.6
849	N	29.7	Very low	36.3	Very low	143 Å²	143	153.9 Å²	153.9	77%	0.765	78%	0.779	S	S	*	*			trans	-106	112	162.1	-82.9	-27.9	0	0	0	110.1	E847	E847-N849 PolarHBondContact O-N 3.13Å
850	Y	27.3	Very low	37.3	Very low	219 Å²	219	152.4 Å²	152.4	86%	0.859	77%	0.767	S	S	*	*			trans	-87.2	110.6	177.6	-169.1	-93.2	0	0	0	108.3
851	T	33.2	Very low	38.5	Very low	127 Å²	127	147.1 Å²	147.1	78%	0.779	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-97.7	125.3	170.6	47.6	0	0	0	0	110
852	P	35.6	Very low	39.4	Very low	100 Å²	100	142.4 Å²	142.4	65%	0.649	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-75.7	160.8	178.5	31.8	-32.6	0	0	0	111.7
853	P	39.9	Very low	40.4	Very low	124 Å²	124	145.3 Å²	145.3	81%	0.805	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-74.2	144.4	-169.4	30	-33.8	0	0	0	113.1	R855	P853-R855 PolarHBondContact O-N 3.4Å
854	D	39.4	Very low	41.2	Very low	172 Å²	172	143 Å²	143	92%	0.92	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-58.3	126.8	179.6	-83.4	-40.8	0	0	0	112.6
855	R	43	Very low	42.5	Very low	228 Å²	228	140.7 Å²	140.7	86%	0.86	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-75.5	144.4	173.9	-77.2	-176.7	172.7	-167.6	-1.6	111.1	P853	P853-R855 PolarHBondContact O-N 3.4Å
856	S	51	Low	43.4	Very low	72 Å²	72	141.4 Å²	141.4	50%	0.503	69%	0.69	S	S	.	*	P	Polyproline II helix	trans	-78.1	136	-177	57.1	0	0	0	0	113.6	W858 I859	S856-W858 PolarHBondContact O-N 3.49Å; S856-I859 PolarHBondContact O-N 3.06Å; S856-I859 VanDerWaalsContact O-N 3.15Å
857	F	49.2	Very low	44.4	Very low	136 Å²	136	143.7 Å²	143.7	60%	0.596	68%	0.682	S	S	*	*	H	α-helix	trans	-49.2	-23.1	179.2	-178	-109.9	0	0	0	115.8	I861	F857-I861 HydrophobicContact CD1-CD1 3.98Å; F857-I861 HydrophobicContact CE1-CD1 3.5Å; F857-I861 HydrophobicContact CZ-CD1 3.91Å; F857-I861 PolarHBondContact O-N 3.21Å
858	W	45.2	Very low	45.3	Very low	195 Å²	195	138.4 Å²	138.4	74%	0.739	67%	0.669	S	S	*	*	H	α-helix	trans	-77.9	-21.1	-178.2	-71.9	99.5	0	0	0	114.2	S856 A862	S856-W858 PolarHBondContact O-N 3.49Å; W858-A862 PolarHBondContact O-N 2.95Å
859	I	57.9	Low	46.3	Very low	89 Å²	89	131.8 Å²	131.8	46%	0.456	66%	0.66	S	S	.	*	H	α-helix	trans	-75.3	-33.5	174.2	-65.8	172.3	0	0	0	110.5	S856 A862 E863	S856-I859 PolarHBondContact O-N 3.06Å; S856-I859 VanDerWaalsContact O-N 3.15Å; I859-A862 PolarHBondContact O-N 3.15Å; I859-E863 PolarHBondContact O-N 3.41Å
860	E	53.5	Low	47.1	Very low	128 Å²	128	135.7 Å²	135.7	60%	0.598	67%	0.665	S	S	*	*	H	α-helix	trans	-68.4	-38.8	175.5	-82.3	179.9	155.1	0	0	112.5	E863 E864	E860-E863 PolarHBondContact O-N 2.87Å; E860-E864 WeakPolarHBondContact O-CB 3.28Å; E860-E864 WeakPolarHBondContact O-CG 3.08Å; E860-E864 PolarHBondContact O-N 3.32Å
