A0A3Q0KG68_SCHMA Loading...

MAM domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KG68, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 908 aa.

						>A0A3Q0KG68_SCHMA|A0A3Q0KG68
MHTNRCLVNVILITLVSVNAQNEFNQIDSPTIIDSLTFPLIIDDLNVENEQLKFPIKEQITPKNVYHTEPISVRRRNSNQSAYKSKYFDKPTIGNEFNHSVFDVGESLCPDVYCFAKRLSSSDELTFDCKSQSFEVTSEDTMIDCHYWHVPSPGADSNQQRQSKQHGKGYDLRIVLKPSTISADDLSPKSNSASRLRISHLKPGVLNWIIETVRLSLKMPLSPVHLTISFIYFKRLGRDDLGNLATKSRVTHLSLWNPFYWDEDSFIPITNKTSNSSNNAGNLAEGPPYFRLSLFCDYENQNPSFRRLWFPWKSWQLRLTHCPDLYICWQWYSKYPICDVKQSTDNPERLLKSFIPSYLISPKSLMNSPQSLKQETGMQILYDNQCLPNPNQTNLVSDLKMNYRDQCLQSDNDKPVRDIQTSKTTLQQTTEMRTTTASVTIMPTTINTATTVNSTPRTSLTTTTITTPLMTASKHSSIAPLSTTSTFTTTTTTENKTDLIIKVNTSTNSLNSTKKEKSQTESLLNINTSKIYPTDLSFNQSNIWSPNHKETTFLDQKSNFNKTIPIILNQDNLIKDGISTEYLTSGLILLAILNIILIICFIILVLWIRRRIKTNSKNKLTNFHDLYQDYSGIDIVGNNSLYATNHCPLLISTISGSYLSGSHPKLNQRHHSFPNSSLSYSQNFNTFLPMSTYKTTDNNKYNSNQSQQFLLGRSTSYSSSMWNGSLRNGLNNNSSSNGHHNERVLLTNRLNSKRHLNYSSNGLSIESSQQITSTPYINRKDHQLINLPLPYHPKEINYKYSSQTLNPSLISSSSLTTVNVTEINGQKERGHKSIYSSRNRLSNGQPSPTPPLREIKKSPVVNYRKSKRKIGSGRPPLAASIKKPHTLVFEDDNQNKWSEDFKTSLHKL
					

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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	49.9	Very low	56.8	Low	211 Å²	211	118 Å²	118	100%	1.039	61%	0.614	S	S	*	*				0	-41.7	0	-69.2	-179.6	85.5	0	0	114.1	T3 N4 R5	M1-T3 PolarHBondContact O-N 2.99Å; M1-N4 PolarHBondContact O-N 3.33Å; M1-R5 PolarHBondContact O-N 3.5Å
2	H	45.1	Very low	56.6	Low	148 Å²	148	116.2 Å²	116.2	69%	0.685	61%	0.605	S	S	*	*	H	α-helix	trans	-59.6	-34.8	-174.1	-71.4	-39.6	0	0	0	115.8	N4 R5 C6	H2-N4 PolarHBondContact O-N 2.99Å; H2-R5 CarbonylContact O-C 3.55Å; H2-R5 WeakPolarHBondContact O-CA 3.27Å; H2-R5 WeakPolarHBondContact O-CB 3.41Å; H2-R5 PolarHBondContact O-N 3.5Å; H2-C6 PolarHBondContact O-N 3.31Å; H2-C6 PolarHBondContact O-SG 2.91Å
3	T	52.4	Low	56.6	Low	109 Å²	109	115.8 Å²	115.8	67%	0.669	60%	0.602	S	S	*	*	H	α-helix	trans	-56.6	-48	177.3	39	0	0	0	0	113.2	M1 R5 C6 L7	M1-T3 PolarHBondContact O-N 2.99Å; T3-R5 VanDerWaalsContact C-N 3.27Å; T3-R5 PolarHBondContact O-N 3.21Å; T3-C6 PolarHBondContact O-N 2.94Å; T3-L7 PolarHBondContact O-N 3.49Å
4	N	51.5	Low	56	Low	122 Å²	122	113 Å²	113	65%	0.652	59%	0.593	S	S	*	*	H	α-helix	trans	-64.5	-32	174.5	-74.9	12.8	0	0	0	112	M1 H2 L7 V8	M1-N4 PolarHBondContact O-N 3.33Å; H2-N4 PolarHBondContact O-N 2.99Å; N4-L7 PolarHBondContact O-N 3.22Å; N4-V8 VanDerWaalsContact O-CB 3.31Å; N4-V8 WeakPolarHBondContact O-CB 3.23Å; N4-V8 VanDerWaalsContact O-CG2 3.27Å; N4-V8 WeakPolarHBondContact O-CG2 3.08Å; N4-V8 PolarHBondContact O-N 2.94Å
5	R	55.6	Low	55.2	Low	180 Å²	180	113.1 Å²	113.1	68%	0.679	59%	0.593	S	S	*	*	H	α-helix	trans	-69.3	-36.6	176.1	-146.6	177.6	-167	-177.6	4.9	111.6	M1 H2 T3 N9	M1-R5 PolarHBondContact O-N 3.5Å; H2-R5 CarbonylContact O-C 3.55Å; H2-R5 WeakPolarHBondContact O-CA 3.27Å; H2-R5 WeakPolarHBondContact O-CB 3.41Å; H2-R5 PolarHBondContact O-N 3.5Å; T3-R5 VanDerWaalsContact C-N 3.27Å; T3-R5 PolarHBondContact O-N 3.21Å; R5-N9 VanDerWaalsContact O-CB 3.24Å; R5-N9 WeakPolarHBondContact O-CB 3.44Å; R5-N9 VanDerWaalsContact O-CG 3.25Å; R5-N9 PolarHBondContact O-N 3.31Å; R5-N9 PolarHBondContact O-OD1 3.45Å
6	C	58.2	Low	54.4	Low	79 Å²	79	111.4 Å²	111.4	53%	0.534	59%	0.589	S	S	.	*	H	α-helix	trans	-67.9	-42	170.8	-66.4	0	0	0	0	112.1	H2 T3 N9 V10	H2-C6 PolarHBondContact O-N 3.31Å; H2-C6 PolarHBondContact O-SG 2.91Å; T3-C6 PolarHBondContact O-N 2.94Å; C6-N9 CarbonylContact O-C 3.58Å; C6-N9 PolarHBondContact O-N 3.09Å; C6-V10 WeakPolarHBondContact O-CG2 3.21Å; C6-V10 PolarHBondContact O-N 2.85Å
7	L	54.9	Low	53.5	Low	105 Å²	105	110.2 Å²	110.2	55%	0.55	59%	0.591	S	S	.	*	H	α-helix	trans	-71.3	-39.8	-178.7	-158.4	153.8	0	0	0	111.7	T3 N4 V10 I11	T3-L7 PolarHBondContact O-N 3.49Å; N4-L7 PolarHBondContact O-N 3.22Å; L7-V10 PolarHBondContact O-N 3.3Å; L7-I11 HydrophobicContact CD2-CD1 3.59Å; L7-I11 HydrophobicContact CD2-CG1 4.21Å; L7-I11 WeakPolarHBondContact O-CG1 3.18Å; L7-I11 PolarHBondContact O-N 3.27Å
8	V	67.6	Low	52.3	Low	87 Å²	87	110.2 Å²	110.2	53%	0.527	60%	0.595	S	S	.	*	H	α-helix	trans	-63.4	-41.6	168.5	171	0	0	0	0	110.9	N4 V10 I11 L12	N4-V8 VanDerWaalsContact O-CB 3.31Å; N4-V8 WeakPolarHBondContact O-CB 3.23Å; N4-V8 VanDerWaalsContact O-CG2 3.27Å; N4-V8 WeakPolarHBondContact O-CG2 3.08Å; N4-V8 PolarHBondContact O-N 2.94Å; V8-V10 VanDerWaalsContact C-N 3.33Å; V8-V10 PolarHBondContact O-N 3Å; V8-I11 PolarHBondContact O-N 2.84Å; V8-L12 WeakPolarHBondContact O-CB 3.17Å; V8-L12 PolarHBondContact O-N 3.2Å
9	N	63.2	Low	51.1	Low	83 Å²	83	110.3 Å²	110.3	44%	0.444	60%	0.596	S	S	.	*	H	α-helix	trans	-65	-33.7	173.8	-81.9	7.5	0	0	0	112.7	R5 C6 I13	R5-N9 VanDerWaalsContact O-CB 3.24Å; R5-N9 WeakPolarHBondContact O-CB 3.44Å; R5-N9 VanDerWaalsContact O-CG 3.25Å; R5-N9 PolarHBondContact O-N 3.31Å; R5-N9 PolarHBondContact O-OD1 3.45Å; C6-N9 CarbonylContact O-C 3.58Å; C6-N9 PolarHBondContact O-N 3.09Å; N9-I13 WeakPolarHBondContact O-CB 3.12Å; N9-I13 WeakPolarHBondContact O-CD1 3.28Å; N9-I13 WeakPolarHBondContact O-CG1 3.35Å; N9-I13 PolarHBondContact O-N 3.08Å
10	V	64.1	Low	50.2	Low	89 Å²	89	109.3 Å²	109.3	54%	0.539	60%	0.603	S	S	.	*	H	α-helix	trans	-69.1	-45.3	174.2	167.3	0	0	0	0	110.5	C6 L7 V8 I13 T14	C6-V10 WeakPolarHBondContact O-CG2 3.21Å; C6-V10 PolarHBondContact O-N 2.85Å; L7-V10 PolarHBondContact O-N 3.3Å; V8-V10 VanDerWaalsContact C-N 3.33Å; V8-V10 PolarHBondContact O-N 3Å; V10-I13 PolarHBondContact O-N 3.4Å; V10-T14 WeakPolarHBondContact O-CG2 3.31Å; V10-T14 PolarHBondContact O-N 2.91Å; V10-T14 PolarHBondContact O-OG1 2.89Å; V10-T14 VanDerWaalsContact O-OG1 3.08Å
11	I	62	Low	49.3	Very low	85 Å²	85	112.6 Å²	112.6	44%	0.436	62%	0.615	S	S	.	*	H	α-helix	trans	-60.9	-46.4	175	-72.2	175.7	0	0	0	110.7	L7 V8 T14 L15	L7-I11 HydrophobicContact CD2-CD1 3.59Å; L7-I11 HydrophobicContact CD2-CG1 4.21Å; L7-I11 WeakPolarHBondContact O-CG1 3.18Å; L7-I11 PolarHBondContact O-N 3.27Å; V8-I11 PolarHBondContact O-N 2.84Å; I11-T14 WeakPolarHBondContact CA-OG1 3.46Å; I11-T14 CarbonylContact O-C 3.56Å; I11-T14 PolarHBondContact O-N 3Å; I11-T14 PolarHBondContact O-OG1 3.01Å; I11-L15 HydrophobicContact CG2-CD1 3.78Å; I11-L15 WeakPolarHBondContact O-CB 3.32Å; I11-L15 WeakPolarHBondContact O-CG 3.25Å; I11-L15 PolarHBondContact O-N 3.49Å
12	L	54.3	Low	48.4	Very low	96 Å²	96	109.3 Å²	109.3	50%	0.503	60%	0.601	S	S	.	*	H	α-helix	trans	-65	-40.2	177.6	-165.3	77.4	0	0	0	111.2	V8 L15 V16	V8-L12 WeakPolarHBondContact O-CB 3.17Å; V8-L12 PolarHBondContact O-N 3.2Å; L12-L15 PolarHBondContact O-N 3.36Å; L12-V16 HydrophobicContact CD1-CG2 4.3Å; L12-V16 HydrophobicContact CG-CG2 4.1Å; L12-V16 WeakPolarHBondContact O-CB 3.41Å; L12-V16 VanDerWaalsContact O-CG2 3.24Å; L12-V16 WeakPolarHBondContact O-CG2 3.44Å; L12-V16 PolarHBondContact O-N 2.59Å
13	I	56.6	Low	47.7	Very low	112 Å²	112	110.7 Å²	110.7	57%	0.574	61%	0.608	S	S	*	*	H	α-helix	trans	-64.4	-41	172.9	-74.3	165.2	0	0	0	110.2	N9 V10 L15 S17	N9-I13 WeakPolarHBondContact O-CB 3.12Å; N9-I13 WeakPolarHBondContact O-CD1 3.28Å; N9-I13 WeakPolarHBondContact O-CG1 3.35Å; N9-I13 PolarHBondContact O-N 3.08Å; V10-I13 PolarHBondContact O-N 3.4Å; I13-L15 VanDerWaalsContact C-N 3.32Å; I13-L15 PolarHBondContact O-N 3.33Å; I13-S17 WeakPolarHBondContact O-CA 3.22Å; I13-S17 WeakPolarHBondContact O-CB 3.46Å; I13-S17 PolarHBondContact O-N 3Å; I13-S17 PolarHBondContact O-OG 3.44Å
14	T	48.4	Very low	46.5	Very low	76 Å²	76	113.8 Å²	113.8	47%	0.466	61%	0.612	S	S	.	*	H	α-helix	trans	-71	-22.8	175.9	52.3	0	0	0	0	114.2	V10 I11 V18	V10-T14 WeakPolarHBondContact O-CG2 3.31Å; V10-T14 PolarHBondContact O-N 2.91Å; V10-T14 PolarHBondContact O-OG1 2.89Å; V10-T14 VanDerWaalsContact O-OG1 3.08Å; I11-T14 WeakPolarHBondContact CA-OG1 3.46Å; I11-T14 CarbonylContact O-C 3.56Å; I11-T14 PolarHBondContact O-N 3Å; I11-T14 PolarHBondContact O-OG1 3.01Å; T14-V18 WeakPolarHBondContact O-CB 3.03Å; T14-V18 WeakPolarHBondContact O-CG2 3.39Å
15	L	43.7	Very low	45.3	Very low	114 Å²	114	115.1 Å²	115.1	60%	0.597	62%	0.62	S	S	*	*	H	α-helix	trans	-87.9	-33.1	174.8	-74	168	0	0	0	112.2	I11 L12 I13 V18 N19	I11-L15 HydrophobicContact CG2-CD1 3.78Å; I11-L15 WeakPolarHBondContact O-CB 3.32Å; I11-L15 WeakPolarHBondContact O-CG 3.25Å; I11-L15 PolarHBondContact O-N 3.49Å; L12-L15 PolarHBondContact O-N 3.36Å; I13-L15 VanDerWaalsContact C-N 3.32Å; I13-L15 PolarHBondContact O-N 3.33Å; L15-V18 CarbonylContact O-C 3.59Å; L15-V18 VanDerWaalsContact O-C 3.26Å; L15-V18 WeakPolarHBondContact O-CA 3.38Å; L15-V18 PolarHBondContact O-N 3.12Å; L15-N19 PolarHBondContact O-N 3.31Å
16	V	43.3	Very low	43.9	Very low	87 Å²	87	115.4 Å²	115.4	53%	0.527	63%	0.628	S	S	.	*	H	α-helix	trans	-87.6	-22.3	178.1	178.9	0	0	0	0	111.9	L12 N19	L12-V16 HydrophobicContact CD1-CG2 4.3Å; L12-V16 HydrophobicContact CG-CG2 4.1Å; L12-V16 WeakPolarHBondContact O-CB 3.41Å; L12-V16 VanDerWaalsContact O-CG2 3.24Å; L12-V16 WeakPolarHBondContact O-CG2 3.44Å; L12-V16 PolarHBondContact O-N 2.59Å; V16-N19 WeakPolarHBondContact O-CB 2.99Å; V16-N19 PolarHBondContact O-N 2.58Å
17	S	38.8	Very low	42.4	Very low	90 Å²	90	119 Å²	119	63%	0.629	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	1.9	159.5	85.1	0	0	0	0	112.8	I13	I13-S17 WeakPolarHBondContact O-CA 3.22Å; I13-S17 WeakPolarHBondContact O-CB 3.46Å; I13-S17 PolarHBondContact O-N 3Å; I13-S17 PolarHBondContact O-OG 3.44Å
18	V	32.3	Very low	41	Very low	110 Å²	110	121.3 Å²	121.3	67%	0.667	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	23	162.6	173.1	0	0	0	0	109.3	T14 L15	T14-V18 WeakPolarHBondContact O-CB 3.03Å; T14-V18 WeakPolarHBondContact O-CG2 3.39Å; L15-V18 CarbonylContact O-C 3.59Å; L15-V18 VanDerWaalsContact O-C 3.26Å; L15-V18 WeakPolarHBondContact O-CA 3.38Å; L15-V18 PolarHBondContact O-N 3.12Å
19	N	29.9	Very low	38.9	Very low	112 Å²	112	122.1 Å²	122.1	60%	0.599	66%	0.663	S	S	*	*	S	Bend	trans	-92.2	123.2	171	-164.7	23.8	0	0	0	111.6	L15 V16 Q21	L15-N19 PolarHBondContact O-N 3.31Å; V16-N19 WeakPolarHBondContact O-CB 2.99Å; V16-N19 PolarHBondContact O-N 2.58Å; N19-Q21 VanDerWaalsContact C-N 3.31Å; N19-Q21 PolarHBondContact O-N 3.46Å
20	A	33	Very low	37.1	Very low	91 Å²	91	123.4 Å²	123.4	75%	0.752	68%	0.676	S	S	*	*	S	Bend	trans	51	20.5	146.2	0	0	0	0	0	121
21	Q	31.4	Very low	35.2	Very low	179 Å²	179	125.9 Å²	125.9	84%	0.836	69%	0.692	S	S	*	*			trans	-137.7	30.6	166.7	-117.5	167.6	5.7	0	0	114	N19 E23	N19-Q21 VanDerWaalsContact C-N 3.31Å; N19-Q21 PolarHBondContact O-N 3.46Å; Q21-E23 PolarHBondContact O-N 2.78Å
22	N	30.2	Very low	33.6	Very low	142 Å²	142	127.4 Å²	127.4	76%	0.759	70%	0.699	S	S	*	*			trans	-71.5	110.3	158	-104.1	-11.4	0	0	0	108.5	F24	N22-F24 PolarHBondContact O-N 3.47Å
23	E	31	Very low	32.2	Very low	176 Å²	176	129.3 Å²	129.3	82%	0.822	71%	0.709	S	S	*	*			trans	-71.5	64.7	175.1	-64.8	170.9	137.9	0	0	111.6	Q21	Q21-E23 PolarHBondContact O-N 2.78Å
24	F	26.8	Very low	30.6	Very low	175 Å²	175	131.1 Å²	131.1	77%	0.768	72%	0.72	S	S	*	*			trans	-72	135.5	150.4	-94.4	-96.8	0	0	0	108.1	N22	N22-F24 PolarHBondContact O-N 3.47Å
25	N	26.3	Very low	29.5	Very low	150 Å²	150	131.9 Å²	131.9	80%	0.802	73%	0.728	S	S	*	*	S	Bend	trans	78	38.7	172.6	-46.9	-19.2	0	0	0	117.9
26	Q	26	Very low	28.6	Very low	185 Å²	185	134 Å²	134	86%	0.864	74%	0.739	S	S	*	*			trans	-162	82.2	143.3	-111.7	161.8	16.5	0	0	112.5
27	I	26.7	Very low	27.8	Very low	154 Å²	154	134.9 Å²	134.9	79%	0.79	75%	0.745	S	S	*	*	S	Bend	trans	-115.6	136.3	155.9	-66.7	178.2	0	0	0	106.2	S29	I27-S29 PolarHBondContact O-N 2.92Å
28	D	26.2	Very low	27.2	Very low	155 Å²	155	137.2 Å²	137.2	83%	0.829	74%	0.744	S	S	*	*			trans	-49.1	117.5	-168.1	-56.5	-75.6	0	0	0	113.8	P30	D28-P30 VanDerWaalsContact O-CD 3.23Å; D28-P30 WeakPolarHBondContact O-CD 3.44Å
29	S	23.5	Very low	26.9	Very low	103 Å²	103	137 Å²	137	72%	0.72	75%	0.745	S	S	*	*			trans	-67.5	115.5	166.1	-61.2	0	0	0	0	109.1	I27 T31	I27-S29 PolarHBondContact O-N 2.92Å; S29-T31 PolarHBondContact O-N 3.1Å
30	P	24.9	Very low	26.8	Very low	110 Å²	110	138.6 Å²	138.6	71%	0.714	75%	0.753	S	S	*	*			trans	-67.6	108.6	168.4	28.4	-32.3	0	0	0	108.4	D28 I32	D28-P30 VanDerWaalsContact O-CD 3.23Å; D28-P30 WeakPolarHBondContact O-CD 3.44Å; P30-I32 VanDerWaalsContact C-N 3.29Å; P30-I32 PolarHBondContact O-N 3.29Å
31	T	24.7	Very low	26.5	Very low	142 Å²	142	141 Å²	141	87%	0.871	75%	0.752	S	S	*	*			trans	-71.2	79.7	-179.2	27.1	0	0	0	0	111.5	S29	S29-T31 PolarHBondContact O-N 3.1Å
32	I	26.7	Very low	26.3	Very low	116 Å²	116	138.7 Å²	138.7	60%	0.595	74%	0.743	S	S	*	*			trans	-118.2	86.2	174	-54.3	-176.7	0	0	0	109.9	P30	P30-I32 VanDerWaalsContact C-N 3.29Å; P30-I32 PolarHBondContact O-N 3.29Å
33	I	25.7	Very low	26	Very low	136 Å²	136	138.4 Å²	138.4	70%	0.697	74%	0.742	S	S	*	*			trans	56.8	85.8	150.4	-47.9	177.8	0	0	0	115.7	S35	I33-S35 PolarHBondContact O-N 2.95Å
34	D	23.7	Very low	26	Very low	151 Å²	151	137.2 Å²	137.2	81%	0.807	74%	0.741	S	S	*	*			trans	-62.2	109.9	147.3	-96.4	-46.7	0	0	0	109.1
35	S	25	Very low	26	Very low	92 Å²	92	136.6 Å²	136.6	64%	0.643	75%	0.745	S	S	*	*			trans	-145	54.2	170.8	74.7	0	0	0	0	113.1	I33	I33-S35 PolarHBondContact O-N 2.95Å
36	L	24.7	Very low	26.2	Very low	157 Å²	157	136.5 Å²	136.5	82%	0.822	75%	0.745	S	S	*	*			trans	-161.1	32.1	152.2	-110.3	165.6	0	0	0	113.5
37	T	26.2	Very low	26.3	Very low	107 Å²	107	132.9 Å²	132.9	66%	0.656	74%	0.735	S	S	*	*			trans	-78.9	124.1	174.4	-33.2	0	0	0	0	109.7
38	F	25.9	Very low	26.5	Very low	139 Å²	139	133.9 Å²	133.9	61%	0.61	74%	0.736	S	S	*	*			trans	-66.7	137	177.1	-72.8	-93.3	0	0	0	110.8	L40	F38-L40 PolarHBondContact O-N 2.78Å
39	P	26.7	Very low	26.5	Very low	106 Å²	106	133.9 Å²	133.9	69%	0.688	74%	0.736	S	S	*	*			trans	-75	90.6	177.3	30.6	-34.3	0	0	0	110.7	I41	P39-I41 PolarHBondContact O-N 2.77Å
40	L	28.1	Very low	26.8	Very low	145 Å²	145	137.8 Å²	137.8	76%	0.759	74%	0.743	S	S	*	*			trans	-78.6	95.5	158.6	-82.6	165.8	0	0	0	108.4	F38 I42	F38-L40 PolarHBondContact O-N 2.78Å; L40-I42 HydrophobicContact CB-CD1 4.39Å; L40-I42 HydrophobicContact CB-CG1 4.3Å; L40-I42 PolarHBondContact O-N 2.93Å
41	I	25.4	Very low	26.8	Very low	142 Å²	142	141.6 Å²	141.6	73%	0.728	75%	0.751	S	S	*	*			trans	-67.5	114.5	163.7	-60.4	172.8	0	0	0	106.7	P39	P39-I41 PolarHBondContact O-N 2.77Å
42	I	27.7	Very low	27.1	Very low	129 Å²	129	141.5 Å²	141.5	66%	0.662	75%	0.745	S	S	*	*			trans	-132.4	67.4	171.8	-49.4	-179	0	0	0	108.1	L40	L40-I42 HydrophobicContact CB-CD1 4.39Å; L40-I42 HydrophobicContact CB-CG1 4.3Å; L40-I42 PolarHBondContact O-N 2.93Å
43	D	24.7	Very low	27	Very low	137 Å²	137	145.6 Å²	145.6	73%	0.733	76%	0.758	S	S	*	*			trans	-82.9	138.1	137.2	-50.2	-64	0	0	0	105.4
44	D	29.5	Very low	27.2	Very low	151 Å²	151	148.1 Å²	148.1	81%	0.807	76%	0.764	S	S	*	*			cis	-112.3	162	11.3	-66.9	-67.8	0	0	0	113.9
45	L	26.8	Very low	27.6	Very low	161 Å²	161	146.5 Å²	146.5	84%	0.843	76%	0.762	S	S	*	*			trans	-136	90.7	169.5	-146.3	178.6	0	0	0	110.8
46	N	31.5	Very low	27.7	Very low	149 Å²	149	150.5 Å²	150.5	80%	0.797	77%	0.774	S	S	*	*			trans	-171	144.2	170.5	-91.7	-33.4	0	0	0	107.7
47	V	28.8	Very low	28	Very low	109 Å²	109	150.5 Å²	150.5	66%	0.661	77%	0.768	S	S	*	*			cis	-155.1	156.8	-6.2	95.7	0	0	0	0	110.3
48	E	30	Very low	28.2	Very low	175 Å²	175	152.4 Å²	152.4	82%	0.818	77%	0.77	S	S	*	*			trans	61.1	149.6	161	-73	172.8	157.1	0	0	123.8
49	N	26.9	Very low	28.1	Very low	155 Å²	155	154.5 Å²	154.5	83%	0.829	78%	0.781	S	S	*	*			trans	-67.5	152.5	-175.9	-51.2	-69	0	0	0	114.3
50	E	29	Very low	28.3	Very low	185 Å²	185	157.2 Å²	157.2	86%	0.864	79%	0.788	S	S	*	*				-158.4	163.2	111.4	-121.7	-176.7	-171.1	0	0	113.2
51	Q	26	Very low	28.1	Very low	190 Å²	190	155.6 Å²	155.6	89%	0.888	78%	0.784	S	S	*	*			trans	-93.8	119.5	178.6	-67.8	-176.5	-1.7	0	0	111.3
52	L	29.8	Very low	28.3	Very low	140 Å²	140	155.2 Å²	155.2	73%	0.733	79%	0.791	S	S	*	*			trans	-116.6	126.1	166	-123.5	77.2	0	0	0	112.1
53	K	25.8	Very low	28.3	Very low	201 Å²	201	157.9 Å²	157.9	87%	0.874	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-77.1	130.7	169	-68.3	173.9	178.5	172.1	0	109.4
54	F	28.4	Very low	28.5	Very low	189 Å²	189	158.1 Å²	158.1	83%	0.829	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-87.9	130.4	164.2	-74.4	-81.5	0	0	0	110.5
55	P	31.9	Very low	28.3	Very low	118 Å²	118	156.7 Å²	156.7	77%	0.766	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-83.6	154.9	-178.6	33.6	-35.3	0	0	0	112.8	K57	P55-K57 PolarHBondContact O-N 3.06Å
56	I	28.8	Very low	28.4	Very low	175 Å²	175	159.1 Å²	159.1	90%	0.897	80%	0.795	S	S	*	*			trans	-82.6	112.1	178.6	-59.9	170.3	0	0	0	110.5
57	K	30.1	Very low	28.1	Very low	157 Å²	157	160.2 Å²	160.2	68%	0.683	80%	0.795	S	S	*	*			trans	-154.6	146.2	162.2	-86.6	-176.6	166.7	-85.8	0	107.3	P55	P55-K57 PolarHBondContact O-N 3.06Å
58	E	29.3	Very low	28.2	Very low	148 Å²	148	161.9 Å²	161.9	69%	0.692	81%	0.806	S	S	*	*			cis	-153.1	158.1	-9.7	-127.4	151.7	-166.9	0	0	108	I60	E58-I60 PolarHBondContact O-N 2.79Å
59	Q	25.4	Very low	28.1	Very low	182 Å²	182	161.6 Å²	161.6	85%	0.85	81%	0.805	S	S	*	*			trans	-72.3	120.4	-178.8	-75.5	-179	-25.4	0	0	111.8
60	I	29.6	Very low	28.1	Very low	164 Å²	164	160.4 Å²	160.4	84%	0.841	81%	0.805	S	S	*	*			trans	-107.3	107.9	164.7	-58.1	-179.8	0	0	0	108.3	E58 P62	E58-I60 PolarHBondContact O-N 2.79Å; I60-P62 WeakPolarHBondContact O-CD 3.35Å
61	T	24.8	Very low	28.2	Very low	110 Å²	110	159.8 Å²	159.8	68%	0.675	81%	0.806	S	S	*	*			trans	-92.7	119.2	176.9	46.8	0	0	0	0	110.8	K63	T61-K63 VanDerWaalsContact C-N 3.32Å; T61-K63 PolarHBondContact O-N 3.41Å
62	P	30.3	Very low	28.2	Very low	134 Å²	134	155.7 Å²	155.7	87%	0.87	80%	0.798	S	S	*	*			trans	-82.7	76.5	171.6	33.1	-33.6	0	0	0	110.5	I60 N64	I60-P62 WeakPolarHBondContact O-CD 3.35Å; P62-N64 PolarHBondContact O-N 3.06Å
63	K	26.7	Very low	28	Very low	185 Å²	185	155.2 Å²	155.2	80%	0.804	80%	0.801	S	S	*	*			trans	-84.5	102.7	159.6	-87.7	-170.6	177	-179.3	0	109.4	T61	T61-K63 VanDerWaalsContact C-N 3.32Å; T61-K63 PolarHBondContact O-N 3.41Å
64	N	29.9	Very low	28	Very low	142 Å²	142	157.3 Å²	157.3	76%	0.759	80%	0.803	S	S	*	*				-168.2	115.6	129.7	-96.8	-20.8	0	0	0	111.1	P62	P62-N64 PolarHBondContact O-N 3.06Å
65	V	24.9	Very low	27.9	Very low	122 Å²	122	159 Å²	159	74%	0.739	80%	0.804	S	S	*	*			trans	-85.6	127.3	166.6	173.3	0	0	0	0	107.8
66	Y	28.1	Very low	27.6	Very low	212 Å²	212	164.3 Å²	164.3	83%	0.831	81%	0.809	S	S	*	*			trans	-135.7	138.6	155.8	-86.9	-74	0	0	0	110.2
67	H	24.7	Very low	27.5	Very low	171 Å²	171	162.8 Å²	162.8	79%	0.792	80%	0.803	S	S	*	*			trans	-75.6	150.8	-179.6	-71.8	-95.6	0	0	0	112.1
68	T	31.9	Very low	27.4	Very low	144 Å²	144	160.8 Å²	160.8	88%	0.883	81%	0.808	S	S	*	*			trans	-130.1	142.2	147.3	-44.8	0	0	0	0	108.4
69	E	28.1	Very low	27.3	Very low	170 Å²	170	161.3 Å²	161.3	79%	0.794	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-80.2	159.2	-165.6	-70.8	-173.9	131.6	0	0	115.1	I71	E69-I71 PolarHBondContact O-N 2.95Å
70	P	27.1	Very low	27.5	Very low	130 Å²	130	161.8 Å²	161.8	84%	0.844	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-73.4	118.5	179.3	29.3	-35.2	0	0	0	112.9
71	I	30.2	Very low	27.4	Very low	171 Å²	171	158.5 Å²	158.5	88%	0.877	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-85.6	123.7	174.3	-61.1	178.1	0	0	0	110.2	E69	E69-I71 PolarHBondContact O-N 2.95Å
72	S	25.5	Very low	27.7	Very low	104 Å²	104	157.6 Å²	157.6	73%	0.727	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-92.6	135.4	178.7	71	0	0	0	0	113.5
73	V	26.2	Very low	27.7	Very low	130 Å²	130	162.2 Å²	162.2	79%	0.788	82%	0.815	S	S	*	*			trans	40.9	116.8	153.7	-172.6	0	0	0	0	118.9
74	R	26.2	Very low	27.7	Very low	246 Å²	246	162.1 Å²	162.1	93%	0.928	82%	0.815	S	S	*	*			trans	-131.7	119.5	142.8	-156	173.1	-168.6	173.9	4.9	111.7
75	R	26.2	Very low	27.7	Very low	224 Å²	224	159.6 Å²	159.6	85%	0.845	81%	0.808	S	S	*	*			trans	-74.6	155	170.9	-84.3	176	162.6	164.1	-6.6	110.9
76	R	25	Very low	27.8	Very low	229 Å²	229	163.6 Å²	163.6	86%	0.864	82%	0.816	S	S	*	*			trans	73.9	138.3	-179.1	-48.2	177.8	177.1	162	-1.8	112.4
77	N	28.1	Very low	27.7	Very low	143 Å²	143	162.9 Å²	162.9	77%	0.765	81%	0.813	S	S	*	*			cis	-127	151.3	27.5	-76.9	-42.3	0	0	0	115.1	N79	N77-N79 PolarHBondContact O-N 3.28Å; N77-N79 VanDerWaalsContact O-N 3.13Å
78	S	27.9	Very low	27.9	Very low	115 Å²	115	164.1 Å²	164.1	80%	0.804	82%	0.816	S	S	*	*			trans	-70.9	92.9	157.7	50.9	0	0	0	0	110.2
79	N	26.2	Very low	27.7	Very low	160 Å²	160	165 Å²	165	86%	0.856	82%	0.816	S	S	*	*			trans	-175	47	160.5	-97.2	-13	0	0	0	110.2	N77 S81	N77-N79 PolarHBondContact O-N 3.28Å; N77-N79 VanDerWaalsContact O-N 3.13Å; N79-S81 PolarHBondContact O-N 3.37Å
80	Q	30	Very low	27.7	Very low	192 Å²	192	166 Å²	166	90%	0.897	82%	0.817	S	S	*	*			trans	-78.8	104	171.1	-156.5	160.5	9.4	0	0	107.7
81	S	28.4	Very low	27.8	Very low	95 Å²	95	165.8 Å²	165.8	66%	0.664	82%	0.816	S	S	*	*			trans	-52.8	139.6	-176.7	53.7	0	0	0	0	111.8	N79 Y83	N79-S81 PolarHBondContact O-N 3.37Å; S81-Y83 PolarHBondContact O-N 3.03Å
82	A	29.7	Very low	28	Very low	90 Å²	90	163.9 Å²	163.9	74%	0.744	81%	0.813	S	S	*	*			trans	-50.9	124.6	168.8	0	0	0	0	0	110.3	K84	A82-K84 PolarHBondContact O-N 2.96Å
83	Y	30.2	Very low	28.1	Very low	231 Å²	231	166.9 Å²	166.9	91%	0.906	82%	0.819	S	S	*	*			trans	-70	77.1	169.2	-111.8	-102.8	0	0	0	108.5	S81 S85	S81-Y83 PolarHBondContact O-N 3.03Å; Y83-S85 PolarHBondContact O-N 2.84Å; Y83-S85 VanDerWaalsContact O-N 3.16Å
84	K	27.4	Very low	28.2	Very low	183 Å²	183	163.5 Å²	163.5	80%	0.796	81%	0.811	S	S	*	*			trans	-55.3	120.3	160.4	-84.6	-167.6	168.1	-163.4	0	107	A82 K86	A82-K84 PolarHBondContact O-N 2.96Å; K84-K86 PolarHBondContact O-N 2.91Å
85	S	28.7	Very low	28.4	Very low	89 Å²	89	159.2 Å²	159.2	62%	0.622	81%	0.806	S	S	*	*			trans	-49.2	124.2	164.8	47.6	0	0	0	0	108.4	Y83 Y87	Y83-S85 PolarHBondContact O-N 2.84Å; Y83-S85 VanDerWaalsContact O-N 3.16Å; S85-Y87 PolarHBondContact O-N 3.44Å; S85-Y87 VanDerWaalsContact O-O 3.07Å
86	K	27.5	Very low	28.3	Very low	207 Å²	207	158 Å²	158	90%	0.9	81%	0.81	S	S	*	*	S	Bend	trans	-80.8	34.9	-169.9	-143.7	176.4	-175.5	-177.7	0	113.6	K84	K84-K86 PolarHBondContact O-N 2.91Å
87	Y	27.5	Very low	28.3	Very low	196 Å²	196	154.9 Å²	154.9	77%	0.769	80%	0.803	S	S	*	*			trans	-113.2	152.5	169.1	-64.6	-83.7	0	0	0	107.3	S85	S85-Y87 PolarHBondContact O-N 3.44Å; S85-Y87 VanDerWaalsContact O-O 3.07Å
88	F	28.6	Very low	28.2	Very low	197 Å²	197	156.4 Å²	156.4	86%	0.864	81%	0.811	S	S	*	*			trans	70.6	61.7	-164.9	-52	-74	0	0	0	115.4
89	D	26.2	Very low	28.3	Very low	164 Å²	164	157.9 Å²	157.9	88%	0.877	81%	0.805	S	S	*	*			trans	-137.5	80	149.7	-100.1	-41.8	0	0	0	109.5
90	K	29.5	Very low	28.3	Very low	189 Å²	189	154.9 Å²	154.9	82%	0.822	80%	0.797	S	S	*	*			trans	-153.4	106.8	164.3	-118.8	-176.4	-176.6	-176	0	109.7	T92	K90-T92 PolarHBondContact O-N 2.75Å; K90-T92 VanDerWaalsContact O-N 3.13Å
91	P	29	Very low	28.5	Very low	126 Å²	126	151.5 Å²	151.5	82%	0.818	79%	0.789	S	S	*	*			trans	-82	89.3	179.6	31.9	-33	0	0	0	110.4
92	T	34.2	Very low	28.9	Very low	132 Å²	132	154.3 Å²	154.3	81%	0.81	79%	0.789	S	S	*	*			trans	-84.6	119.9	173.5	-42.9	0	0	0	0	109.8	K90	K90-T92 PolarHBondContact O-N 2.75Å; K90-T92 VanDerWaalsContact O-N 3.13Å
93	I	28	Very low	29.3	Very low	166 Å²	166	157.4 Å²	157.4	85%	0.851	79%	0.793	S	S	*	*			trans	-76.1	136.4	-176.2	-65	162.8	0	0	0	110.4
94	G	27.3	Very low	30.6	Very low	60 Å²	60	150.2 Å²	150.2	62%	0.619	77%	0.773	S	S	*	*			trans	97.9	93.8	162.3	0	0	0	0	0	116.2
95	N	29.7	Very low	32.3	Very low	156 Å²	156	143.5 Å²	143.5	83%	0.834	76%	0.756	S	S	*	*				-174.2	128.4	125.4	-95.5	-23	0	0	0	110.9	F97	N95-F97 PolarHBondContact O-N 3.4Å
96	E	25.9	Very low	34.8	Very low	197 Å²	197	144.1 Å²	144.1	92%	0.921	75%	0.749	S	S	*	*			trans	-82.6	77.5	-179.8	-67.1	-173.5	119.2	0	0	112
97	F	25.2	Very low	37.5	Very low	165 Å²	165	136.4 Å²	136.4	72%	0.724	72%	0.722	S	S	*	*			trans	-113.1	103	161.3	-84.8	-87.5	0	0	0	110	N95 H99	N95-F97 PolarHBondContact O-N 3.4Å; F97-H99 PolarHBondContact O-N 3.49Å
98	N	25.2	Very low	40.4	Very low	174 Å²	174	132.6 Å²	132.6	93%	0.93	71%	0.714	S	S	*	*			trans	-72.7	57.7	176.6	-102	-37	0	0	0	112	S100	N98-S100 PolarHBondContact O-N 3.08Å
99	H	28.8	Very low	43.4	Very low	146 Å²	146	123.7 Å²	123.7	68%	0.676	68%	0.676	S	S	*	*			trans	-79.8	105.1	156.8	-67.1	-36.6	0	0	0	107.8	F97 V101	F97-H99 PolarHBondContact O-N 3.49Å; H99-V101 HydrophobicContact CB-CG2 3.91Å; H99-V101 PolarHBondContact O-N 2.03Å
100	S	27.8	Very low	46.4	Very low	98 Å²	98	117.5 Å²	117.5	69%	0.685	65%	0.645	S	S	*	*			trans	-69.6	68.1	162.1	63.2	0	0	0	0	109.1	N98 F102	N98-S100 PolarHBondContact O-N 3.08Å; S100-F102 VanDerWaalsContact C-N 3.28Å; S100-F102 PolarHBondContact O-N 3.42Å
101	V	34.5	Very low	49.2	Very low	121 Å²	121	112.3 Å²	112.3	73%	0.733	63%	0.626	S	S	*	*			trans	-63.1	98.8	163.6	-176.3	0	0	0	0	104.9	H99 D103	H99-V101 HydrophobicContact CB-CG2 3.91Å; H99-V101 PolarHBondContact O-N 2.03Å; V101-D103 PolarHBondContact O-N 3.48Å
102	F	36.3	Very low	52.1	Low	153 Å²	153	106.8 Å²	106.8	67%	0.671	59%	0.59	S	S	*	*			trans	-56.9	116.7	165.9	-76.5	-91.4	0	0	0	106.1	S100 V104	S100-F102 VanDerWaalsContact C-N 3.28Å; S100-F102 PolarHBondContact O-N 3.42Å; F102-V104 VanDerWaalsContact C-N 3.31Å; F102-V104 VanDerWaalsContact O-CG2 3.3Å; F102-V104 WeakPolarHBondContact O-CG2 3.26Å; F102-V104 PolarHBondContact O-N 2.94Å
103	D	38.5	Very low	54.9	Low	156 Å²	156	105.4 Å²	105.4	83%	0.834	57%	0.57	S	S	*	*			trans	-66.4	95.1	179.9	-165.3	12.8	0	0	0	107.9	V101 G105	V101-D103 PolarHBondContact O-N 3.48Å; D103-G105 PolarHBondContact O-N 3.22Å
104	V	56.4	Low	58	Low	79 Å²	79	97.5 Å²	97.5	48%	0.479	53%	0.53	S	S	.	.			trans	-76.3	93.6	-174.5	-176.3	0	0	0	0	106.5	F102 E106 W148	F102-V104 VanDerWaalsContact C-N 3.31Å; F102-V104 VanDerWaalsContact O-CG2 3.3Å; F102-V104 WeakPolarHBondContact O-CG2 3.26Å; F102-V104 PolarHBondContact O-N 2.94Å; V104-E106 PolarHBondContact O-N 2.96Å; V104-W148 HydrophobicContact CG1-CB 3.79Å; V104-W148 HydrophobicContact CG1-CD2 4Å; V104-W148 HydrophobicContact CG1-CG 3.44Å; V104-W148 VanDerWaalsContact CG1-CG 3.44Å
105	G	63.8	Low	61	Low	43 Å²	43	95.1 Å²	95.1	44%	0.443	50%	0.503	S	S	.	.			trans	-66.2	64.9	-179.9	0	0	0	0	0	113.7	D103 S107	D103-G105 PolarHBondContact O-N 3.22Å; G105-S107 PolarHBondContact O-N 3.46Å; G105-S107 VanDerWaalsContact O-N 3.14Å; G105-S107 PolarHBondContact O-OG 2.96Å
106	E	80.3	Confident	63.8	Low	101 Å²	101	87.7 Å²	87.7	47%	0.472	46%	0.463	S	S	.	.			trans	-53.7	116.2	171.4	-176.2	179.9	158.2	0	0	108.6	V104 H146 W148 K177	V104-E106 PolarHBondContact O-N 2.96Å; E106-H146 HydrophobicContact CG-CB 4.01Å; E106-H146 IonicContact OE1-CE1 3.68Å; E106-H146 PolarHBondContact OE1-CE1 3.28Å; E106-H146 IonicContact OE1-CG 3.64Å; E106-H146 VanDerWaalsContact OE1-CG 3.29Å; E106-H146 IonicContact OE1-ND1 2.92Å; E106-H146 PolarHBondContact OE1-ND1 3.33Å; E106-W148 HydrophobicContact CB-CE3 4.4Å; E106-W148 HydrophobicContact CG-CE3 4.11Å; E106-W148 HydrophobicContact CG-CZ3 4.31Å; E106-K177 IonicContact OE1-NZ 2.8Å; E106-K177 PolarHBondContact OE1-NZ 2.95Å
107	S	85.3	Confident	66.7	Low	46 Å²	46	81.6 Å²	81.6	32%	0.322	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	148.9	-173.6	-64.9	0	0	0	0	109.2	G105 H146 Y147	G105-S107 PolarHBondContact O-N 3.46Å; G105-S107 VanDerWaalsContact O-N 3.14Å; G105-S107 PolarHBondContact O-OG 2.96Å; S107-H146 CarbonylContact O-C 3.57Å; S107-H146 WeakPolarHBondContact O-CA 3.34Å; S107-Y147 PolarHBondContact N-O 2.92Å; S107-Y147 VanDerWaalsContact O-CD1 3.26Å; S107-Y147 WeakPolarHBondContact O-CD1 3.39Å; S107-Y147 PolarHBondContact O-N 2.89Å
108	L	88.6	Confident	69.4	Low	115 Å²	115	79.2 Å²	79.2	60%	0.602	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	140.5	171.3	-71	170.3	0	0	0	110.2	C145 Y147	L108-C145 CarbonylContact C-O 3.51Å; L108-C145 WeakPolarHBondContact CA-O 3.44Å; L108-Y147 VanDerWaalsContact O-CE1 3.3Å; L108-Y147 WeakPolarHBondContact O-CE1 3.47Å
109	C	91.8	Very high	71.6	Confident	11 Å²	11	75 Å²	75	7%	0.074	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-57.8	124.9	-179.9	-65.3	0	0	0	0	111	V112 C145 V213	C109-V112 HydrophobicContact CB-CB 3.89Å; C109-V112 HydrophobicContact CB-CG1 4.47Å; C109-V112 HydrophobicContact CB-CG2 4.45Å; C109-C145 HydrophobicContact CB-CB 3.55Å; C109-C145 WeakPolarHBondContact CB-SG 3.35Å; C109-C145 PolarHBondContact N-O 3.05Å; C109-C145 WeakPolarHBondContact SG-CB 3.04Å; C109-C145 PolarHBondContact SG-O 3.26Å; C109-C145 CovalentContact SG-SG 2.04Å; C109-C145 PolarHBondContact SG-SG 3.21Å; C109-V213 HydrophobicContact CB-CG2 3.8Å
110	P	88.3	Confident	73.2	Confident	34 Å²	34	73 Å²	73	22%	0.221	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	138.7	174.1	28.8	-35.2	0	0	0	109.8	V112 L217	P110-V112 PolarHBondContact O-N 3.41Å; P110-V112 VanDerWaalsContact O-N 3.13Å; P110-L217 HydrophobicContact CG-CD2 4.31Å; P110-L217 HydrophobicContact CG-CG 4.35Å
111	D	87.5	Confident	75	Confident	80 Å²	80	74.9 Å²	74.9	43%	0.428	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	29	172.8	-43.9	-65.1	0	0	0	114.5	S131 T212 S216	D111-S131 VanDerWaalsContact O-CA 3.31Å; D111-S131 WeakPolarHBondContact O-CA 3.19Å; D111-T212 HydrophobicContact CB-CG2 3.9Å; D111-T212 WeakPolarHBondContact O-CG2 3.31Å; D111-S216 WeakPolarHBondContact OD2-CB 3.32Å; D111-S216 PolarHBondContact OD2-OG 3.44Å
112	V	91.5	Very high	76.4	Confident	10 Å²	10	71 Å²	71	6%	0.061	39%	0.39	C	S	.	.			trans	-133.9	111.4	177.9	174.3	0	0	0	0	111.2	C109 P110 C114 C145 W208 I209 T212 V213	C109-V112 HydrophobicContact CB-CB 3.89Å; C109-V112 HydrophobicContact CB-CG1 4.47Å; C109-V112 HydrophobicContact CB-CG2 4.45Å; P110-V112 PolarHBondContact O-N 3.41Å; P110-V112 VanDerWaalsContact O-N 3.13Å; V112-C114 VanDerWaalsContact CG1-SG 3.56Å; V112-C145 HydrophobicContact CG1-CB 4.03Å; V112-W208 HydrophobicContact CG1-CZ3 4.28Å; V112-W208 HydrophobicContact CG2-CH2 4.15Å; V112-W208 HydrophobicContact CG2-CZ3 4.06Å; V112-I209 HydrophobicContact CG1-CG1 4.18Å; V112-I209 HydrophobicContact CG1-CG2 4.17Å; V112-T212 HydrophobicContact CG2-CG2 3.83Å; V112-V213 HydrophobicContact CG2-CG2 3.96Å
113	Y	91.3	Very high	78	Confident	102 Å²	102	69.9 Å²	69.9	40%	0.4	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	110.7	173.7	-60.4	-90.2	0	0	0	109.1	C129 K130 Q132 S133	Y113-C129 CarbonylContact O-C 3.26Å; Y113-C129 WeakPolarHBondContact O-CA 3.3Å; Y113-K130 PolarHBondContact N-O 3.11Å; Y113-K130 PolarHBondContact O-N 3.44Å; Y113-Q132 VanDerWaalsContact CD2-C 3.4Å; Y113-S133 VanDerWaalsContact CD2-N 3.34Å
114	C	93.1	Very high	80.1	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.007	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	147.3	-175	-69	0	0	0	0	112.5	V112 F127 C129 I143	V112-C114 VanDerWaalsContact CG1-SG 3.56Å; C114-F127 HydrophobicContact CB-CE2 3.91Å; C114-F127 HydrophobicContact CB-CZ 4.03Å; C114-C129 VanDerWaalsContact CA-SG 3.57Å; C114-C129 HydrophobicContact CB-CB 4.05Å; C114-C129 WeakPolarHBondContact CB-SG 3.48Å; C114-C129 WeakPolarHBondContact SG-CB 3.3Å; C114-C129 CovalentContact SG-SG 2.04Å; C114-C129 PolarHBondContact SG-SG 3.2Å; C114-I143 HydrophobicContact CB-CB 4.08Å; C114-I143 HydrophobicContact CB-CG2 4.26Å; C114-I143 PolarHBondContact O-N 3.01Å
115	F	90.6	Very high	81.5	Confident	9 Å²	9	62.6 Å²	62.6	4%	0.039	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	153.4	-175.2	60.9	-75.5	0	0	0	111.6	K117 D128 K130 F134 T141 M142	F115-K117 HydrophobicContact CD2-CB 4.06Å; F115-K117 HydrophobicContact CE2-CB 4.1Å; F115-D128 VanDerWaalsContact CD1-O 3.26Å; F115-D128 WeakPolarHBondContact CD1-O 3.39Å; F115-D128 HydrophobicContact CE1-CB 3.93Å; F115-D128 HydrophobicContact CE2-CB 4.11Å; F115-D128 HydrophobicContact CZ-CB 3.6Å; F115-D128 PolarHBondContact N-O 3.04Å; F115-D128 PolarHBondContact O-N 3.13Å; F115-D128 VanDerWaalsContact O-O 3.09Å; F115-K130 HydrophobicContact CE1-CD 3.88Å; F115-K130 HydrophobicContact CE1-CG 4.08Å; F115-K130 HydrophobicContact CZ-CD 4.24Å; F115-F134 HydrophobicContact CB-CE1 4.31Å; F115-F134 HydrophobicContact CB-CZ 3.8Å; F115-F134 HydrophobicContact CD1-CD1 4.42Å; F115-F134 AromaticContact CD1-CE1 3.35Å; F115-F134 HydrophobicContact CD1-CE1 3.35Å; F115-F134 AromaticContact CD1-CZ 3.47Å; F115-F134 HydrophobicContact CD1-CZ 3.47Å; F115-F134 VanDerWaalsContact CD1-CZ 3.47Å; F115-F134 HydrophobicContact CD2-CE2 4.45Å; F115-F134 AromaticContact CD2-CZ 3.85Å; F115-F134 HydrophobicContact CD2-CZ 3.85Å; F115-F134 HydrophobicContact CE1-CD1 4.46Å; F115-F134 AromaticContact CE1-CE1 3.75Å; F115-F134 HydrophobicContact CE1-CE1 3.75Å; F115-F134 AromaticContact CE1-CZ 3.99Å; F115-F134 HydrophobicContact CE1-CZ 3.99Å; F115-F134 HydrophobicContact CE2-CZ 4.32Å; F115-F134 AromaticContact CG-CE1 3.83Å; F115-F134 HydrophobicContact CG-CE1 3.83Å; F115-F134 HydrophobicContact CG-CE2 4.41Å; F115-F134 AromaticContact CG-CZ 3.42Å; F115-F134 HydrophobicContact CG-CZ 3.42Å; F115-F134 VanDerWaalsContact CG-CZ 3.42Å; F115-F134 HydrophobicContact CZ-CE1 4.49Å; F115-F134 HydrophobicContact CZ-CZ 4.39Å; F115-T141 CarbonylContact C-O 3.55Å; F115-T141 WeakPolarHBondContact CA-O 3.33Å; F115-M142 HydrophobicContact CB-SD 4.07Å
116	A	90.1	Very high	82.7	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	114.9	166.4	0	0	0	0	0	109.1	L125 T126 T141 I143 L196 I198	A116-L125 HydrophobicContact CB-CB 4.39Å; A116-T126 WeakPolarHBondContact CA-O 3.21Å; A116-T141 PolarHBondContact N-O 3.33Å; A116-T141 PolarHBondContact O-N 2.96Å; A116-I143 HydrophobicContact CB-CD1 4.1Å; A116-L196 HydrophobicContact CB-CD2 3.94Å; A116-L196 HydrophobicContact CB-CG 4.44Å; A116-I198 HydrophobicContact CB-CD1 4.15Å; A116-I198 HydrophobicContact CB-CG1 4.46Å
117	K	86.7	Confident	83.3	Confident	69 Å²	69	57.3 Å²	57.3	30%	0.3	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135.1	178.8	-178.8	161.1	-160.9	73.4	0	111	F115 L125 T126 T137 E139 D140	F115-K117 HydrophobicContact CD2-CB 4.06Å; F115-K117 HydrophobicContact CE2-CB 4.1Å; K117-L125 WeakPolarHBondContact O-CA 3.32Å; K117-T126 PolarHBondContact N-O 2.83Å; K117-T126 PolarHBondContact O-N 2.97Å; K117-T137 PolarHBondContact NZ-OG1 3.05Å; K117-E139 IonicContact NZ-OE2 3.23Å; K117-D140 WeakPolarHBondContact CB-OD1 3.49Å; K117-D140 WeakPolarHBondContact CD-OD1 3.03Å; K117-D140 WeakPolarHBondContact CG-OD1 3.38Å; K117-D140 IonicContact NZ-OD1 3.53Å; K117-D140 PolarHBondContact NZ-OD1 3.44Å; K117-D140 IonicContact NZ-OD2 3.62Å
118	R	81.2	Confident	83.6	Confident	116 Å²	116	56.5 Å²	56.5	44%	0.438	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	131.8	171.1	-164.4	-173.8	-124.6	124.7	-6	110.1	S122 D123 L125	R118-S122 WeakPolarHBondContact CD-O 3.12Å; R118-S122 WeakPolarHBondContact CG-O 3Å; R118-D123 IonicContact CZ-OD1 3.33Å; R118-D123 IonicContact NE-OD1 3.15Å; R118-D123 PolarHBondContact NE-OD1 2.96Å; R118-D123 VanDerWaalsContact NE-OD1 3.15Å; R118-D123 IonicContact NH2-OD1 2.68Å; R118-D123 PolarHBondContact NH2-OD1 3.34Å; R118-L125 HydrophobicContact CB-CD2 3.97Å
119	L	71.9	Confident	83.8	Confident	85 Å²	85	51.3 Å²	51.3	45%	0.445	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-78	120.8	167.9	-89.1	68.3	0	0	0	108.9	S122 E124 T126	L119-S122 WeakPolarHBondContact CB-OG 3.28Å; L119-S122 PolarHBondContact O-N 2.95Å; L119-S122 PolarHBondContact O-OG 3.5Å; L119-E124 PolarHBondContact N-O 3.49Å; L119-E124 VanDerWaalsContact N-O 3.09Å; L119-T126 WeakPolarHBondContact CD1-OG1 3.34Å
120	S	61.7	Low	83.8	Confident	103 Å²	103	54.5 Å²	54.5	72%	0.72	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	140.9	-177.3	46.8	0	0	0	0	112.2	S122	S120-S122 VanDerWaalsContact C-N 3.3Å; S120-S122 PolarHBondContact O-N 2.77Å
121	S	65	Low	83.7	Confident	139 Å²	139	56 Å²	56	97%	0.972	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	0.8	-165.3	76	0	0	0	0	117.6
122	S	64.1	Low	83.4	Confident	38 Å²	38	59.3 Å²	59.3	27%	0.266	32%	0.316	S	S	.	.	S	Bend	trans	-133	154.8	177	75.2	0	0	0	0	113	R118 L119 S120 E124	R118-S122 WeakPolarHBondContact CD-O 3.12Å; R118-S122 WeakPolarHBondContact CG-O 3Å; L119-S122 WeakPolarHBondContact CB-OG 3.28Å; L119-S122 PolarHBondContact O-N 2.95Å; L119-S122 PolarHBondContact O-OG 3.5Å; S120-S122 VanDerWaalsContact C-N 3.3Å; S120-S122 PolarHBondContact O-N 2.77Å; S122-E124 PolarHBondContact O-N 2.87Å; S122-E124 PolarHBondContact OG-N 3.15Å
123	D	70.2	Confident	82.7	Confident	130 Å²	130	62.9 Å²	62.9	70%	0.695	34%	0.341	S	S	*	.			trans	-82.8	13.7	167.6	-76.2	-39	0	0	0	113.2	R118 L125	R118-D123 IonicContact CZ-OD1 3.33Å; R118-D123 IonicContact NE-OD1 3.15Å; R118-D123 PolarHBondContact NE-OD1 2.96Å; R118-D123 VanDerWaalsContact NE-OD1 3.15Å; R118-D123 IonicContact NH2-OD1 2.68Å; R118-D123 PolarHBondContact NH2-OD1 3.34Å; D123-L125 PolarHBondContact O-N 2.79Å
124	E	82.3	Confident	81.8	Confident	56 Å²	56	60.2 Å²	60.2	26%	0.262	33%	0.332	S	S	.	.			trans	-85.1	106.2	-179	-62.1	-153.3	134.6	0	0	111.4	L119 S122 H200 K234	L119-E124 PolarHBondContact N-O 3.49Å; L119-E124 VanDerWaalsContact N-O 3.09Å; S122-E124 PolarHBondContact O-N 2.87Å; S122-E124 PolarHBondContact OG-N 3.15Å; E124-H200 IonicContact OE1-NE2 2.79Å; E124-H200 IonicContact OE2-CD2 2.87Å; E124-H200 IonicContact OE2-CE1 3.3Å; E124-H200 IonicContact OE2-NE2 2.71Å; E124-H200 PolarHBondContact OE2-NE2 3.35Å; E124-K234 IonicContact OE1-NZ 2.97Å; E124-K234 PolarHBondContact OE1-NZ 3.32Å
125	L	87.3	Confident	80.5	Confident	27 Å²	27	68.9 Å²	68.9	14%	0.141	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	133.8	169.6	-67	176.8	0	0	0	111.2	A116 K117 R118 D123 L196 S199 H200	A116-L125 HydrophobicContact CB-CB 4.39Å; K117-L125 WeakPolarHBondContact O-CA 3.32Å; R118-L125 HydrophobicContact CB-CD2 3.97Å; D123-L125 PolarHBondContact O-N 2.79Å; L125-L196 HydrophobicContact CD1-CD1 3.57Å; L125-L196 HydrophobicContact CD1-CG 4.44Å; L125-S199 PolarHBondContact O-N 2.92Å; L125-H200 PolarHBondContact O-N 3.26Å
126	T	88.8	Confident	79.1	Confident	30 Å²	30	72 Å²	72	18%	0.184	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.9	172.6	-64.9	0	0	0	0	111.2	A116 K117 L119 H200	A116-T126 WeakPolarHBondContact CA-O 3.21Å; K117-T126 PolarHBondContact N-O 2.83Å; K117-T126 PolarHBondContact O-N 2.97Å; L119-T126 WeakPolarHBondContact CD1-OG1 3.34Å; T126-H200 VanDerWaalsContact CA-O 3.3Å; T126-H200 WeakPolarHBondContact CA-O 3.47Å; T126-H200 HydrophobicContact CG2-CB 4.31Å
127	F	92.3	Very high	78	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.009	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	126.7	177.6	-177.5	-108.6	0	0	0	112.5	C114 C129 I143 L176 I198 H200 L201 K202 V205 L206 I209	C114-F127 HydrophobicContact CB-CE2 3.91Å; C114-F127 HydrophobicContact CB-CZ 4.03Å; F127-C129 WeakPolarHBondContact CZ-SG 3.15Å; F127-I143 HydrophobicContact CD2-CD1 3.46Å; F127-I143 VanDerWaalsContact CD2-CD1 3.46Å; F127-I143 HydrophobicContact CE2-CB 4.39Å; F127-I143 HydrophobicContact CE2-CD1 3.47Å; F127-I143 VanDerWaalsContact CE2-CD1 3.47Å; F127-I143 HydrophobicContact CE2-CG2 4.15Å; F127-L176 HydrophobicContact CZ-CD1 3.98Å; F127-I198 HydrophobicContact CB-CD1 3.9Å; F127-I198 HydrophobicContact CB-CG2 3.82Å; F127-I198 HydrophobicContact CD2-CD1 3.97Å; F127-I198 HydrophobicContact CG-CD1 4.27Å; F127-H200 PolarHBondContact N-O 2.96Å; F127-L201 HydrophobicContact CB-CD1 4.12Å; F127-L201 HydrophobicContact CD1-CD1 3.45Å; F127-L201 VanDerWaalsContact CD1-CD1 3.45Å; F127-L201 HydrophobicContact CD1-CG 4.17Å; F127-L201 HydrophobicContact CE1-CD1 4.23Å; F127-L201 HydrophobicContact CG-CD1 4.12Å; F127-K202 VanDerWaalsContact O-CB 3.27Å; F127-K202 WeakPolarHBondContact O-CB 3.27Å; F127-K202 PolarHBondContact O-N 3.46Å; F127-K202 VanDerWaalsContact O-N 3.09Å; F127-V205 HydrophobicContact CD1-CG1 3.6Å; F127-V205 HydrophobicContact CE1-CG1 3.79Å; F127-V205 HydrophobicContact CE1-CG2 4.4Å; F127-L206 HydrophobicContact CE1-CD2 4.21Å; F127-I209 HydrophobicContact CE1-CD1 4.01Å; F127-I209 HydrophobicContact CZ-CD1 4.02Å
128	D	91.9	Very high	76.8	Confident	29 Å²	29	78 Å²	78	16%	0.155	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	160.1	174.6	-169.4	10.5	0	0	0	110.7	F115 K202	F115-D128 VanDerWaalsContact CD1-O 3.26Å; F115-D128 WeakPolarHBondContact CD1-O 3.39Å; F115-D128 HydrophobicContact CE1-CB 3.93Å; F115-D128 HydrophobicContact CE2-CB 4.11Å; F115-D128 HydrophobicContact CZ-CB 3.6Å; F115-D128 PolarHBondContact N-O 3.04Å; F115-D128 PolarHBondContact O-N 3.13Å; F115-D128 VanDerWaalsContact O-O 3.09Å; D128-K202 HydrophobicContact CB-CD 4.06Å; D128-K202 WeakPolarHBondContact OD1-CD 3.28Å; D128-K202 WeakPolarHBondContact OD1-CE 3.47Å; D128-K202 IonicContact OD1-NZ 3.87Å; D128-K202 PolarHBondContact OD1-NZ 3.1Å; D128-K202 IonicContact OD2-NZ 3.71Å; D128-K202 PolarHBondContact OD2-NZ 3.3Å
129	C	92.6	Very high	76.2	Confident	7 Å²	7	77.5 Å²	77.5	5%	0.047	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	151.2	173.8	-49.8	0	0	0	0	111.2	Y113 C114 F127 V205 W208 I209	Y113-C129 CarbonylContact O-C 3.26Å; Y113-C129 WeakPolarHBondContact O-CA 3.3Å; C114-C129 VanDerWaalsContact CA-SG 3.57Å; C114-C129 HydrophobicContact CB-CB 4.05Å; C114-C129 WeakPolarHBondContact CB-SG 3.48Å; C114-C129 WeakPolarHBondContact SG-CB 3.3Å; C114-C129 CovalentContact SG-SG 2.04Å; C114-C129 PolarHBondContact SG-SG 3.2Å; F127-C129 WeakPolarHBondContact CZ-SG 3.15Å; C129-V205 HydrophobicContact CB-CG2 4.01Å; C129-W208 HydrophobicContact CB-CE3 4.01Å; C129-W208 HydrophobicContact CB-CZ3 3.57Å; C129-I209 HydrophobicContact CB-CG1 4.32Å; C129-I209 VanDerWaalsContact SG-CD1 3.53Å
130	K	90.8	Very high	76.5	Confident	78 Å²	78	74.2 Å²	74.2	34%	0.339	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	156.3	179.9	-68.7	161.6	-175.1	158.2	0	110.5	Y113 F115 Q132 F134 W208	Y113-K130 PolarHBondContact N-O 3.11Å; Y113-K130 PolarHBondContact O-N 3.44Å; F115-K130 HydrophobicContact CE1-CD 3.88Å; F115-K130 HydrophobicContact CE1-CG 4.08Å; F115-K130 HydrophobicContact CZ-CD 4.24Å; K130-Q132 VanDerWaalsContact C-N 3.31Å; K130-F134 HydrophobicContact CD-CB 4.27Å; K130-F134 HydrophobicContact CD-CD1 3.64Å; K130-F134 HydrophobicContact CD-CE1 4.28Å; K130-F134 HydrophobicContact CD-CG 4.04Å; K130-W208 VanDerWaalsContact C-CH2 3.47Å
131	S	86.9	Confident	77.6	Confident	65 Å²	65	71.7 Å²	71.7	46%	0.455	41%	0.406	S	S	.	.	S	Bend	trans	-77.8	-14.2	175.5	50.1	0	0	0	0	114.7	D111	D111-S131 VanDerWaalsContact O-CA 3.31Å; D111-S131 WeakPolarHBondContact O-CA 3.19Å
132	Q	81.6	Confident	78.7	Confident	150 Å²	150	67.6 Å²	67.6	70%	0.701	37%	0.372	S	S	*	.	S	Bend	trans	-125.1	143.5	-179.6	-65.7	177.6	-4.2	0	0	109.2	Y113 K130 F134	Y113-Q132 VanDerWaalsContact CD2-C 3.4Å; K130-Q132 VanDerWaalsContact C-N 3.31Å; Q132-F134 PolarHBondContact O-N 3.11Å
133	S	75.8	Confident	79.9	Confident	85 Å²	85	66 Å²	66	59%	0.594	36%	0.361	S	S	*	.			trans	-57.3	126.5	167	53.1	0	0	0	0	109.2	Y113	Y113-S133 VanDerWaalsContact CD2-N 3.34Å
134	F	73.2	Confident	80.9	Confident	45 Å²	45	61.4 Å²	61.4	20%	0.197	34%	0.336	C	S	.	.			trans	-107.4	160.9	173.2	65.1	-78.2	0	0	0	109	F115 K130 Q132 V136 M142	F115-F134 HydrophobicContact CB-CE1 4.31Å; F115-F134 HydrophobicContact CB-CZ 3.8Å; F115-F134 HydrophobicContact CD1-CD1 4.42Å; F115-F134 AromaticContact CD1-CE1 3.35Å; F115-F134 HydrophobicContact CD1-CE1 3.35Å; F115-F134 AromaticContact CD1-CZ 3.47Å; F115-F134 HydrophobicContact CD1-CZ 3.47Å; F115-F134 VanDerWaalsContact CD1-CZ 3.47Å; F115-F134 HydrophobicContact CD2-CE2 4.45Å; F115-F134 AromaticContact CD2-CZ 3.85Å; F115-F134 HydrophobicContact CD2-CZ 3.85Å; F115-F134 HydrophobicContact CE1-CD1 4.46Å; F115-F134 AromaticContact CE1-CE1 3.75Å; F115-F134 HydrophobicContact CE1-CE1 3.75Å; F115-F134 AromaticContact CE1-CZ 3.99Å; F115-F134 HydrophobicContact CE1-CZ 3.99Å; F115-F134 HydrophobicContact CE2-CZ 4.32Å; F115-F134 AromaticContact CG-CE1 3.83Å; F115-F134 HydrophobicContact CG-CE1 3.83Å; F115-F134 HydrophobicContact CG-CE2 4.41Å; F115-F134 AromaticContact CG-CZ 3.42Å; F115-F134 HydrophobicContact CG-CZ 3.42Å; F115-F134 VanDerWaalsContact CG-CZ 3.42Å; F115-F134 HydrophobicContact CZ-CE1 4.49Å; F115-F134 HydrophobicContact CZ-CZ 4.39Å; K130-F134 HydrophobicContact CD-CB 4.27Å; K130-F134 HydrophobicContact CD-CD1 3.64Å; K130-F134 HydrophobicContact CD-CE1 4.28Å; K130-F134 HydrophobicContact CD-CG 4.04Å; Q132-F134 PolarHBondContact O-N 3.11Å; F134-V136 PolarHBondContact O-N 2.9Å; F134-M142 HydrophobicContact CZ-SD 4.08Å
135	E	65	Low	81.4	Confident	183 Å²	183	59 Å²	59	86%	0.855	33%	0.325	S	S	*	.			trans	-66.2	113.2	174.3	-168.5	164.1	-144.8	0	0	109.3	T137	E135-T137 PolarHBondContact O-N 2.84Å
136	V	62.7	Low	81.7	Confident	75 Å²	75	58.8 Å²	58.8	46%	0.455	32%	0.323	S	S	.	.			trans	-73.7	116.4	-173.7	-177.7	0	0	0	0	108.6	F134 D140 M142	F134-V136 PolarHBondContact O-N 2.9Å; V136-D140 HydrophobicContact CG1-CB 4.3Å; V136-M142 HydrophobicContact CB-SD 4.47Å; V136-M142 HydrophobicContact CG1-CG 3.9Å; V136-M142 HydrophobicContact CG1-SD 3.94Å; V136-M142 HydrophobicContact CG2-CE 4.31Å; V136-M142 HydrophobicContact CG2-CG 4.17Å; V136-M142 HydrophobicContact CG2-SD 3.66Å
137	T	65.6	Low	81.9	Confident	61 Å²	61	59.3 Å²	59.3	37%	0.374	32%	0.323	S	S	.	.			trans	-80.3	153.4	173.3	70.5	0	0	0	0	109.8	K117 E135 E139 D140	K117-T137 PolarHBondContact NZ-OG1 3.05Å; E135-T137 PolarHBondContact O-N 2.84Å; T137-E139 PolarHBondContact O-N 2.98Å; T137-D140 WeakPolarHBondContact CB-OD2 3.37Å; T137-D140 PolarHBondContact N-OD2 3.27Å; T137-D140 VanDerWaalsContact N-OD2 3.16Å; T137-D140 PolarHBondContact O-N 3.41Å; T137-D140 PolarHBondContact OG1-OD2 3.45Å
138	S	61.8	Low	81.7	Confident	135 Å²	135	61.2 Å²	61.2	94%	0.944	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-5.1	178.8	48.5	0	0	0	0	114.5
139	E	69.6	Low	81.3	Confident	104 Å²	104	65 Å²	65	49%	0.486	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-10.9	172.1	-57.4	-174.7	147.3	0	0	113.9	K117 T137	K117-E139 IonicContact NZ-OE2 3.23Å; T137-E139 PolarHBondContact O-N 2.98Å
140	D	78	Confident	80.5	Confident	16 Å²	16	66.4 Å²	66.4	9%	0.086	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	116.9	-174.7	-57.9	-44.8	0	0	0	110.7	K117 V136 T137	K117-D140 WeakPolarHBondContact CB-OD1 3.49Å; K117-D140 WeakPolarHBondContact CD-OD1 3.03Å; K117-D140 WeakPolarHBondContact CG-OD1 3.38Å; K117-D140 IonicContact NZ-OD1 3.53Å; K117-D140 PolarHBondContact NZ-OD1 3.44Å; K117-D140 IonicContact NZ-OD2 3.62Å; V136-D140 HydrophobicContact CG1-CB 4.3Å; T137-D140 WeakPolarHBondContact CB-OD2 3.37Å; T137-D140 PolarHBondContact N-OD2 3.27Å; T137-D140 VanDerWaalsContact N-OD2 3.16Å; T137-D140 PolarHBondContact O-N 3.41Å; T137-D140 PolarHBondContact OG1-OD2 3.45Å
141	T	84.3	Confident	79.5	Confident	51 Å²	51	65.8 Å²	65.8	31%	0.313	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	115.8	172.8	-53.9	0	0	0	0	110	F115 A116 L196	F115-T141 CarbonylContact C-O 3.55Å; F115-T141 WeakPolarHBondContact CA-O 3.33Å; A116-T141 PolarHBondContact N-O 3.33Å; A116-T141 PolarHBondContact O-N 2.96Å; T141-L196 HydrophobicContact CG2-CD1 3.9Å; T141-L196 HydrophobicContact CG2-CD2 3.97Å
142	M	87.9	Confident	78.5	Confident	52 Å²	52	63.8 Å²	63.8	26%	0.256	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	144.5	-179.9	-66.7	-57.7	-65.8	0	0	112.5	F115 F134 V136 S179	F115-M142 HydrophobicContact CB-SD 4.07Å; F134-M142 HydrophobicContact CZ-SD 4.08Å; V136-M142 HydrophobicContact CB-SD 4.47Å; V136-M142 HydrophobicContact CG1-CG 3.9Å; V136-M142 HydrophobicContact CG1-SD 3.94Å; V136-M142 HydrophobicContact CG2-CE 4.31Å; V136-M142 HydrophobicContact CG2-CG 4.17Å; V136-M142 HydrophobicContact CG2-SD 3.66Å; M142-S179 WeakPolarHBondContact O-CB 3.4Å; M142-S179 PolarHBondContact O-N 2.88Å
143	I	90.2	Very high	77.3	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.026	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	115.4	-179.1	-66.6	164.9	0	0	0	108.3	C114 A116 F127 L176 K177 L196 I198 I231	C114-I143 HydrophobicContact CB-CB 4.08Å; C114-I143 HydrophobicContact CB-CG2 4.26Å; C114-I143 PolarHBondContact O-N 3.01Å; A116-I143 HydrophobicContact CB-CD1 4.1Å; F127-I143 HydrophobicContact CD2-CD1 3.46Å; F127-I143 VanDerWaalsContact CD2-CD1 3.46Å; F127-I143 HydrophobicContact CE2-CB 4.39Å; F127-I143 HydrophobicContact CE2-CD1 3.47Å; F127-I143 VanDerWaalsContact CE2-CD1 3.47Å; F127-I143 HydrophobicContact CE2-CG2 4.15Å; I143-L176 HydrophobicContact CG2-CB 4.33Å; I143-K177 CarbonylContact C-O 3.55Å; I143-K177 WeakPolarHBondContact CA-O 3.26Å; I143-K177 WeakPolarHBondContact CG2-O 3.47Å; I143-L196 HydrophobicContact CD1-CD2 3.66Å; I143-L196 HydrophobicContact CG1-CD2 3.82Å; I143-I198 HydrophobicContact CD1-CD1 4.12Å; I143-I231 HydrophobicContact CD1-CD1 4.16Å; I143-I231 HydrophobicContact CG1-CD1 4.4Å; I143-I231 HydrophobicContact CG2-CD1 3.92Å
144	D	89.9	Confident	76.2	Confident	33 Å²	33	62.2 Å²	62.2	18%	0.176	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	130.2	177.8	-56.6	-26.9	0	0	0	109.8	L176 K177 S179	D144-L176 WeakPolarHBondContact O-CA 3.47Å; D144-K177 HydrophobicContact CB-CG 4Å; D144-K177 PolarHBondContact N-O 3.4Å; D144-K177 PolarHBondContact O-N 2.87Å; D144-S179 WeakPolarHBondContact OD1-CB 3.48Å; D144-S179 PolarHBondContact OD1-OG 3.19Å; D144-S179 WeakPolarHBondContact OD2-CA 3.23Å; D144-S179 PolarHBondContact OD2-OG 3.23Å
145	C	93.8	Very high	75.1	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.034	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	120.7	166.8	-176.2	0	0	0	0	108.3	L108 C109 V112 V175 L176	L108-C145 CarbonylContact C-O 3.51Å; L108-C145 WeakPolarHBondContact CA-O 3.44Å; C109-C145 HydrophobicContact CB-CB 3.55Å; C109-C145 WeakPolarHBondContact CB-SG 3.35Å; C109-C145 PolarHBondContact N-O 3.05Å; C109-C145 WeakPolarHBondContact SG-CB 3.04Å; C109-C145 PolarHBondContact SG-O 3.26Å; C109-C145 CovalentContact SG-SG 2.04Å; C109-C145 PolarHBondContact SG-SG 3.21Å; V112-C145 HydrophobicContact CG1-CB 4.03Å; C145-V175 WeakPolarHBondContact CA-O 3.36Å; C145-L176 HydrophobicContact CB-CD2 3.73Å
146	H	92.6	Very high	74.3	Confident	23 Å²	23	59.3 Å²	59.3	11%	0.106	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	149.3	174.8	-71.7	-104.4	0	0	0	110.7	E106 S107 I174 V175 K177	E106-H146 HydrophobicContact CG-CB 4.01Å; E106-H146 IonicContact OE1-CE1 3.68Å; E106-H146 PolarHBondContact OE1-CE1 3.28Å; E106-H146 IonicContact OE1-CG 3.64Å; E106-H146 VanDerWaalsContact OE1-CG 3.29Å; E106-H146 IonicContact OE1-ND1 2.92Å; E106-H146 PolarHBondContact OE1-ND1 3.33Å; S107-H146 CarbonylContact O-C 3.57Å; S107-H146 WeakPolarHBondContact O-CA 3.34Å; H146-I174 CarbonylContact O-C 3.58Å; H146-I174 WeakPolarHBondContact O-CA 3.44Å; H146-V175 PolarHBondContact N-O 3.45Å; H146-V175 PolarHBondContact O-N 2.82Å; H146-K177 WeakPolarHBondContact CD2-CE 3.31Å; H146-K177 PolarHBondContact CD2-NZ 2.94Å; H146-K177 VanDerWaalsContact CD2-NZ 3.28Å; H146-K177 PolarHBondContact CE1-NZ 2.91Å; H146-K177 WeakPolarHBondContact NE2-CE 3.26Å; H146-K177 PolarHBondContact NE2-NZ 3.37Å
147	Y	92.4	Very high	73.6	Confident	42 Å²	42	59.7 Å²	59.7	17%	0.165	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	159	173.2	83.2	-80.8	0	0	0	112.1	S107 L108 L172 R173 V213 L217	S107-Y147 PolarHBondContact N-O 2.92Å; S107-Y147 VanDerWaalsContact O-CD1 3.26Å; S107-Y147 WeakPolarHBondContact O-CD1 3.39Å; S107-Y147 PolarHBondContact O-N 2.89Å; L108-Y147 VanDerWaalsContact O-CE1 3.3Å; L108-Y147 WeakPolarHBondContact O-CE1 3.47Å; Y147-L172 HydrophobicContact CD2-CD1 3.96Å; Y147-R173 WeakPolarHBondContact CA-O 3.38Å; Y147-R173 WeakPolarHBondContact CB-O 3.36Å; Y147-V213 HydrophobicContact CG-CG1 4.48Å; Y147-L217 HydrophobicContact CD2-CD1 3.48Å; Y147-L217 VanDerWaalsContact CD2-CD1 3.48Å; Y147-L217 HydrophobicContact CE2-CD1 3.43Å; Y147-L217 VanDerWaalsContact CE2-CD1 3.43Å; Y147-L217 HydrophobicContact CE2-CD2 3.67Å; Y147-L217 HydrophobicContact CE2-CG 4.19Å; Y147-L217 HydrophobicContact CG-CD1 4.21Å
148	W	89	Confident	72.6	Confident	42 Å²	42	64.2 Å²	64.2	16%	0.159	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	159	162.4	61.2	95.7	0	0	0	110.6	V104 E106 R173 V175	V104-W148 HydrophobicContact CG1-CB 3.79Å; V104-W148 HydrophobicContact CG1-CD2 4Å; V104-W148 HydrophobicContact CG1-CG 3.44Å; V104-W148 VanDerWaalsContact CG1-CG 3.44Å; E106-W148 HydrophobicContact CB-CE3 4.4Å; E106-W148 HydrophobicContact CG-CE3 4.11Å; E106-W148 HydrophobicContact CG-CZ3 4.31Å; W148-R173 HydrophobicContact CD2-CB 3.94Å; W148-R173 HydrophobicContact CG-CB 4.3Å; W148-R173 HydrophobicContact CZ2-CB 4.02Å; W148-R173 HydrophobicContact CZ2-CG 4.41Å; W148-R173 PolarHBondContact N-O 2.82Å; W148-R173 VanDerWaalsContact N-O 3.1Å; W148-R173 PolarHBondContact O-N 2.82Å; W148-V175 HydrophobicContact CH2-CG2 3.49Å; W148-V175 VanDerWaalsContact CH2-CG2 3.49Å; W148-V175 HydrophobicContact CZ3-CB 4.46Å; W148-V175 HydrophobicContact CZ3-CG2 3.51Å
149	H	84.3	Confident	71.8	Confident	107 Å²	107	65.1 Å²	65.1	50%	0.495	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	137.2	171.6	53.6	41.6	0	0	0	111.1	Y170	H149-Y170 HydrophobicContact CB-CD1 4.12Å
150	V	75.9	Confident	70.7	Confident	38 Å²	38	63.3 Å²	63.3	23%	0.23	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.2	171.4	179.7	0	0	0	0	107.8	S152 Y170 D171 R173	V150-S152 PolarHBondContact O-N 3.11Å; V150-Y170 CarbonylContact O-C 3.56Å; V150-Y170 WeakPolarHBondContact O-CA 3.48Å; V150-D171 PolarHBondContact N-O 3.5Å; V150-D171 PolarHBondContact O-N 2.73Å; V150-R173 HydrophobicContact CG2-CG 4.01Å
151	P	68.9	Low	69.1	Low	65 Å²	65	73.8 Å²	73.8	42%	0.422	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	127.4	173.4	-22.2	33	0	0	0	110.7	Y170	P151-Y170 HydrophobicContact CB-CE1 4.38Å; P151-Y170 HydrophobicContact CG-CE1 4.12Å
152	S	65.6	Low	67	Low	23 Å²	23	79.4 Å²	79.4	16%	0.161	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-64.9	142.5	178.6	-52.7	0	0	0	0	110.2	V150 G154 A155 G169 Y170 D171	V150-S152 PolarHBondContact O-N 3.11Å; S152-G154 PolarHBondContact O-N 3.15Å; S152-A155 VanDerWaalsContact O-CB 3.23Å; S152-A155 WeakPolarHBondContact O-CB 3.44Å; S152-A155 PolarHBondContact O-N 2.84Å; S152-A155 VanDerWaalsContact O-N 3.09Å; S152-G169 PolarHBondContact N-O 3.03Å; S152-G169 WeakPolarHBondContact OG-CA 3.21Å; S152-G169 PolarHBondContact OG-O 2.85Å; S152-Y170 WeakPolarHBondContact OG-CA 3.5Å; S152-Y170 PolarHBondContact OG-N 2.88Å; S152-Y170 VanDerWaalsContact OG-N 3.1Å; S152-D171 VanDerWaalsContact CB-OD1 3.31Å; S152-D171 WeakPolarHBondContact CB-OD1 3.48Å; S152-D171 PolarHBondContact OG-N 3.28Å; S152-D171 PolarHBondContact OG-OD1 2.68Å