861	I	59.1	Low	47.7	Very low	61 Å²	61	129 Å²	129	31%	0.313	65%	0.648	S	S	.	*	H	α-helix	trans	-69.4	-36.4	177.1	-67.2	175.6	0	0	0	111.5	F857 E863 E864 L865	F857-I861 HydrophobicContact CD1-CD1 3.98Å; F857-I861 HydrophobicContact CE1-CD1 3.5Å; F857-I861 HydrophobicContact CZ-CD1 3.91Å; F857-I861 PolarHBondContact O-N 3.21Å; I861-E863 VanDerWaalsContact C-N 3.34Å; I861-E864 PolarHBondContact O-N 3.2Å; I861-L865 HydrophobicContact CG2-CD1 4.07Å; I861-L865 PolarHBondContact O-N 3.5Å
862	A	52.1	Low	48.2	Very low	60 Å²	60	131.8 Å²	131.8	50%	0.496	66%	0.655	S	S	.	*	H	α-helix	trans	-67.1	-35	177.3	0	0	0	0	0	112.3	W858 I859 R866	W858-A862 PolarHBondContact O-N 2.95Å; I859-A862 PolarHBondContact O-N 3.15Å; A862-R866 WeakPolarHBondContact O-CB 3.46Å; A862-R866 PolarHBondContact O-N 3.11Å
863	E	53.1	Low	48.3	Very low	131 Å²	131	134.1 Å²	134.1	61%	0.612	66%	0.662	S	S	*	*	H	α-helix	trans	-75.1	-35.1	173.4	-74.7	-174.8	159.9	0	0	112.4	I859 E860 I861 R866 Y867	I859-E863 PolarHBondContact O-N 3.41Å; E860-E863 PolarHBondContact O-N 2.87Å; I861-E863 VanDerWaalsContact C-N 3.34Å; E863-R866 PolarHBondContact O-N 3.37Å; E863-Y867 WeakPolarHBondContact O-CB 3.36Å; E863-Y867 PolarHBondContact O-N 2.85Å
864	E	51.6	Low	48	Very low	120 Å²	120	137.4 Å²	137.4	56%	0.561	66%	0.664	S	S	*	*	H	α-helix	trans	-68.2	-38.8	175.2	-78.5	-72.3	163	0	0	113	E860 I861 R866 Y867 A868	E860-E864 WeakPolarHBondContact O-CB 3.28Å; E860-E864 WeakPolarHBondContact O-CG 3.08Å; E860-E864 PolarHBondContact O-N 3.32Å; I861-E864 PolarHBondContact O-N 3.2Å; E864-R866 VanDerWaalsContact C-N 3.33Å; E864-Y867 PolarHBondContact O-N 3.11Å; E864-A868 VanDerWaalsContact O-CB 3.31Å; E864-A868 WeakPolarHBondContact O-CB 3.13Å; E864-A868 PolarHBondContact O-N 3.15Å
865	L	54.6	Low	48	Very low	122 Å²	122	138.1 Å²	138.1	64%	0.639	66%	0.662	S	S	*	*	H	α-helix	trans	-67	-35.4	172.8	-80	166.4	0	0	0	111.9	I861 Y867 S869	I861-L865 HydrophobicContact CG2-CD1 4.07Å; I861-L865 PolarHBondContact O-N 3.5Å; L865-Y867 VanDerWaalsContact C-N 3.34Å; L865-S869 WeakPolarHBondContact O-CB 3.2Å; L865-S869 PolarHBondContact O-N 2.91Å; L865-S869 VanDerWaalsContact O-N 3.14Å
866	R	50.4	Low	47.8	Very low	203 Å²	203	137.2 Å²	137.2	77%	0.766	66%	0.664	S	S	*	*	H	α-helix	trans	-69.6	-31.7	174.2	-169.5	176.2	172.7	177.6	-2.5	112	A862 E863 E864	A862-R866 WeakPolarHBondContact O-CB 3.46Å; A862-R866 PolarHBondContact O-N 3.11Å; E863-R866 PolarHBondContact O-N 3.37Å; E864-R866 VanDerWaalsContact C-N 3.33Å
867	Y	47.9	Very low	47.1	Very low	163 Å²	163	145.1 Å²	145.1	64%	0.639	68%	0.683	S	S	*	*	H	α-helix	trans	-78.3	-37	175.6	-159	-96.3	0	0	0	112.5	E863 E864 L865 S869 W870	E863-Y867 WeakPolarHBondContact O-CB 3.36Å; E863-Y867 PolarHBondContact O-N 2.85Å; E864-Y867 PolarHBondContact O-N 3.11Å; L865-Y867 VanDerWaalsContact C-N 3.34Å; Y867-S869 VanDerWaalsContact C-N 3.33Å; Y867-S869 PolarHBondContact O-N 2.85Å; Y867-W870 PolarHBondContact O-N 3.38Å