153	P	56.3	Low	65.2	Low	124 Å²	124	78.2 Å²	78.2	81%	0.805	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	130	175.1	-25.2	34.7	0	0	0	111.9
154	G	52.4	Low	63.3	Low	77 Å²	77	82.6 Å²	82.6	79%	0.794	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	9.1	-177.6	0	0	0	0	0	115.6	S152 D156	S152-G154 PolarHBondContact O-N 3.15Å; G154-D156 VanDerWaalsContact C-N 3.35Å; G154-D156 PolarHBondContact O-N 3.36Å
155	A	50.7	Low	61.3	Low	43 Å²	43	88.1 Å²	88.1	36%	0.355	47%	0.468	S	S	.	.			trans	-75.3	81.9	172.3	0	0	0	0	0	111.8	S152 S157	S152-A155 VanDerWaalsContact O-CB 3.23Å; S152-A155 WeakPolarHBondContact O-CB 3.44Å; S152-A155 PolarHBondContact O-N 2.84Å; S152-A155 VanDerWaalsContact O-N 3.09Å; A155-S157 PolarHBondContact O-N 3.02Å
156	D	47.3	Very low	59.2	Low	125 Å²	125	92.5 Å²	92.5	67%	0.668	49%	0.488	S	S	*	.			trans	-50.2	128.9	177.4	-78.9	-25.1	0	0	0	112.3	G154 N158 Q159	G154-D156 VanDerWaalsContact C-N 3.35Å; G154-D156 PolarHBondContact O-N 3.36Å; D156-N158 PolarHBondContact O-N 2.81Å; D156-Q159 PolarHBondContact O-N 2.97Å
157	S	49.9	Very low	57.5	Low	82 Å²	82	91.5 Å²	91.5	57%	0.573	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-55.5	-26.4	-174.3	50.8	0	0	0	0	114	A155 Q160	A155-S157 PolarHBondContact O-N 3.02Å; S157-Q160 WeakPolarHBondContact O-CB 3.46Å; S157-Q160 VanDerWaalsContact O-CG 3.27Å; S157-Q160 WeakPolarHBondContact O-CG 3.43Å
158	N	44.2	Very low	55.7	Low	156 Å²	156	95.4 Å²	95.4	83%	0.834	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-79.3	-17.9	-174.4	-65.4	-30.5	0	0	0	114.8	D156	D156-N158 PolarHBondContact O-N 2.81Å
159	Q	43.9	Very low	54.5	Low	155 Å²	155	94.5 Å²	94.5	72%	0.724	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-90.7	-0.9	175.3	-67.7	-163.8	5.2	0	0	114.1	D156 R161 Q162	D156-Q159 PolarHBondContact O-N 2.97Å; Q159-R161 PolarHBondContact O-N 3.44Å; Q159-Q162 PolarHBondContact O-N 2.86Å
160	Q	46.3	Very low	53.9	Low	66 Å²	66	91.1 Å²	91.1	31%	0.308	49%	0.488	S	S	.	.	H	α-helix	trans	-58.2	-18	-166.3	-82.2	-171.2	19.1	0	0	117.1	S157 K164	S157-Q160 WeakPolarHBondContact O-CB 3.46Å; S157-Q160 VanDerWaalsContact O-CG 3.27Å; S157-Q160 WeakPolarHBondContact O-CG 3.43Å; Q160-K164 WeakPolarHBondContact O-CD 3.41Å; Q160-K164 WeakPolarHBondContact O-CG 3.4Å
161	R	45.4	Very low	54.2	Low	236 Å²	236	91.4 Å²	91.4	89%	0.891	49%	0.488	S	S	*	.	H	α-helix	trans	-77.3	-32.6	-174.7	-77.1	-169.6	174.8	-166.4	-0.8	114.5	Q159	Q159-R161 PolarHBondContact O-N 3.44Å
162	Q	39.5	Very low	55.1	Low	168 Å²	168	88.3 Å²	88.3	79%	0.785	47%	0.468	S	S	*	.	H	α-helix	trans	-97.5	-29.1	177.8	-71.1	-177	-7.6	0	0	112.8	Q159 K164	Q159-Q162 PolarHBondContact O-N 2.86Å; Q162-K164 PolarHBondContact O-N 3.39Å
163	S	50.1	Low	56.3	Low	27 Å²	27	91.7 Å²	91.7	19%	0.189	48%	0.477	C	S	.	.	H	α-helix	trans	-68.3	-34.6	-177.8	84.7	0	0	0	0	113	Q165 H166 G167 K168	S163-Q165 VanDerWaalsContact C-N 3.33Å; S163-Q165 PolarHBondContact O-N 3.32Å; S163-H166 PolarHBondContact O-N 3.22Å; S163-G167 PolarHBondContact O-N 2.83Å; S163-K168 CarbonylContact C-O 3.55Å; S163-K168 WeakPolarHBondContact CB-O 3.44Å; S163-K168 PolarHBondContact O-N 2.78Å; S163-K168 PolarHBondContact OG-O 2.94Å
164	K	51.1	Low	58.1	Low	97 Å²	97	85.8 Å²	85.8	42%	0.422	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-59	-34.3	-178.6	-79.2	175.5	-173	174.5	0	114.2	Q160 Q162 H166 G167 Y170	Q160-K164 WeakPolarHBondContact O-CD 3.41Å; Q160-K164 WeakPolarHBondContact O-CG 3.4Å; Q162-K164 PolarHBondContact O-N 3.39Å; K164-H166 PolarHBondContact O-N 3.49Å; K164-H166 VanDerWaalsContact O-N 3.12Å; K164-G167 PolarHBondContact O-N 2.88Å; K164-Y170 HydrophobicContact CD-CE2 4.43Å; K164-Y170 WeakPolarHBondContact CE-OH 3.38Å; K164-Y170 HydrophobicContact CG-CD2 4.47Å; K164-Y170 HydrophobicContact CG-CE2 3.75Å
165	Q	47.8	Very low	60.1	Low	149 Å²	149	83.2 Å²	83.2	70%	0.696	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-69	-8.4	-177.3	-76.3	-171.5	-27.5	0	0	114.8	S163	S163-Q165 VanDerWaalsContact C-N 3.33Å; S163-Q165 PolarHBondContact O-N 3.32Å
166	H	50.2	Low	62.1	Low	98 Å²	98	81.2 Å²	81.2	45%	0.454	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-129.5	7.4	177	-63.3	-37.1	0	0	0	113.9	S163 K164 K168 L221	S163-H166 PolarHBondContact O-N 3.22Å; K164-H166 PolarHBondContact O-N 3.49Å; K164-H166 VanDerWaalsContact O-N 3.12Å; H166-K168 VanDerWaalsContact C-N 3.29Å; H166-K168 PolarHBondContact O-N 2.95Å; H166-L221 HydrophobicContact CB-CD1 4.3Å; H166-L221 PolarHBondContact O-N 2.86Å
167	G	55.4	Low	64.2	Low	1 Å²	1	78 Å²	78	1%	0.01	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	70	20.6	-173.1	0	0	0	0	0	114.2	S163 K164	S163-G167 PolarHBondContact O-N 2.83Å; K164-G167 PolarHBondContact O-N 2.88Å
168	K	56.2	Low	66	Low	125 Å²	125	74.6 Å²	74.6	54%	0.543	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	124.5	173.5	-72.5	-173.2	176.8	-176	0	109.3	S163 H166	S163-K168 CarbonylContact C-O 3.55Å; S163-K168 WeakPolarHBondContact CB-O 3.44Å; S163-K168 PolarHBondContact O-N 2.78Å; S163-K168 PolarHBondContact OG-O 2.94Å; H166-K168 VanDerWaalsContact C-N 3.29Å; H166-K168 PolarHBondContact O-N 2.95Å
169	G	62.8	Low	67.8	Low	22 Å²	22	68.2 Å²	68.2	23%	0.227	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	12.5	-175.2	0	0	0	0	0	114.8	S152	S152-G169 PolarHBondContact N-O 3.03Å; S152-G169 WeakPolarHBondContact OG-CA 3.21Å; S152-G169 PolarHBondContact OG-O 2.85Å
170	Y	73	Confident	68.9	Low	37 Å²	37	66.9 Å²	66.9	15%	0.145	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	127.6	167.2	-68.9	-89.5	0	0	0	111.1	H149 V150 P151 S152 K164 S222	H149-Y170 HydrophobicContact CB-CD1 4.12Å; V150-Y170 CarbonylContact O-C 3.56Å; V150-Y170 WeakPolarHBondContact O-CA 3.48Å; P151-Y170 HydrophobicContact CB-CE1 4.38Å; P151-Y170 HydrophobicContact CG-CE1 4.12Å; S152-Y170 WeakPolarHBondContact OG-CA 3.5Å; S152-Y170 PolarHBondContact OG-N 2.88Å; S152-Y170 VanDerWaalsContact OG-N 3.1Å; K164-Y170 HydrophobicContact CD-CE2 4.43Å; K164-Y170 WeakPolarHBondContact CE-OH 3.38Å; K164-Y170 HydrophobicContact CG-CD2 4.47Å; K164-Y170 HydrophobicContact CG-CE2 3.75Å; Y170-S222 VanDerWaalsContact O-CB 3.32Å; Y170-S222 WeakPolarHBondContact O-CB 3.33Å
171	D	80.9	Confident	69.1	Low	44 Å²	44	70.6 Å²	70.6	24%	0.235	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.2	171.2	-62.7	6.7	0	0	0	108.3	V150 S152 P223	V150-D171 PolarHBondContact N-O 3.5Å; V150-D171 PolarHBondContact O-N 2.73Å; S152-D171 VanDerWaalsContact CB-OD1 3.31Å; S152-D171 WeakPolarHBondContact CB-OD1 3.48Å; S152-D171 PolarHBondContact OG-N 3.28Å; S152-D171 PolarHBondContact OG-OD1 2.68Å; D171-P223 HydrophobicContact CB-CG 4.28Å; D171-P223 VanDerWaalsContact OD1-CG 3.28Å; D171-P223 WeakPolarHBondContact OD1-CG 3.37Å
172	L	88.6	Confident	68.7	Low	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.3	179	173.3	59.8	0	0	0	109.4	Y147 I174 V213 R214 L217 M219 P223 V224 H225	Y147-L172 HydrophobicContact CD2-CD1 3.96Å; L172-I174 HydrophobicContact CD1-CG1 4.46Å; L172-I174 HydrophobicContact CD2-CD1 4.25Å; L172-I174 HydrophobicContact CG-CD1 4.37Å; L172-I174 HydrophobicContact CG-CG1 4.15Å; L172-V213 HydrophobicContact CD2-CG1 4.14Å; L172-R214 HydrophobicContact CD2-CG 4.24Å; L172-L217 HydrophobicContact CD1-CD1 3.96Å; L172-L217 HydrophobicContact CD2-CD1 4.48Å; L172-M219 HydrophobicContact CD1-CE 4.13Å; L172-P223 PolarHBondContact N-O 2.84Å; L172-V224 HydrophobicContact CB-CG2 3.91Å; L172-V224 HydrophobicContact CD2-CG2 3.95Å; L172-V224 HydrophobicContact CG-CG2 4.07Å; L172-V224 CarbonylContact O-C 3.59Å; L172-V224 VanDerWaalsContact O-CA 3.28Å; L172-V224 WeakPolarHBondContact O-CA 3.47Å; L172-H225 PolarHBondContact O-N 3.09Å
173	R	91.5	Very high	68.3	Low	94 Å²	94	61.1 Å²	61.1	36%	0.355	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	136.8	170.7	-58.5	-145.6	-179.9	163.1	2.8	109.9	Y147 W148 V150 H225	Y147-R173 WeakPolarHBondContact CA-O 3.38Å; Y147-R173 WeakPolarHBondContact CB-O 3.36Å; W148-R173 HydrophobicContact CD2-CB 3.94Å; W148-R173 HydrophobicContact CG-CB 4.3Å; W148-R173 HydrophobicContact CZ2-CB 4.02Å; W148-R173 HydrophobicContact CZ2-CG 4.41Å; W148-R173 PolarHBondContact N-O 2.82Å; W148-R173 VanDerWaalsContact N-O 3.1Å; W148-R173 PolarHBondContact O-N 2.82Å; V150-R173 HydrophobicContact CG2-CG 4.01Å; R173-H225 WeakPolarHBondContact CA-O 3.32Å; R173-H225 HydrophobicContact CG-CB 4.11Å
174	I	93.6	Very high	67.3	Low	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.4	173.7	-59.7	176.3	0	0	0	107.7	H146 L172 I209 I210 V213 V224 H225 L226 T227	H146-I174 CarbonylContact O-C 3.58Å; H146-I174 WeakPolarHBondContact O-CA 3.44Å; L172-I174 HydrophobicContact CD1-CG1 4.46Å; L172-I174 HydrophobicContact CD2-CD1 4.25Å; L172-I174 HydrophobicContact CG-CD1 4.37Å; L172-I174 HydrophobicContact CG-CG1 4.15Å; I174-I209 HydrophobicContact CG2-CG2 4.46Å; I174-I210 HydrophobicContact CD1-CG1 4.2Å; I174-V213 HydrophobicContact CD1-CB 4.17Å; I174-V213 HydrophobicContact CD1-CG1 4.13Å; I174-V213 HydrophobicContact CD1-CG2 4.45Å; I174-V224 HydrophobicContact CD1-CG1 4.4Å; I174-H225 PolarHBondContact N-O 3.07Å; I174-L226 HydrophobicContact CB-CD1 4.26Å; I174-L226 HydrophobicContact CG2-CD1 4.09Å; I174-L226 WeakPolarHBondContact O-CA 3.32Å; I174-T227 PolarHBondContact O-N 3.33Å
175	V	93.8	Very high	66.2	Low	22 Å²	22	69.4 Å²	69.4	13%	0.133	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.8	178.4	-174.7	0	0	0	0	109.6	C145 H146 W148 T227	C145-V175 WeakPolarHBondContact CA-O 3.36Å; H146-V175 PolarHBondContact N-O 3.45Å; H146-V175 PolarHBondContact O-N 2.82Å; W148-V175 HydrophobicContact CH2-CG2 3.49Å; W148-V175 VanDerWaalsContact CH2-CG2 3.49Å; W148-V175 HydrophobicContact CZ3-CB 4.46Å; W148-V175 HydrophobicContact CZ3-CG2 3.51Å; V175-T227 CarbonylContact C-O 3.59Å; V175-T227 VanDerWaalsContact CA-O 3.31Å; V175-T227 WeakPolarHBondContact CA-O 3.37Å; V175-T227 HydrophobicContact CG1-CG2 4.5Å
176	L	93.9	Very high	65.3	Low	1 Å²	1	70.4 Å²	70.4	1%	0.005	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	128.3	168.7	-58.9	177.9	0	0	0	108.9	F127 I143 D144 C145 L206 I209 L226 T227 I228 S229	F127-L176 HydrophobicContact CZ-CD1 3.98Å; I143-L176 HydrophobicContact CG2-CB 4.33Å; D144-L176 WeakPolarHBondContact O-CA 3.47Å; C145-L176 HydrophobicContact CB-CD2 3.73Å; L176-L206 HydrophobicContact CD1-CD2 3.89Å; L176-I209 HydrophobicContact CD1-CD1 3.94Å; L176-I209 HydrophobicContact CD2-CD1 4.35Å; L176-L226 HydrophobicContact CD1-CD1 4.48Å; L176-L226 HydrophobicContact CG-CD1 4.49Å; L176-T227 PolarHBondContact N-O 3.08Å; L176-I228 HydrophobicContact CD1-CG1 4.33Å; L176-S229 PolarHBondContact O-N 3.29Å
177	K	90.8	Very high	64.5	Low	57 Å²	57	69 Å²	69	25%	0.248	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	146.5	177.4	67.4	-168.5	-175	-157.9	0	110.4	E106 I143 D144 H146 S179	E106-K177 IonicContact OE1-NZ 2.8Å; E106-K177 PolarHBondContact OE1-NZ 2.95Å; I143-K177 CarbonylContact C-O 3.55Å; I143-K177 WeakPolarHBondContact CA-O 3.26Å; I143-K177 WeakPolarHBondContact CG2-O 3.47Å; D144-K177 HydrophobicContact CB-CG 4Å; D144-K177 PolarHBondContact N-O 3.4Å; D144-K177 PolarHBondContact O-N 2.87Å; H146-K177 WeakPolarHBondContact CD2-CE 3.31Å; H146-K177 PolarHBondContact CD2-NZ 2.94Å; H146-K177 VanDerWaalsContact CD2-NZ 3.28Å; H146-K177 PolarHBondContact CE1-NZ 2.91Å; H146-K177 WeakPolarHBondContact NE2-CE 3.26Å; H146-K177 PolarHBondContact NE2-NZ 3.37Å; K177-S179 PolarHBondContact O-N 2.91Å
178	P	87.3	Confident	63.3	Low	12 Å²	12	74.2 Å²	74.2	8%	0.078	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	138.5	170	-22.2	33.7	0	0	0	110.3	T180 L196 S229 F230 I231	P178-T180 PolarHBondContact O-N 3.29Å; P178-L196 HydrophobicContact CG-CB 3.97Å; P178-L196 HydrophobicContact CG-CD2 4.34Å; P178-S229 WeakPolarHBondContact CD-O 3.28Å; P178-F230 HydrophobicContact CG-CB 4.07Å; P178-I231 HydrophobicContact CG-CG1 4.05Å
179	S	82.9	Confident	62.2	Low	21 Å²	21	77.3 Å²	77.3	15%	0.147	44%	0.436	C	S	.	.			trans	-70.7	131.5	179.1	-160.2	0	0	0	0	110.5	M142 D144 K177 I181	M142-S179 WeakPolarHBondContact O-CB 3.4Å; M142-S179 PolarHBondContact O-N 2.88Å; D144-S179 WeakPolarHBondContact OD1-CB 3.48Å; D144-S179 PolarHBondContact OD1-OG 3.19Å; D144-S179 WeakPolarHBondContact OD2-CA 3.23Å; D144-S179 PolarHBondContact OD2-OG 3.23Å; K177-S179 PolarHBondContact O-N 2.91Å; S179-I181 PolarHBondContact O-N 3.48Å
180	T	66.7	Low	60.8	Low	128 Å²	128	80.2 Å²	80.2	79%	0.785	45%	0.452	S	S	*	.	S	Bend	trans	-79.3	-2.6	177.2	56.9	0	0	0	0	113	P178	P178-T180 PolarHBondContact O-N 3.29Å
181	I	48.8	Very low	58.8	Low	144 Å²	144	85.7 Å²	85.7	74%	0.738	48%	0.484	S	S	*	.			trans	-107.5	73.6	-173	-50.1	177.8	0	0	0	109.1	S179	S179-I181 PolarHBondContact O-N 3.48Å
182	S	37.1	Very low	56.8	Low	113 Å²	113	88 Å²	88	79%	0.79	50%	0.504	S	S	*	.			trans	-106.1	74	178.7	177.1	0	0	0	0	111.5
183	A	32	Very low	54.9	Low	92 Å²	92	90.5 Å²	90.5	76%	0.76	53%	0.525	S	S	*	.			trans	61.6	159.2	169.9	0	0	0	0	0	117.8	D185	A183-D185 PolarHBondContact O-N 2.92Å
184	D	28.1	Very low	53.2	Low	160 Å²	160	89.7 Å²	89.7	86%	0.856	53%	0.533	S	S	*	.	S	Bend	trans	-71.5	98	175.7	-56.7	-84.4	0	0	0	111.2
185	D	29.7	Very low	52.3	Low	137 Å²	137	94 Å²	94	73%	0.733	55%	0.55	S	S	*	.			trans	-163.5	110.7	148.2	-113	-27.8	0	0	0	115.6	A183 S187	A183-D185 PolarHBondContact O-N 2.92Å; D185-S187 PolarHBondContact O-N 2.92Å
186	L	29	Very low	51.8	Low	171 Å²	171	93.7 Å²	93.7	90%	0.895	55%	0.547	S	S	*	.			trans	24.7	57.8	135	-66	165.5	0	0	0	120
187	S	31.8	Very low	51.5	Low	67 Å²	67	100.3 Å²	100.3	47%	0.469	57%	0.572	S	S	.	*			trans	-146.9	103.2	166	-175.4	0	0	0	0	113.9	D185 K189 S190	D185-S187 PolarHBondContact O-N 2.92Å; S187-K189 PolarHBondContact O-N 3.22Å; S187-K189 VanDerWaalsContact O-N 3.14Å; S187-S190 PolarHBondContact O-OG 3.48Å
188	P	30.1	Very low	51.4	Low	112 Å²	112	97.6 Å²	97.6	73%	0.727	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	8.1	174	31.7	-35.4	0	0	0	113.9
189	K	33.6	Very low	51.4	Low	190 Å²	190	97.8 Å²	97.8	83%	0.826	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-3.7	-179.2	-70.1	-173.6	175.3	-179.8	0	114.1	S187	S187-K189 PolarHBondContact O-N 3.22Å; S187-K189 VanDerWaalsContact O-N 3.14Å
190	S	33	Very low	51.5	Low	82 Å²	82	100.8 Å²	100.8	57%	0.573	57%	0.573	S	S	*	*			trans	-93.4	17.5	-178.7	53.6	0	0	0	0	114.7	S187 S192	S187-S190 PolarHBondContact O-OG 3.48Å; S190-S192 PolarHBondContact O-N 2.89Å
191	N	32.6	Very low	52.6	Low	152 Å²	152	95.3 Å²	95.3	81%	0.813	54%	0.539	S	S	*	.			trans	-67.7	2.8	-177.1	-78.5	-21.5	0	0	0	115.6
192	S	37.9	Very low	54.5	Low	92 Å²	92	92.9 Å²	92.9	64%	0.643	52%	0.523	S	S	*	.	S	Bend	trans	-86.7	119.9	163.1	50.6	0	0	0	0	109.7	S190 S194	S190-S192 PolarHBondContact O-N 2.89Å; S192-S194 PolarHBondContact O-N 3.33Å
193	A	49	Very low	56.8	Low	54 Å²	54	92 Å²	92	45%	0.446	52%	0.515	S	S	.	.			trans	-53.7	112.6	173.2	0	0	0	0	0	109.5	R195 F230	A193-R195 PolarHBondContact O-N 3.39Å; A193-F230 HydrophobicContact CB-CD1 3.91Å; A193-F230 HydrophobicContact CB-CE1 3.98Å; A193-F230 HydrophobicContact CB-CG 4.35Å; A193-F230 HydrophobicContact CB-CZ 4.49Å
194	S	56.3	Low	59.3	Low	76 Å²	76	88.9 Å²	88.9	53%	0.531	49%	0.492	S	S	.	.			trans	-66.5	111.3	-161.7	47.2	0	0	0	0	111.1	S192 L196	S192-S194 PolarHBondContact O-N 3.33Å; S194-L196 PolarHBondContact O-N 3.1Å
195	R	73.4	Confident	62.3	Low	91 Å²	91	81.6 Å²	81.6	34%	0.343	45%	0.453	S	S	.	.			trans	-68.3	105.4	-176.4	-65.4	175.8	173	-144.5	-9.3	109.6	A193 R197 F230 Y232 D297 Y298	A193-R195 PolarHBondContact O-N 3.39Å; R195-R197 PolarHBondContact O-N 3.43Å; R195-F230 WeakPolarHBondContact CA-O 3.11Å; R195-Y232 HydrophobicContact CB-CD2 4.29Å; R195-Y232 HydrophobicContact CB-CE2 4.07Å; R195-Y232 HydrophobicContact CG-CE2 4.09Å; R195-Y232 PolarHBondContact NH1-OH 3.5Å; R195-D297 IonicContact CZ-OD2 2.82Å; R195-D297 IonicContact NH1-OD2 3.69Å; R195-D297 PolarHBondContact NH1-OD2 3.36Å; R195-D297 IonicContact NH2-OD2 2.6Å; R195-D297 PolarHBondContact NH2-OD2 3.14Å; R195-Y298 VanDerWaalsContact NH1-CE1 3.29Å; R195-Y298 PolarHBondContact NH1-OH 3.29Å
196	L	84.5	Confident	65.4	Low	15 Å²	15	75.1 Å²	75.1	8%	0.079	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	103.5	-170.9	-167.2	59.2	0	0	0	110.2	A116 L125 T141 I143 P178 S194 I198 F230 I231 Y232	A116-L196 HydrophobicContact CB-CD2 3.94Å; A116-L196 HydrophobicContact CB-CG 4.44Å; L125-L196 HydrophobicContact CD1-CD1 3.57Å; L125-L196 HydrophobicContact CD1-CG 4.44Å; T141-L196 HydrophobicContact CG2-CD1 3.9Å; T141-L196 HydrophobicContact CG2-CD2 3.97Å; I143-L196 HydrophobicContact CD1-CD2 3.66Å; I143-L196 HydrophobicContact CG1-CD2 3.82Å; P178-L196 HydrophobicContact CG-CB 3.97Å; P178-L196 HydrophobicContact CG-CD2 4.34Å; S194-L196 PolarHBondContact O-N 3.1Å; L196-I198 HydrophobicContact CD2-CD1 4.24Å; L196-I198 HydrophobicContact CG-CD1 4.35Å; L196-I198 HydrophobicContact CG-CG1 4.09Å; L196-I198 PolarHBondContact O-N 3.12Å; L196-F230 PolarHBondContact N-O 3.24Å; L196-I231 HydrophobicContact CB-CG1 4.16Å; L196-I231 HydrophobicContact CD2-CG1 4.36Å; L196-I231 WeakPolarHBondContact O-CA 3.22Å; L196-Y232 PolarHBondContact O-N 2.92Å
197	R	86.8	Confident	68.3	Low	140 Å²	140	69.1 Å²	69.1	53%	0.528	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	105.2	177.2	-64.8	-170.7	-172.2	146.1	5.4	110.4	R195 Y232 E299	R195-R197 PolarHBondContact O-N 3.43Å; R197-Y232 CarbonylContact C-O 3.59Å; R197-Y232 WeakPolarHBondContact CA-O 3.22Å; R197-E299 IonicContact CZ-OE1 3.6Å; R197-E299 IonicContact CZ-OE2 3.93Å; R197-E299 VanDerWaalsContact CZ-OE2 3.25Å; R197-E299 IonicContact NE-OE2 3.69Å; R197-E299 PolarHBondContact NE-OE2 3.28Å; R197-E299 IonicContact NH2-OE1 3.63Å; R197-E299 PolarHBondContact NH2-OE1 3.13Å; R197-E299 IonicContact NH2-OE2 2.74Å; R197-E299 PolarHBondContact NH2-OE2 3.28Å
198	I	88.3	Confident	71.1	Confident	1 Å²	1	70 Å²	70	1%	0.005	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122.9	-178.9	-61	-170.2	0	0	0	108.9	A116 F127 I143 L196 H200 I231 Y232 F233 K234	A116-I198 HydrophobicContact CB-CD1 4.15Å; A116-I198 HydrophobicContact CB-CG1 4.46Å; F127-I198 HydrophobicContact CB-CD1 3.9Å; F127-I198 HydrophobicContact CB-CG2 3.82Å; F127-I198 HydrophobicContact CD2-CD1 3.97Å; F127-I198 HydrophobicContact CG-CD1 4.27Å; I143-I198 HydrophobicContact CD1-CD1 4.12Å; L196-I198 HydrophobicContact CD2-CD1 4.24Å; L196-I198 HydrophobicContact CG-CD1 4.35Å; L196-I198 HydrophobicContact CG-CG1 4.09Å; L196-I198 PolarHBondContact O-N 3.12Å; I198-H200 VanDerWaalsContact CG2-O 3.23Å; I198-H200 WeakPolarHBondContact CG2-O 3.31Å; I198-I231 HydrophobicContact CB-CG2 4.49Å; I198-I231 HydrophobicContact CD1-CG2 3.52Å; I198-I231 HydrophobicContact CG1-CG2 3.95Å; I198-Y232 PolarHBondContact N-O 2.85Å; I198-F233 HydrophobicContact CB-CD1 3.96Å; I198-F233 HydrophobicContact CB-CE1 4.16Å; I198-F233 HydrophobicContact CD1-CE1 4.3Å; I198-F233 HydrophobicContact CG2-CD1 4Å; I198-F233 HydrophobicContact CG2-CE1 4.09Å; I198-F233 WeakPolarHBondContact O-CA 3.22Å; I198-K234 PolarHBondContact O-N 2.77Å
199	S	86.8	Confident	74.2	Confident	15 Å²	15	64.7 Å²	64.7	11%	0.105	35%	0.346	C	S	.	.	S	Bend	trans	-81	-41.1	-178.1	-69	0	0	0	0	112.3	L125	L125-S199 PolarHBondContact O-N 2.92Å
200	H	85.5	Confident	77	Confident	84 Å²	84	55.7 Å²	55.7	39%	0.389	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	140.5	-179.6	-52.4	-74.2	0	0	0	111.3	E124 L125 T126 F127 I198	E124-H200 IonicContact OE1-NE2 2.79Å; E124-H200 IonicContact OE2-CD2 2.87Å; E124-H200 IonicContact OE2-CE1 3.3Å; E124-H200 IonicContact OE2-NE2 2.71Å; E124-H200 PolarHBondContact OE2-NE2 3.35Å; L125-H200 PolarHBondContact O-N 3.26Å; T126-H200 VanDerWaalsContact CA-O 3.3Å; T126-H200 WeakPolarHBondContact CA-O 3.47Å; T126-H200 HydrophobicContact CG2-CB 4.31Å; F127-H200 PolarHBondContact N-O 2.96Å; I198-H200 VanDerWaalsContact CG2-O 3.23Å; I198-H200 WeakPolarHBondContact CG2-O 3.31Å
201	L	90.5	Very high	79.7	Confident	14 Å²	14	54.8 Å²	54.8	7%	0.073	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	139.3	165.6	-162.3	99	0	0	0	108.2	F127 P203 V205 L206 F233 D240	F127-L201 HydrophobicContact CB-CD1 4.12Å; F127-L201 HydrophobicContact CD1-CD1 3.45Å; F127-L201 VanDerWaalsContact CD1-CD1 3.45Å; F127-L201 HydrophobicContact CD1-CG 4.17Å; F127-L201 HydrophobicContact CE1-CD1 4.23Å; F127-L201 HydrophobicContact CG-CD1 4.12Å; L201-P203 WeakPolarHBondContact O-CD 3.47Å; L201-V205 HydrophobicContact CD1-CG1 4.19Å; L201-V205 HydrophobicContact CD2-CG1 3.85Å; L201-V205 HydrophobicContact CG-CG1 3.74Å; L201-L206 HydrophobicContact CD1-CD1 4.4Å; L201-L206 HydrophobicContact CD1-CG 4.33Å; L201-L206 HydrophobicContact CD2-CD1 3.99Å; L201-L206 HydrophobicContact CD2-CG 3.99Å; L201-F233 HydrophobicContact CD1-CD1 4.24Å; L201-F233 HydrophobicContact CD1-CE1 3.49Å; L201-F233 VanDerWaalsContact CD1-CE1 3.49Å; L201-F233 HydrophobicContact CD1-CZ 3.89Å; L201-D240 HydrophobicContact CD2-CB 3.71Å; L201-D240 WeakPolarHBondContact CD2-OD1 3.37Å
202	K	88.8	Confident	82.5	Confident	93 Å²	93	48.5 Å²	48.5	40%	0.404	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-68.4	124.2	169.4	-176.4	-179.1	-179.4	179.5	0	109.5	F127 D128 G204 V205	F127-K202 VanDerWaalsContact O-CB 3.27Å; F127-K202 WeakPolarHBondContact O-CB 3.27Å; F127-K202 PolarHBondContact O-N 3.46Å; F127-K202 VanDerWaalsContact O-N 3.09Å; D128-K202 HydrophobicContact CB-CD 4.06Å; D128-K202 WeakPolarHBondContact OD1-CD 3.28Å; D128-K202 WeakPolarHBondContact OD1-CE 3.47Å; D128-K202 IonicContact OD1-NZ 3.87Å; D128-K202 PolarHBondContact OD1-NZ 3.1Å; D128-K202 IonicContact OD2-NZ 3.71Å; D128-K202 PolarHBondContact OD2-NZ 3.3Å; K202-G204 PolarHBondContact O-N 3.05Å; K202-V205 HydrophobicContact CB-CB 4.26Å; K202-V205 HydrophobicContact CB-CG1 4.33Å; K202-V205 WeakPolarHBondContact O-CB 3.31Å; K202-V205 WeakPolarHBondContact O-CG1 3.39Å; K202-V205 PolarHBondContact O-N 3.21Å
203	P	84.4	Confident	85	Confident	95 Å²	95	44.1 Å²	44.1	62%	0.617	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.7	128.3	-173.6	-33	37.6	0	0	0	113.7	L201 V205 D239	L201-P203 WeakPolarHBondContact O-CD 3.47Å; P203-V205 VanDerWaalsContact C-N 3.28Å; P203-V205 PolarHBondContact O-N 3.46Å; P203-D239 HydrophobicContact CB-CB 4.32Å
204	G	85.1	Confident	86.9	Confident	26 Å²	26	41.8 Å²	41.8	27%	0.268	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	2.1	179.1	0	0	0	0	0	117	K202 L206 N207 W208 D239	K202-G204 PolarHBondContact O-N 3.05Å; G204-L206 VanDerWaalsContact C-N 3.31Å; G204-L206 PolarHBondContact O-N 3.1Å; G204-N207 WeakPolarHBondContact O-CB 3.4Å; G204-N207 PolarHBondContact O-N 3.03Å; G204-N207 VanDerWaalsContact O-N 3.11Å; G204-W208 PolarHBondContact O-N 2.88Å; G204-D239 PolarHBondContact N-O 2.77Å
205	V	92	Very high	88.4	Confident	7 Å²	7	44.2 Å²	44.2	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-60.8	-35.9	-177.2	69.6	0	0	0	0	113.1	F127 C129 L201 K202 P203 N207 W208 I209	F127-V205 HydrophobicContact CD1-CG1 3.6Å; F127-V205 HydrophobicContact CE1-CG1 3.79Å; F127-V205 HydrophobicContact CE1-CG2 4.4Å; C129-V205 HydrophobicContact CB-CG2 4.01Å; L201-V205 HydrophobicContact CD1-CG1 4.19Å; L201-V205 HydrophobicContact CD2-CG1 3.85Å; L201-V205 HydrophobicContact CG-CG1 3.74Å; K202-V205 HydrophobicContact CB-CB 4.26Å; K202-V205 HydrophobicContact CB-CG1 4.33Å; K202-V205 WeakPolarHBondContact O-CB 3.31Å; K202-V205 WeakPolarHBondContact O-CG1 3.39Å; K202-V205 PolarHBondContact O-N 3.21Å; P203-V205 VanDerWaalsContact C-N 3.28Å; P203-V205 PolarHBondContact O-N 3.46Å; V205-N207 VanDerWaalsContact C-N 3.33Å; V205-N207 PolarHBondContact O-N 3.26Å; V205-W208 WeakPolarHBondContact O-CB 3.21Å; V205-W208 PolarHBondContact O-N 2.7Å; V205-W208 VanDerWaalsContact O-N 3.09Å; V205-I209 WeakPolarHBondContact O-CG1 3.43Å; V205-I209 PolarHBondContact O-N 2.9Å
206	L	93.4	Very high	89	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-63.1	-38.2	176	-66.3	174.5	0	0	0	112.3	F127 L176 L201 G204 I209 I210 L226 I228 L241 L244	F127-L206 HydrophobicContact CE1-CD2 4.21Å; L176-L206 HydrophobicContact CD1-CD2 3.89Å; L201-L206 HydrophobicContact CD1-CD1 4.4Å; L201-L206 HydrophobicContact CD1-CG 4.33Å; L201-L206 HydrophobicContact CD2-CD1 3.99Å; L201-L206 HydrophobicContact CD2-CG 3.99Å; G204-L206 VanDerWaalsContact C-N 3.31Å; G204-L206 PolarHBondContact O-N 3.1Å; L206-I209 HydrophobicContact CD2-CD1 4.23Å; L206-I210 WeakPolarHBondContact O-CD1 3.18Å; L206-I210 VanDerWaalsContact O-CG1 3.3Å; L206-I210 WeakPolarHBondContact O-CG1 3.42Å; L206-I210 PolarHBondContact O-N 2.89Å; L206-L226 HydrophobicContact CD2-CD2 4.31Å; L206-I228 HydrophobicContact CD1-CD1 4.12Å; L206-I228 HydrophobicContact CD2-CD1 3.96Å; L206-L241 HydrophobicContact CD1-CD2 4.31Å; L206-L244 HydrophobicContact CB-CD2 3.88Å; L206-L244 HydrophobicContact CD1-CD1 4.41Å
207	N	90.3	Very high	89	Confident	45 Å²	45	43.7 Å²	43.7	24%	0.241	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-39.5	172.2	169.1	84.1	0	0	0	111.3	G204 V205 I210 E211 L244 S248	G204-N207 WeakPolarHBondContact O-CB 3.4Å; G204-N207 PolarHBondContact O-N 3.03Å; G204-N207 VanDerWaalsContact O-N 3.11Å; V205-N207 VanDerWaalsContact C-N 3.33Å; V205-N207 PolarHBondContact O-N 3.26Å; N207-I210 PolarHBondContact O-N 2.99Å; N207-E211 WeakPolarHBondContact O-CG 3.26Å; N207-E211 PolarHBondContact O-N 2.81Å; N207-E211 VanDerWaalsContact O-N 3.08Å; N207-L244 HydrophobicContact CB-CD2 4.44Å; N207-S248 PolarHBondContact OD1-OG 2.74Å
208	W	91.9	Very high	88.9	Confident	85 Å²	85	44.7 Å²	44.7	32%	0.322	23%	0.232	S	C	.	.	H	α-helix	trans	-63.6	-40.9	177.1	176.9	85	0	0	0	113	V112 C129 K130 G204 V205 T212	V112-W208 HydrophobicContact CG1-CZ3 4.28Å; V112-W208 HydrophobicContact CG2-CH2 4.15Å; V112-W208 HydrophobicContact CG2-CZ3 4.06Å; C129-W208 HydrophobicContact CB-CE3 4.01Å; C129-W208 HydrophobicContact CB-CZ3 3.57Å; K130-W208 VanDerWaalsContact C-CH2 3.47Å; G204-W208 PolarHBondContact O-N 2.88Å; V205-W208 WeakPolarHBondContact O-CB 3.21Å; V205-W208 PolarHBondContact O-N 2.7Å; V205-W208 VanDerWaalsContact O-N 3.09Å; W208-T212 VanDerWaalsContact CE2-OG1 3.31Å; W208-T212 HydrophobicContact CH2-CG2 4.35Å; W208-T212 HydrophobicContact CZ2-CG2 4.24Å; W208-T212 WeakPolarHBondContact CZ2-OG1 3.44Å; W208-T212 VanDerWaalsContact O-CB 3.31Å; W208-T212 WeakPolarHBondContact O-CB 3.34Å; W208-T212 PolarHBondContact O-N 3.3Å; W208-T212 PolarHBondContact O-OG1 3.15Å
209	I	93.9	Very high	88.5	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-57.5	-52.2	174.6	-67	165.3	0	0	0	110.1	V112 F127 C129 I174 L176 V205 L206 E211 T212 V213	V112-I209 HydrophobicContact CG1-CG1 4.18Å; V112-I209 HydrophobicContact CG1-CG2 4.17Å; F127-I209 HydrophobicContact CE1-CD1 4.01Å; F127-I209 HydrophobicContact CZ-CD1 4.02Å; C129-I209 HydrophobicContact CB-CG1 4.32Å; C129-I209 VanDerWaalsContact SG-CD1 3.53Å; I174-I209 HydrophobicContact CG2-CG2 4.46Å; L176-I209 HydrophobicContact CD1-CD1 3.94Å; L176-I209 HydrophobicContact CD2-CD1 4.35Å; V205-I209 WeakPolarHBondContact O-CG1 3.43Å; V205-I209 PolarHBondContact O-N 2.9Å; L206-I209 HydrophobicContact CD2-CD1 4.23Å; I209-E211 PolarHBondContact O-N 3.24Å; I209-T212 PolarHBondContact O-N 2.95Å; I209-V213 WeakPolarHBondContact O-CG2 3.3Å; I209-V213 PolarHBondContact O-N 3.14Å
210	I	92.2	Very high	88	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-46.1	-174.3	-64.6	161.7	0	0	0	111.1	I174 L206 N207 V213 R214 V224 L226 L244 V250	I174-I210 HydrophobicContact CD1-CG1 4.2Å; L206-I210 WeakPolarHBondContact O-CD1 3.18Å; L206-I210 VanDerWaalsContact O-CG1 3.3Å; L206-I210 WeakPolarHBondContact O-CG1 3.42Å; L206-I210 PolarHBondContact O-N 2.89Å; N207-I210 PolarHBondContact O-N 2.99Å; I210-V213 PolarHBondContact O-N 3.18Å; I210-R214 VanDerWaalsContact CG2-NH1 3.31Å; I210-R214 WeakPolarHBondContact O-CB 3.38Å; I210-R214 WeakPolarHBondContact O-CG 3.06Å; I210-R214 PolarHBondContact O-N 3.13Å; I210-V224 HydrophobicContact CD1-CG1 4.46Å; I210-V224 HydrophobicContact CG1-CG1 4.41Å; I210-V224 HydrophobicContact CG2-CB 4.49Å; I210-V224 HydrophobicContact CG2-CG1 4.35Å; I210-V224 HydrophobicContact CG2-CG2 4.01Å; I210-L226 HydrophobicContact CD1-CD2 4.34Å; I210-L244 HydrophobicContact CD1-CD2 3.84Å; I210-V250 HydrophobicContact CD1-CG2 3.46Å; I210-V250 VanDerWaalsContact CD1-CG2 3.46Å
211	E	90.5	Very high	87.4	Confident	63 Å²	63	47.2 Å²	47.2	29%	0.294	25%	0.25	S	S	.	.	H	α-helix	trans	-68.8	-37.4	-179.3	-67.8	-56.8	108.2	0	0	112.1	N207 I209 R214 L215	N207-E211 WeakPolarHBondContact O-CG 3.26Å; N207-E211 PolarHBondContact O-N 2.81Å; N207-E211 VanDerWaalsContact O-N 3.08Å; I209-E211 PolarHBondContact O-N 3.24Å; E211-R214 PolarHBondContact O-N 2.81Å; E211-R214 IonicContact OE1-CZ 3.15Å; E211-R214 IonicContact OE1-NH1 3.79Å; E211-R214 PolarHBondContact OE1-NH1 3Å; E211-L215 WeakPolarHBondContact O-CB 3.3Å; E211-L215 VanDerWaalsContact O-CG 3.23Å; E211-L215 WeakPolarHBondContact O-CG 3.39Å; E211-L215 PolarHBondContact O-N 2.03Å
212	T	91.3	Very high	87	Confident	21 Å²	21	46.5 Å²	46.5	13%	0.129	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-49.9	174.3	-59.8	0	0	0	0	111.1	D111 V112 W208 I209 R214 L215 S216	D111-T212 HydrophobicContact CB-CG2 3.9Å; D111-T212 WeakPolarHBondContact O-CG2 3.31Å; V112-T212 HydrophobicContact CG2-CG2 3.83Å; W208-T212 VanDerWaalsContact CE2-OG1 3.31Å; W208-T212 HydrophobicContact CH2-CG2 4.35Å; W208-T212 HydrophobicContact CZ2-CG2 4.24Å; W208-T212 WeakPolarHBondContact CZ2-OG1 3.44Å; W208-T212 VanDerWaalsContact O-CB 3.31Å; W208-T212 WeakPolarHBondContact O-CB 3.34Å; W208-T212 PolarHBondContact O-N 3.3Å; W208-T212 PolarHBondContact O-OG1 3.15Å; I209-T212 PolarHBondContact O-N 2.95Å; T212-R214 VanDerWaalsContact C-N 3.34Å; T212-R214 PolarHBondContact O-N 3.48Å; T212-L215 PolarHBondContact O-N 3.29Å; T212-S216 PolarHBondContact O-N 2.79Å; T212-S216 VanDerWaalsContact O-N 3.1Å; T212-S216 PolarHBondContact O-OG 3.49Å
213	V	90.7	Very high	86.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-41.2	176.2	175.5	0	0	0	0	111.4	C109 V112 Y147 L172 I174 I209 I210 L215 L217	C109-V213 HydrophobicContact CB-CG2 3.8Å; V112-V213 HydrophobicContact CG2-CG2 3.96Å; Y147-V213 HydrophobicContact CG-CG1 4.48Å; L172-V213 HydrophobicContact CD2-CG1 4.14Å; I174-V213 HydrophobicContact CD1-CB 4.17Å; I174-V213 HydrophobicContact CD1-CG1 4.13Å; I174-V213 HydrophobicContact CD1-CG2 4.45Å; I209-V213 WeakPolarHBondContact O-CG2 3.3Å; I209-V213 PolarHBondContact O-N 3.14Å; I210-V213 PolarHBondContact O-N 3.18Å; V213-L215 PolarHBondContact O-N 2.92Å; V213-L217 HydrophobicContact CG1-CD1 3.58Å; V213-L217 HydrophobicContact CG1-CG 4.25Å; V213-L217 VanDerWaalsContact O-CB 3.3Å; V213-L217 WeakPolarHBondContact O-CB 3.41Å; V213-L217 WeakPolarHBondContact O-CG 3.23Å; V213-L217 PolarHBondContact O-N 3.34Å
214	R	88.2	Confident	87.1	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.015	21%	0.209	C	C	.	.	H	α-helix	trans	-61.1	-42.3	175.3	-85	-162.1	177.2	102.7	11.2	113.6	L172 I210 E211 T212 K218 M219 S222 S248	L172-R214 HydrophobicContact CD2-CG 4.24Å; I210-R214 VanDerWaalsContact CG2-NH1 3.31Å; I210-R214 WeakPolarHBondContact O-CB 3.38Å; I210-R214 WeakPolarHBondContact O-CG 3.06Å; I210-R214 PolarHBondContact O-N 3.13Å; E211-R214 PolarHBondContact O-N 2.81Å; E211-R214 IonicContact OE1-CZ 3.15Å; E211-R214 IonicContact OE1-NH1 3.79Å; E211-R214 PolarHBondContact OE1-NH1 3Å; T212-R214 VanDerWaalsContact C-N 3.34Å; T212-R214 PolarHBondContact O-N 3.48Å; R214-K218 WeakPolarHBondContact O-CA 3.08Å; R214-K218 PolarHBondContact O-N 3.27Å; R214-M219 WeakPolarHBondContact CD-O 3.04Å; R214-M219 WeakPolarHBondContact CG-O 3.36Å; R214-M219 PolarHBondContact O-N 3.18Å; R214-S222 PolarHBondContact NE-O 3.09Å; R214-S222 PolarHBondContact NH2-O 3.1Å; R214-S248 VanDerWaalsContact CZ-O 3.25Å; R214-S248 PolarHBondContact NH1-O 3.01Å; R214-S248 PolarHBondContact NH2-O 3.38Å
215	L	87.1	Confident	87.5	Confident	128 Å²	128	39.1 Å²	39.1	67%	0.67	20%	0.201	S	C	*	.	H	α-helix	trans	-66.7	-48.9	-177.7	-74.7	166.9	0	0	0	110.6	E211 T212 V213 L217 K218	E211-L215 WeakPolarHBondContact O-CB 3.3Å; E211-L215 VanDerWaalsContact O-CG 3.23Å; E211-L215 WeakPolarHBondContact O-CG 3.39Å; E211-L215 PolarHBondContact O-N 2.03Å; T212-L215 PolarHBondContact O-N 3.29Å; V213-L215 PolarHBondContact O-N 2.92Å; L215-L217 VanDerWaalsContact C-N 3.33Å; L215-L217 PolarHBondContact O-N 3.19Å; L215-K218 PolarHBondContact O-N 3.37Å; L215-K218 VanDerWaalsContact O-N 3.12Å
216	S	86.3	Confident	87.6	Confident	51 Å²	51	38.9 Å²	38.9	36%	0.357	20%	0.2	S	C	.	.	H	α-helix	trans	-66.4	-33.8	179.3	-60.2	0	0	0	0	112.5	D111 T212	D111-S216 WeakPolarHBondContact OD2-CB 3.32Å; D111-S216 PolarHBondContact OD2-OG 3.44Å; T212-S216 PolarHBondContact O-N 2.79Å; T212-S216 VanDerWaalsContact O-N 3.1Å; T212-S216 PolarHBondContact O-OG 3.49Å
217	L	84.6	Confident	87.7	Confident	44 Å²	44	40.3 Å²	40.3	23%	0.23	21%	0.208	C	C	.	.	H	α-helix	trans	-84.1	-6.3	173.3	-60.9	178.5	0	0	0	114.7	P110 Y147 L172 V213 L215 M219	P110-L217 HydrophobicContact CG-CD2 4.31Å; P110-L217 HydrophobicContact CG-CG 4.35Å; Y147-L217 HydrophobicContact CD2-CD1 3.48Å; Y147-L217 VanDerWaalsContact CD2-CD1 3.48Å; Y147-L217 HydrophobicContact CE2-CD1 3.43Å; Y147-L217 VanDerWaalsContact CE2-CD1 3.43Å; Y147-L217 HydrophobicContact CE2-CD2 3.67Å; Y147-L217 HydrophobicContact CE2-CG 4.19Å; Y147-L217 HydrophobicContact CG-CD1 4.21Å; L172-L217 HydrophobicContact CD1-CD1 3.96Å; L172-L217 HydrophobicContact CD2-CD1 4.48Å; V213-L217 HydrophobicContact CG1-CD1 3.58Å; V213-L217 HydrophobicContact CG1-CG 4.25Å; V213-L217 VanDerWaalsContact O-CB 3.3Å; V213-L217 WeakPolarHBondContact O-CB 3.41Å; V213-L217 WeakPolarHBondContact O-CG 3.23Å; V213-L217 PolarHBondContact O-N 3.34Å; L215-L217 VanDerWaalsContact C-N 3.33Å; L215-L217 PolarHBondContact O-N 3.19Å; L217-M219 VanDerWaalsContact C-N 3.28Å; L217-M219 HydrophobicContact CB-CE 3.89Å; L217-M219 HydrophobicContact CB-CG 4.48Å; L217-M219 HydrophobicContact CD1-CE 3.75Å; L217-M219 HydrophobicContact CG-CE 4.44Å; L217-M219 PolarHBondContact O-N 2.83Å
218	K	84.1	Confident	87.8	Confident	160 Å²	160	38.4 Å²	38.4	70%	0.696	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.4	37.3	-176.3	-55.6	174.9	-175.6	173.1	0	113.9	R214 L215 P220	R214-K218 WeakPolarHBondContact O-CA 3.08Å; R214-K218 PolarHBondContact O-N 3.27Å; L215-K218 PolarHBondContact O-N 3.37Å; L215-K218 VanDerWaalsContact O-N 3.12Å; K218-P220 WeakPolarHBondContact O-CD 3.49Å
219	M	79.9	Confident	87.7	Confident	18 Å²	18	35.3 Å²	35.3	9%	0.089	19%	0.19	C	C	.	.			trans	-113.9	64.2	178.2	-67.7	-163.9	-78.3	0	0	112.4	L172 R214 L217 L221 S222	L172-M219 HydrophobicContact CD1-CE 4.13Å; R214-M219 WeakPolarHBondContact CD-O 3.04Å; R214-M219 WeakPolarHBondContact CG-O 3.36Å; R214-M219 PolarHBondContact O-N 3.18Å; L217-M219 VanDerWaalsContact C-N 3.28Å; L217-M219 HydrophobicContact CB-CE 3.89Å; L217-M219 HydrophobicContact CB-CG 4.48Å; L217-M219 HydrophobicContact CD1-CE 3.75Å; L217-M219 HydrophobicContact CG-CE 4.44Å; L217-M219 PolarHBondContact O-N 2.83Å; M219-L221 VanDerWaalsContact C-N 3.26Å; M219-L221 PolarHBondContact O-N 3.46Å; M219-S222 PolarHBondContact O-OG 3.34Å
220	P	76.8	Confident	87.3	Confident	69 Å²	69	37.3 Å²	37.3	45%	0.448	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-19	-172.6	27.9	-36.4	0	0	0	114.9	K218	K218-P220 WeakPolarHBondContact O-CD 3.49Å
221	L	74.5	Confident	87.1	Confident	66 Å²	66	37.4 Å²	37.4	35%	0.346	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-6.8	-173.6	-60.3	-180	0	0	0	114.5	H166 M219 R249	H166-L221 HydrophobicContact CB-CD1 4.3Å; H166-L221 PolarHBondContact O-N 2.86Å; M219-L221 VanDerWaalsContact C-N 3.26Å; M219-L221 PolarHBondContact O-N 3.46Å; L221-R249 PolarHBondContact O-NH1 3.5Å
222	S	80.8	Confident	87	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.185	C	C	.	.			trans	-63.2	140.6	-175.9	54.7	0	0	0	0	112.1	Y170 R214 M219	Y170-S222 VanDerWaalsContact O-CB 3.32Å; Y170-S222 WeakPolarHBondContact O-CB 3.33Å; R214-S222 PolarHBondContact NE-O 3.09Å; R214-S222 PolarHBondContact NH2-O 3.1Å; M219-S222 PolarHBondContact O-OG 3.34Å
223	P	86.2	Confident	87	Confident	35 Å²	35	33.7 Å²	33.7	23%	0.227	18%	0.18	C	C	.	.			trans	-67.3	145	168	31.2	-34	0	0	0	109.6	D171 L172 T251	D171-P223 HydrophobicContact CB-CG 4.28Å; D171-P223 VanDerWaalsContact OD1-CG 3.28Å; D171-P223 WeakPolarHBondContact OD1-CG 3.37Å; L172-P223 PolarHBondContact N-O 2.84Å; P223-T251 HydrophobicContact CB-CG2 3.56Å
224	V	89.6	Confident	86.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.5	-179.2	162.6	0	0	0	0	112.3	L172 I174 I210 L226 R249 V250 T251 H252	L172-V224 HydrophobicContact CB-CG2 3.91Å; L172-V224 HydrophobicContact CD2-CG2 3.95Å; L172-V224 HydrophobicContact CG-CG2 4.07Å; L172-V224 CarbonylContact O-C 3.59Å; L172-V224 VanDerWaalsContact O-CA 3.28Å; L172-V224 WeakPolarHBondContact O-CA 3.47Å; I174-V224 HydrophobicContact CD1-CG1 4.4Å; I210-V224 HydrophobicContact CD1-CG1 4.46Å; I210-V224 HydrophobicContact CG1-CG1 4.41Å; I210-V224 HydrophobicContact CG2-CB 4.49Å; I210-V224 HydrophobicContact CG2-CG1 4.35Å; I210-V224 HydrophobicContact CG2-CG2 4.01Å; V224-L226 HydrophobicContact CG1-CB 4.38Å; V224-R249 PolarHBondContact N-O 3.48Å; V224-V250 HydrophobicContact CB-CG2 4.39Å; V224-V250 HydrophobicContact CG1-CG2 4.07Å; V224-V250 CarbonylContact O-C 3.57Å; V224-V250 WeakPolarHBondContact O-CA 3.47Å; V224-T251 PolarHBondContact O-N 3.33Å; V224-T251 PolarHBondContact O-OG1 2.9Å; V224-H252 PolarHBondContact O-N 2.84Å
225	H	92.7	Very high	87	Confident	24 Å²	24	44.4 Å²	44.4	11%	0.111	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	105.3	161.8	179.4	-167.7	0	0	0	108.9	L172 R173 I174 T227 H252 S254	L172-H225 PolarHBondContact O-N 3.09Å; R173-H225 WeakPolarHBondContact CA-O 3.32Å; R173-H225 HydrophobicContact CG-CB 4.11Å; I174-H225 PolarHBondContact N-O 3.07Å; H225-T227 PolarHBondContact NE2-OG1 3.24Å; H225-H252 CarbonylContact C-O 3.47Å; H225-H252 VanDerWaalsContact CA-O 3.31Å; H225-H252 WeakPolarHBondContact CA-O 3.5Å; H225-H252 HydrophobicContact CB-CB 4.15Å; H225-H252 AromaticContact CD2-CG 3.46Å; H225-H252 VanDerWaalsContact CD2-CG 3.46Å; H225-H252 AromaticContact CD2-ND1 3.58Å; H225-H252 PolarHBondContact CD2-O 2.91Å; H225-H252 AromaticContact CE1-CE1 3.69Å; H225-H252 AromaticContact CE1-ND1 3.46Å; H225-H252 PolarHBondContact CE1-ND1 2.81Å; H225-H252 AromaticContact CG-ND1 3.87Å; H225-H252 AromaticContact ND1-ND1 3.82Å; H225-H252 AromaticContact NE2-CD2 3.93Å; H225-H252 AromaticContact NE2-CE1 3.46Å; H225-H252 PolarHBondContact NE2-CE1 3.32Å; H225-H252 AromaticContact NE2-CG 3.56Å; H225-H252 AromaticContact NE2-ND1 3.3Å; H225-H252 PolarHBondContact NE2-ND1 2.04Å; H225-H252 AromaticContact NE2-NE2 3.86Å; H225-S254 PolarHBondContact NE2-OG 2.76Å
226	L	94.9	Very high	87.1	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	126.3	172	177.7	61.3	0	0	0	109.6	I174 L176 L206 I210 V224 I228 V250 H252 L253 S254	I174-L226 HydrophobicContact CB-CD1 4.26Å; I174-L226 HydrophobicContact CG2-CD1 4.09Å; I174-L226 WeakPolarHBondContact O-CA 3.32Å; L176-L226 HydrophobicContact CD1-CD1 4.48Å; L176-L226 HydrophobicContact CG-CD1 4.49Å; L206-L226 HydrophobicContact CD2-CD2 4.31Å; I210-L226 HydrophobicContact CD1-CD2 4.34Å; V224-L226 HydrophobicContact CG1-CB 4.38Å; L226-I228 HydrophobicContact CD1-CG1 4.43Å; L226-I228 HydrophobicContact CD2-CD1 4.34Å; L226-I228 HydrophobicContact CD2-CG1 4.48Å; L226-I228 HydrophobicContact CG-CG1 4.23Å; L226-V250 HydrophobicContact CB-CG1 4.38Å; L226-H252 PolarHBondContact N-O 2.85Å; L226-L253 HydrophobicContact CB-CD1 4.11Å; L226-L253 HydrophobicContact CD2-CD1 3.87Å; L226-L253 HydrophobicContact CG-CD1 4.02Å; L226-L253 CarbonylContact O-C 3.49Å; L226-L253 WeakPolarHBondContact O-CA 3.44Å; L226-S254 PolarHBondContact O-N 2.59Å
227	T	95	Very high	87.1	Confident	31 Å²	31	36.2 Å²	36.2	19%	0.19	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.2	170.6	-62.6	0	0	0	0	110.1	I174 V175 L176 H225 S254	I174-T227 PolarHBondContact O-N 3.33Å; V175-T227 CarbonylContact C-O 3.59Å; V175-T227 VanDerWaalsContact CA-O 3.31Å; V175-T227 WeakPolarHBondContact CA-O 3.37Å; V175-T227 HydrophobicContact CG1-CG2 4.5Å; L176-T227 PolarHBondContact N-O 3.08Å; H225-T227 PolarHBondContact NE2-OG1 3.24Å; T227-S254 WeakPolarHBondContact CA-O 3.39Å
228	I	93.5	Very high	87	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.026	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	115.5	174.7	-52.7	179.9	0	0	0	107.4	L176 L206 L226 I231 F233 S254 L255	L176-I228 HydrophobicContact CD1-CG1 4.33Å; L206-I228 HydrophobicContact CD1-CD1 4.12Å; L206-I228 HydrophobicContact CD2-CD1 3.96Å; L226-I228 HydrophobicContact CD1-CG1 4.43Å; L226-I228 HydrophobicContact CD2-CD1 4.34Å; L226-I228 HydrophobicContact CD2-CG1 4.48Å; L226-I228 HydrophobicContact CG-CG1 4.23Å; I228-I231 HydrophobicContact CG2-CB 3.83Å; I228-I231 HydrophobicContact CG2-CD1 4.11Å; I228-I231 HydrophobicContact CG2-CG2 4.11Å; I228-F233 HydrophobicContact CD1-CE2 3.81Å; I228-F233 HydrophobicContact CD1-CZ 4.11Å; I228-F233 HydrophobicContact CG2-CE2 3.82Å; I228-F233 HydrophobicContact CG2-CZ 4.03Å; I228-S254 PolarHBondContact N-O 2.99Å; I228-L255 HydrophobicContact CB-CB 4.33Å
229	S	88.6	Confident	86.9	Confident	21 Å²	21	30.5 Å²	30.5	15%	0.147	15%	0.153	C	C	.	.			trans	-118	144.1	-169	-159.9	0	0	0	0	111.2	L176 P178 I231	L176-S229 PolarHBondContact O-N 3.29Å; P178-S229 WeakPolarHBondContact CD-O 3.28Å; S229-I231 PolarHBondContact O-N 2.8Å
230	F	85.2	Confident	87.3	Confident	43 Å²	43	30.5 Å²	30.5	19%	0.189	15%	0.153	C	C	.	.	S	Bend	trans	49.3	8.6	-175.1	-62.1	-90.9	0	0	0	117.3	P178 A193 R195 L196 W722	P178-F230 HydrophobicContact CG-CB 4.07Å; A193-F230 HydrophobicContact CB-CD1 3.91Å; A193-F230 HydrophobicContact CB-CE1 3.98Å; A193-F230 HydrophobicContact CB-CG 4.35Å; A193-F230 HydrophobicContact CB-CZ 4.49Å; R195-F230 WeakPolarHBondContact CA-O 3.11Å; L196-F230 PolarHBondContact N-O 3.24Å; F230-W722 HydrophobicContact CD2-CH2 4.36Å; F230-W722 AromaticContact CE2-CH2 3.47Å; F230-W722 HydrophobicContact CE2-CH2 3.47Å; F230-W722 VanDerWaalsContact CE2-CH2 3.47Å; F230-W722 AromaticContact CE2-CZ2 3.56Å; F230-W722 HydrophobicContact CE2-CZ2 3.56Å; F230-W722 HydrophobicContact CE2-CZ3 4.1Å; F230-W722 HydrophobicContact CZ-CH2 4.11Å; F230-W722 HydrophobicContact CZ-CZ2 4.29Å; F230-W722 HydrophobicContact CZ-CZ3 4.3Å
231	I	88.7	Confident	87.9	Confident	2 Å²	2	27.3 Å²	27.3	1%	0.01	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	127	176.5	-67.8	156.8	0	0	0	108.6	I143 P178 L196 I198 I228 S229 F233	I143-I231 HydrophobicContact CD1-CD1 4.16Å; I143-I231 HydrophobicContact CG1-CD1 4.4Å; I143-I231 HydrophobicContact CG2-CD1 3.92Å; P178-I231 HydrophobicContact CG-CG1 4.05Å; L196-I231 HydrophobicContact CB-CG1 4.16Å; L196-I231 HydrophobicContact CD2-CG1 4.36Å; L196-I231 WeakPolarHBondContact O-CA 3.22Å; I198-I231 HydrophobicContact CB-CG2 4.49Å; I198-I231 HydrophobicContact CD1-CG2 3.52Å; I198-I231 HydrophobicContact CG1-CG2 3.95Å; I228-I231 HydrophobicContact CG2-CB 3.83Å; I228-I231 HydrophobicContact CG2-CD1 4.11Å; I228-I231 HydrophobicContact CG2-CG2 4.11Å; S229-I231 PolarHBondContact O-N 2.8Å; I231-F233 HydrophobicContact CG2-CD1 4.35Å; I231-F233 HydrophobicContact CG2-CE1 3.77Å; I231-F233 HydrophobicContact CG2-CE2 4.03Å; I231-F233 HydrophobicContact CG2-CZ 3.6Å
232	Y	89.1	Confident	88.3	Confident	1 Å²	1	24.3 Å²	24.3	0%	0.004	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	120.3	-179.7	-73	-103.7	0	0	0	109.4	R195 L196 R197 I198 W256	R195-Y232 HydrophobicContact CB-CD2 4.29Å; R195-Y232 HydrophobicContact CB-CE2 4.07Å; R195-Y232 HydrophobicContact CG-CE2 4.09Å; R195-Y232 PolarHBondContact NH1-OH 3.5Å; L196-Y232 PolarHBondContact O-N 2.92Å; R197-Y232 CarbonylContact C-O 3.59Å; R197-Y232 WeakPolarHBondContact CA-O 3.22Å; I198-Y232 PolarHBondContact N-O 2.85Å; Y232-W256 HydrophobicContact CD1-CB 4.01Å; Y232-W256 HydrophobicContact CD1-CG 4.34Å; Y232-W256 HydrophobicContact CD2-CG 4.5Å; Y232-W256 HydrophobicContact CE1-CB 4.01Å; Y232-W256 AromaticContact CE1-CD2 3.98Å; Y232-W256 HydrophobicContact CE1-CD2 3.98Å; Y232-W256 HydrophobicContact CE1-CE3 4.02Å; Y232-W256 AromaticContact CE1-CG 3.99Å; Y232-W256 HydrophobicContact CE1-CG 3.99Å; Y232-W256 HydrophobicContact CE2-CD2 4.22Å; Y232-W256 HydrophobicContact CE2-CG 4.14Å; Y232-W256 HydrophobicContact CG-CB 4.4Å; Y232-W256 AromaticContact CZ-CD2 3.65Å; Y232-W256 AromaticContact CZ-CE3 3.9Å; Y232-W256 AromaticContact CZ-CG 3.87Å
233	F	90.9	Very high	88.4	Confident	4 Å²	4	25.5 Å²	25.5	2%	0.018	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	131.2	178.7	-61.5	-70.9	0	0	0	111.8	I198 L201 I228 I231 L236 P258 F259	I198-F233 HydrophobicContact CB-CD1 3.96Å; I198-F233 HydrophobicContact CB-CE1 4.16Å; I198-F233 HydrophobicContact CD1-CE1 4.3Å; I198-F233 HydrophobicContact CG2-CD1 4Å; I198-F233 HydrophobicContact CG2-CE1 4.09Å; I198-F233 WeakPolarHBondContact O-CA 3.22Å; L201-F233 HydrophobicContact CD1-CD1 4.24Å; L201-F233 HydrophobicContact CD1-CE1 3.49Å; L201-F233 VanDerWaalsContact CD1-CE1 3.49Å; L201-F233 HydrophobicContact CD1-CZ 3.89Å; I228-F233 HydrophobicContact CD1-CE2 3.81Å; I228-F233 HydrophobicContact CD1-CZ 4.11Å; I228-F233 HydrophobicContact CG2-CE2 3.82Å; I228-F233 HydrophobicContact CG2-CZ 4.03Å; I231-F233 HydrophobicContact CG2-CD1 4.35Å; I231-F233 HydrophobicContact CG2-CE1 3.77Å; I231-F233 HydrophobicContact CG2-CE2 4.03Å; I231-F233 HydrophobicContact CG2-CZ 3.6Å; F233-L236 HydrophobicContact CB-CD1 4.33Å; F233-L236 HydrophobicContact CB-CD2 4.01Å; F233-L236 HydrophobicContact CB-CG 3.83Å; F233-L236 HydrophobicContact CD1-CD2 4.36Å; F233-L236 HydrophobicContact CD2-CD1 3.91Å; F233-L236 HydrophobicContact CD2-CD2 3.86Å; F233-L236 HydrophobicContact CD2-CG 4.1Å; F233-L236 HydrophobicContact CE2-CD2 4.41Å; F233-L236 HydrophobicContact CG-CD1 4.41Å; F233-L236 HydrophobicContact CG-CD2 3.82Å; F233-L236 HydrophobicContact CG-CG 4.11Å; F233-P258 HydrophobicContact CB-CB 4.37Å; F233-P258 CarbonylContact O-C 3.56Å; F233-P258 WeakPolarHBondContact O-CA 3.31Å; F233-P258 VanDerWaalsContact O-CB 3.31Å; F233-P258 WeakPolarHBondContact O-CB 3.44Å; F233-F259 PolarHBondContact O-N 2.84Å
234	K	89.2	Confident	88.4	Confident	98 Å²	98	24 Å²	24	43%	0.426	11%	0.113	S	C	.	.	S	Bend	trans	-66.3	-38.7	173.7	-172.7	176	-179.3	172	0	112	E124 I198 Y260	E124-K234 IonicContact OE1-NZ 2.97Å; E124-K234 PolarHBondContact OE1-NZ 3.32Å; I198-K234 PolarHBondContact O-N 2.77Å; K234-Y260 PolarHBondContact O-N 3.42Å; K234-Y260 VanDerWaalsContact O-N 3.12Å
235	R	88.7	Confident	88	Confident	131 Å²	131	24.1 Å²	24.1	49%	0.494	12%	0.115	S	C	.	.			trans	-139.2	143.3	173.9	179.6	166.4	-168.6	170.1	6.7	110.2	Y260 D262	R235-Y260 WeakPolarHBondContact CA-O 3.34Å; R235-Y260 HydrophobicContact CB-CD1 4.42Å; R235-Y260 HydrophobicContact CG-CD1 3.91Å; R235-Y260 HydrophobicContact CG-CE1 4.35Å; R235-D262 IonicContact CZ-OD1 3.27Å; R235-D262 IonicContact CZ-OD2 3.76Å; R235-D262 VanDerWaalsContact CZ-OD2 3.27Å; R235-D262 IonicContact NE-OD1 3.25Å; R235-D262 IonicContact NE-OD2 2.88Å; R235-D262 PolarHBondContact NE-OD2 3.21Å; R235-D262 IonicContact NH2-OD1 2.7Å; R235-D262 PolarHBondContact NH2-OD1 2.86Å; R235-D262 IonicContact NH2-OD2 2.72Å; R235-D262 PolarHBondContact NH2-OD2 3.37Å
236	L	89.9	Confident	87.1	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.005	12%	0.121	C	C	.	.	B	Isolated β-bridge	trans	-127.9	114.7	162.1	-73.8	176.7	0	0	0	110.1	F233 D240 L241 L255 P258 Y260 D262 S265	F233-L236 HydrophobicContact CB-CD1 4.33Å; F233-L236 HydrophobicContact CB-CD2 4.01Å; F233-L236 HydrophobicContact CB-CG 3.83Å; F233-L236 HydrophobicContact CD1-CD2 4.36Å; F233-L236 HydrophobicContact CD2-CD1 3.91Å; F233-L236 HydrophobicContact CD2-CD2 3.86Å; F233-L236 HydrophobicContact CD2-CG 4.1Å; F233-L236 HydrophobicContact CE2-CD2 4.41Å; F233-L236 HydrophobicContact CG-CD1 4.41Å; F233-L236 HydrophobicContact CG-CD2 3.82Å; F233-L236 HydrophobicContact CG-CG 4.11Å; L236-D240 HydrophobicContact CD2-CB 4.44Å; L236-L241 HydrophobicContact CB-CD1 4.06Å; L236-L241 HydrophobicContact CB-CG 4.48Å; L236-L241 HydrophobicContact CD1-CD1 4.26Å; L236-L255 HydrophobicContact CD1-CD1 4.31Å; L236-L255 HydrophobicContact CD1-CD2 3.81Å; L236-P258 HydrophobicContact CD1-CB 4.19Å; L236-P258 HydrophobicContact CD1-CG 4.18Å; L236-P258 HydrophobicContact CG-CB 4.24Å; L236-Y260 PolarHBondContact N-O 2.9Å; L236-D262 PolarHBondContact O-N 3.18Å; L236-S265 PolarHBondContact O-OG 3.5Å
237	G	87.1	Confident	86.4	Confident	6 Å²	6	29.9 Å²	29.9	6%	0.062	14%	0.143	C	C	.	.			trans	-105.7	178.8	-176.6	0	0	0	0	0	113.9	D239 D240 L241 D262 S265	G237-D239 VanDerWaalsContact C-N 3.32Å; G237-D239 PolarHBondContact O-N 3.22Å; G237-D240 PolarHBondContact N-OD2 2.95Å; G237-D240 WeakPolarHBondContact O-CB 3.44Å; G237-D240 PolarHBondContact O-N 2.9Å; G237-D240 VanDerWaalsContact O-N 3.13Å; G237-L241 PolarHBondContact O-N 3.12Å; G237-L241 VanDerWaalsContact O-N 3.14Å; G237-D262 WeakPolarHBondContact CA-OD2 3.01Å; G237-S265 WeakPolarHBondContact CA-OG 3.32Å
238	R	82.6	Confident	85.8	Confident	23 Å²	23	28.4 Å²	28.4	9%	0.087	13%	0.134	C	C	.	.	H	α-helix	trans	-68.8	-28.8	177.8	-169.1	171.5	157	-138.5	-12.1	114.3	D240 G242 D264 S265 I267 P268 I269 D339	R238-D240 PolarHBondContact O-N 2.98Å; R238-G242 PolarHBondContact O-N 2.63Å; R238-G242 VanDerWaalsContact O-N 3.12Å; R238-D264 WeakPolarHBondContact CD-O 3.36Å; R238-D264 WeakPolarHBondContact CD-OD2 3.3Å; R238-D264 IonicContact CZ-OD2 3.29Å; R238-D264 IonicContact NE-OD2 3.61Å; R238-D264 IonicContact NH1-OD2 3.42Å; R238-D264 PolarHBondContact NH1-OD2 2.67Å; R238-S265 PolarHBondContact N-OG 2.75Å; R238-I267 VanDerWaalsContact CD-O 3.28Å; R238-I267 WeakPolarHBondContact CD-O 3.26Å; R238-I267 WeakPolarHBondContact CG-O 3.32Å; R238-I267 PolarHBondContact NE-O 2.86Å; R238-P268 PolarHBondContact NH2-O 3.04Å; R238-P268 VanDerWaalsContact NH2-O 3.09Å; R238-I269 HydrophobicContact CG-CD1 4.4Å; R238-I269 HydrophobicContact CG-CG1 3.99Å; R238-I269 WeakPolarHBondContact O-CD1 3.5Å; R238-D339 IonicContact CZ-OD1 3.14Å; R238-D339 IonicContact CZ-OD2 2.67Å; R238-D339 IonicContact NH1-OD1 2.69Å; R238-D339 PolarHBondContact NH1-OD1 2.65Å; R238-D339 IonicContact NH1-OD2 2.73Å; R238-D339 IonicContact NH2-OD1 2.84Å; R238-D339 IonicContact NH2-OD2 2.68Å; R238-D339 PolarHBondContact NH2-OD2 3.02Å
239	D	82.2	Confident	85.3	Confident	61 Å²	61	32.5 Å²	32.5	33%	0.326	15%	0.149	S	C	.	.	H	α-helix	trans	-63.2	-22.4	171.9	-62.2	-40.1	0	0	0	112.3	P203 G204 G237 I269 K341	P203-D239 HydrophobicContact CB-CB 4.32Å; G204-D239 PolarHBondContact N-O 2.77Å; G237-D239 VanDerWaalsContact C-N 3.32Å; G237-D239 PolarHBondContact O-N 3.22Å; D239-I269 HydrophobicContact CB-CD1 4.46Å; D239-I269 WeakPolarHBondContact OD1-CD1 3.46Å; D239-K341 IonicContact OD1-NZ 3.32Å; D239-K341 PolarHBondContact OD1-NZ 2.85Å; D239-K341 IonicContact OD2-NZ 2.85Å; D239-K341 PolarHBondContact OD2-NZ 2.89Å
240	D	87.8	Confident	85.3	Confident	19 Å²	19	31.5 Å²	31.5	10%	0.102	14%	0.142	C	C	.	.	H	α-helix	trans	-94.2	-48.1	-178.2	-50.9	-44.5	0	0	0	112	L201 L236 G237 R238	L201-D240 HydrophobicContact CD2-CB 3.71Å; L201-D240 WeakPolarHBondContact CD2-OD1 3.37Å; L236-D240 HydrophobicContact CD2-CB 4.44Å; G237-D240 PolarHBondContact N-OD2 2.95Å; G237-D240 WeakPolarHBondContact O-CB 3.44Å; G237-D240 PolarHBondContact O-N 2.9Å; G237-D240 VanDerWaalsContact O-N 3.13Å; R238-D240 PolarHBondContact O-N 2.98Å
241	L	89	Confident	85.4	Confident	2 Å²	2	31 Å²	31	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-106.6	-31	-166.3	-58.2	-174.2	0	0	0	115.2	L206 L236 G237 N243 L244 L253 W261 S265 F266	L206-L241 HydrophobicContact CD1-CD2 4.31Å; L236-L241 HydrophobicContact CB-CD1 4.06Å; L236-L241 HydrophobicContact CB-CG 4.48Å; L236-L241 HydrophobicContact CD1-CD1 4.26Å; G237-L241 PolarHBondContact O-N 3.12Å; G237-L241 VanDerWaalsContact O-N 3.14Å; L241-N243 PolarHBondContact O-N 2.96Å; L241-L244 HydrophobicContact CB-CD1 4.43Å; L241-L244 HydrophobicContact CD2-CD1 3.63Å; L241-L244 WeakPolarHBondContact O-CB 3.49Å; L241-L244 WeakPolarHBondContact O-CG 3.13Å; L241-L244 PolarHBondContact O-N 3.03Å; L241-L253 HydrophobicContact CD2-CD2 4.19Å; L241-W261 HydrophobicContact CD1-CZ2 3.55Å; L241-S265 CarbonylContact C-O 3.56Å; L241-S265 WeakPolarHBondContact CB-O 3.15Å; L241-F266 HydrophobicContact CB-CD1 4.24Å; L241-F266 HydrophobicContact CB-CE1 4.13Å; L241-F266 HydrophobicContact CD1-CE1 4.1Å; L241-F266 HydrophobicContact CD1-CZ 4.08Å
242	G	82.8	Confident	85.6	Confident	2 Å²	2	32.1 Å²	32.1	2%	0.021	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.9	-164.8	0	0	0	0	0	114.7	R238 T246 S265 P268	R238-G242 PolarHBondContact O-N 2.63Å; R238-G242 VanDerWaalsContact O-N 3.12Å; G242-T246 PolarHBondContact O-OG1 2.82Å; G242-S265 WeakPolarHBondContact CA-O 3.17Å; G242-S265 PolarHBondContact N-O 2.87Å; G242-P268 WeakPolarHBondContact O-CA 3.32Å
243	N	82	Confident	85.8	Confident	25 Å²	25	32.1 Å²	32.1	13%	0.134	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-12	178.1	-68.3	-53.5	0	0	0	114.2	L241 T246 K247 S248	L241-N243 PolarHBondContact O-N 2.96Å; N243-T246 PolarHBondContact O-N 3.41Å; N243-K247 HydrophobicContact CB-CD 4.01Å; N243-K247 HydrophobicContact CB-CG 4.37Å; N243-K247 WeakPolarHBondContact O-CB 3.18Å; N243-K247 PolarHBondContact O-N 3.03Å; N243-K247 WeakPolarHBondContact OD1-CE 3.49Å; N243-K247 PolarHBondContact OD1-NZ 3.08Å; N243-S248 PolarHBondContact O-N 3.31Å