868	A	50.8	Low	46.6	Very low	69 Å²	69	144.4 Å²	144.4	57%	0.57	69%	0.692	S	S	*	*	H	α-helix	trans	-66.7	-31.8	175.2	0	0	0	0	0	112.8	E864 W870	E864-A868 VanDerWaalsContact O-CB 3.31Å; E864-A868 WeakPolarHBondContact O-CB 3.13Å; E864-A868 PolarHBondContact O-N 3.15Å; A868-W870 VanDerWaalsContact C-N 3.27Å; A868-W870 PolarHBondContact O-N 3.34Å
869	S	48	Very low	46.1	Very low	106 Å²	106	139.6 Å²	139.6	74%	0.741	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-17.1	175.8	176.6	0	0	0	0	114.2	L865 Y867	L865-S869 WeakPolarHBondContact O-CB 3.2Å; L865-S869 PolarHBondContact O-N 2.91Å; L865-S869 VanDerWaalsContact O-N 3.14Å; Y867-S869 VanDerWaalsContact C-N 3.33Å; Y867-S869 PolarHBondContact O-N 2.85Å
870	W	46.9	Very low	44.9	Very low	225 Å²	225	143.5 Å²	143.5	85%	0.852	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	-4.1	-169.9	-146.8	63.6	0	0	0	114.6	Y867 A868	Y867-W870 PolarHBondContact O-N 3.38Å; A868-W870 VanDerWaalsContact C-N 3.27Å; A868-W870 PolarHBondContact O-N 3.34Å
871	C	38.5	Very low	44	Very low	77 Å²	77	143.5 Å²	143.5	52%	0.52	72%	0.723	S	S	.	*			trans	-125.5	67.6	-171.3	-81.7	0	0	0	0	113.8
872	M	45.4	Very low	42.8	Very low	186 Å²	186	152.1 Å²	152.1	92%	0.916	75%	0.752	S	S	*	*			trans	-96.5	56.1	163.2	-84.4	-83	-87.2	0	0	111
873	N	37.6	Very low	41.8	Very low	150 Å²	150	155.9 Å²	155.9	80%	0.802	77%	0.769	S	S	*	*	S	Bend	trans	-175.8	121.6	149.9	-113	-34.1	0	0	0	113.2
874	K	33.4	Very low	40.8	Very low	192 Å²	192	155.4 Å²	155.4	84%	0.835	78%	0.779	S	S	*	*			trans	73.9	105.8	162.8	-66.9	-172.8	176.7	-179.6	0	120.9
875	Q	38.8	Very low	40.2	Very low	188 Å²	188	155.5 Å²	155.5	88%	0.879	79%	0.793	S	S	*	*			trans	24.2	101.5	133.2	-73	178.9	-24.7	0	0	120.5
876	K	38.1	Very low	39.2	Very low	209 Å²	209	158.3 Å²	158.3	91%	0.909	80%	0.8	S	S	*	*				168.9	131.1	108.1	-93.9	178.7	179.4	178.5	0	109.9
877	R	37	Very low	38.3	Very low	237 Å²	237	154.3 Å²	154.3	89%	0.894	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-94.5	134.9	-176.2	-159.6	-176.3	-159.6	-175.9	5.8	110.3
878	P	38.2	Very low	37.5	Very low	121 Å²	121	153.5 Å²	153.5	79%	0.786	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-84.5	139.8	162.8	15	-1.4	0	0	0	110.9
879	A	35.1	Very low	36.9	Very low	95 Å²	95	157.4 Å²	157.4	79%	0.785	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-81.3	134.8	-175.3	0	0	0	0	0	112.4
880	L	32.8	Very low	36.3	Very low	170 Å²	170	158.2 Å²	158.2	89%	0.89	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-84.1	118.4	171	-100.9	136.3	0	0	0	110.3