244	L	86.4	Confident	86	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.016	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-46.6	-168.6	-71.1	177.9	0	0	0	113.6	L206 N207 I210 L241 S248 R249 V250 L253	L206-L244 HydrophobicContact CB-CD2 3.88Å; L206-L244 HydrophobicContact CD1-CD1 4.41Å; N207-L244 HydrophobicContact CB-CD2 4.44Å; I210-L244 HydrophobicContact CD1-CD2 3.84Å; L241-L244 HydrophobicContact CB-CD1 4.43Å; L241-L244 HydrophobicContact CD2-CD1 3.63Å; L241-L244 WeakPolarHBondContact O-CB 3.49Å; L241-L244 WeakPolarHBondContact O-CG 3.13Å; L241-L244 PolarHBondContact O-N 3.03Å; L244-S248 WeakPolarHBondContact CA-OG 3.4Å; L244-S248 CarbonylContact O-C 3.59Å; L244-S248 VanDerWaalsContact O-CA 3.26Å; L244-S248 WeakPolarHBondContact O-CA 3.46Å; L244-S248 VanDerWaalsContact O-CB 3.26Å; L244-S248 WeakPolarHBondContact O-CB 3.45Å; L244-S248 PolarHBondContact O-N 2.87Å; L244-S248 PolarHBondContact O-OG 3.48Å; L244-R249 PolarHBondContact O-N 2.82Å; L244-V250 HydrophobicContact CB-CB 4.18Å; L244-V250 HydrophobicContact CB-CG2 3.95Å; L244-V250 HydrophobicContact CD2-CG2 4.41Å; L244-V250 WeakPolarHBondContact O-CG2 3.41Å; L244-V250 PolarHBondContact O-N 2.79Å; L244-L253 HydrophobicContact CD1-CD2 4.46Å
245	A	81.4	Confident	86.2	Confident	3 Å²	3	27.7 Å²	27.7	3%	0.025	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-30.5	178.9	0	0	0	0	0	112.7	R249 V250 P287 F290 W312	A245-R249 WeakPolarHBondContact O-CA 3.3Å; A245-V250 WeakPolarHBondContact CA-O 3.41Å; A245-V250 WeakPolarHBondContact CB-O 3.35Å; A245-P287 HydrophobicContact CB-CG 4.03Å; A245-P287 WeakPolarHBondContact O-CD 3.37Å; A245-F290 HydrophobicContact CB-CD2 3.9Å; A245-F290 HydrophobicContact CB-CE2 4.15Å; A245-W312 HydrophobicContact CB-CH2 4.41Å; A245-W312 HydrophobicContact CB-CZ2 3.38Å
246	T	74.9	Confident	86.3	Confident	39 Å²	39	23.5 Å²	23.5	24%	0.239	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-36.5	-170.1	50.6	0	0	0	0	114.1	G242 N243 P268	G242-T246 PolarHBondContact O-OG1 2.82Å; N243-T246 PolarHBondContact O-N 3.41Å; T246-P268 HydrophobicContact CG2-CB 4.41Å; T246-P268 HydrophobicContact CG2-CG 3.64Å
247	K	79	Confident	86.3	Confident	108 Å²	108	23.6 Å²	23.6	47%	0.47	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-57.9	173.1	-59.8	-179.8	-175.6	153.6	0	109.3	N243 R249 I269	N243-K247 HydrophobicContact CB-CD 4.01Å; N243-K247 HydrophobicContact CB-CG 4.37Å; N243-K247 WeakPolarHBondContact O-CB 3.18Å; N243-K247 PolarHBondContact O-N 3.03Å; N243-K247 WeakPolarHBondContact OD1-CE 3.49Å; N243-K247 PolarHBondContact OD1-NZ 3.08Å; K247-R249 VanDerWaalsContact C-N 3.27Å; K247-R249 PolarHBondContact O-N 2.81Å; K247-I269 PolarHBondContact NZ-O 2.79Å
248	S	82.8	Confident	86.4	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.111	C	C	.	.	S	Bend	trans	-81.5	8.9	-175.2	-11	0	0	0	0	114.7	N207 R214 N243 L244 V250	N207-S248 PolarHBondContact OD1-OG 2.74Å; R214-S248 VanDerWaalsContact CZ-O 3.25Å; R214-S248 PolarHBondContact NH1-O 3.01Å; R214-S248 PolarHBondContact NH2-O 3.38Å; N243-S248 PolarHBondContact O-N 3.31Å; L244-S248 WeakPolarHBondContact CA-OG 3.4Å; L244-S248 CarbonylContact O-C 3.59Å; L244-S248 VanDerWaalsContact O-CA 3.26Å; L244-S248 WeakPolarHBondContact O-CA 3.46Å; L244-S248 VanDerWaalsContact O-CB 3.26Å; L244-S248 WeakPolarHBondContact O-CB 3.45Å; L244-S248 PolarHBondContact O-N 2.87Å; L244-S248 PolarHBondContact O-OG 3.48Å; S248-V250 PolarHBondContact O-N 3.06Å
249	R	83	Confident	86.7	Confident	90 Å²	90	26.5 Å²	26.5	34%	0.34	13%	0.126	S	C	.	.			trans	43	36.3	177.9	-59.3	174.1	161.6	-127.3	-16.3	114.8	L221 V224 L244 A245 K247 T251	L221-R249 PolarHBondContact O-NH1 3.5Å; V224-R249 PolarHBondContact N-O 3.48Å; L244-R249 PolarHBondContact O-N 2.82Å; A245-R249 WeakPolarHBondContact O-CA 3.3Å; K247-R249 VanDerWaalsContact C-N 3.27Å; K247-R249 PolarHBondContact O-N 2.81Å; R249-T251 PolarHBondContact O-N 3.02Å
250	V	88.4	Confident	87	Confident	0 Å²	0	29 Å²	29	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	117.3	171.7	179.1	0	0	0	0	108.2	I210 V224 L226 L244 A245 S248 H252 L253 F290	I210-V250 HydrophobicContact CD1-CG2 3.46Å; I210-V250 VanDerWaalsContact CD1-CG2 3.46Å; V224-V250 HydrophobicContact CB-CG2 4.39Å; V224-V250 HydrophobicContact CG1-CG2 4.07Å; V224-V250 CarbonylContact O-C 3.57Å; V224-V250 WeakPolarHBondContact O-CA 3.47Å; L226-V250 HydrophobicContact CB-CG1 4.38Å; L244-V250 HydrophobicContact CB-CB 4.18Å; L244-V250 HydrophobicContact CB-CG2 3.95Å; L244-V250 HydrophobicContact CD2-CG2 4.41Å; L244-V250 WeakPolarHBondContact O-CG2 3.41Å; L244-V250 PolarHBondContact O-N 2.79Å; A245-V250 WeakPolarHBondContact CA-O 3.41Å; A245-V250 WeakPolarHBondContact CB-O 3.35Å; S248-V250 PolarHBondContact O-N 3.06Å; V250-H252 VanDerWaalsContact CG1-O 3.27Å; V250-H252 WeakPolarHBondContact CG1-O 3.4Å; V250-L253 HydrophobicContact CG1-CB 4.31Å; V250-F290 HydrophobicContact CG1-CE2 4.29Å; V250-F290 WeakPolarHBondContact O-CD2 3.27Å
251	T	87.7	Confident	87	Confident	34 Å²	34	28.2 Å²	28.2	21%	0.209	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	-21.5	176.3	54.9	0	0	0	0	112.1	P223 V224 R249 P287 F290 R291	P223-T251 HydrophobicContact CB-CG2 3.56Å; V224-T251 PolarHBondContact O-N 3.33Å; V224-T251 PolarHBondContact O-OG1 2.9Å; R249-T251 PolarHBondContact O-N 3.02Å; T251-P287 HydrophobicContact CG2-CB 3.88Å; T251-P287 HydrophobicContact CG2-CG 4.38Å; T251-F290 CarbonylContact O-C 3.49Å; T251-R291 PolarHBondContact O-N 3.17Å
252	H	92.2	Very high	86.8	Confident	25 Å²	25	29.1 Å²	29.1	12%	0.116	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	125.7	171.6	-171.9	-177.7	0	0	0	109.9	V224 H225 L226 V250 S254 R291 S293	V224-H252 PolarHBondContact O-N 2.84Å; H225-H252 CarbonylContact C-O 3.47Å; H225-H252 VanDerWaalsContact CA-O 3.31Å; H225-H252 WeakPolarHBondContact CA-O 3.5Å; H225-H252 HydrophobicContact CB-CB 4.15Å; H225-H252 AromaticContact CD2-CG 3.46Å; H225-H252 VanDerWaalsContact CD2-CG 3.46Å; H225-H252 AromaticContact CD2-ND1 3.58Å; H225-H252 PolarHBondContact CD2-O 2.91Å; H225-H252 AromaticContact CE1-CE1 3.69Å; H225-H252 AromaticContact CE1-ND1 3.46Å; H225-H252 PolarHBondContact CE1-ND1 2.81Å; H225-H252 AromaticContact CG-ND1 3.87Å; H225-H252 AromaticContact ND1-ND1 3.82Å; H225-H252 AromaticContact NE2-CD2 3.93Å; H225-H252 AromaticContact NE2-CE1 3.46Å; H225-H252 PolarHBondContact NE2-CE1 3.32Å; H225-H252 AromaticContact NE2-CG 3.56Å; H225-H252 AromaticContact NE2-ND1 3.3Å; H225-H252 PolarHBondContact NE2-ND1 2.04Å; H225-H252 AromaticContact NE2-NE2 3.86Å; L226-H252 PolarHBondContact N-O 2.85Å; V250-H252 VanDerWaalsContact CG1-O 3.27Å; V250-H252 WeakPolarHBondContact CG1-O 3.4Å; H252-S254 PolarHBondContact NE2-OG 3.13Å; H252-R291 CarbonylContact C-O 3.5Å; H252-R291 VanDerWaalsContact CA-O 3.31Å; H252-R291 WeakPolarHBondContact CA-O 3.36Å; H252-R291 HydrophobicContact CB-CB 4.1Å; H252-R291 PolarHBondContact CD2-O 3.47Å; H252-S293 PolarHBondContact NE2-OG 3.11Å
253	L	94.1	Very high	86.7	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.1	168.6	-177.5	59.3	0	0	0	109.8	L226 L241 L244 V250 L255 F266 F290 R291 L292 S293	L226-L253 HydrophobicContact CB-CD1 4.11Å; L226-L253 HydrophobicContact CD2-CD1 3.87Å; L226-L253 HydrophobicContact CG-CD1 4.02Å; L226-L253 CarbonylContact O-C 3.49Å; L226-L253 WeakPolarHBondContact O-CA 3.44Å; L241-L253 HydrophobicContact CD2-CD2 4.19Å; L244-L253 HydrophobicContact CD1-CD2 4.46Å; V250-L253 HydrophobicContact CG1-CB 4.31Å; L253-L255 HydrophobicContact CD1-CD2 4.12Å; L253-L255 HydrophobicContact CD2-CD2 3.75Å; L253-L255 HydrophobicContact CG-CD2 3.84Å; L253-L255 HydrophobicContact CG-CG 4.42Å; L253-F266 HydrophobicContact CD2-CE1 4.14Å; L253-F266 HydrophobicContact CD2-CZ 4.2Å; L253-F290 HydrophobicContact CB-CE2 4.46Å; L253-F290 HydrophobicContact CB-CZ 4.02Å; L253-R291 PolarHBondContact N-O 3.17Å; L253-L292 HydrophobicContact CB-CD1 4.03Å; L253-L292 HydrophobicContact CD2-CD1 4.06Å; L253-L292 HydrophobicContact CG-CD1 4.06Å; L253-L292 CarbonylContact O-C 3.52Å; L253-L292 WeakPolarHBondContact O-CA 3.49Å; L253-S293 PolarHBondContact O-N 3.31Å
254	S	94.9	Very high	86.4	Confident	8 Å²	8	31.1 Å²	31.1	6%	0.056	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.4	171.3	-70.2	0	0	0	0	109.9	H225 L226 T227 I228 H252 S293	H225-S254 PolarHBondContact NE2-OG 2.76Å; L226-S254 PolarHBondContact O-N 2.59Å; T227-S254 WeakPolarHBondContact CA-O 3.39Å; I228-S254 PolarHBondContact N-O 2.99Å; H252-S254 PolarHBondContact NE2-OG 3.13Å; S254-S293 WeakPolarHBondContact CA-O 3.47Å
255	L	93.4	Very high	86.4	Confident	2 Å²	2	31 Å²	31	1%	0.01	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	161.3	176.9	54.5	82.4	0	0	0	113	I228 L236 L253 W261 S293 L294 F295	I228-L255 HydrophobicContact CB-CB 4.33Å; L236-L255 HydrophobicContact CD1-CD1 4.31Å; L236-L255 HydrophobicContact CD1-CD2 3.81Å; L253-L255 HydrophobicContact CD1-CD2 4.12Å; L253-L255 HydrophobicContact CD2-CD2 3.75Å; L253-L255 HydrophobicContact CG-CD2 3.84Å; L253-L255 HydrophobicContact CG-CG 4.42Å; L255-W261 HydrophobicContact CD1-CH2 4.05Å; L255-W261 HydrophobicContact CD1-CZ3 4.13Å; L255-S293 PolarHBondContact N-O 3.46Å; L255-L294 HydrophobicContact CD1-CD2 3.47Å; L255-L294 VanDerWaalsContact CD1-CD2 3.47Å; L255-L294 HydrophobicContact CG-CD2 4.21Å; L255-L294 WeakPolarHBondContact O-CA 3.42Å; L255-F295 PolarHBondContact O-N 2.81Å
256	W	90.3	Very high	86.6	Confident	43 Å²	43	31 Å²	31	16%	0.163	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	138.9	167.1	-71.5	103.3	0	0	0	110.4	Y232 P258 F295 D297	Y232-W256 HydrophobicContact CD1-CB 4.01Å; Y232-W256 HydrophobicContact CD1-CG 4.34Å; Y232-W256 HydrophobicContact CD2-CG 4.5Å; Y232-W256 HydrophobicContact CE1-CB 4.01Å; Y232-W256 AromaticContact CE1-CD2 3.98Å; Y232-W256 HydrophobicContact CE1-CD2 3.98Å; Y232-W256 HydrophobicContact CE1-CE3 4.02Å; Y232-W256 AromaticContact CE1-CG 3.99Å; Y232-W256 HydrophobicContact CE1-CG 3.99Å; Y232-W256 HydrophobicContact CE2-CD2 4.22Å; Y232-W256 HydrophobicContact CE2-CG 4.14Å; Y232-W256 HydrophobicContact CG-CB 4.4Å; Y232-W256 AromaticContact CZ-CD2 3.65Å; Y232-W256 AromaticContact CZ-CE3 3.9Å; Y232-W256 AromaticContact CZ-CG 3.87Å; W256-P258 WeakPolarHBondContact O-CD 3.31Å; W256-P258 VanDerWaalsContact O-N 3.12Å; W256-F295 WeakPolarHBondContact CA-O 3.38Å; W256-F295 HydrophobicContact CD2-CB 4.09Å; W256-F295 HydrophobicContact CE3-CB 3.57Å; W256-F295 HydrophobicContact CH2-CB 4.31Å; W256-F295 HydrophobicContact CZ3-CB 3.68Å; W256-D297 HydrophobicContact CZ3-CB 3.92Å
257	N	89.9	Confident	86.8	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.011	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-51.8	116.8	176.5	-177.8	42.3	0	0	0	109.7	F295 N300 N302 S304	N257-F295 PolarHBondContact N-O 2.87Å; N257-N300 HydrophobicContact CB-CB 4.38Å; N257-N300 PolarHBondContact ND2-O 3Å; N257-N300 PolarHBondContact O-ND2 2.63Å; N257-N302 PolarHBondContact ND2-O 3.06Å; N257-S304 WeakPolarHBondContact OD1-CB 3.31Å; N257-S304 PolarHBondContact OD1-OG 3.29Å
258	P	90.5	Very high	86.6	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.006	11%	0.111	C	C	.	.	P	Polyproline II helix	trans	-67.7	160.5	-178.7	30.2	-36.4	0	0	0	110.3	F233 L236 W256 Y260 W261 S304	F233-P258 HydrophobicContact CB-CB 4.37Å; F233-P258 CarbonylContact O-C 3.56Å; F233-P258 WeakPolarHBondContact O-CA 3.31Å; F233-P258 VanDerWaalsContact O-CB 3.31Å; F233-P258 WeakPolarHBondContact O-CB 3.44Å; L236-P258 HydrophobicContact CD1-CB 4.19Å; L236-P258 HydrophobicContact CD1-CG 4.18Å; L236-P258 HydrophobicContact CG-CB 4.24Å; W256-P258 WeakPolarHBondContact O-CD 3.31Å; W256-P258 VanDerWaalsContact O-N 3.12Å; P258-Y260 PolarHBondContact O-N 3.5Å; P258-W261 VanDerWaalsContact CD-CE3 3.48Å; P258-W261 HydrophobicContact CG-CB 4.05Å; P258-W261 HydrophobicContact CG-CD2 3.84Å; P258-W261 HydrophobicContact CG-CE3 3.37Å; P258-W261 HydrophobicContact CG-CG 4.18Å; P258-W261 HydrophobicContact CG-CZ3 3.97Å; P258-S304 WeakPolarHBondContact O-CB 3.45Å
259	F	88.1	Confident	85.9	Confident	90 Å²	90	26.2 Å²	26.2	40%	0.395	12%	0.118	S	C	.	.	S	Bend	trans	-68.5	-27.5	177.6	-67.8	-87	0	0	0	112.6	F233 E299	F233-F259 PolarHBondContact O-N 2.84Å; F259-E299 HydrophobicContact CE1-CB 4.38Å; F259-E299 WeakPolarHBondContact CE1-O 3.1Å; F259-E299 HydrophobicContact CZ-CB 4.29Å
260	Y	88.2	Confident	84.8	Confident	113 Å²	113	23.9 Å²	23.9	44%	0.443	11%	0.114	S	C	.	.			trans	-149.8	143.7	174.5	172.1	-95.7	0	0	0	110.5	K234 R235 L236 P258 D262	K234-Y260 PolarHBondContact O-N 3.42Å; K234-Y260 VanDerWaalsContact O-N 3.12Å; R235-Y260 WeakPolarHBondContact CA-O 3.34Å; R235-Y260 HydrophobicContact CB-CD1 4.42Å; R235-Y260 HydrophobicContact CG-CD1 3.91Å; R235-Y260 HydrophobicContact CG-CE1 4.35Å; L236-Y260 PolarHBondContact N-O 2.9Å; P258-Y260 PolarHBondContact O-N 3.5Å; Y260-D262 WeakPolarHBondContact CE1-OD1 3.07Å; Y260-D262 PolarHBondContact OH-OD1 3.16Å
261	W	88.3	Confident	83	Confident	2 Å²	2	30 Å²	30	1%	0.008	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-138.3	122.8	-175.8	-159.8	-30.7	0	0	0	109.6	L241 L255 P258 F266 L292 L294 S304 F305 L308	L241-W261 HydrophobicContact CD1-CZ2 3.55Å; L255-W261 HydrophobicContact CD1-CH2 4.05Å; L255-W261 HydrophobicContact CD1-CZ3 4.13Å; P258-W261 VanDerWaalsContact CD-CE3 3.48Å; P258-W261 HydrophobicContact CG-CB 4.05Å; P258-W261 HydrophobicContact CG-CD2 3.84Å; P258-W261 HydrophobicContact CG-CE3 3.37Å; P258-W261 HydrophobicContact CG-CG 4.18Å; P258-W261 HydrophobicContact CG-CZ3 3.97Å; W261-F266 HydrophobicContact CH2-CE2 4.26Å; W261-F266 HydrophobicContact CH2-CZ 4.31Å; W261-F266 AromaticContact CZ2-CE2 3.49Å; W261-F266 HydrophobicContact CZ2-CE2 3.49Å; W261-F266 VanDerWaalsContact CZ2-CE2 3.49Å; W261-F266 AromaticContact CZ2-CZ 3.63Å; W261-F266 HydrophobicContact CZ2-CZ 3.63Å; W261-L292 HydrophobicContact CH2-CD1 4.28Å; W261-L292 HydrophobicContact CH2-CD2 3.86Å; W261-L292 HydrophobicContact CZ2-CD2 4.37Å; W261-L294 HydrophobicContact CH2-CD1 4.47Å; W261-L294 HydrophobicContact CH2-CD2 3.75Å; W261-L294 HydrophobicContact CZ3-CD1 3.81Å; W261-L294 HydrophobicContact CZ3-CD2 3.57Å; W261-L294 HydrophobicContact CZ3-CG 4.36Å; W261-S304 PolarHBondContact N-O 3.06Å; W261-F305 HydrophobicContact CB-CB 4.16Å; W261-F305 HydrophobicContact CB-CD1 4.46Å; W261-F305 HydrophobicContact CD2-CD1 4.3Å; W261-F305 AromaticContact CE3-CD1 3.98Å; W261-F305 HydrophobicContact CE3-CD1 3.98Å; W261-F305 HydrophobicContact CE3-CE1 4.32Å; W261-F305 HydrophobicContact CG-CD1 4.5Å; W261-L308 HydrophobicContact CD2-CD1 4.41Å; W261-L308 HydrophobicContact CG-CD1 4.46Å
262	D	84.4	Confident	80.4	Confident	22 Å²	22	31 Å²	31	12%	0.118	15%	0.148	C	C	.	.			trans	-68	138	175.7	-65.8	-62.5	0	0	0	111.3	R235 L236 G237 Y260 D264 S265	R235-D262 IonicContact CZ-OD1 3.27Å; R235-D262 IonicContact CZ-OD2 3.76Å; R235-D262 VanDerWaalsContact CZ-OD2 3.27Å; R235-D262 IonicContact NE-OD1 3.25Å; R235-D262 IonicContact NE-OD2 2.88Å; R235-D262 PolarHBondContact NE-OD2 3.21Å; R235-D262 IonicContact NH2-OD1 2.7Å; R235-D262 PolarHBondContact NH2-OD1 2.86Å; R235-D262 IonicContact NH2-OD2 2.72Å; R235-D262 PolarHBondContact NH2-OD2 3.37Å; L236-D262 PolarHBondContact O-N 3.18Å; G237-D262 WeakPolarHBondContact CA-OD2 3.01Å; Y260-D262 WeakPolarHBondContact CE1-OD1 3.07Å; Y260-D262 PolarHBondContact OH-OD1 3.16Å; D262-D264 PolarHBondContact O-N 3.03Å; D262-D264 VanDerWaalsContact O-N 3.17Å; D262-S265 WeakPolarHBondContact O-CB 3.31Å; D262-S265 PolarHBondContact O-N 3.27Å; D262-S265 VanDerWaalsContact O-N 3.13Å; D262-S265 PolarHBondContact O-OG 3.19Å; D262-S265 VanDerWaalsContact O-OG 3.11Å
263	E	80.5	Confident	77.3	Confident	39 Å²	39	34.7 Å²	34.7	18%	0.182	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-34.9	-172.3	-55	-164.3	162.6	0	0	112.1	R307 W309	E263-R307 VanDerWaalsContact CA-O 3.26Å; E263-R307 WeakPolarHBondContact CA-O 3.26Å; E263-R307 HydrophobicContact CB-CB 4.42Å; E263-R307 VanDerWaalsContact CB-O 3.32Å; E263-R307 WeakPolarHBondContact CB-O 3.33Å; E263-R307 HydrophobicContact CG-CB 4.15Å; E263-R307 WeakPolarHBondContact CG-O 3.4Å; E263-W309 VanDerWaalsContact O-CD1 3.23Å; E263-W309 PolarHBondContact O-N 3.32Å
264	D	76.9	Confident	74.1	Confident	30 Å²	30	39.2 Å²	39.2	16%	0.16	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	3.9	-176.7	83.5	-25.8	0	0	0	114.4	R238 D262 F266 I267	R238-D264 WeakPolarHBondContact CD-O 3.36Å; R238-D264 WeakPolarHBondContact CD-OD2 3.3Å; R238-D264 IonicContact CZ-OD2 3.29Å; R238-D264 IonicContact NE-OD2 3.61Å; R238-D264 IonicContact NH1-OD2 3.42Å; R238-D264 PolarHBondContact NH1-OD2 2.67Å; D262-D264 PolarHBondContact O-N 3.03Å; D262-D264 VanDerWaalsContact O-N 3.17Å; D264-F266 PolarHBondContact O-N 3.33Å; D264-I267 HydrophobicContact CB-CD1 3.98Å; D264-I267 HydrophobicContact CB-CG1 4.27Å; D264-I267 VanDerWaalsContact O-CB 3.32Å; D264-I267 WeakPolarHBondContact O-CB 3.4Å; D264-I267 WeakPolarHBondContact O-CG1 2.9Å; D264-I267 PolarHBondContact O-N 2.93Å
265	S	85.6	Confident	70.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-25.8	-168.7	-78.7	0	0	0	0	116.4	L236 G237 R238 L241 G242 D262	L236-S265 PolarHBondContact O-OG 3.5Å; G237-S265 WeakPolarHBondContact CA-OG 3.32Å; R238-S265 PolarHBondContact N-OG 2.75Å; L241-S265 CarbonylContact C-O 3.56Å; L241-S265 WeakPolarHBondContact CB-O 3.15Å; G242-S265 WeakPolarHBondContact CA-O 3.17Å; G242-S265 PolarHBondContact N-O 2.87Å; D262-S265 WeakPolarHBondContact O-CB 3.31Å; D262-S265 PolarHBondContact O-N 3.27Å; D262-S265 VanDerWaalsContact O-N 3.13Å; D262-S265 PolarHBondContact O-OG 3.19Å; D262-S265 VanDerWaalsContact O-OG 3.11Å
266	F	85.3	Confident	67.8	Low	3 Å²	3	50 Å²	50	1%	0.013	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-5.5	176.2	-75.6	-58.3	0	0	0	115	L241 L253 W261 D264 F290 L292 L308 F310 W312	L241-F266 HydrophobicContact CB-CD1 4.24Å; L241-F266 HydrophobicContact CB-CE1 4.13Å; L241-F266 HydrophobicContact CD1-CE1 4.1Å; L241-F266 HydrophobicContact CD1-CZ 4.08Å; L253-F266 HydrophobicContact CD2-CE1 4.14Å; L253-F266 HydrophobicContact CD2-CZ 4.2Å; W261-F266 HydrophobicContact CH2-CE2 4.26Å; W261-F266 HydrophobicContact CH2-CZ 4.31Å; W261-F266 AromaticContact CZ2-CE2 3.49Å; W261-F266 HydrophobicContact CZ2-CE2 3.49Å; W261-F266 VanDerWaalsContact CZ2-CE2 3.49Å; W261-F266 AromaticContact CZ2-CZ 3.63Å; W261-F266 HydrophobicContact CZ2-CZ 3.63Å; D264-F266 PolarHBondContact O-N 3.33Å; F266-F290 HydrophobicContact CD1-CE1 4.41Å; F266-F290 HydrophobicContact CD1-CZ 4.37Å; F266-F290 AromaticContact CE1-CE1 3.95Å; F266-F290 HydrophobicContact CE1-CE1 3.95Å; F266-F290 AromaticContact CE1-CZ 3.75Å; F266-F290 HydrophobicContact CE1-CZ 3.75Å; F266-F290 HydrophobicContact CZ-CE1 4.11Å; F266-F290 HydrophobicContact CZ-CZ 4.21Å; F266-L292 HydrophobicContact CE2-CD2 3.71Å; F266-L292 HydrophobicContact CZ-CD1 4.15Å; F266-L292 HydrophobicContact CZ-CD2 3.87Å; F266-L308 HydrophobicContact CD2-CD1 3.87Å; F266-L308 HydrophobicContact CD2-CD2 4.37Å; F266-L308 HydrophobicContact CD2-CG 4.15Å; F266-L308 HydrophobicContact CE2-CD1 4.15Å; F266-L308 HydrophobicContact CE2-CD2 4.09Å; F266-L308 HydrophobicContact CE2-CG 4.37Å; F266-F310 HydrophobicContact CD2-CZ 4.32Å; F266-F310 HydrophobicContact CE2-CZ 4.3Å; F266-W312 HydrophobicContact CB-CH2 3.73Å; F266-W312 HydrophobicContact CB-CZ3 4.11Å; F266-W312 AromaticContact CD1-CH2 3.69Å; F266-W312 HydrophobicContact CD1-CH2 3.69Å; F266-W312 HydrophobicContact CD1-CZ3 4.38Å; F266-W312 AromaticContact CG-CH2 3.84Å; F266-W312 HydrophobicContact CG-CH2 3.84Å; F266-W312 HydrophobicContact CG-CZ3 4.19Å
267	I	79.3	Confident	64.7	Low	12 Å²	12	52.3 Å²	52.3	6%	0.062	29%	0.29	C	S	.	.	S	Bend	trans	-73.3	125.9	177.6	-58.1	-170.4	0	0	0	109.2	R238 D264 W309 I337 F354 P356	R238-I267 VanDerWaalsContact CD-O 3.28Å; R238-I267 WeakPolarHBondContact CD-O 3.26Å; R238-I267 WeakPolarHBondContact CG-O 3.32Å; R238-I267 PolarHBondContact NE-O 2.86Å; D264-I267 HydrophobicContact CB-CD1 3.98Å; D264-I267 HydrophobicContact CB-CG1 4.27Å; D264-I267 VanDerWaalsContact O-CB 3.32Å; D264-I267 WeakPolarHBondContact O-CB 3.4Å; D264-I267 WeakPolarHBondContact O-CG1 2.9Å; D264-I267 PolarHBondContact O-N 2.93Å; I267-W309 HydrophobicContact CD1-CB 4.23Å; I267-W309 HydrophobicContact CG1-CB 4.39Å; I267-I337 HydrophobicContact CD1-CB 4.43Å; I267-I337 HydrophobicContact CD1-CD1 4.31Å; I267-F354 HydrophobicContact CG2-CB 4.19Å; I267-P356 HydrophobicContact CD1-CG 3.94Å
268	P	74.1	Confident	61.7	Low	5 Å²	5	60.3 Å²	60.3	3%	0.032	33%	0.333	C	S	.	.			trans	-59.4	146.6	-177.9	-27	36.3	0	0	0	114	R238 G242 T246 T270 F354	R238-P268 PolarHBondContact NH2-O 3.04Å; R238-P268 VanDerWaalsContact NH2-O 3.09Å; G242-P268 WeakPolarHBondContact O-CA 3.32Å; T246-P268 HydrophobicContact CG2-CB 4.41Å; T246-P268 HydrophobicContact CG2-CG 3.64Å; P268-T270 PolarHBondContact O-N 3.33Å; P268-F354 HydrophobicContact CG-CD2 3.81Å; P268-F354 HydrophobicContact CG-CE2 4.25Å; P268-F354 HydrophobicContact CG-CG 4.36Å
269	I	68.8	Low	58.5	Low	29 Å²	29	66.9 Å²	66.9	15%	0.149	37%	0.368	C	S	.	.			trans	-85.8	98.7	172.8	-56.4	-176.1	0	0	0	108.7	R238 D239 K247 N271	R238-I269 HydrophobicContact CG-CD1 4.4Å; R238-I269 HydrophobicContact CG-CG1 3.99Å; R238-I269 WeakPolarHBondContact O-CD1 3.5Å; D239-I269 HydrophobicContact CB-CD1 4.46Å; D239-I269 WeakPolarHBondContact OD1-CD1 3.46Å; K247-I269 PolarHBondContact NZ-O 2.79Å; I269-N271 VanDerWaalsContact C-N 3.27Å; I269-N271 WeakPolarHBondContact CG2-OD1 3.49Å; I269-N271 PolarHBondContact O-N 2.97Å
270	T	59.4	Low	55.7	Low	42 Å²	42	66.2 Å²	66.2	26%	0.258	38%	0.379	S	S	.	.			trans	-80.9	73.3	174.8	53.9	0	0	0	0	109.8	P268 K272	P268-T270 PolarHBondContact O-N 3.33Å; T270-K272 PolarHBondContact O-N 2.93Å; T270-K272 VanDerWaalsContact O-N 3.1Å
271	N	50	Low	52.7	Low	129 Å²	129	63.4 Å²	63.4	69%	0.69	39%	0.385	S	S	*	.			trans	-54.8	118.2	173.8	-84.2	6.5	0	0	0	110	I269	I269-N271 VanDerWaalsContact C-N 3.27Å; I269-N271 WeakPolarHBondContact CG2-OD1 3.49Å; I269-N271 PolarHBondContact O-N 2.97Å
272	K	34.1	Very low	49.9	Very low	53 Å²	53	70.1 Å²	70.1	23%	0.23	42%	0.421	C	S	.	.	S	Bend	trans	-57.6	154	153.7	-68.9	170	176.2	166.7	0	107.9	T270 Q342 D345 N346 R349	T270-K272 PolarHBondContact O-N 2.93Å; T270-K272 VanDerWaalsContact O-N 3.1Å; K272-Q342 VanDerWaalsContact CD-OE1 3.29Å; K272-Q342 VanDerWaalsContact NZ-OE1 3.12Å; K272-D345 PolarHBondContact NZ-O 2.72Å; K272-N346 PolarHBondContact NZ-O 2.81Å; K272-R349 HydrophobicContact CD-CB 4.34Å
273	T	26.4	Very low	47.7	Very low	104 Å²	104	74.6 Å²	74.6	64%	0.638	44%	0.444	S	S	*	.			trans	56.2	86.6	174.7	56.2	0	0	0	0	117.5
274	S	27.6	Very low	45.5	Very low	95 Å²	95	76 Å²	76	66%	0.664	46%	0.462	S	S	*	.			trans	-124.5	112.2	130.1	59.6	0	0	0	0	108	S276	S274-S276 PolarHBondContact O-N 3.32Å
275	N	28.9	Very low	43.9	Very low	155 Å²	155	83.1 Å²	83.1	83%	0.829	49%	0.494	S	S	*	.			trans	-77.3	25.9	-177.8	-71.1	-5.4	0	0	0	113
276	S	26.7	Very low	42.1	Very low	81 Å²	81	84.8 Å²	84.8	57%	0.566	51%	0.512	S	S	*	.			trans	-104.3	115.8	-175.6	42.9	0	0	0	0	111.8	S274	S274-S276 PolarHBondContact O-N 3.32Å
277	S	24.7	Very low	40.5	Very low	92 Å²	92	85.3 Å²	85.3	64%	0.643	52%	0.515	S	S	*	.			trans	69.1	142.6	176.8	82	0	0	0	0	116.7	N279	S277-N279 PolarHBondContact O-N 2.71Å
278	N	27	Very low	39.6	Very low	170 Å²	170	90.1 Å²	90.1	91%	0.909	55%	0.547	S	S	*	.	S	Bend	trans	-73.7	13.2	173.7	-68.8	-33.7	0	0	0	113.3	A280	N278-A280 PolarHBondContact O-N 2.97Å
279	N	25.1	Very low	40	Very low	139 Å²	139	94 Å²	94	74%	0.743	56%	0.562	S	S	*	*			trans	-82.2	65.7	174.2	-70.7	-18.9	0	0	0	110.7	S277 G281	S277-N279 PolarHBondContact O-N 2.71Å; N279-G281 PolarHBondContact O-N 2.87Å
280	A	27.9	Very low	40.9	Very low	76 Å²	76	92.7 Å²	92.7	63%	0.628	56%	0.555	S	S	*	*			trans	-69.2	39.1	142.3	0	0	0	0	0	110.8	N278	N278-A280 PolarHBondContact O-N 2.97Å
281	G	25.1	Very low	42.4	Very low	54 Å²	54	93.9 Å²	93.9	56%	0.557	56%	0.555	S	S	*	*			trans	-55.4	148.5	163.9	0	0	0	0	0	108.3	N279	N279-G281 PolarHBondContact O-N 2.87Å
282	N	29.5	Very low	44.5	Very low	143 Å²	143	87.8 Å²	87.8	77%	0.765	52%	0.522	S	S	*	.			trans	-44.8	149.8	-172.7	-54.5	-35.3	0	0	0	111.9	A284	N282-A284 WeakPolarHBondContact O-CA 3.16Å; N282-A284 WeakPolarHBondContact O-CB 3.38Å; N282-A284 PolarHBondContact O-N 2.8Å
283	L	38.4	Very low	47.3	Very low	116 Å²	116	85.4 Å²	85.4	61%	0.607	51%	0.512	S	S	*	.			trans	-59.9	96.3	153.1	-86.9	80.2	0	0	0	105.3	E285 F354	L283-E285 VanDerWaalsContact C-N 3.32Å; L283-E285 PolarHBondContact O-N 2.92Å; L283-F354 HydrophobicContact CD2-CD2 4.41Å; L283-F354 HydrophobicContact CD2-CE2 4.39Å
284	A	35.4	Very low	50.5	Low	68 Å²	68	80.4 Å²	80.4	56%	0.562	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	82.1	-150.8	0	0	0	0	0	110.7	N282	N282-A284 WeakPolarHBondContact O-CA 3.16Å; N282-A284 WeakPolarHBondContact O-CB 3.38Å; N282-A284 PolarHBondContact O-N 2.8Å
285	E	42.9	Very low	53.4	Low	179 Å²	179	78.2 Å²	78.2	84%	0.836	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	72	-176.6	-64.4	-179.4	120.3	0	0	111	L283	L283-E285 VanDerWaalsContact C-N 3.32Å; L283-E285 PolarHBondContact O-N 2.92Å
286	G	46.5	Very low	56.2	Low	36 Å²	36	71 Å²	71	37%	0.371	42%	0.422	S	S	.	.			trans	-46.6	130.1	160.5	0	0	0	0	0	108.1
287	P	51.8	Low	58.8	Low	13 Å²	13	69.4 Å²	69.4	8%	0.084	41%	0.407	C	S	.	.			trans	-55	142.2	-147.8	15.9	-31.3	0	0	0	112	A245 T251 Y289	A245-P287 HydrophobicContact CB-CG 4.03Å; A245-P287 WeakPolarHBondContact O-CD 3.37Å; T251-P287 HydrophobicContact CG2-CB 3.88Å; T251-P287 HydrophobicContact CG2-CG 4.38Å; P287-Y289 PolarHBondContact O-N 3.13Å
288	P	61.8	Low	61.3	Low	113 Å²	113	71.4 Å²	71.4	73%	0.734	40%	0.402	S	S	*	.	S	Bend	trans	-60.8	-18.3	-172.3	25.1	-35.2	0	0	0	112.9	S314	P288-S314 WeakPolarHBondContact O-CB 3.49Å
289	Y	81.1	Confident	63.5	Low	86 Å²	86	65.1 Å²	65.1	34%	0.337	37%	0.367	S	S	.	.			trans	-143.7	136.1	177.7	176.6	-104	0	0	0	110.2	P287 R291 S314 Q316	P287-Y289 PolarHBondContact O-N 3.13Å; Y289-R291 HydrophobicContact CE1-CB 3.95Å; Y289-S314 WeakPolarHBondContact CA-O 3.38Å; Y289-Q316 HydrophobicContact CE2-CB 3.98Å; Y289-Q316 WeakPolarHBondContact OH-CB 3.46Å
290	F	88.1	Confident	66	Low	2 Å²	2	58.7 Å²	58.7	1%	0.009	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.4	171	179.9	-101.6	0	0	0	111.5	A245 V250 T251 L253 F266 L292 F310 W312 S314 W315 Q316	A245-F290 HydrophobicContact CB-CD2 3.9Å; A245-F290 HydrophobicContact CB-CE2 4.15Å; V250-F290 HydrophobicContact CG1-CE2 4.29Å; V250-F290 WeakPolarHBondContact O-CD2 3.27Å; T251-F290 CarbonylContact O-C 3.49Å; L253-F290 HydrophobicContact CB-CE2 4.46Å; L253-F290 HydrophobicContact CB-CZ 4.02Å; F266-F290 HydrophobicContact CD1-CE1 4.41Å; F266-F290 HydrophobicContact CD1-CZ 4.37Å; F266-F290 AromaticContact CE1-CE1 3.95Å; F266-F290 HydrophobicContact CE1-CE1 3.95Å; F266-F290 AromaticContact CE1-CZ 3.75Å; F266-F290 HydrophobicContact CE1-CZ 3.75Å; F266-F290 HydrophobicContact CZ-CE1 4.11Å; F266-F290 HydrophobicContact CZ-CZ 4.21Å; F290-L292 HydrophobicContact CE1-CB 4.16Å; F290-F310 HydrophobicContact CD1-CE1 4.24Å; F290-F310 HydrophobicContact CE1-CE1 4.36Å; F290-W312 HydrophobicContact CB-CD2 3.59Å; F290-W312 HydrophobicContact CB-CE3 3.69Å; F290-W312 HydrophobicContact CB-CG 3.94Å; F290-W312 HydrophobicContact CB-CZ3 4.2Å; F290-W312 HydrophobicContact CD1-CD2 4.34Å; F290-W312 AromaticContact CD1-CE3 3.69Å; F290-W312 HydrophobicContact CD1-CE3 3.69Å; F290-W312 AromaticContact CD1-CH2 3.79Å; F290-W312 HydrophobicContact CD1-CH2 3.79Å; F290-W312 HydrophobicContact CD1-CZ2 4.45Å; F290-W312 AromaticContact CD1-CZ3 3.35Å; F290-W312 HydrophobicContact CD1-CZ3 3.35Å; F290-W312 HydrophobicContact CD2-CH2 4.36Å; F290-W312 HydrophobicContact CD2-CZ2 4.33Å; F290-W312 AromaticContact CE1-CH2 3.94Å; F290-W312 HydrophobicContact CE1-CH2 3.94Å; F290-W312 AromaticContact CE1-CZ3 3.8Å; F290-W312 HydrophobicContact CE1-CZ3 3.8Å; F290-W312 HydrophobicContact CG-CD2 4.01Å; F290-W312 AromaticContact CG-CE3 3.83Å; F290-W312 HydrophobicContact CG-CE3 3.83Å; F290-W312 HydrophobicContact CG-CH2 4Å; F290-W312 HydrophobicContact CG-CZ2 4.21Å; F290-W312 AromaticContact CG-CZ3 3.8Å; F290-W312 HydrophobicContact CG-CZ3 3.8Å; F290-W312 HydrophobicContact CZ-CH2 4.3Å; F290-S314 PolarHBondContact N-O 3.47Å; F290-W315 HydrophobicContact CB-CB 4.41Å; F290-W315 CarbonylContact O-C 3.53Å; F290-W315 WeakPolarHBondContact O-CA 3.14Å; F290-W315 WeakPolarHBondContact O-CB 3.44Å; F290-Q316 PolarHBondContact O-N 2.05Å
291	R	91.6	Very high	68	Low	68 Å²	68	59.7 Å²	59.7	26%	0.257	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.3	179.1	-172.3	179.1	-168.2	-177.1	20.7	111.1	T251 H252 L253 Y289 Q316	T251-R291 PolarHBondContact O-N 3.17Å; H252-R291 CarbonylContact C-O 3.5Å; H252-R291 VanDerWaalsContact CA-O 3.31Å; H252-R291 WeakPolarHBondContact CA-O 3.36Å; H252-R291 HydrophobicContact CB-CB 4.1Å; H252-R291 PolarHBondContact CD2-O 3.47Å; L253-R291 PolarHBondContact N-O 3.17Å; Y289-R291 HydrophobicContact CE1-CB 3.95Å; R291-Q316 WeakPolarHBondContact CA-O 3.49Å; R291-Q316 HydrophobicContact CG-CB 4.38Å
292	L	93.5	Very high	70.5	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127	169.5	-174.7	57.4	0	0	0	109.7	L253 W261 F266 F290 L294 L308 F310 Q316 L317 R318	L253-L292 HydrophobicContact CB-CD1 4.03Å; L253-L292 HydrophobicContact CD2-CD1 4.06Å; L253-L292 HydrophobicContact CG-CD1 4.06Å; L253-L292 CarbonylContact O-C 3.52Å; L253-L292 WeakPolarHBondContact O-CA 3.49Å; W261-L292 HydrophobicContact CH2-CD1 4.28Å; W261-L292 HydrophobicContact CH2-CD2 3.86Å; W261-L292 HydrophobicContact CZ2-CD2 4.37Å; F266-L292 HydrophobicContact CE2-CD2 3.71Å; F266-L292 HydrophobicContact CZ-CD1 4.15Å; F266-L292 HydrophobicContact CZ-CD2 3.87Å; F290-L292 HydrophobicContact CE1-CB 4.16Å; L292-L294 HydrophobicContact CD1-CD2 3.87Å; L292-L294 HydrophobicContact CD2-CD1 4.41Å; L292-L294 HydrophobicContact CD2-CD2 4.15Å; L292-L294 HydrophobicContact CD2-CG 4.3Å; L292-L294 HydrophobicContact CG-CD2 3.88Å; L292-L294 HydrophobicContact CG-CG 4.08Å; L292-L308 HydrophobicContact CD2-CD2 4.26Å; L292-F310 HydrophobicContact CD2-CZ 4.05Å; L292-Q316 PolarHBondContact N-O 2.83Å; L292-L317 HydrophobicContact CB-CD1 3.97Å; L292-L317 HydrophobicContact CD2-CD1 3.98Å; L292-L317 HydrophobicContact CG-CD1 3.9Å; L292-L317 WeakPolarHBondContact O-CA 3.18Å; L292-R318 PolarHBondContact O-N 3.17Å
293	S	94.1	Very high	72.8	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	116.8	169	-75.4	0	0	0	0	109.4	H252 L253 S254 L255 R318	H252-S293 PolarHBondContact NE2-OG 3.11Å; L253-S293 PolarHBondContact O-N 3.31Å; S254-S293 WeakPolarHBondContact CA-O 3.47Å; L255-S293 PolarHBondContact N-O 3.46Å; S293-R318 CarbonylContact C-O 3.02Å; S293-R318 WeakPolarHBondContact CA-O 3.48Å
294	L	92	Very high	75	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	137.4	172.9	-57.1	-174.8	0	0	0	110.6	L255 W261 L292 F305 L317 R318 L319 T320	L255-L294 HydrophobicContact CD1-CD2 3.47Å; L255-L294 VanDerWaalsContact CD1-CD2 3.47Å; L255-L294 HydrophobicContact CG-CD2 4.21Å; L255-L294 WeakPolarHBondContact O-CA 3.42Å; W261-L294 HydrophobicContact CH2-CD1 4.47Å; W261-L294 HydrophobicContact CH2-CD2 3.75Å; W261-L294 HydrophobicContact CZ3-CD1 3.81Å; W261-L294 HydrophobicContact CZ3-CD2 3.57Å; W261-L294 HydrophobicContact CZ3-CG 4.36Å; L292-L294 HydrophobicContact CD1-CD2 3.87Å; L292-L294 HydrophobicContact CD2-CD1 4.41Å; L292-L294 HydrophobicContact CD2-CD2 4.15Å; L292-L294 HydrophobicContact CD2-CG 4.3Å; L292-L294 HydrophobicContact CG-CD2 3.88Å; L292-L294 HydrophobicContact CG-CG 4.08Å; L294-F305 HydrophobicContact CD1-CE1 4.27Å; L294-L317 HydrophobicContact CD1-CD1 4.11Å; L294-L317 HydrophobicContact CG-CD1 4.05Å; L294-R318 PolarHBondContact N-O 3.23Å; L294-L319 HydrophobicContact CB-CD2 4.25Å; L294-L319 HydrophobicContact CD1-CD2 3.98Å; L294-T320 PolarHBondContact O-N 2.95Å; L294-T320 PolarHBondContact O-OG1 3.06Å
295	F	89.8	Confident	77.3	Confident	49 Å²	49	50.5 Å²	50.5	22%	0.215	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127.2	172	-58.8	-87	0	0	0	108.6	L255 W256 N257 T320	L255-F295 PolarHBondContact O-N 2.81Å; W256-F295 WeakPolarHBondContact CA-O 3.38Å; W256-F295 HydrophobicContact CD2-CB 4.09Å; W256-F295 HydrophobicContact CE3-CB 3.57Å; W256-F295 HydrophobicContact CH2-CB 4.31Å; W256-F295 HydrophobicContact CZ3-CB 3.68Å; N257-F295 PolarHBondContact N-O 2.87Å; F295-T320 HydrophobicContact CD1-CG2 4.34Å; F295-T320 HydrophobicContact CE1-CG2 4.46Å
296	C	87.7	Confident	78.9	Confident	3 Å²	3	46 Å²	46	2%	0.02	23%	0.232	C	C	.	.			trans	-109.3	159.3	172.4	-61	0	0	0	0	110.3	N300 T320 C322	C296-N300 WeakPolarHBondContact CA-OD1 3.47Å; C296-T320 PolarHBondContact N-O 2.87Å; C296-C322 HydrophobicContact CB-CB 3.83Å; C296-C322 WeakPolarHBondContact CB-SG 3.44Å; C296-C322 VanDerWaalsContact SG-CA 3.52Å; C296-C322 WeakPolarHBondContact SG-CB 3.33Å; C296-C322 CovalentContact SG-SG 2.05Å; C296-C322 PolarHBondContact SG-SG 2.85Å
297	D	82	Confident	80.5	Confident	48 Å²	48	44.7 Å²	44.7	26%	0.257	22%	0.216	S	C	.	.			trans	-153.3	-176.1	179.1	-165.5	8.2	0	0	0	109.2	R195 W256 E299 N300 Q301	R195-D297 IonicContact CZ-OD2 2.82Å; R195-D297 IonicContact NH1-OD2 3.69Å; R195-D297 PolarHBondContact NH1-OD2 3.36Å; R195-D297 IonicContact NH2-OD2 2.6Å; R195-D297 PolarHBondContact NH2-OD2 3.14Å; W256-D297 HydrophobicContact CZ3-CB 3.92Å; D297-E299 PolarHBondContact O-N 2.82Å; D297-E299 VanDerWaalsContact O-N 3.15Å; D297-N300 PolarHBondContact N-OD1 3.41Å; D297-N300 PolarHBondContact O-N 3.1Å; D297-N300 PolarHBondContact O-OD1 3.11Å; D297-N300 VanDerWaalsContact O-OD1 3.14Å; D297-Q301 WeakPolarHBondContact O-CG 3.05Å; D297-Q301 PolarHBondContact O-N 3.3Å
298	Y	77	Confident	82.2	Confident	134 Å²	134	44.1 Å²	44.1	53%	0.525	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-26.1	-179.6	71	-93.1	0	0	0	114.4	R195	R195-Y298 VanDerWaalsContact NH1-CE1 3.29Å; R195-Y298 PolarHBondContact NH1-OH 3.29Å
299	E	73.2	Confident	83.2	Confident	37 Å²	37	38.9 Å²	38.9	17%	0.173	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-28.8	179.8	-59	-160.8	175.1	0	0	113.7	R197 F259 D297	R197-E299 IonicContact CZ-OE1 3.6Å; R197-E299 IonicContact CZ-OE2 3.93Å; R197-E299 VanDerWaalsContact CZ-OE2 3.25Å; R197-E299 IonicContact NE-OE2 3.69Å; R197-E299 PolarHBondContact NE-OE2 3.28Å; R197-E299 IonicContact NH2-OE1 3.63Å; R197-E299 PolarHBondContact NH2-OE1 3.13Å; R197-E299 IonicContact NH2-OE2 2.74Å; R197-E299 PolarHBondContact NH2-OE2 3.28Å; F259-E299 HydrophobicContact CE1-CB 4.38Å; F259-E299 WeakPolarHBondContact CE1-O 3.1Å; F259-E299 HydrophobicContact CZ-CB 4.29Å; D297-E299 PolarHBondContact O-N 2.82Å; D297-E299 VanDerWaalsContact O-N 3.15Å
300	N	76.9	Confident	83.5	Confident	5 Å²	5	34.8 Å²	34.8	3%	0.027	16%	0.161	C	C	.	.	S	Bend	trans	-131	40	-169.4	58.7	3.5	0	0	0	111.5	N257 C296 D297 N302	N257-N300 HydrophobicContact CB-CB 4.38Å; N257-N300 PolarHBondContact ND2-O 3Å; N257-N300 PolarHBondContact O-ND2 2.63Å; C296-N300 WeakPolarHBondContact CA-OD1 3.47Å; D297-N300 PolarHBondContact N-OD1 3.41Å; D297-N300 PolarHBondContact O-N 3.1Å; D297-N300 PolarHBondContact O-OD1 3.11Å; D297-N300 VanDerWaalsContact O-OD1 3.14Å; N300-N302 PolarHBondContact O-N 3.09Å
301	Q	70.3	Confident	83	Confident	96 Å²	96	34.9 Å²	34.9	45%	0.449	16%	0.162	S	C	.	.			trans	-60.7	-28.5	174.7	-66.9	-172.4	7.3	0	0	113.7	D297 P323	D297-Q301 WeakPolarHBondContact O-CG 3.05Å; D297-Q301 PolarHBondContact O-N 3.3Å; Q301-P323 HydrophobicContact CB-CG 4.1Å; Q301-P323 WeakPolarHBondContact O-CD 3.02Å; Q301-P323 WeakPolarHBondContact O-CG 3.48Å
302	N	76.8	Confident	82.4	Confident	131 Å²	131	32.3 Å²	32.3	70%	0.701	15%	0.152	S	C	*	.	S	Bend	trans	-75.1	148.2	-178.3	-71.2	-27.6	0	0	0	111.5	N257 N300 S304	N257-N302 PolarHBondContact ND2-O 3.06Å; N300-N302 PolarHBondContact O-N 3.09Å; N302-S304 PolarHBondContact O-N 2.93Å
303	P	77.1	Confident	81.5	Confident	46 Å²	46	40.8 Å²	40.8	30%	0.299	19%	0.189	S	C	.	.			trans	-67.7	121.5	175	28.3	-32.6	0	0	0	109.5	F305 D324 P362	P303-F305 VanDerWaalsContact C-N 3.31Å; P303-F305 PolarHBondContact O-N 3Å; P303-D324 WeakPolarHBondContact CD-OD2 3.34Å; P303-D324 WeakPolarHBondContact CG-OD2 3.2Å; P303-P362 HydrophobicContact CB-CB 4.47Å; P303-P362 HydrophobicContact CB-CG 3.63Å; P303-P362 HydrophobicContact CG-CG 4.2Å
304	S	84.5	Confident	81	Confident	7 Å²	7	42.2 Å²	42.2	5%	0.049	20%	0.199	C	C	.	.	S	Bend	trans	-75.5	-21	-173.3	56	0	0	0	0	113.9	N257 P258 W261 N302	N257-S304 WeakPolarHBondContact OD1-CB 3.31Å; N257-S304 PolarHBondContact OD1-OG 3.29Å; P258-S304 WeakPolarHBondContact O-CB 3.45Å; W261-S304 PolarHBondContact N-O 3.06Å; N302-S304 PolarHBondContact O-N 2.93Å
305	F	84.2	Confident	80.8	Confident	5 Å²	5	42.2 Å²	42.2	2%	0.022	20%	0.199	C	C	.	.			trans	-126.9	144	174.6	52.8	-91.9	0	0	0	111.2	W261 L294 P303 L308 Y326 I360	W261-F305 HydrophobicContact CB-CB 4.16Å; W261-F305 HydrophobicContact CB-CD1 4.46Å; W261-F305 HydrophobicContact CD2-CD1 4.3Å; W261-F305 AromaticContact CE3-CD1 3.98Å; W261-F305 HydrophobicContact CE3-CD1 3.98Å; W261-F305 HydrophobicContact CE3-CE1 4.32Å; W261-F305 HydrophobicContact CG-CD1 4.5Å; L294-F305 HydrophobicContact CD1-CE1 4.27Å; P303-F305 VanDerWaalsContact C-N 3.31Å; P303-F305 PolarHBondContact O-N 3Å; F305-L308 HydrophobicContact CB-CB 4.48Å; F305-L308 HydrophobicContact CD1-CB 4.27Å; F305-L308 HydrophobicContact CD1-CD2 3.98Å; F305-L308 HydrophobicContact CD2-CB 3.58Å; F305-L308 HydrophobicContact CE1-CB 4.42Å; F305-L308 HydrophobicContact CE1-CD2 3.71Å; F305-L308 HydrophobicContact CE2-CB 3.72Å; F305-L308 HydrophobicContact CE2-CD2 4.32Å; F305-L308 HydrophobicContact CG-CB 3.86Å; F305-L308 HydrophobicContact CG-CD2 4.42Å; F305-L308 HydrophobicContact CZ-CB 4.15Å; F305-L308 HydrophobicContact CZ-CD2 3.88Å; F305-Y326 HydrophobicContact CE1-CE1 4.2Å; F305-Y326 AromaticContact CE2-CD1 3.8Å; F305-Y326 HydrophobicContact CE2-CD1 3.8Å; F305-Y326 AromaticContact CE2-CE1 3.64Å; F305-Y326 HydrophobicContact CE2-CE1 3.64Å; F305-Y326 AromaticContact CZ-CD1 3.75Å; F305-Y326 HydrophobicContact CZ-CD1 3.75Å; F305-Y326 AromaticContact CZ-CE1 3.44Å; F305-Y326 HydrophobicContact CZ-CE1 3.44Å; F305-Y326 VanDerWaalsContact CZ-CE1 3.44Å; F305-I360 HydrophobicContact CE2-CG2 4.23Å
306	R	77.4	Confident	80.9	Confident	83 Å²	83	40.2 Å²	40.2	31%	0.313	19%	0.191	S	C	.	.	S	Bend	trans	-74.8	-40.3	165.5	-175.1	-172.6	-174.4	-161.1	-3.4	110.9	P362 L365 D398	R306-P362 WeakPolarHBondContact O-CD 3.47Å; R306-L365 HydrophobicContact CG-CD1 4.15Å; R306-L365 HydrophobicContact CG-CD2 4.01Å; R306-D398 IonicContact CZ-OD1 2.76Å; R306-D398 VanDerWaalsContact CZ-OD1 3.23Å; R306-D398 IonicContact CZ-OD2 3.56Å; R306-D398 IonicContact NH1-OD1 2.77Å; R306-D398 PolarHBondContact NH1-OD1 2.91Å; R306-D398 IonicContact NH1-OD2 2.73Å; R306-D398 VanDerWaalsContact NH2-CG 3.29Å; R306-D398 IonicContact NH2-OD1 2.63Å; R306-D398 PolarHBondContact NH2-OD1 3.27Å; R306-D398 IonicContact NH2-OD2 2.65Å; R306-D398 PolarHBondContact NH2-OD2 2.84Å
307	R	80.6	Confident	81.1	Confident	10 Å²	10	40.1 Å²	40.1	4%	0.038	19%	0.19	C	C	.	.			trans	-142.6	146.3	176.7	-64.5	-173.1	169.1	115	3.1	109.2	E263 L359 I360 L395 D398	E263-R307 VanDerWaalsContact CA-O 3.26Å; E263-R307 WeakPolarHBondContact CA-O 3.26Å; E263-R307 HydrophobicContact CB-CB 4.42Å; E263-R307 VanDerWaalsContact CB-O 3.32Å; E263-R307 WeakPolarHBondContact CB-O 3.33Å; E263-R307 HydrophobicContact CG-CB 4.15Å; E263-R307 WeakPolarHBondContact CG-O 3.4Å; R307-L359 HydrophobicContact CB-CD1 3.5Å; R307-L359 VanDerWaalsContact CB-CD1 3.5Å; R307-L359 HydrophobicContact CG-CD1 3.73Å; R307-I360 CarbonylContact C-O 3.58Å; R307-I360 WeakPolarHBondContact CA-O 3.48Å; R307-L395 PolarHBondContact NH2-O 3.06Å; R307-D398 IonicContact CZ-OD2 3.67Å; R307-D398 VanDerWaalsContact CZ-OD2 3.3Å; R307-D398 IonicContact NH1-OD2 2.96Å; R307-D398 PolarHBondContact NH1-OD2 3.04Å; R307-D398 IonicContact NH2-OD2 2.6Å; R307-D398 PolarHBondContact NH2-OD2 3.46Å
308	L	85.8	Confident	81.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	121	173.4	-171.3	62.1	0	0	0	109.2	W261 F266 L292 F305 F310 I360	W261-L308 HydrophobicContact CD2-CD1 4.41Å; W261-L308 HydrophobicContact CG-CD1 4.46Å; F266-L308 HydrophobicContact CD2-CD1 3.87Å; F266-L308 HydrophobicContact CD2-CD2 4.37Å; F266-L308 HydrophobicContact CD2-CG 4.15Å; F266-L308 HydrophobicContact CE2-CD1 4.15Å; F266-L308 HydrophobicContact CE2-CD2 4.09Å; F266-L308 HydrophobicContact CE2-CG 4.37Å; L292-L308 HydrophobicContact CD2-CD2 4.26Å; F305-L308 HydrophobicContact CB-CB 4.48Å; F305-L308 HydrophobicContact CD1-CB 4.27Å; F305-L308 HydrophobicContact CD1-CD2 3.98Å; F305-L308 HydrophobicContact CD2-CB 3.58Å; F305-L308 HydrophobicContact CE1-CB 4.42Å; F305-L308 HydrophobicContact CE1-CD2 3.71Å; F305-L308 HydrophobicContact CE2-CB 3.72Å; F305-L308 HydrophobicContact CE2-CD2 4.32Å; F305-L308 HydrophobicContact CG-CB 3.86Å; F305-L308 HydrophobicContact CG-CD2 4.42Å; F305-L308 HydrophobicContact CZ-CB 4.15Å; F305-L308 HydrophobicContact CZ-CD2 3.88Å; L308-F310 HydrophobicContact CB-CE2 4.1Å; L308-F310 HydrophobicContact CD2-CE2 3.62Å; L308-F310 HydrophobicContact CD2-CZ 3.84Å; L308-F310 HydrophobicContact CG-CD2 4.36Å; L308-F310 HydrophobicContact CG-CE2 3.57Å; L308-F310 HydrophobicContact CG-CZ 4.19Å; L308-I360 PolarHBondContact N-O 3.16Å; L308-I360 PolarHBondContact O-N 3.07Å
309	W	84.6	Confident	82.3	Confident	3 Å²	3	33 Å²	33	1%	0.011	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.7	-171.7	-65.2	105	0	0	0	111.9	E263 I267 W331 I337 P356 L359 L399	E263-W309 VanDerWaalsContact O-CD1 3.23Å; E263-W309 PolarHBondContact O-N 3.32Å; I267-W309 HydrophobicContact CD1-CB 4.23Å; I267-W309 HydrophobicContact CG1-CB 4.39Å; W309-W331 HydrophobicContact CH2-CD2 4.08Å; W309-W331 AromaticContact CH2-CE3 3.75Å; W309-W331 HydrophobicContact CH2-CE3 3.75Å; W309-W331 AromaticContact CH2-CH2 3.88Å; W309-W331 HydrophobicContact CH2-CH2 3.88Å; W309-W331 HydrophobicContact CH2-CZ2 4.17Å; W309-W331 AromaticContact CH2-CZ3 3.67Å; W309-W331 HydrophobicContact CH2-CZ3 3.67Å; W309-W331 HydrophobicContact CZ3-CB 4.48Å; W309-W331 AromaticContact CZ3-CD2 3.6Å; W309-W331 HydrophobicContact CZ3-CD2 3.6Å; W309-W331 AromaticContact CZ3-CE2 3.99Å; W309-W331 AromaticContact CZ3-CE3 3.62Å; W309-W331 HydrophobicContact CZ3-CE3 3.62Å; W309-W331 HydrophobicContact CZ3-CG 4.03Å; W309-W331 HydrophobicContact CZ3-CH2 4.39Å; W309-W331 HydrophobicContact CZ3-CZ2 4.36Å; W309-W331 HydrophobicContact CZ3-CZ3 4.04Å; W309-I337 HydrophobicContact CD2-CD1 3.44Å; W309-I337 VanDerWaalsContact CD2-CD1 3.44Å; W309-I337 HydrophobicContact CE3-CD1 3.98Å; W309-I337 HydrophobicContact CG-CD1 3.71Å; W309-I337 HydrophobicContact CH2-CD1 4.25Å; W309-I337 HydrophobicContact CZ2-CD1 3.78Å; W309-I337 HydrophobicContact CZ3-CD1 4.34Å; W309-P356 HydrophobicContact CB-CB 4.25Å; W309-P356 HydrophobicContact CB-CG 4.25Å; W309-P356 HydrophobicContact CD2-CB 4.49Å; W309-P356 HydrophobicContact CD2-CG 4.44Å; W309-P356 HydrophobicContact CE3-CB 3.8Å; W309-P356 HydrophobicContact CE3-CG 4.11Å; W309-L359 HydrophobicContact CD2-CD1 4.16Å; W309-L359 HydrophobicContact CE3-CB 3.97Å; W309-L359 HydrophobicContact CE3-CD1 4.17Å; W309-L359 HydrophobicContact CH2-CB 4.3Å; W309-L359 HydrophobicContact CH2-CD1 4.11Å; W309-L359 HydrophobicContact CH2-CD2 3.92Å; W309-L359 HydrophobicContact CH2-CG 4.33Å; W309-L359 HydrophobicContact CZ2-CD1 4.05Å; W309-L359 HydrophobicContact CZ2-CD2 4.44Å; W309-L359 HydrophobicContact CZ3-CB 3.73Å; W309-L359 HydrophobicContact CZ3-CD1 4.16Å; W309-L359 HydrophobicContact CZ3-CD2 4.2Å; W309-L359 HydrophobicContact CZ3-CG 4.24Å; W309-L399 HydrophobicContact CH2-CD1 4.33Å; W309-L399 HydrophobicContact CZ2-CD1 4.1Å
310	F	85.8	Confident	83	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	116.8	-177.5	-78.4	-103.3	0	0	0	111.4	F266 F290 L292 L308 W312 W315 S357 Y358 I360	F266-F310 HydrophobicContact CD2-CZ 4.32Å; F266-F310 HydrophobicContact CE2-CZ 4.3Å; F290-F310 HydrophobicContact CD1-CE1 4.24Å; F290-F310 HydrophobicContact CE1-CE1 4.36Å; L292-F310 HydrophobicContact CD2-CZ 4.05Å; L308-F310 HydrophobicContact CB-CE2 4.1Å; L308-F310 HydrophobicContact CD2-CE2 3.62Å; L308-F310 HydrophobicContact CD2-CZ 3.84Å; L308-F310 HydrophobicContact CG-CD2 4.36Å; L308-F310 HydrophobicContact CG-CE2 3.57Å; L308-F310 HydrophobicContact CG-CZ 4.19Å; F310-W312 HydrophobicContact CB-CE3 4.46Å; F310-W312 AromaticContact CD1-CE3 3.83Å; F310-W312 HydrophobicContact CD1-CE3 3.83Å; F310-W312 AromaticContact CD1-CZ3 3.65Å; F310-W312 HydrophobicContact CD1-CZ3 3.65Å; F310-W312 HydrophobicContact CE1-CZ3 4.17Å; F310-W312 HydrophobicContact CG-CZ3 4.43Å; F310-W315 HydrophobicContact CD1-CB 4.48Å; F310-W315 HydrophobicContact CD1-CD2 4.15Å; F310-W315 HydrophobicContact CD1-CE3 4.46Å; F310-W315 HydrophobicContact CD1-CG 4.13Å; F310-W315 HydrophobicContact CG-CD2 4.47Å; F310-S357 PolarHBondContact O-N 2.76Å; F310-Y358 PolarHBondContact N-O 3.3Å; F310-Y358 PolarHBondContact O-N 2.82Å; F310-Y358 VanDerWaalsContact O-N 3.11Å; F310-I360 HydrophobicContact CD2-CD1 3.75Å; F310-I360 HydrophobicContact CD2-CG1 3.9Å; F310-I360 HydrophobicContact CE2-CB 4.41Å; F310-I360 HydrophobicContact CE2-CD1 3.32Å; F310-I360 HydrophobicContact CE2-CG1 3.82Å; F310-I360 HydrophobicContact CZ-CD1 3.85Å
311	P	79.1	Confident	83.4	Confident	5 Å²	5	36.3 Å²	36.3	3%	0.032	17%	0.174	C	C	.	.			trans	-78.5	-21.3	179.5	27.3	-34.9	0	0	0	115.6	F354 S357	P311-F354 HydrophobicContact CB-CD1 3.58Å; P311-F354 HydrophobicContact CB-CE1 3.18Å; P311-F354 HydrophobicContact CB-CE2 4.46Å; P311-F354 HydrophobicContact CB-CG 4.42Å; P311-F354 HydrophobicContact CB-CZ 3.69Å; P311-F354 WeakPolarHBondContact O-CE1 3.48Å; P311-S357 PolarHBondContact O-OG 3.36Å
312	W	78.6	Confident	84	Confident	13 Å²	13	32.5 Å²	32.5	5%	0.049	16%	0.158	C	C	.	.	S	Bend	trans	-80.2	151.4	-172.3	-51.3	-85.3	0	0	0	113.4	A245 F266 F290 F310 Y358	A245-W312 HydrophobicContact CB-CH2 4.41Å; A245-W312 HydrophobicContact CB-CZ2 3.38Å; F266-W312 HydrophobicContact CB-CH2 3.73Å; F266-W312 HydrophobicContact CB-CZ3 4.11Å; F266-W312 AromaticContact CD1-CH2 3.69Å; F266-W312 HydrophobicContact CD1-CH2 3.69Å; F266-W312 HydrophobicContact CD1-CZ3 4.38Å; F266-W312 AromaticContact CG-CH2 3.84Å; F266-W312 HydrophobicContact CG-CH2 3.84Å; F266-W312 HydrophobicContact CG-CZ3 4.19Å; F290-W312 HydrophobicContact CB-CD2 3.59Å; F290-W312 HydrophobicContact CB-CE3 3.69Å; F290-W312 HydrophobicContact CB-CG 3.94Å; F290-W312 HydrophobicContact CB-CZ3 4.2Å; F290-W312 HydrophobicContact CD1-CD2 4.34Å; F290-W312 AromaticContact CD1-CE3 3.69Å; F290-W312 HydrophobicContact CD1-CE3 3.69Å; F290-W312 AromaticContact CD1-CH2 3.79Å; F290-W312 HydrophobicContact CD1-CH2 3.79Å; F290-W312 HydrophobicContact CD1-CZ2 4.45Å; F290-W312 AromaticContact CD1-CZ3 3.35Å; F290-W312 HydrophobicContact CD1-CZ3 3.35Å; F290-W312 HydrophobicContact CD2-CH2 4.36Å; F290-W312 HydrophobicContact CD2-CZ2 4.33Å; F290-W312 AromaticContact CE1-CH2 3.94Å; F290-W312 HydrophobicContact CE1-CH2 3.94Å; F290-W312 AromaticContact CE1-CZ3 3.8Å; F290-W312 HydrophobicContact CE1-CZ3 3.8Å; F290-W312 HydrophobicContact CG-CD2 4.01Å; F290-W312 AromaticContact CG-CE3 3.83Å; F290-W312 HydrophobicContact CG-CE3 3.83Å; F290-W312 HydrophobicContact CG-CH2 4Å; F290-W312 HydrophobicContact CG-CZ2 4.21Å; F290-W312 AromaticContact CG-CZ3 3.8Å; F290-W312 HydrophobicContact CG-CZ3 3.8Å; F290-W312 HydrophobicContact CZ-CH2 4.3Å; F310-W312 HydrophobicContact CB-CE3 4.46Å; F310-W312 AromaticContact CD1-CE3 3.83Å; F310-W312 HydrophobicContact CD1-CE3 3.83Å; F310-W312 AromaticContact CD1-CZ3 3.65Å; F310-W312 HydrophobicContact CD1-CZ3 3.65Å; F310-W312 HydrophobicContact CE1-CZ3 4.17Å; F310-W312 HydrophobicContact CG-CZ3 4.43Å; W312-Y358 WeakPolarHBondContact O-CD2 3.19Å; W312-Y358 VanDerWaalsContact O-CE2 3.26Å; W312-Y358 WeakPolarHBondContact O-CE2 3.26Å
313	K	74.7	Confident	84	Confident	179 Å²	179	27.5 Å²	27.5	78%	0.778	13%	0.133	S	C	*	.	S	Bend	trans	-69.4	-29.6	176.4	-73.3	-174.8	177.2	179.4	0	114	Y358	K313-Y358 PolarHBondContact O-OH 3.43Å; K313-Y358 VanDerWaalsContact O-OH 3.08Å
314	S	82.2	Confident	84	Confident	32 Å²	32	27.1 Å²	27.1	22%	0.224	13%	0.128	C	C	.	.	S	Bend	trans	-139	145.2	174.3	-169.2	0	0	0	0	109.9	P288 Y289 F290 D383	P288-S314 WeakPolarHBondContact O-CB 3.49Å; Y289-S314 WeakPolarHBondContact CA-O 3.38Å; F290-S314 PolarHBondContact N-O 3.47Å; S314-D383 VanDerWaalsContact CA-OD2 3.22Å; S314-D383 WeakPolarHBondContact CA-OD2 3.41Å; S314-D383 WeakPolarHBondContact CB-OD2 3.47Å; S314-D383 VanDerWaalsContact OG-CG 3.3Å; S314-D383 PolarHBondContact OG-OD2 2.75Å
315	W	89.5	Confident	83.7	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.5	167.2	-176.3	55	-91	0	0	0	111.4	F290 F310 L317 C328 Y358 I360 L381 D383 C386	F290-W315 HydrophobicContact CB-CB 4.41Å; F290-W315 CarbonylContact O-C 3.53Å; F290-W315 WeakPolarHBondContact O-CA 3.14Å; F290-W315 WeakPolarHBondContact O-CB 3.44Å; F310-W315 HydrophobicContact CD1-CB 4.48Å; F310-W315 HydrophobicContact CD1-CD2 4.15Å; F310-W315 HydrophobicContact CD1-CE3 4.46Å; F310-W315 HydrophobicContact CD1-CG 4.13Å; F310-W315 HydrophobicContact CG-CD2 4.47Å; W315-L317 HydrophobicContact CE3-CB 4.39Å; W315-L317 HydrophobicContact CZ3-CB 3.99Å; W315-C328 HydrophobicContact CH2-CB 3.99Å; W315-C328 VanDerWaalsContact CH2-SG 3.51Å; W315-C328 HydrophobicContact CZ2-CB 4.44Å; W315-C328 WeakPolarHBondContact CZ2-SG 3.37Å; W315-Y358 AromaticContact CD1-CD2 3.8Å; W315-Y358 AromaticContact CE2-CG 3.88Å; W315-Y358 AromaticContact CZ2-CD1 4Å; W315-Y358 HydrophobicContact CZ2-CD1 4Å; W315-Y358 AromaticContact CZ2-CG 3.9Å; W315-Y358 HydrophobicContact CZ2-CG 3.9Å; W315-Y358 AromaticContact NE1-CD1 3.8Å; W315-Y358 AromaticContact NE1-CD2 3.03Å; W315-Y358 AromaticContact NE1-CE2 3.49Å; W315-Y358 AromaticContact NE1-CG 3.24Å; W315-I360 HydrophobicContact CE3-CD1 4.31Å; W315-I360 HydrophobicContact CH2-CD1 3.47Å; W315-I360 VanDerWaalsContact CH2-CD1 3.47Å; W315-I360 HydrophobicContact CH2-CG1 3.92Å; W315-I360 HydrophobicContact CZ2-CD1 4.26Å; W315-I360 HydrophobicContact CZ2-CG1 4.44Å; W315-I360 HydrophobicContact CZ3-CD1 3.5Å; W315-I360 VanDerWaalsContact CZ3-CD1 3.5Å; W315-I360 HydrophobicContact CZ3-CG1 4.44Å; W315-L381 HydrophobicContact CZ3-CB 4.28Å; W315-D383 HydrophobicContact CG-CB 4.47Å; W315-D383 PolarHBondContact O-N 3.14Å; W315-C386 WeakPolarHBondContact CZ2-SG 3.23Å
316	Q	91.6	Very high	83.7	Confident	8 Å²	8	30 Å²	30	4%	0.037	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	131.2	171.9	179.1	-171.8	74.4	0	0	110.3	Y289 F290 R291 L292 I380 L381 Y382	Y289-Q316 HydrophobicContact CE2-CB 3.98Å; Y289-Q316 WeakPolarHBondContact OH-CB 3.46Å; F290-Q316 PolarHBondContact O-N 2.05Å; R291-Q316 WeakPolarHBondContact CA-O 3.49Å; R291-Q316 HydrophobicContact CG-CB 4.38Å; L292-Q316 PolarHBondContact N-O 2.83Å; Q316-I380 HydrophobicContact CG-CG2 3.65Å; Q316-L381 WeakPolarHBondContact CA-O 3.46Å; Q316-Y382 HydrophobicContact CB-CD1 4.44Å; Q316-Y382 HydrophobicContact CG-CD1 4.27Å; Q316-Y382 HydrophobicContact CG-CE1 4.18Å; Q316-Y382 PolarHBondContact NE2-OH 2.87Å
317	L	92.4	Very high	84.1	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	120	166.3	172	58.1	0	0	0	109.1	L292 L294 W315 L319 I360 I380 L381	L292-L317 HydrophobicContact CB-CD1 3.97Å; L292-L317 HydrophobicContact CD2-CD1 3.98Å; L292-L317 HydrophobicContact CG-CD1 3.9Å; L292-L317 WeakPolarHBondContact O-CA 3.18Å; L294-L317 HydrophobicContact CD1-CD1 4.11Å; L294-L317 HydrophobicContact CG-CD1 4.05Å; W315-L317 HydrophobicContact CE3-CB 4.39Å; W315-L317 HydrophobicContact CZ3-CB 3.99Å; L317-L319 HydrophobicContact CD1-CG 4.16Å; L317-L319 HydrophobicContact CD2-CD1 3.88Å; L317-L319 HydrophobicContact CD2-CD2 4.43Å; L317-L319 HydrophobicContact CD2-CG 4.14Å; L317-L319 HydrophobicContact CG-CD1 4.01Å; L317-L319 HydrophobicContact CG-CG 3.98Å; L317-I360 HydrophobicContact CB-CD1 4.05Å; L317-I360 HydrophobicContact CD2-CD1 3.61Å; L317-I360 HydrophobicContact CD2-CG2 3.99Å; L317-I360 HydrophobicContact CG-CD1 4.48Å; L317-I380 CarbonylContact O-C 3.54Å; L317-I380 WeakPolarHBondContact O-CA 3.23Å; L317-L381 HydrophobicContact CB-CB 4.42Å; L317-L381 PolarHBondContact N-O 2.91Å; L317-L381 PolarHBondContact O-N 2.92Å
318	R	92.8	Very high	84.4	Confident	30 Å²	30	27.7 Å²	27.7	11%	0.113	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.7	167.9	172.8	176.3	167.4	-175	-2.9	108.9	L292 S293 L294 M378 Q379 I380 S719	L292-R318 PolarHBondContact O-N 3.17Å; S293-R318 CarbonylContact C-O 3.02Å; S293-R318 WeakPolarHBondContact CA-O 3.48Å; L294-R318 PolarHBondContact N-O 3.23Å; R318-M378 HydrophobicContact CG-CG 4.14Å; R318-M378 HydrophobicContact CG-SD 4.28Å; R318-M378 PolarHBondContact NE-SD 3.31Å; R318-Q379 WeakPolarHBondContact CA-O 3.4Å; R318-I380 HydrophobicContact CB-CG1 4.42Å; R318-I380 HydrophobicContact CG-CG1 4.28Å; R318-S719 PolarHBondContact NH2-OG 3.24Å
319	L	89.6	Confident	84.4	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.01	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	131.9	172.4	-64.3	137.5	0	0	0	107.7	L294 L317 C322 Y326 M378 Q379	L294-L319 HydrophobicContact CB-CD2 4.25Å; L294-L319 HydrophobicContact CD1-CD2 3.98Å; L317-L319 HydrophobicContact CD1-CG 4.16Å; L317-L319 HydrophobicContact CD2-CD1 3.88Å; L317-L319 HydrophobicContact CD2-CD2 4.43Å; L317-L319 HydrophobicContact CD2-CG 4.14Å; L317-L319 HydrophobicContact CG-CD1 4.01Å; L317-L319 HydrophobicContact CG-CG 3.98Å; L319-C322 HydrophobicContact CB-CB 4.27Å; L319-C322 HydrophobicContact CD2-CB 4.3Å; L319-Y326 HydrophobicContact CD1-CD2 3.5Å; L319-Y326 HydrophobicContact CD1-CE2 4.23Å; L319-Y326 HydrophobicContact CD1-CG 3.74Å; L319-Y326 HydrophobicContact CD2-CD2 3.9Å; L319-Y326 HydrophobicContact CD2-CE2 3.77Å; L319-Y326 HydrophobicContact CD2-CG 4.41Å; L319-Y326 HydrophobicContact CG-CD2 4.31Å; L319-M378 CarbonylContact O-C 3.57Å; L319-M378 WeakPolarHBondContact O-CA 3.39Å; L319-Q379 HydrophobicContact CB-CB 4.27Å; L319-Q379 HydrophobicContact CD1-CB 4.32Å; L319-Q379 PolarHBondContact N-O 2.76Å; L319-Q379 PolarHBondContact O-N 2.94Å
320	T	88.1	Confident	84.4	Confident	8 Å²	8	31 Å²	31	5%	0.049	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	121.3	-176.2	-36.4	0	0	0	0	108.8	L294 F295 C296 C322 M378	L294-T320 PolarHBondContact O-N 2.95Å; L294-T320 PolarHBondContact O-OG1 3.06Å; F295-T320 HydrophobicContact CD1-CG2 4.34Å; F295-T320 HydrophobicContact CE1-CG2 4.46Å; C296-T320 PolarHBondContact N-O 2.87Å; T320-C322 PolarHBondContact O-N 3.28Å; T320-M378 HydrophobicContact CG2-CG 4.4Å
321	H	85.2	Confident	84.1	Confident	105 Å²	105	32.2 Å²	32.2	49%	0.486	16%	0.156	S	C	.	.	S	Bend	trans	62.4	14.9	-176.8	-46	-56.2	0	0	0	115.8	T376 G377	H321-T376 PolarHBondContact ND1-O 3.02Å; H321-G377 PolarHBondContact N-O 3.35Å