881	T	34.9	Very low	35.6	Very low	128 Å²	128	157.7 Å²	157.7	79%	0.785	83%	0.83	S	S	*	*			trans	-88.8	107.4	173.9	47.2	0	0	0	0	110.4
882	R	34.1	Very low	35.3	Very low	242 Å²	242	157.5 Å²	157.5	91%	0.913	84%	0.841	S	S	*	*			trans	-115.9	110	155.4	-90.8	-173.2	173.2	174.8	-0	108.5
883	T	31.7	Very low	34.6	Very low	140 Å²	140	157.8 Å²	157.8	86%	0.859	84%	0.84	S	S	*	*			trans	-86.5	115	171.7	43.9	0	0	0	0	109.5
884	C	31.3	Very low	34.3	Very low	120 Å²	120	161.8 Å²	161.8	81%	0.811	84%	0.844	S	S	*	*			trans	-84.1	124.6	167.8	-168.1	0	0	0	0	108.7	K886	C884-K886 PolarHBondContact O-N 3.46Å
885	S	38.6	Very low	34.2	Very low	122 Å²	122	159.3 Å²	159.3	85%	0.853	84%	0.838	S	S	*	*	S	Bend	trans	-86.9	11.7	-167.5	53.3	0	0	0	0	115.6
886	K	34.8	Very low	34	Very low	182 Å²	182	157.2 Å²	157.2	79%	0.791	83%	0.833	S	S	*	*	S	Bend	trans	-145.4	99	171.6	-79.7	-176.8	176.9	173.7	0	110.1	C884	C884-K886 PolarHBondContact O-N 3.46Å
887	C	30.5	Very low	33.8	Very low	119 Å²	119	156.6 Å²	156.6	80%	0.804	83%	0.831	S	S	*	*			trans	158.8	82.6	147.6	-85.4	0	0	0	0	110.1
888	T	31.4	Very low	33.8	Very low	146 Å²	146	156.9 Å²	156.9	90%	0.896	85%	0.848	S	S	*	*			trans	-88.1	115.1	159.7	42.2	0	0	0	0	108.7
889	I	37.7	Very low	33.6	Very low	150 Å²	150	158.7 Å²	158.7	77%	0.769	85%	0.852	S	S	*	*			trans	-110.9	127.4	169.2	-57.8	172.8	0	0	0	107.7
890	P	35.3	Very low	33.5	Very low	123 Å²	123	162 Å²	162	80%	0.799	86%	0.855	S	S	*	*			trans	-80.7	140.4	172.2	-6.8	24.4	0	0	0	112.2
891	K	32.2	Very low	33.6	Very low	215 Å²	215	161.6 Å²	161.6	94%	0.935	85%	0.853	S	S	*	*			trans	-67.2	150.3	-174.5	-66.1	169.4	172.9	174.3	0	114.5
892	G	31.6	Very low	33.5	Very low	73 Å²	73	163.5 Å²	163.5	75%	0.753	86%	0.857	S	S	*	*			trans	178.7	125.3	155.3	0	0	0	0	0	115.6
893	Q	31.6	Very low	33.4	Very low	192 Å²	192	158.6 Å²	158.6	90%	0.897	85%	0.854	S	S	*	*			trans	86.6	88.1	158.1	-70.1	-180	-25.2	0	0	121.5
894	R	31	Very low	33.6	Very low	233 Å²	233	159.9 Å²	159.9	88%	0.879	85%	0.853	S	S	*	*				34	123.5	105.4	-125.3	-172.7	-147.7	-173.7	6.5	118.2
895	I	31.8	Very low	33.7	Very low	140 Å²	140	162.7 Å²	162.7	72%	0.718	86%	0.856	S	S	*	*				145.5	124.4	120.3	-73.1	156.2	0	0	0	112.6
896	N	35.2	Very low	33.3	Very low	145 Å²	145	165.8 Å²	165.8	78%	0.775	86%	0.857	S	S	*	*			trans	21.1	136.1	148.2	-54.9	-11.6	0	0	0	121.5
897	K	32.6	Very low	33.2	Very low	195 Å²	195	164.5 Å²	164.5	85%	0.848	86%	0.862	S	S	*	*				-169.7	127.2	120.8	-98	160.9	-178.2	-175.4	0	107.1
898	L	37.8	Very low	33.5	Very low	243 Å²	243	168.6 Å²	168.6	100%	1.272	87%	0.867	S	S	*	*				54.8	0	94.3	-102.6	164.2	0	0	0	112

Retrieved 898 of 898 residues in 1515.2 ms (Link to these results)

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