322	C	84.7	Confident	83.8	Confident	15 Å²	15	38 Å²	38	10%	0.101	18%	0.179	C	C	.	.			trans	-80	128.9	176.4	-56.9	0	0	0	0	110.3	C296 L319 T320 Y326	C296-C322 HydrophobicContact CB-CB 3.83Å; C296-C322 WeakPolarHBondContact CB-SG 3.44Å; C296-C322 VanDerWaalsContact SG-CA 3.52Å; C296-C322 WeakPolarHBondContact SG-CB 3.33Å; C296-C322 CovalentContact SG-SG 2.05Å; C296-C322 PolarHBondContact SG-SG 2.85Å; L319-C322 HydrophobicContact CB-CB 4.27Å; L319-C322 HydrophobicContact CD2-CB 4.3Å; T320-C322 PolarHBondContact O-N 3.28Å; C322-Y326 HydrophobicContact CB-CE2 4.44Å
323	P	75.9	Confident	83.3	Confident	27 Å²	27	39 Å²	39	18%	0.175	19%	0.188	C	C	.	.	S	Bend	trans	-85.4	-8.7	-169.6	33.9	-37.6	0	0	0	114.9	Q301	Q301-P323 HydrophobicContact CB-CG 4.1Å; Q301-P323 WeakPolarHBondContact O-CD 3.02Å; Q301-P323 WeakPolarHBondContact O-CG 3.48Å
324	D	76.1	Confident	83	Confident	38 Å²	38	39.1 Å²	39.1	20%	0.203	19%	0.188	C	C	.	.	S	Bend	trans	-91.5	141.1	171.4	-100.1	-60.3	0	0	0	110.7	P303 Y326 S364	P303-D324 WeakPolarHBondContact CD-OD2 3.34Å; P303-D324 WeakPolarHBondContact CG-OD2 3.2Å; D324-Y326 HydrophobicContact CB-CD2 4.42Å; D324-Y326 HydrophobicContact CB-CE2 3.81Å; D324-Y326 WeakPolarHBondContact O-CD2 3.31Å; D324-Y326 VanDerWaalsContact O-CE2 3.27Å; D324-Y326 WeakPolarHBondContact O-CE2 3.16Å; D324-S364 PolarHBondContact OD1-OG 3Å
325	L	78.6	Confident	82.4	Confident	67 Å²	67	42.6 Å²	42.6	35%	0.351	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-81.5	124.5	167.2	-70.7	170.7	0	0	0	109.5	K363	L325-K363 HydrophobicContact CB-CB 4.15Å; L325-K363 HydrophobicContact CB-CD 4.2Å; L325-K363 HydrophobicContact CD1-CD 4.27Å; L325-K363 WeakPolarHBondContact O-CB 3.41Å; L325-K363 PolarHBondContact O-N 3.27Å
326	Y	84.5	Confident	81.6	Confident	5 Å²	5	43.3 Å²	43.3	2%	0.02	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	149.2	177.7	-66.7	-104.1	0	0	0	111.3	F305 L319 C322 D324 I360 P362 Q379	F305-Y326 HydrophobicContact CE1-CE1 4.2Å; F305-Y326 AromaticContact CE2-CD1 3.8Å; F305-Y326 HydrophobicContact CE2-CD1 3.8Å; F305-Y326 AromaticContact CE2-CE1 3.64Å; F305-Y326 HydrophobicContact CE2-CE1 3.64Å; F305-Y326 AromaticContact CZ-CD1 3.75Å; F305-Y326 HydrophobicContact CZ-CD1 3.75Å; F305-Y326 AromaticContact CZ-CE1 3.44Å; F305-Y326 HydrophobicContact CZ-CE1 3.44Å; F305-Y326 VanDerWaalsContact CZ-CE1 3.44Å; L319-Y326 HydrophobicContact CD1-CD2 3.5Å; L319-Y326 HydrophobicContact CD1-CE2 4.23Å; L319-Y326 HydrophobicContact CD1-CG 3.74Å; L319-Y326 HydrophobicContact CD2-CD2 3.9Å; L319-Y326 HydrophobicContact CD2-CE2 3.77Å; L319-Y326 HydrophobicContact CD2-CG 4.41Å; L319-Y326 HydrophobicContact CG-CD2 4.31Å; C322-Y326 HydrophobicContact CB-CE2 4.44Å; D324-Y326 HydrophobicContact CB-CD2 4.42Å; D324-Y326 HydrophobicContact CB-CE2 3.81Å; D324-Y326 WeakPolarHBondContact O-CD2 3.31Å; D324-Y326 VanDerWaalsContact O-CE2 3.27Å; D324-Y326 WeakPolarHBondContact O-CE2 3.16Å; Y326-I360 HydrophobicContact CD1-CG2 4.3Å; Y326-P362 HydrophobicContact CD1-CG 4.23Å; Y326-P362 HydrophobicContact CE1-CG 3.88Å; Y326-Q379 PolarHBondContact O-NE2 2.04Å
327	I	85.2	Confident	80.6	Confident	37 Å²	37	44.3 Å²	44.3	19%	0.19	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144.9	176	-67.8	178	0	0	0	109.3	W329 I360 S361 K363	I327-W329 HydrophobicContact CG2-CD2 4.28Å; I327-W329 HydrophobicContact CG2-CH2 4.49Å; I327-W329 HydrophobicContact CG2-CZ2 3.83Å; I327-I360 WeakPolarHBondContact O-CA 3.35Å; I327-S361 PolarHBondContact N-O 3.45Å; I327-S361 PolarHBondContact O-N 3.22Å; I327-K363 HydrophobicContact CD1-CB 3.86Å; I327-K363 HydrophobicContact CD1-CD 3.91Å; I327-K363 HydrophobicContact CD1-CG 3.63Å; I327-K363 HydrophobicContact CG1-CB 4.13Å; I327-K363 HydrophobicContact CG1-CD 4.48Å; I327-K363 HydrophobicContact CG1-CG 4.37Å
328	C	88.2	Confident	79.4	Confident	7 Å²	7	45 Å²	45	5%	0.047	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	140.4	170.3	-179.3	0	0	0	0	112.6	W315 L359 C386 L387	W315-C328 HydrophobicContact CH2-CB 3.99Å; W315-C328 VanDerWaalsContact CH2-SG 3.51Å; W315-C328 HydrophobicContact CZ2-CB 4.44Å; W315-C328 WeakPolarHBondContact CZ2-SG 3.37Å; C328-L359 CarbonylContact C-O 3.58Å; C328-L359 WeakPolarHBondContact CA-O 3.42Å; C328-C386 HydrophobicContact CB-CB 3.82Å; C328-C386 WeakPolarHBondContact CB-SG 3.34Å; C328-C386 WeakPolarHBondContact SG-CB 3.35Å; C328-C386 CovalentContact SG-SG 2.03Å; C328-C386 PolarHBondContact SG-SG 2.85Å; C328-L387 PolarHBondContact O-N 3.33Å; C328-L387 VanDerWaalsContact O-N 3.08Å
329	W	85.9	Confident	77.8	Confident	26 Å²	26	45.3 Å²	45.3	10%	0.098	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	141.5	170.1	-53.2	100.9	0	0	0	111.5	I327 Y358 L359 M366 L387 N389 P390	I327-W329 HydrophobicContact CG2-CD2 4.28Å; I327-W329 HydrophobicContact CG2-CH2 4.49Å; I327-W329 HydrophobicContact CG2-CZ2 3.83Å; W329-Y358 WeakPolarHBondContact O-CA 2.99Å; W329-L359 HydrophobicContact CB-CB 4.44Å; W329-L359 PolarHBondContact N-O 2.92Å; W329-L359 PolarHBondContact O-N 3.17Å; W329-M366 HydrophobicContact CZ2-CG 4.36Å; W329-M366 HydrophobicContact CZ2-SD 4Å; W329-L387 CarbonylContact C-O 3.51Å; W329-L387 VanDerWaalsContact CA-O 3.25Å; W329-L387 WeakPolarHBondContact CA-O 3.48Å; W329-L387 HydrophobicContact CE3-CB 3.55Å; W329-L387 HydrophobicContact CE3-CD1 4.42Å; W329-L387 HydrophobicContact CH2-CD1 3.98Å; W329-L387 HydrophobicContact CZ3-CB 3.51Å; W329-L387 HydrophobicContact CZ3-CD1 3.7Å; W329-L387 HydrophobicContact CZ3-CG 4.27Å; W329-N389 HydrophobicContact CB-CB 4.46Å; W329-P390 HydrophobicContact CE3-CG 4.48Å; W329-P390 HydrophobicContact CH2-CG 4.13Å; W329-P390 HydrophobicContact CZ3-CG 3.87Å
330	Q	84.3	Confident	76.1	Confident	48 Å²	48	49.4 Å²	49.4	22%	0.224	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	133	169.3	-66.1	-178.2	-14.8	0	0	110.5	Y332 Y358 C386 L387 N389	Q330-Y332 HydrophobicContact CB-CD2 4.4Å; Q330-Y332 HydrophobicContact CB-CE2 3.77Å; Q330-Y332 PolarHBondContact OE1-OH 2.9Å; Q330-Y358 HydrophobicContact CG-CD1 3.95Å; Q330-Y358 HydrophobicContact CG-CE1 3.77Å; Q330-C386 HydrophobicContact CG-CB 3.67Å; Q330-L387 PolarHBondContact N-O 2.7Å; Q330-N389 WeakPolarHBondContact O-CB 3.35Å
331	W	79	Confident	74.3	Confident	25 Å²	25	55.8 Å²	55.8	10%	0.095	27%	0.267	C	S	.	.			trans	-95.8	132.5	-179.7	-173.4	-110.2	0	0	0	111.3	W309 S333 P356 S357 V396 L399 L408	W309-W331 HydrophobicContact CH2-CD2 4.08Å; W309-W331 AromaticContact CH2-CE3 3.75Å; W309-W331 HydrophobicContact CH2-CE3 3.75Å; W309-W331 AromaticContact CH2-CH2 3.88Å; W309-W331 HydrophobicContact CH2-CH2 3.88Å; W309-W331 HydrophobicContact CH2-CZ2 4.17Å; W309-W331 AromaticContact CH2-CZ3 3.67Å; W309-W331 HydrophobicContact CH2-CZ3 3.67Å; W309-W331 HydrophobicContact CZ3-CB 4.48Å; W309-W331 AromaticContact CZ3-CD2 3.6Å; W309-W331 HydrophobicContact CZ3-CD2 3.6Å; W309-W331 AromaticContact CZ3-CE2 3.99Å; W309-W331 AromaticContact CZ3-CE3 3.62Å; W309-W331 HydrophobicContact CZ3-CE3 3.62Å; W309-W331 HydrophobicContact CZ3-CG 4.03Å; W309-W331 HydrophobicContact CZ3-CH2 4.39Å; W309-W331 HydrophobicContact CZ3-CZ2 4.36Å; W309-W331 HydrophobicContact CZ3-CZ3 4.04Å; W331-S333 VanDerWaalsContact CE2-CB 3.42Å; W331-S333 VanDerWaalsContact CZ2-CB 3.44Å; W331-P356 VanDerWaalsContact CD1-O 3.23Å; W331-S357 PolarHBondContact N-O 3.36Å; W331-V396 HydrophobicContact CH2-CG2 4.47Å; W331-L399 HydrophobicContact CH2-CD1 4.16Å; W331-L408 HydrophobicContact CH2-CD1 4.2Å; W331-L408 HydrophobicContact CZ2-CD1 3.7Å
332	Y	71.8	Confident	72.4	Confident	127 Å²	127	52.7 Å²	52.7	50%	0.498	25%	0.253	S	S	.	.			trans	-128.6	12.4	-173	-72.1	-72.1	0	0	0	113.6	Q330 P388	Q330-Y332 HydrophobicContact CB-CD2 4.4Å; Q330-Y332 HydrophobicContact CB-CE2 3.77Å; Q330-Y332 PolarHBondContact OE1-OH 2.9Å; Y332-P388 HydrophobicContact CE2-CB 4.23Å
333	S	69.8	Low	70.2	Confident	34 Å²	34	56 Å²	56	24%	0.238	28%	0.277	C	S	.	.			trans	-68.6	141.4	175.3	-171.8	0	0	0	0	110.7	W331 Y335 L408	W331-S333 VanDerWaalsContact CE2-CB 3.42Å; W331-S333 VanDerWaalsContact CZ2-CB 3.44Å; S333-Y335 PolarHBondContact OG-N 3.39Å; S333-Y335 VanDerWaalsContact OG-N 3.11Å; S333-Y335 PolarHBondContact OG-O 3.29Å; S333-L408 WeakPolarHBondContact OG-CD1 3.27Å
334	K	67.4	Low	68.6	Low	181 Å²	181	59.5 Å²	59.5	79%	0.787	30%	0.298	S	S	*	.	S	Bend	trans	-76	-13.9	169.4	-62.9	-177.5	-179.4	179.8	0	112.6
335	Y	69.6	Low	66.7	Low	105 Å²	105	63.4 Å²	63.4	41%	0.412	32%	0.319	S	S	.	.	S	Bend	trans	-103.8	139.2	-174.9	-58.7	-65.7	0	0	0	111.2	S333 M401 Q406	S333-Y335 PolarHBondContact OG-N 3.39Å; S333-Y335 VanDerWaalsContact OG-N 3.11Å; S333-Y335 PolarHBondContact OG-O 3.29Å; Y335-M401 HydrophobicContact CD1-CE 3.59Å; Y335-M401 HydrophobicContact CD2-CE 3.75Å; Y335-M401 HydrophobicContact CD2-SD 3.74Å; Y335-M401 HydrophobicContact CE1-CE 3.81Å; Y335-M401 HydrophobicContact CE2-CE 3.95Å; Y335-M401 HydrophobicContact CE2-SD 4.16Å; Y335-M401 HydrophobicContact CG-CE 3.56Å; Y335-M401 HydrophobicContact CG-SD 3.98Å; Y335-Q406 HydrophobicContact CD1-CB 4.5Å; Y335-Q406 VanDerWaalsContact CD1-O 3.3Å; Y335-Q406 WeakPolarHBondContact CD1-O 3.15Å
336	P	71.9	Confident	64.9	Low	14 Å²	14	64.2 Å²	64.2	9%	0.091	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-65.8	166.4	170.9	34	-40.5	0	0	0	111	S353 I355 Q406 C407 L408	P336-S353 WeakPolarHBondContact CB-OG 3.22Å; P336-S353 WeakPolarHBondContact CG-OG 3.46Å; P336-I355 HydrophobicContact CB-CG1 4.39Å; P336-Q406 WeakPolarHBondContact CD-O 3.33Å; P336-C407 HydrophobicContact CG-CB 3.96Å; P336-C407 CarbonylContact O-C 3.43Å; P336-C407 VanDerWaalsContact O-CA 3.32Å; P336-C407 WeakPolarHBondContact O-CA 3.46Å; P336-L408 PolarHBondContact O-N 3.33Å
337	I	70.8	Confident	62.9	Low	29 Å²	29	67.6 Å²	67.6	15%	0.149	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-77.5	143.3	164.1	-63	-179.7	0	0	0	108.3	I267 W309 D339 P356 L408	I267-I337 HydrophobicContact CD1-CB 4.43Å; I267-I337 HydrophobicContact CD1-CD1 4.31Å; W309-I337 HydrophobicContact CD2-CD1 3.44Å; W309-I337 VanDerWaalsContact CD2-CD1 3.44Å; W309-I337 HydrophobicContact CE3-CD1 3.98Å; W309-I337 HydrophobicContact CG-CD1 3.71Å; W309-I337 HydrophobicContact CH2-CD1 4.25Å; W309-I337 HydrophobicContact CZ2-CD1 3.78Å; W309-I337 HydrophobicContact CZ3-CD1 4.34Å; I337-D339 PolarHBondContact O-N 3.42Å; I337-P356 HydrophobicContact CD1-CG 3.82Å; I337-P356 HydrophobicContact CG1-CG 4.14Å; I337-L408 CarbonylContact C-O 3.59Å; I337-L408 WeakPolarHBondContact CA-O 3.28Å
338	C	67.8	Low	60.7	Low	15 Å²	15	73.7 Å²	73.7	10%	0.101	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-67.1	129.6	179	-65.4	0	0	0	0	111	V340 C407 L408 Q409	C338-V340 PolarHBondContact O-N 3.47Å; C338-C407 WeakPolarHBondContact CA-SG 3.27Å; C338-C407 HydrophobicContact CB-CB 3.93Å; C338-C407 WeakPolarHBondContact CB-SG 3.32Å; C338-C407 WeakPolarHBondContact SG-CB 3.28Å; C338-C407 PolarHBondContact SG-O 2.85Å; C338-C407 CovalentContact SG-SG 2.03Å; C338-C407 PolarHBondContact SG-SG 2.82Å; C338-L408 PolarHBondContact N-O 3.07Å; C338-L408 VanDerWaalsContact SG-C 3.5Å; C338-Q409 HydrophobicContact CB-CB 4.07Å
339	D	59.8	Low	58.4	Low	36 Å²	36	80.5 Å²	80.5	19%	0.193	40%	0.398	C	S	.	.			trans	-77.8	110.8	174.2	-165	-17.2	0	0	0	109.2	R238 I337 K341 Q342	R238-D339 IonicContact CZ-OD1 3.14Å; R238-D339 IonicContact CZ-OD2 2.67Å; R238-D339 IonicContact NH1-OD1 2.69Å; R238-D339 PolarHBondContact NH1-OD1 2.65Å; R238-D339 IonicContact NH1-OD2 2.73Å; R238-D339 IonicContact NH2-OD1 2.84Å; R238-D339 IonicContact NH2-OD2 2.68Å; R238-D339 PolarHBondContact NH2-OD2 3.02Å; I337-D339 PolarHBondContact O-N 3.42Å; D339-K341 PolarHBondContact O-N 2.6Å; D339-Q342 HydrophobicContact CB-CB 4.21Å; D339-Q342 HydrophobicContact CB-CG 4.13Å; D339-Q342 PolarHBondContact O-N 2.97Å; D339-Q342 PolarHBondContact OD2-NE2 3.29Å; D339-Q342 VanDerWaalsContact OD2-NE2 3.09Å
340	V	52.7	Low	56.2	Low	89 Å²	89	81 Å²	81	54%	0.539	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-25.2	-173.4	-174.9	0	0	0	0	112.5	C338	C338-V340 PolarHBondContact O-N 3.47Å
341	K	50.5	Low	54.1	Low	141 Å²	141	86 Å²	86	61%	0.613	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	8.5	-178.6	-59.2	-178	-175.4	178	0	115.2	D239 D339	D239-K341 IonicContact OD1-NZ 3.32Å; D239-K341 PolarHBondContact OD1-NZ 2.85Å; D239-K341 IonicContact OD2-NZ 2.85Å; D239-K341 PolarHBondContact OD2-NZ 2.89Å; D339-K341 PolarHBondContact O-N 2.6Å
342	Q	46.2	Very low	52.5	Low	40 Å²	40	91.9 Å²	91.9	19%	0.187	46%	0.456	C	S	.	.			trans	-120.8	26.1	-173	-61.9	-155.3	45.3	0	0	117.3	K272 D339 L350	K272-Q342 VanDerWaalsContact CD-OE1 3.29Å; K272-Q342 VanDerWaalsContact NZ-OE1 3.12Å; D339-Q342 HydrophobicContact CB-CB 4.21Å; D339-Q342 HydrophobicContact CB-CG 4.13Å; D339-Q342 PolarHBondContact O-N 2.97Å; D339-Q342 PolarHBondContact OD2-NE2 3.29Å; D339-Q342 VanDerWaalsContact OD2-NE2 3.09Å; Q342-L350 HydrophobicContact CB-CD2 4.28Å
343	S	37.5	Very low	51.6	Low	86 Å²	86	88 Å²	88	60%	0.601	45%	0.448	S	S	*	.			trans	-90.6	111.8	147.8	162	0	0	0	0	107.1
344	T	43.4	Very low	51.2	Low	100 Å²	100	89.5 Å²	89.5	61%	0.613	45%	0.45	S	S	*	.	S	Bend		-131.6	-21	54.7	45.7	0	0	0	0	116.6
345	D	36.9	Very low	51.2	Low	120 Å²	120	84.3 Å²	84.3	64%	0.642	43%	0.43	S	S	*	.	S	Bend	trans	-99.2	110.8	-151.8	-71.6	0.9	0	0	0	115.1	K272	K272-D345 PolarHBondContact NZ-O 2.72Å
346	N	40.6	Very low	51.3	Low	84 Å²	84	79.5 Å²	79.5	45%	0.449	41%	0.412	S	S	.	.			trans	63.9	105.7	166.8	-162.8	-28.2	0	0	0	116	K272 E348	K272-N346 PolarHBondContact NZ-O 2.81Å; N346-E348 PolarHBondContact OD1-N 2.63Å; N346-E348 VanDerWaalsContact OD1-N 3.15Å
347	P	41.2	Very low	51.6	Low	75 Å²	75	80.7 Å²	80.7	49%	0.487	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-73.7	-26.3	-176.7	30.4	-35.1	0	0	0	113.8	R349 L350	P347-R349 PolarHBondContact O-N 2.73Å; P347-L350 HydrophobicContact CB-CD1 4.11Å; P347-L350 VanDerWaalsContact O-CB 3.23Å; P347-L350 WeakPolarHBondContact O-CB 3.46Å; P347-L350 WeakPolarHBondContact O-CG 3.05Å; P347-L350 PolarHBondContact O-N 2.96Å
348	E	38.5	Very low	52.2	Low	165 Å²	165	80.8 Å²	80.8	77%	0.771	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-67.7	-21.7	-178.2	-61.8	-171.4	146.4	0	0	112.4	N346 L350	N346-E348 PolarHBondContact OD1-N 2.63Å; N346-E348 VanDerWaalsContact OD1-N 3.15Å; E348-L350 VanDerWaalsContact C-N 3.34Å
349	R	40.1	Very low	53.1	Low	151 Å²	151	80.2 Å²	80.2	57%	0.57	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-82.4	-3.2	171.1	-76.7	-175.9	169.9	-177.9	-3.5	114.2	K272 P347 L351	K272-R349 HydrophobicContact CD-CB 4.34Å; P347-R349 PolarHBondContact O-N 2.73Å; R349-L351 VanDerWaalsContact C-N 3.34Å
350	L	41.5	Very low	54.3	Low	35 Å²	35	78.5 Å²	78.5	18%	0.183	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-76.7	-18.2	178.3	-62.4	173.7	0	0	0	113.2	Q342 P347 E348 K352 S353 D405	Q342-L350 HydrophobicContact CB-CD2 4.28Å; P347-L350 HydrophobicContact CB-CD1 4.11Å; P347-L350 VanDerWaalsContact O-CB 3.23Å; P347-L350 WeakPolarHBondContact O-CB 3.46Å; P347-L350 WeakPolarHBondContact O-CG 3.05Å; P347-L350 PolarHBondContact O-N 2.96Å; E348-L350 VanDerWaalsContact C-N 3.34Å; L350-K352 PolarHBondContact O-N 2.77Å; L350-S353 WeakPolarHBondContact O-CB 3.09Å; L350-S353 PolarHBondContact O-N 3.4Å; L350-S353 PolarHBondContact O-OG 2.89Å; L350-S353 VanDerWaalsContact O-OG 3.11Å; L350-D405 HydrophobicContact CD1-CB 3.82Å
351	L	39.5	Very low	55.8	Low	154 Å²	154	74.3 Å²	74.3	81%	0.806	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	13.1	-176.2	-91.5	155.9	0	0	0	116.4	R349	R349-L351 VanDerWaalsContact C-N 3.34Å
352	K	45.8	Very low	57.2	Low	149 Å²	149	67.6 Å²	67.6	65%	0.648	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	14.7	164.6	-76.4	-166.6	173.3	-173.4	0	113.6	L350	L350-K352 PolarHBondContact O-N 2.77Å
353	S	52.5	Low	58.6	Low	46 Å²	46	70 Å²	70	32%	0.322	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-57.1	136.2	169	52.1	0	0	0	0	111.9	P336 L350	P336-S353 WeakPolarHBondContact CB-OG 3.22Å; P336-S353 WeakPolarHBondContact CG-OG 3.46Å; L350-S353 WeakPolarHBondContact O-CB 3.09Å; L350-S353 PolarHBondContact O-N 3.4Å; L350-S353 PolarHBondContact O-OG 2.89Å; L350-S353 VanDerWaalsContact O-OG 3.11Å
354	F	62.1	Low	59.7	Low	64 Å²	64	69.3 Å²	69.3	28%	0.281	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-79	130.3	179.8	-152.8	-66.3	0	0	0	110.8	I267 P268 L283 P311	I267-F354 HydrophobicContact CG2-CB 4.19Å; P268-F354 HydrophobicContact CG-CD2 3.81Å; P268-F354 HydrophobicContact CG-CE2 4.25Å; P268-F354 HydrophobicContact CG-CG 4.36Å; L283-F354 HydrophobicContact CD2-CD2 4.41Å; L283-F354 HydrophobicContact CD2-CE2 4.39Å; P311-F354 HydrophobicContact CB-CD1 3.58Å; P311-F354 HydrophobicContact CB-CE1 3.18Å; P311-F354 HydrophobicContact CB-CE2 4.46Å; P311-F354 HydrophobicContact CB-CG 4.42Å; P311-F354 HydrophobicContact CB-CZ 3.69Å; P311-F354 WeakPolarHBondContact O-CE1 3.48Å
355	I	67.5	Low	60.2	Low	73 Å²	73	68.4 Å²	68.4	37%	0.374	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-92.5	121.9	175.1	-53.9	176.7	0	0	0	108.6	P336	P336-I355 HydrophobicContact CB-CG1 4.39Å
356	P	70.5	Confident	60.8	Low	4 Å²	4	64.8 Å²	64.8	3%	0.026	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-57.8	150.5	173.1	-23.7	34.1	0	0	0	111.8	I267 W309 W331 I337	I267-P356 HydrophobicContact CD1-CG 3.94Å; W309-P356 HydrophobicContact CB-CB 4.25Å; W309-P356 HydrophobicContact CB-CG 4.25Å; W309-P356 HydrophobicContact CD2-CB 4.49Å; W309-P356 HydrophobicContact CD2-CG 4.44Å; W309-P356 HydrophobicContact CE3-CB 3.8Å; W309-P356 HydrophobicContact CE3-CG 4.11Å; W331-P356 VanDerWaalsContact CD1-O 3.23Å; I337-P356 HydrophobicContact CD1-CG 3.82Å; I337-P356 HydrophobicContact CG1-CG 4.14Å
357	S	78.3	Confident	60.8	Low	39 Å²	39	68.4 Å²	68.4	27%	0.273	35%	0.346	S	S	.	.			trans	-103.8	-27.5	174.2	-63.4	0	0	0	0	112.4	F310 P311 W331	F310-S357 PolarHBondContact O-N 2.76Å; P311-S357 PolarHBondContact O-OG 3.36Å; W331-S357 PolarHBondContact N-O 3.36Å
358	Y	84.4	Confident	60.5	Low	30 Å²	30	68 Å²	68	12%	0.118	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	158.6	-177	-54.9	-100.3	0	0	0	112.2	F310 W312 K313 W315 W329 Q330 D383 C386	F310-Y358 PolarHBondContact N-O 3.3Å; F310-Y358 PolarHBondContact O-N 2.82Å; F310-Y358 VanDerWaalsContact O-N 3.11Å; W312-Y358 WeakPolarHBondContact O-CD2 3.19Å; W312-Y358 VanDerWaalsContact O-CE2 3.26Å; W312-Y358 WeakPolarHBondContact O-CE2 3.26Å; K313-Y358 PolarHBondContact O-OH 3.43Å; K313-Y358 VanDerWaalsContact O-OH 3.08Å; W315-Y358 AromaticContact CD1-CD2 3.8Å; W315-Y358 AromaticContact CE2-CG 3.88Å; W315-Y358 AromaticContact CZ2-CD1 4Å; W315-Y358 HydrophobicContact CZ2-CD1 4Å; W315-Y358 AromaticContact CZ2-CG 3.9Å; W315-Y358 HydrophobicContact CZ2-CG 3.9Å; W315-Y358 AromaticContact NE1-CD1 3.8Å; W315-Y358 AromaticContact NE1-CD2 3.03Å; W315-Y358 AromaticContact NE1-CE2 3.49Å; W315-Y358 AromaticContact NE1-CG 3.24Å; W329-Y358 WeakPolarHBondContact O-CA 2.99Å; Q330-Y358 HydrophobicContact CG-CD1 3.95Å; Q330-Y358 HydrophobicContact CG-CE1 3.77Å; Y358-D383 HydrophobicContact CE1-CB 4.24Å; Y358-D383 WeakPolarHBondContact CE1-O 3.12Å; Y358-C386 HydrophobicContact CD1-CB 3.86Å; Y358-C386 VanDerWaalsContact CD1-SG 3.52Å; Y358-C386 HydrophobicContact CE1-CB 4.06Å
359	L	85.3	Confident	60.3	Low	3 Å²	3	65.2 Å²	65.2	2%	0.016	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	126.6	179.1	166.1	60	0	0	0	109.4	R307 W309 C328 W329	R307-L359 HydrophobicContact CB-CD1 3.5Å; R307-L359 VanDerWaalsContact CB-CD1 3.5Å; R307-L359 HydrophobicContact CG-CD1 3.73Å; W309-L359 HydrophobicContact CD2-CD1 4.16Å; W309-L359 HydrophobicContact CE3-CB 3.97Å; W309-L359 HydrophobicContact CE3-CD1 4.17Å; W309-L359 HydrophobicContact CH2-CB 4.3Å; W309-L359 HydrophobicContact CH2-CD1 4.11Å; W309-L359 HydrophobicContact CH2-CD2 3.92Å; W309-L359 HydrophobicContact CH2-CG 4.33Å; W309-L359 HydrophobicContact CZ2-CD1 4.05Å; W309-L359 HydrophobicContact CZ2-CD2 4.44Å; W309-L359 HydrophobicContact CZ3-CB 3.73Å; W309-L359 HydrophobicContact CZ3-CD1 4.16Å; W309-L359 HydrophobicContact CZ3-CD2 4.2Å; W309-L359 HydrophobicContact CZ3-CG 4.24Å; C328-L359 CarbonylContact C-O 3.58Å; C328-L359 WeakPolarHBondContact CA-O 3.42Å; W329-L359 HydrophobicContact CB-CB 4.44Å; W329-L359 PolarHBondContact N-O 2.92Å; W329-L359 PolarHBondContact O-N 3.17Å
360	I	86.6	Confident	60.2	Low	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	137.4	171.6	-52.3	-175	0	0	0	109.7	F305 R307 L308 F310 W315 L317 Y326 I327 L381	F305-I360 HydrophobicContact CE2-CG2 4.23Å; R307-I360 CarbonylContact C-O 3.58Å; R307-I360 WeakPolarHBondContact CA-O 3.48Å; L308-I360 PolarHBondContact N-O 3.16Å; L308-I360 PolarHBondContact O-N 3.07Å; F310-I360 HydrophobicContact CD2-CD1 3.75Å; F310-I360 HydrophobicContact CD2-CG1 3.9Å; F310-I360 HydrophobicContact CE2-CB 4.41Å; F310-I360 HydrophobicContact CE2-CD1 3.32Å; F310-I360 HydrophobicContact CE2-CG1 3.82Å; F310-I360 HydrophobicContact CZ-CD1 3.85Å; W315-I360 HydrophobicContact CE3-CD1 4.31Å; W315-I360 HydrophobicContact CH2-CD1 3.47Å; W315-I360 VanDerWaalsContact CH2-CD1 3.47Å; W315-I360 HydrophobicContact CH2-CG1 3.92Å; W315-I360 HydrophobicContact CZ2-CD1 4.26Å; W315-I360 HydrophobicContact CZ2-CG1 4.44Å; W315-I360 HydrophobicContact CZ3-CD1 3.5Å; W315-I360 VanDerWaalsContact CZ3-CD1 3.5Å; W315-I360 HydrophobicContact CZ3-CG1 4.44Å; L317-I360 HydrophobicContact CB-CD1 4.05Å; L317-I360 HydrophobicContact CD2-CD1 3.61Å; L317-I360 HydrophobicContact CD2-CG2 3.99Å; L317-I360 HydrophobicContact CG-CD1 4.48Å; Y326-I360 HydrophobicContact CD1-CG2 4.3Å; I327-I360 WeakPolarHBondContact O-CA 3.35Å; I360-L381 HydrophobicContact CG2-CD1 4.22Å
361	S	84.1	Confident	60.1	Low	2 Å²	2	70.8 Å²	70.8	1%	0.014	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	148.3	179.6	58.8	0	0	0	0	112.2	I327	I327-S361 PolarHBondContact N-O 3.45Å; I327-S361 PolarHBondContact O-N 3.22Å
362	P	80	Confident	60.3	Low	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	139.6	171	-20.1	31.2	0	0	0	112.6	P303 R306 Y326 S364 L365	P303-P362 HydrophobicContact CB-CB 4.47Å; P303-P362 HydrophobicContact CB-CG 3.63Å; P303-P362 HydrophobicContact CG-CG 4.2Å; R306-P362 WeakPolarHBondContact O-CD 3.47Å; Y326-P362 HydrophobicContact CD1-CG 4.23Å; Y326-P362 HydrophobicContact CE1-CG 3.88Å; P362-S364 WeakPolarHBondContact CB-OG 3.46Å; P362-S364 PolarHBondContact O-N 3.12Å; P362-L365 HydrophobicContact CB-CD1 4.17Å; P362-L365 HydrophobicContact CG-CD1 4.02Å; P362-L365 PolarHBondContact O-N 3.22Å
363	K	73.7	Confident	60.4	Low	90 Å²	90	70 Å²	70	39%	0.391	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-63	-29.9	-179.6	-176.7	169.1	-172.9	179.5	0	112.7	L325 I327 L365 M366	L325-K363 HydrophobicContact CB-CB 4.15Å; L325-K363 HydrophobicContact CB-CD 4.2Å; L325-K363 HydrophobicContact CD1-CD 4.27Å; L325-K363 WeakPolarHBondContact O-CB 3.41Å; L325-K363 PolarHBondContact O-N 3.27Å; I327-K363 HydrophobicContact CD1-CB 3.86Å; I327-K363 HydrophobicContact CD1-CD 3.91Å; I327-K363 HydrophobicContact CD1-CG 3.63Å; I327-K363 HydrophobicContact CG1-CB 4.13Å; I327-K363 HydrophobicContact CG1-CD 4.48Å; I327-K363 HydrophobicContact CG1-CG 4.37Å; K363-L365 PolarHBondContact O-N 3.23Å; K363-M366 PolarHBondContact O-N 3.38Å
364	S	60.7	Low	60.3	Low	72 Å²	72	73.1 Å²	73.1	50%	0.503	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-56.7	-27.5	174.7	41.1	0	0	0	0	113.5	D324 P362	D324-S364 PolarHBondContact OD1-OG 3Å; P362-S364 WeakPolarHBondContact CB-OG 3.46Å; P362-S364 PolarHBondContact O-N 3.12Å
365	L	54.3	Low	59.7	Low	81 Å²	81	77.3 Å²	77.3	42%	0.424	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-86.2	-8.5	175.5	-82.5	134.8	0	0	0	114.8	R306 P362 K363	R306-L365 HydrophobicContact CG-CD1 4.15Å; R306-L365 HydrophobicContact CG-CD2 4.01Å; P362-L365 HydrophobicContact CB-CD1 4.17Å; P362-L365 HydrophobicContact CG-CD1 4.02Å; P362-L365 PolarHBondContact O-N 3.22Å; K363-L365 PolarHBondContact O-N 3.23Å
366	M	49.9	Very low	59.1	Low	43 Å²	43	78 Å²	78	21%	0.212	42%	0.416	C	S	.	.	S	Bend	trans	-110.3	20.2	-168.6	-77.3	-75.1	125.1	0	0	114.3	W329 K363 L395	W329-M366 HydrophobicContact CZ2-CG 4.36Å; W329-M366 HydrophobicContact CZ2-SD 4Å; K363-M366 PolarHBondContact O-N 3.38Å; M366-L395 HydrophobicContact CE-CD2 4.07Å; M366-L395 HydrophobicContact CE-CG 4.2Å; M366-L395 HydrophobicContact SD-CD2 4.19Å
367	N	39.6	Very low	58.8	Low	160 Å²	160	79.9 Å²	79.9	86%	0.856	44%	0.437	S	S	*	.	S	Bend	trans	74.7	108.5	-166.8	-47.2	-81.9	0	0	0	113.8
368	S	35.2	Very low	59	Low	68 Å²	68	83 Å²	83	48%	0.476	45%	0.448	S	S	.	.			trans	-152.6	143.7	159.8	-177	0	0	0	0	109.1
369	P	36	Very low	59.1	Low	106 Å²	106	83.9 Å²	83.9	69%	0.688	45%	0.454	S	S	*	.			trans	-59.2	149.7	166.3	-21.3	33.5	0	0	0	111.6	S371	P369-S371 PolarHBondContact O-N 3.09Å; P369-S371 VanDerWaalsContact O-N 3.1Å
370	Q	37.8	Very low	59.3	Low	206 Å²	206	86.4 Å²	86.4	96%	0.963	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	93.2	175.9	-65.4	169.9	-45.4	0	0	110.3
371	S	37.7	Very low	59.4	Low	96 Å²	96	87.3 Å²	87.3	67%	0.671	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-155.9	-24.9	169.4	59.8	0	0	0	0	116.8	P369	P369-S371 PolarHBondContact O-N 3.09Å; P369-S371 VanDerWaalsContact O-N 3.1Å
372	L	44.7	Very low	59.6	Low	112 Å²	112	91.1 Å²	91.1	59%	0.586	49%	0.486	S	S	*	.			trans	-110.5	84.8	-178.6	-100.4	63	0	0	0	112.1	Q374	L372-Q374 HydrophobicContact CD2-CG 4.5Å; L372-Q374 HydrophobicContact CG-CG 4.47Å; L372-Q374 PolarHBondContact O-N 2.67Å
373	K	47.7	Very low	59.8	Low	174 Å²	174	92.4 Å²	92.4	76%	0.757	49%	0.493	S	S	*	.			trans	-79.5	94.5	140.9	-82.2	-168.2	171.4	-168	0	105.6
374	Q	50.4	Low	60.2	Low	113 Å²	113	94 Å²	94	53%	0.528	51%	0.506	S	S	.	.			trans	-89.9	161.3	-178	-141.4	167.9	5.6	0	0	110.3	L372	L372-Q374 HydrophobicContact CD2-CG 4.5Å; L372-Q374 HydrophobicContact CG-CG 4.47Å; L372-Q374 PolarHBondContact O-N 2.67Å
375	E	48.7	Very low	61.4	Low	151 Å²	151	95.8 Å²	95.8	71%	0.706	51%	0.506	S	S	*	.			trans	-62	156.3	-159.7	-66.6	167.7	114.9	0	0	115.5	G377	E375-G377 PolarHBondContact O-N 2.73Å
376	T	54.9	Low	63	Low	87 Å²	87	92.3 Å²	92.3	53%	0.534	49%	0.488	S	S	.	.	S	Bend	trans	-74.2	46.2	-166.2	43.9	0	0	0	0	115	H321	H321-T376 PolarHBondContact ND1-O 3.02Å
377	G	65.9	Low	64.6	Low	45 Å²	45	94.5 Å²	94.5	46%	0.464	50%	0.501	S	S	.	.			trans	-73.8	-161.5	178.5	0	0	0	0	0	114.9	H321 E375	H321-G377 PolarHBondContact N-O 3.35Å; E375-G377 PolarHBondContact O-N 2.73Å
378	M	81.8	Confident	66.3	Low	104 Å²	104	90.8 Å²	90.8	51%	0.512	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	111.1	176.8	-171.1	-169.4	-43.4	0	0	109.5	R318 L319 T320 I380	R318-M378 HydrophobicContact CG-CG 4.14Å; R318-M378 HydrophobicContact CG-SD 4.28Å; R318-M378 PolarHBondContact NE-SD 3.31Å; L319-M378 CarbonylContact O-C 3.57Å; L319-M378 WeakPolarHBondContact O-CA 3.39Å; T320-M378 HydrophobicContact CG2-CG 4.4Å; M378-I380 HydrophobicContact CG-CG1 4.33Å; M378-I380 HydrophobicContact SD-CD1 4.09Å; M378-I380 HydrophobicContact SD-CG1 4.39Å
379	Q	87	Confident	67.9	Low	48 Å²	48	88.2 Å²	88.2	22%	0.224	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135.7	171.4	-167.8	-176.2	13.3	0	0	109.4	R318 L319 Y326	R318-Q379 WeakPolarHBondContact CA-O 3.4Å; L319-Q379 HydrophobicContact CB-CB 4.27Å; L319-Q379 HydrophobicContact CD1-CB 4.32Å; L319-Q379 PolarHBondContact N-O 2.76Å; L319-Q379 PolarHBondContact O-N 2.94Å; Y326-Q379 PolarHBondContact O-NE2 2.04Å
380	I	88.9	Confident	68.7	Low	57 Å²	57	87.1 Å²	87.1	29%	0.292	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124.9	171.1	-52.4	-179.3	0	0	0	108.4	Q316 L317 R318 M378 Y382	Q316-I380 HydrophobicContact CG-CG2 3.65Å; L317-I380 CarbonylContact O-C 3.54Å; L317-I380 WeakPolarHBondContact O-CA 3.23Å; R318-I380 HydrophobicContact CB-CG1 4.42Å; R318-I380 HydrophobicContact CG-CG1 4.28Å; M378-I380 HydrophobicContact CG-CG1 4.33Å; M378-I380 HydrophobicContact SD-CD1 4.09Å; M378-I380 HydrophobicContact SD-CG1 4.39Å; I380-Y382 HydrophobicContact CB-CE2 4.24Å; I380-Y382 HydrophobicContact CG2-CD2 4.06Å; I380-Y382 HydrophobicContact CG2-CE2 3.46Å; I380-Y382 VanDerWaalsContact CG2-CE2 3.46Å
381	L	89.1	Confident	69.4	Low	18 Å²	18	80.8 Å²	80.8	9%	0.094	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	139.3	173.7	-64.3	177.2	0	0	0	109.6	W315 Q316 L317 I360	W315-L381 HydrophobicContact CZ3-CB 4.28Å; Q316-L381 WeakPolarHBondContact CA-O 3.46Å; L317-L381 HydrophobicContact CB-CB 4.42Å; L317-L381 PolarHBondContact N-O 2.91Å; L317-L381 PolarHBondContact O-N 2.92Å; I360-L381 HydrophobicContact CG2-CD1 4.22Å
382	Y	87.7	Confident	70	Confident	82 Å²	82	82.3 Å²	82.3	32%	0.322	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	149.9	175.5	-62.9	-99.4	0	0	0	110.7	Q316 I380 N384 Q385 C386	Q316-Y382 HydrophobicContact CB-CD1 4.44Å; Q316-Y382 HydrophobicContact CG-CD1 4.27Å; Q316-Y382 HydrophobicContact CG-CE1 4.18Å; Q316-Y382 PolarHBondContact NE2-OH 2.87Å; I380-Y382 HydrophobicContact CB-CE2 4.24Å; I380-Y382 HydrophobicContact CG2-CD2 4.06Å; I380-Y382 HydrophobicContact CG2-CE2 3.46Å; I380-Y382 VanDerWaalsContact CG2-CE2 3.46Å; Y382-N384 VanDerWaalsContact CB-OD1 3.28Å; Y382-N384 WeakPolarHBondContact CB-OD1 3.43Å; Y382-N384 PolarHBondContact O-N 3.15Å; Y382-Q385 WeakPolarHBondContact O-CB 3.43Å; Y382-Q385 PolarHBondContact O-N 3.42Å; Y382-C386 PolarHBondContact O-SG 2.9Å
383	D	83.8	Confident	69.8	Low	27 Å²	27	82.1 Å²	82.1	14%	0.144	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-46	-39.4	171.2	63.8	-27.5	0	0	0	114.8	S314 W315 Y358 Q385 C386	S314-D383 VanDerWaalsContact CA-OD2 3.22Å; S314-D383 WeakPolarHBondContact CA-OD2 3.41Å; S314-D383 WeakPolarHBondContact CB-OD2 3.47Å; S314-D383 VanDerWaalsContact OG-CG 3.3Å; S314-D383 PolarHBondContact OG-OD2 2.75Å; W315-D383 HydrophobicContact CG-CB 4.47Å; W315-D383 PolarHBondContact O-N 3.14Å; Y358-D383 HydrophobicContact CE1-CB 4.24Å; Y358-D383 WeakPolarHBondContact CE1-O 3.12Å; D383-Q385 VanDerWaalsContact C-N 3.33Å; D383-C386 WeakPolarHBondContact O-CB 3.3Å; D383-C386 PolarHBondContact O-N 2.9Å; D383-C386 PolarHBondContact O-SG 2.95Å; D383-C386 VanDerWaalsContact O-SG 3.42Å
384	N	83.4	Confident	69.4	Low	124 Å²	124	78.8 Å²	78.8	66%	0.663	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-80.6	-8.7	-178.9	69.6	-0.2	0	0	0	114.3	Y382	Y382-N384 VanDerWaalsContact CB-OD1 3.28Å; Y382-N384 WeakPolarHBondContact CB-OD1 3.43Å; Y382-N384 PolarHBondContact O-N 3.15Å
385	Q	85.5	Confident	69.1	Low	110 Å²	110	74.5 Å²	74.5	51%	0.514	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-96.8	-6.8	173.9	-66.3	172.1	-14.6	0	0	112.6	Y382 D383 L387	Y382-Q385 WeakPolarHBondContact O-CB 3.43Å; Y382-Q385 PolarHBondContact O-N 3.42Å; D383-Q385 VanDerWaalsContact C-N 3.33Å; Q385-L387 PolarHBondContact O-N 2.69Å
386	C	87.1	Confident	69.2	Low	7 Å²	7	69 Å²	69	5%	0.047	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-65.9	125.8	-179.4	-64.1	0	0	0	0	111.8	W315 C328 Q330 Y358 Y382 D383	W315-C386 WeakPolarHBondContact CZ2-SG 3.23Å; C328-C386 HydrophobicContact CB-CB 3.82Å; C328-C386 WeakPolarHBondContact CB-SG 3.34Å; C328-C386 WeakPolarHBondContact SG-CB 3.35Å; C328-C386 CovalentContact SG-SG 2.03Å; C328-C386 PolarHBondContact SG-SG 2.85Å; Q330-C386 HydrophobicContact CG-CB 3.67Å; Y358-C386 HydrophobicContact CD1-CB 3.86Å; Y358-C386 VanDerWaalsContact CD1-SG 3.52Å; Y358-C386 HydrophobicContact CE1-CB 4.06Å; Y382-C386 PolarHBondContact O-SG 2.9Å; D383-C386 WeakPolarHBondContact O-CB 3.3Å; D383-C386 PolarHBondContact O-N 2.9Å; D383-C386 PolarHBondContact O-SG 2.95Å; D383-C386 VanDerWaalsContact O-SG 3.42Å
387	L	83	Confident	68.9	Low	90 Å²	90	69 Å²	69	47%	0.471	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	144.8	178.4	-66.2	173.3	0	0	0	110.4	C328 W329 Q330 Q385 N389	C328-L387 PolarHBondContact O-N 3.33Å; C328-L387 VanDerWaalsContact O-N 3.08Å; W329-L387 CarbonylContact C-O 3.51Å; W329-L387 VanDerWaalsContact CA-O 3.25Å; W329-L387 WeakPolarHBondContact CA-O 3.48Å; W329-L387 HydrophobicContact CE3-CB 3.55Å; W329-L387 HydrophobicContact CE3-CD1 4.42Å; W329-L387 HydrophobicContact CH2-CD1 3.98Å; W329-L387 HydrophobicContact CZ3-CB 3.51Å; W329-L387 HydrophobicContact CZ3-CD1 3.7Å; W329-L387 HydrophobicContact CZ3-CG 4.27Å; Q330-L387 PolarHBondContact N-O 2.7Å; Q385-L387 PolarHBondContact O-N 2.69Å; L387-N389 PolarHBondContact O-N 3.47Å
388	P	76.3	Confident	68.3	Low	81 Å²	81	68 Å²	68	53%	0.526	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	132	168.7	27.4	-33.7	0	0	0	109.2	Y332 P390	Y332-P388 HydrophobicContact CE2-CB 4.23Å; P388-P390 VanDerWaalsContact O-CD 3.31Å; P388-P390 WeakPolarHBondContact O-CD 3.36Å; P388-P390 VanDerWaalsContact O-N 3.07Å
389	N	68.3	Low	67.3	Low	15 Å²	15	63.3 Å²	63.3	8%	0.08	34%	0.344	C	S	.	.			trans	-58	114.6	-178.8	179.4	-16.6	0	0	0	110.4	W329 Q330 L387 N391	W329-N389 HydrophobicContact CB-CB 4.46Å; Q330-N389 WeakPolarHBondContact O-CB 3.35Å; L387-N389 PolarHBondContact O-N 3.47Å; N389-N391 VanDerWaalsContact C-N 3.29Å; N389-N391 PolarHBondContact O-N 2.9Å; N389-N391 PolarHBondContact OD1-N 3.5Å
390	P	53.3	Low	66.4	Low	82 Å²	82	66.9 Å²	66.9	53%	0.532	36%	0.359	S	S	.	.	S	Bend	trans	-76.9	-14	-164.4	30.2	-36.8	0	0	0	113.5	W329 P388	W329-P390 HydrophobicContact CE3-CG 4.48Å; W329-P390 HydrophobicContact CH2-CG 4.13Å; W329-P390 HydrophobicContact CZ3-CG 3.87Å; P388-P390 VanDerWaalsContact O-CD 3.31Å; P388-P390 WeakPolarHBondContact O-CD 3.36Å; P388-P390 VanDerWaalsContact O-N 3.07Å
391	N	51.5	Low	65.5	Low	73 Å²	73	66.1 Å²	66.1	39%	0.39	35%	0.354	S	S	.	.			trans	-145.1	90.2	176	-83.4	-65.2	0	0	0	110.6	N389 T393 N394 L395	N389-N391 VanDerWaalsContact C-N 3.29Å; N389-N391 PolarHBondContact O-N 2.9Å; N389-N391 PolarHBondContact OD1-N 3.5Å; N391-T393 PolarHBondContact O-N 3.05Å; N391-N394 HydrophobicContact CB-CB 3.82Å; N391-N394 PolarHBondContact O-N 2.8Å; N391-L395 PolarHBondContact O-N 2.68Å; N391-L395 VanDerWaalsContact O-N 3.1Å
392	Q	50.4	Low	64.7	Low	128 Å²	128	67 Å²	67	60%	0.598	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-20.1	168.3	-66.6	-174.1	-3.3	0	0	113.2	V396	Q392-V396 WeakPolarHBondContact O-CG2 3.23Å
393	T	40.8	Very low	63.9	Low	108 Å²	108	72.4 Å²	72.4	66%	0.663	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-32.4	179.1	47.1	0	0	0	0	114.5	N391	N391-T393 PolarHBondContact O-N 3.05Å
394	N	38.9	Very low	63.1	Low	104 Å²	104	80 Å²	80	56%	0.556	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-27.3	-171.8	-67.4	-32.8	0	0	0	114.4	N391 V396 S397	N391-N394 HydrophobicContact CB-CB 3.82Å; N391-N394 PolarHBondContact O-N 2.8Å; N394-V396 PolarHBondContact O-N 3.36Å; N394-S397 PolarHBondContact O-N 2.96Å; N394-S397 PolarHBondContact O-OG 3.27Å
395	L	44.5	Very low	62.2	Low	23 Å²	23	75.7 Å²	75.7	12%	0.12	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-7.6	169.7	-98.7	79.1	0	0	0	112.8	R307 M366 N391	R307-L395 PolarHBondContact NH2-O 3.06Å; M366-L395 HydrophobicContact CE-CD2 4.07Å; M366-L395 HydrophobicContact CE-CG 4.2Å; M366-L395 HydrophobicContact SD-CD2 4.19Å; N391-L395 PolarHBondContact O-N 2.68Å; N391-L395 VanDerWaalsContact O-N 3.1Å
396	V	50.4	Low	61.7	Low	37 Å²	37	76.3 Å²	76.3	22%	0.224	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	8.7	-178.2	179.2	0	0	0	0	111.1	W331 Q392 N394 D398 L399 L408	W331-V396 HydrophobicContact CH2-CG2 4.47Å; Q392-V396 WeakPolarHBondContact O-CG2 3.23Å; N394-V396 PolarHBondContact O-N 3.36Å; V396-D398 PolarHBondContact O-N 2.88Å; V396-L399 HydrophobicContact CG1-CB 4Å; V396-L399 WeakPolarHBondContact CG1-O 3.41Å; V396-L399 CarbonylContact O-C 3.58Å; V396-L399 PolarHBondContact O-N 2.9Å; V396-L408 HydrophobicContact CG1-CD2 4.41Å
397	S	48.9	Very low	61	Low	86 Å²	86	76.4 Å²	76.4	60%	0.601	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-31.6	174	58.4	0	0	0	0	113.6	N394	N394-S397 PolarHBondContact O-N 2.96Å; N394-S397 PolarHBondContact O-OG 3.27Å
398	D	54.5	Low	60.6	Low	25 Å²	25	72.6 Å²	72.6	13%	0.134	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	4.4	174.9	-31.3	-91.6	0	0	0	113.5	R306 R307 V396 S410 D411	R306-D398 IonicContact CZ-OD1 2.76Å; R306-D398 VanDerWaalsContact CZ-OD1 3.23Å; R306-D398 IonicContact CZ-OD2 3.56Å; R306-D398 IonicContact NH1-OD1 2.77Å; R306-D398 PolarHBondContact NH1-OD1 2.91Å; R306-D398 IonicContact NH1-OD2 2.73Å; R306-D398 VanDerWaalsContact NH2-CG 3.29Å; R306-D398 IonicContact NH2-OD1 2.63Å; R306-D398 PolarHBondContact NH2-OD1 3.27Å; R306-D398 IonicContact NH2-OD2 2.65Å; R306-D398 PolarHBondContact NH2-OD2 2.84Å; R307-D398 IonicContact CZ-OD2 3.67Å; R307-D398 VanDerWaalsContact CZ-OD2 3.3Å; R307-D398 IonicContact NH1-OD2 2.96Å; R307-D398 PolarHBondContact NH1-OD2 3.04Å; R307-D398 IonicContact NH2-OD2 2.6Å; R307-D398 PolarHBondContact NH2-OD2 3.46Å; V396-D398 PolarHBondContact O-N 2.88Å; D398-S410 CarbonylContact O-C 3.56Å; D398-S410 VanDerWaalsContact O-CA 3.31Å; D398-S410 WeakPolarHBondContact O-CA 3.36Å; D398-D411 PolarHBondContact O-N 3.13Å
399	L	60.4	Low	60.3	Low	5 Å²	5	71.8 Å²	71.8	3%	0.026	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	91	-171.1	-77.2	165.2	0	0	0	110.4	W309 W331 V396 Q409	W309-L399 HydrophobicContact CH2-CD1 4.33Å; W309-L399 HydrophobicContact CZ2-CD1 4.1Å; W331-L399 HydrophobicContact CH2-CD1 4.16Å; V396-L399 HydrophobicContact CG1-CB 4Å; V396-L399 WeakPolarHBondContact CG1-O 3.41Å; V396-L399 CarbonylContact O-C 3.58Å; V396-L399 PolarHBondContact O-N 2.9Å; L399-Q409 CarbonylContact C-O 3.46Å; L399-Q409 VanDerWaalsContact CA-O 3.3Å; L399-Q409 WeakPolarHBondContact CA-O 3.29Å
400	K	67.3	Low	60	Low	122 Å²	122	71.5 Å²	71.5	53%	0.53	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	138.2	178.3	-73.3	-167	172.8	76.1	0	111.2	N402 Q409 D411	K400-N402 PolarHBondContact O-N 3.18Å; K400-Q409 PolarHBondContact N-O 3.47Å; K400-Q409 PolarHBondContact O-N 3.4Å; K400-D411 WeakPolarHBondContact CD-OD1 3.11Å; K400-D411 IonicContact NZ-OD1 2.9Å; K400-D411 PolarHBondContact NZ-OD1 3.4Å; K400-D411 IonicContact NZ-OD2 3.5Å; K400-D411 PolarHBondContact NZ-OD2 2.82Å
401	M	69.7	Low	60	Low	41 Å²	41	70.8 Å²	70.8	20%	0.202	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	112.8	172.7	-172.3	67.7	-161.3	0	0	110.1	Y335 Y403 Q406 L408	Y335-M401 HydrophobicContact CD1-CE 3.59Å; Y335-M401 HydrophobicContact CD2-CE 3.75Å; Y335-M401 HydrophobicContact CD2-SD 3.74Å; Y335-M401 HydrophobicContact CE1-CE 3.81Å; Y335-M401 HydrophobicContact CE2-CE 3.95Å; Y335-M401 HydrophobicContact CE2-SD 4.16Å; Y335-M401 HydrophobicContact CG-CE 3.56Å; Y335-M401 HydrophobicContact CG-SD 3.98Å; M401-Y403 HydrophobicContact CB-CE1 4.41Å; M401-Y403 HydrophobicContact CB-CE2 4.17Å; M401-Y403 HydrophobicContact CG-CD1 4.05Å; M401-Y403 HydrophobicContact CG-CE1 3.91Å; M401-Y403 HydrophobicContact CG-CE2 4.38Å; M401-Y403 HydrophobicContact CG-CG 4.36Å; M401-Y403 VanDerWaalsContact O-CD2 3.31Å; M401-Y403 WeakPolarHBondContact O-CD2 3.22Å; M401-Y403 PolarHBondContact O-N 3.29Å; M401-Q406 VanDerWaalsContact CE-C 3.41Å; M401-L408 HydrophobicContact CB-CD2 4.24Å; M401-L408 HydrophobicContact SD-CD2 3.81Å; M401-L408 HydrophobicContact SD-CG 4.07Å
402	N	73	Confident	59.8	Low	36 Å²	36	73 Å²	73	19%	0.193	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	97.6	165.8	179.1	-8.8	0	0	0	108.5	K400 R404 D405 Q406 C407	K400-N402 PolarHBondContact O-N 3.18Å; N402-R404 VanDerWaalsContact C-N 3.25Å; N402-R404 PolarHBondContact O-N 2.96Å; N402-R404 WeakPolarHBondContact OD1-CB 3.15Å; N402-R404 PolarHBondContact OD1-N 3.21Å; N402-D405 PolarHBondContact ND2-OD2 3.39Å; N402-D405 PolarHBondContact O-N 2.82Å; N402-D405 PolarHBondContact OD1-N 2.82Å; N402-D405 PolarHBondContact OD1-OD2 2.94Å; N402-Q406 WeakPolarHBondContact O-CA 3.46Å; N402-Q406 PolarHBondContact O-N 3.4Å; N402-C407 PolarHBondContact N-O 2.88Å; N402-C407 PolarHBondContact O-N 2.88Å
403	Y	70	Confident	59.5	Low	197 Å²	197	70.2 Å²	70.2	77%	0.773	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-21.9	-179.6	-64.7	-81.9	0	0	0	114.3	M401	M401-Y403 HydrophobicContact CB-CE1 4.41Å; M401-Y403 HydrophobicContact CB-CE2 4.17Å; M401-Y403 HydrophobicContact CG-CD1 4.05Å; M401-Y403 HydrophobicContact CG-CE1 3.91Å; M401-Y403 HydrophobicContact CG-CE2 4.38Å; M401-Y403 HydrophobicContact CG-CG 4.36Å; M401-Y403 VanDerWaalsContact O-CD2 3.31Å; M401-Y403 WeakPolarHBondContact O-CD2 3.22Å; M401-Y403 PolarHBondContact O-N 3.29Å
404	R	67.4	Low	59.2	Low	185 Å²	185	73.3 Å²	73.3	70%	0.698	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-47.4	178.8	-176.1	-171.5	-175.3	176.6	-0.5	110.8	N402	N402-R404 VanDerWaalsContact C-N 3.25Å; N402-R404 PolarHBondContact O-N 2.96Å; N402-R404 WeakPolarHBondContact OD1-CB 3.15Å; N402-R404 PolarHBondContact OD1-N 3.21Å
405	D	65.6	Low	58.9	Low	34 Å²	34	72.9 Å²	72.9	18%	0.182	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	5.4	-171	-54.2	-51.4	0	0	0	112.3	L350 N402 C407	L350-D405 HydrophobicContact CD1-CB 3.82Å; N402-D405 PolarHBondContact ND2-OD2 3.39Å; N402-D405 PolarHBondContact O-N 2.82Å; N402-D405 PolarHBondContact OD1-N 2.82Å; N402-D405 PolarHBondContact OD1-OD2 2.94Å; D405-C407 VanDerWaalsContact C-N 3.28Å; D405-C407 PolarHBondContact O-N 3.03Å
406	Q	73.5	Confident	58.3	Low	123 Å²	123	78 Å²	78	58%	0.575	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	38.5	178.5	-57.1	-170.6	16.5	0	0	114.3	Y335 P336 M401 N402	Y335-Q406 HydrophobicContact CD1-CB 4.5Å; Y335-Q406 VanDerWaalsContact CD1-O 3.3Å; Y335-Q406 WeakPolarHBondContact CD1-O 3.15Å; P336-Q406 WeakPolarHBondContact CD-O 3.33Å; M401-Q406 VanDerWaalsContact CE-C 3.41Å; N402-Q406 WeakPolarHBondContact O-CA 3.46Å; N402-Q406 PolarHBondContact O-N 3.4Å
407	C	74.1	Confident	57.1	Low	9 Å²	9	86.6 Å²	86.6	6%	0.061	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	166	-174.7	62.6	0	0	0	0	112.4	P336 C338 N402 D405	P336-C407 HydrophobicContact CG-CB 3.96Å; P336-C407 CarbonylContact O-C 3.43Å; P336-C407 VanDerWaalsContact O-CA 3.32Å; P336-C407 WeakPolarHBondContact O-CA 3.46Å; C338-C407 WeakPolarHBondContact CA-SG 3.27Å; C338-C407 HydrophobicContact CB-CB 3.93Å; C338-C407 WeakPolarHBondContact CB-SG 3.32Å; C338-C407 WeakPolarHBondContact SG-CB 3.28Å; C338-C407 PolarHBondContact SG-O 2.85Å; C338-C407 CovalentContact SG-SG 2.03Å; C338-C407 PolarHBondContact SG-SG 2.82Å; N402-C407 PolarHBondContact N-O 2.88Å; N402-C407 PolarHBondContact O-N 2.88Å; D405-C407 VanDerWaalsContact C-N 3.28Å; D405-C407 PolarHBondContact O-N 3.03Å
408	L	73.3	Confident	56	Low	11 Å²	11	88.7 Å²	88.7	6%	0.058	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.2	176.9	-71	162	0	0	0	110.5	W331 S333 P336 I337 C338 V396 M401	W331-L408 HydrophobicContact CH2-CD1 4.2Å; W331-L408 HydrophobicContact CZ2-CD1 3.7Å; S333-L408 WeakPolarHBondContact OG-CD1 3.27Å; P336-L408 PolarHBondContact O-N 3.33Å; I337-L408 CarbonylContact C-O 3.59Å; I337-L408 WeakPolarHBondContact CA-O 3.28Å; C338-L408 PolarHBondContact N-O 3.07Å; C338-L408 VanDerWaalsContact SG-C 3.5Å; V396-L408 HydrophobicContact CG1-CD2 4.41Å; M401-L408 HydrophobicContact CB-CD2 4.24Å; M401-L408 HydrophobicContact SD-CD2 3.81Å; M401-L408 HydrophobicContact SD-CG 4.07Å
409	Q	70.3	Confident	54.7	Low	63 Å²	63	95.6 Å²	95.6	29%	0.294	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.9	-177.7	-177.5	172.7	-6.7	0	0	110.9	C338 L399 K400 D413	C338-Q409 HydrophobicContact CB-CB 4.07Å; L399-Q409 CarbonylContact C-O 3.46Å; L399-Q409 VanDerWaalsContact CA-O 3.3Å; L399-Q409 WeakPolarHBondContact CA-O 3.29Å; K400-Q409 PolarHBondContact N-O 3.47Å; K400-Q409 PolarHBondContact O-N 3.4Å; Q409-D413 PolarHBondContact NE2-O 3.18Å
410	S	62.9	Low	53	Low	9 Å²	9	103.6 Å²	103.6	6%	0.063	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	137.8	174.7	-163	0	0	0	0	111.1	D398 N412 D413	D398-S410 CarbonylContact O-C 3.56Å; D398-S410 VanDerWaalsContact O-CA 3.31Å; D398-S410 WeakPolarHBondContact O-CA 3.36Å; S410-N412 PolarHBondContact O-N 2.83Å; S410-D413 WeakPolarHBondContact CB-OD2 3.48Å; S410-D413 WeakPolarHBondContact O-CA 3.35Å; S410-D413 WeakPolarHBondContact O-CB 3.48Å; S410-D413 PolarHBondContact O-N 3.18Å
411	D	53.2	Low	51.1	Low	68 Å²	68	103.6 Å²	103.6	36%	0.364	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-19.4	177	-116	-3.3	0	0	0	112.9	D398 K400	D398-D411 PolarHBondContact O-N 3.13Å; K400-D411 WeakPolarHBondContact CD-OD1 3.11Å; K400-D411 IonicContact NZ-OD1 2.9Å; K400-D411 PolarHBondContact NZ-OD1 3.4Å; K400-D411 IonicContact NZ-OD2 3.5Å; K400-D411 PolarHBondContact NZ-OD2 2.82Å
412	N	46.3	Very low	49	Very low	118 Å²	118	105.9 Å²	105.9	63%	0.631	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-29.2	169.7	-74.2	-4.3	0	0	0	111.7	S410 K414	S410-N412 PolarHBondContact O-N 2.83Å; N412-K414 PolarHBondContact O-N 3.07Å
413	D	45.4	Very low	46.7	Very low	71 Å²	71	114 Å²	114	38%	0.38	56%	0.557	S	S	.	*			trans	-80.8	60.2	178.1	-63.9	-38.4	0	0	0	111	Q409 S410 P415	Q409-D413 PolarHBondContact NE2-O 3.18Å; S410-D413 WeakPolarHBondContact CB-OD2 3.48Å; S410-D413 WeakPolarHBondContact O-CA 3.35Å; S410-D413 WeakPolarHBondContact O-CB 3.48Å; S410-D413 PolarHBondContact O-N 3.18Å; D413-P415 WeakPolarHBondContact O-CD 3.47Å
414	K	34.3	Very low	44.6	Very low	173 Å²	173	110.4 Å²	110.4	75%	0.752	56%	0.556	S	S	*	*			trans	-59.7	118.5	152.5	-75	-177.6	179.3	175	0	106.3	N412 V416	N412-K414 PolarHBondContact O-N 3.07Å; K414-V416 PolarHBondContact O-N 3.39Å
415	P	32.1	Very low	42.6	Very low	95 Å²	95	107.7 Å²	107.7	62%	0.617	56%	0.56	S	S	*	*			trans	-58.8	122	179.4	24.1	-33	0	0	0	108.1	D413 R417	D413-P415 WeakPolarHBondContact O-CD 3.47Å; P415-R417 VanDerWaalsContact C-N 3.34Å; P415-R417 PolarHBondContact O-N 2.97Å
416	V	31.1	Very low	40.8	Very low	129 Å²	129	114 Å²	114	78%	0.782	59%	0.593	S	S	*	*			trans	-60.7	103.1	169.8	177.3	0	0	0	0	105.4	K414 D418	K414-V416 PolarHBondContact O-N 3.39Å; V416-D418 PolarHBondContact O-N 3.38Å; V416-D418 VanDerWaalsContact O-N 3.13Å
417	R	26.2	Very low	38.5	Very low	218 Å²	218	116.2 Å²	116.2	82%	0.823	60%	0.603	S	S	*	*			trans	-56.7	122.1	171.1	-78.2	-171.9	176.4	-169.6	-0.4	106.7	P415 I419	P415-R417 VanDerWaalsContact C-N 3.34Å; P415-R417 PolarHBondContact O-N 2.97Å; R417-I419 PolarHBondContact O-N 3.28Å
418	D	24.9	Very low	36.3	Very low	131 Å²	131	124.6 Å²	124.6	70%	0.701	64%	0.642	S	S	*	*			trans	-49.7	130.1	174.8	-70.6	-68.4	0	0	0	109.8	V416 Q420	V416-D418 PolarHBondContact O-N 3.38Å; V416-D418 VanDerWaalsContact O-N 3.13Å; D418-Q420 PolarHBondContact O-N 2.98Å
419	I	28.6	Very low	34	Very low	170 Å²	170	130.6 Å²	130.6	87%	0.872	68%	0.679	S	S	*	*	S	Bend	trans	-78.9	55.4	174.6	-50.3	-178	0	0	0	108.1	R417	R417-I419 PolarHBondContact O-N 3.28Å
420	Q	24.9	Very low	32.2	Very low	172 Å²	172	133.5 Å²	133.5	80%	0.804	70%	0.701	S	S	*	*			trans	-134.7	31.9	172.7	-70.4	-160.3	-11.7	0	0	110.7	D418 S422	D418-Q420 PolarHBondContact O-N 2.98Å; Q420-S422 PolarHBondContact O-N 3.24Å; Q420-S422 VanDerWaalsContact O-N 3.12Å
421	T	26.8	Very low	30.6	Very low	123 Å²	123	141.6 Å²	141.6	76%	0.755	74%	0.738	S	S	*	*			trans	-79.8	79	152.2	-26.1	0	0	0	0	108.3
422	S	26.3	Very low	29.2	Very low	88 Å²	88	146.8 Å²	146.8	62%	0.615	76%	0.762	S	S	*	*			trans	-53.4	147.9	162	43.2	0	0	0	0	109.5	Q420 T424	Q420-S422 PolarHBondContact O-N 3.24Å; Q420-S422 VanDerWaalsContact O-N 3.12Å; S422-T424 VanDerWaalsContact C-N 3.29Å; S422-T424 PolarHBondContact O-N 2.78Å; S422-T424 PolarHBondContact O-OG1 3.14Å
423	K	24	Very low	28.2	Very low	206 Å²	206	152.2 Å²	152.2	90%	0.896	77%	0.774	S	S	*	*			trans	-70	79.8	-176.8	-71.7	-179.1	176.4	177.2	0	111.8	T425	K423-T425 PolarHBondContact O-N 2.87Å
424	T	25.8	Very low	27.2	Very low	123 Å²	123	155.1 Å²	155.1	76%	0.755	79%	0.794	S	S	*	*			trans	-85	88.2	159.9	15.5	0	0	0	0	109.2	S422 L426	S422-T424 VanDerWaalsContact C-N 3.29Å; S422-T424 PolarHBondContact O-N 2.78Å; S422-T424 PolarHBondContact O-OG1 3.14Å; T424-L426 VanDerWaalsContact C-N 3.26Å; T424-L426 PolarHBondContact O-N 3.27Å
425	T	24.7	Very low	27.1	Very low	128 Å²	128	152.9 Å²	152.9	79%	0.785	80%	0.795	S	S	*	*			trans	-67.8	80.7	173.2	-33.4	0	0	0	0	110	K423	K423-T425 PolarHBondContact O-N 2.87Å
426	L	28.3	Very low	26.8	Very low	166 Å²	166	155.5 Å²	155.5	87%	0.869	81%	0.81	S	S	*	*			trans	-83.1	118.2	170.1	-162.9	71.7	0	0	0	109.1	T424 Q428	T424-L426 VanDerWaalsContact C-N 3.26Å; T424-L426 PolarHBondContact O-N 3.27Å; L426-Q428 PolarHBondContact O-N 2.95Å
427	Q	24.5	Very low	26.7	Very low	169 Å²	169	153.7 Å²	153.7	79%	0.79	81%	0.808	S	S	*	*			trans	-69.7	126.3	179.6	-65.3	169.2	-28.6	0	0	110.6
428	Q	29	Very low	26.6	Very low	186 Å²	186	148.6 Å²	148.6	87%	0.869	81%	0.806	S	S	*	*			trans	-132.1	99	147	-88.6	-169.3	-24.9	0	0	109.1	L426 T430	L426-Q428 PolarHBondContact O-N 2.95Å; Q428-T430 PolarHBondContact O-N 2.85Å
429	T	25	Very low	26.8	Very low	136 Å²	136	147.8 Å²	147.8	83%	0.834	81%	0.806	S	S	*	*			trans	-79	107.8	170.5	-54.2	0	0	0	0	108.6
430	T	31.1	Very low	26.7	Very low	125 Å²	125	146 Å²	146	77%	0.767	80%	0.803	S	S	*	*			trans	-139.4	148.9	161.2	-28.2	0	0	0	0	109.5	Q428	Q428-T430 PolarHBondContact O-N 2.85Å
431	E	30.1	Very low	27	Very low	179 Å²	179	145.6 Å²	145.6	84%	0.836	80%	0.804	S	S	*	*			trans	-77.1	167.7	-151	-66.6	159.7	97.6	0	0	116.8
432	M	23.9	Very low	27	Very low	177 Å²	177	147.1 Å²	147.1	87%	0.872	81%	0.805	S	S	*	*			trans	-51.2	141.6	164.7	-58.6	166.9	-80.9	0	0	112.2
433	R	25.5	Very low	27.3	Very low	231 Å²	231	147.5 Å²	147.5	87%	0.872	81%	0.805	S	S	*	*				-161	122.1	108.6	-154.6	162.3	-175.3	152.4	0.3	112.8
434	T	24.4	Very low	27.5	Very low	132 Å²	132	142.8 Å²	142.8	81%	0.81	79%	0.794	S	S	*	*			trans	-83.1	133.6	161.7	27.6	0	0	0	0	110.4
435	T	31.8	Very low	27.6	Very low	126 Å²	126	143.3 Å²	143.3	77%	0.773	80%	0.797	S	S	*	*			trans	-167.2	110.3	138.2	19.1	0	0	0	0	111.3
436	T	25.6	Very low	27.8	Very low	151 Å²	151	144.1 Å²	144.1	93%	0.926	80%	0.795	S	S	*	*			trans	-86	113	156.6	42.8	0	0	0	0	109.2
437	A	30	Very low	27.9	Very low	91 Å²	91	143.7 Å²	143.7	75%	0.752	79%	0.794	S	S	*	*			trans	-141.6	107.9	167	0	0	0	0	0	109.8
438	S	24	Very low	28	Very low	111 Å²	111	142.2 Å²	142.2	78%	0.776	80%	0.796	S	S	*	*			trans	-73.7	161.6	153.8	44.2	0	0	0	0	108.3
439	V	29.4	Very low	28.3	Very low	114 Å²	114	137.9 Å²	137.9	69%	0.691	79%	0.792	S	S	*	*				-167.3	141.9	59.6	163.4	0	0	0	0	109.6
440	T	26.2	Very low	28.4	Very low	132 Å²	132	137.3 Å²	137.3	81%	0.81	79%	0.789	S	S	*	*			trans	61.7	160.3	171.4	51.2	0	0	0	0	117
441	I	30.7	Very low	28.4	Very low	163 Å²	163	137.8 Å²	137.8	84%	0.836	79%	0.792	S	S	*	*			cis	-126.4	153.6	12.8	-66.5	171	0	0	0	111.3
442	M	25.8	Very low	28.3	Very low	155 Å²	155	134.9 Å²	134.9	76%	0.764	79%	0.786	S	S	*	*			trans	-116.2	165.9	169.9	-131.4	-152.6	138.8	0	0	107.9
443	P	34.1	Very low	28.7	Very low	96 Å²	96	133 Å²	133	62%	0.623	78%	0.78	S	S	*	*			cis	-149.5	177.1	17.9	41.5	-18.8	0	0	0	119.6
444	T	26.9	Very low	28.8	Very low	108 Å²	108	127.8 Å²	127.8	66%	0.663	78%	0.778	S	S	*	*			trans	50	114.1	145.9	50.4	0	0	0	0	123.7
445	T	28.7	Very low	29.4	Very low	133 Å²	133	127 Å²	127	82%	0.816	77%	0.774	S	S	*	*				-148.4	115.4	123.8	12.5	0	0	0	0	107.3
446	I	27.8	Very low	29.8	Very low	146 Å²	146	126.7 Å²	126.7	75%	0.749	77%	0.773	S	S	*	*				40.5	107.2	92.6	-53.9	178.2	0	0	0	113
447	N	31.6	Very low	30	Very low	157 Å²	157	130.7 Å²	130.7	84%	0.84	77%	0.772	S	S	*	*			trans	-159.5	135.9	136.6	-108.9	-30.5	0	0	0	111.1
448	T	27	Very low	30.1	Very low	137 Å²	137	132.5 Å²	132.5	84%	0.84	77%	0.774	S	S	*	*			trans	-139.1	109.3	171.3	-50.4	0	0	0	0	107.1
449	A	34.4	Very low	30.4	Very low	95 Å²	95	131.4 Å²	131.4	79%	0.785	77%	0.766	S	S	*	*			trans	-133.3	129.5	-177.7	0	0	0	0	0	109.9
450	T	26.9	Very low	30.5	Very low	125 Å²	125	133.3 Å²	133.3	77%	0.767	77%	0.771	S	S	*	*			trans	-121.6	102	-176.1	49.9	0	0	0	0	111.6
451	T	31.3	Very low	30.8	Very low	134 Å²	134	132.5 Å²	132.5	82%	0.822	77%	0.766	S	S	*	*			trans	-152.4	110.8	158.7	29.4	0	0	0	0	106.7
452	V	29.2	Very low	30.6	Very low	119 Å²	119	130 Å²	130	72%	0.721	76%	0.759	S	S	*	*				91.3	130.1	53.6	169.8	0	0	0	0	112.1
453	N	31.1	Very low	30.8	Very low	138 Å²	138	128 Å²	128	74%	0.738	76%	0.756	S	S	*	*			trans	73.2	91.1	171.1	-65.8	-8.3	0	0	0	120.1
454	S	28	Very low	30.5	Very low	121 Å²	121	128.7 Å²	128.7	85%	0.846	76%	0.758	S	S	*	*			trans	-134.2	116	130.1	58.5	0	0	0	0	109.7
455	T	35.9	Very low	30.6	Very low	116 Å²	116	130.6 Å²	130.6	71%	0.712	76%	0.763	S	S	*	*			trans	-156.3	163.2	-170.2	54.4	0	0	0	0	109.6
456	P	42	Very low	30.5	Very low	118 Å²	118	130.9 Å²	130.9	77%	0.766	76%	0.764	S	S	*	*				-136.7	-172.7	-83.4	33.8	-11.2	0	0	0	113.6
457	R	30.1	Very low	30.7	Very low	236 Å²	236	130 Å²	130	89%	0.891	77%	0.766	S	S	*	*			trans	-130.6	148.3	149.8	-93.1	179	166.3	166.8	-5.1	107.5
458	T	30	Very low	31	Very low	129 Å²	129	128.1 Å²	128.1	79%	0.791	76%	0.763	S	S	*	*			cis	-129.3	161.2	25.3	-56.2	0	0	0	0	113.6
459	S	31.9	Very low	31	Very low	88 Å²	88	128.3 Å²	128.3	62%	0.615	76%	0.758	S	S	*	*			trans	-48.7	146.5	178.6	-6.2	0	0	0	0	115.1
460	L	30.1	Very low	30.8	Very low	154 Å²	154	132.9 Å²	132.9	81%	0.806	77%	0.765	S	S	*	*				58.9	139.3	77.2	-63.8	145.6	0	0	0	113
461	T	32.6	Very low	30.8	Very low	114 Å²	114	131.6 Å²	131.6	70%	0.699	76%	0.757	S	S	*	*			cis	-153.4	143.3	27.9	-20.5	0	0	0	0	108.4
462	T	28.2	Very low	30.9	Very low	110 Å²	110	130.5 Å²	130.5	68%	0.675	76%	0.761	S	S	*	*				33.6	134.8	96.2	-4.8	0	0	0	0	114.3
463	T	29.5	Very low	30.8	Very low	115 Å²	115	129.6 Å²	129.6	71%	0.706	76%	0.76	S	S	*	*			cis	-163.1	167.4	39.2	-30.3	0	0	0	0	113.4
464	T	27.7	Very low	31	Very low	110 Å²	110	132.3 Å²	132.3	68%	0.675	77%	0.766	S	S	*	*			trans	-8.2	142.5	163	46	0	0	0	0	124.5
465	I	27.8	Very low	31.1	Very low	148 Å²	148	134.8 Å²	134.8	76%	0.759	76%	0.764	S	S	*	*			trans	65.1	103.8	137.4	-57	160.7	0	0	0	118.6
466	T	28.3	Very low	30.8	Very low	138 Å²	138	134.2 Å²	134.2	85%	0.847	76%	0.764	S	S	*	*				-168	159.2	108.5	2.6	0	0	0	0	112.4
467	T	31.6	Very low	30.2	Very low	129 Å²	129	133 Å²	133	79%	0.791	76%	0.759	S	S	*	*			trans	-129.2	166.1	167	31.3	0	0	0	0	108.2
468	P	38.2	Very low	30.4	Very low	117 Å²	117	129.7 Å²	129.7	76%	0.76	76%	0.757	S	S	*	*			cis	-132.5	-160.8	-12.3	33.2	-11.3	0	0	0	112.8
469	L	25.4	Very low	30.4	Very low	141 Å²	141	127.7 Å²	127.7	74%	0.738	75%	0.753	S	S	*	*			trans	77.1	104	144.6	-162	74.5	0	0	0	119	T471	L469-T471 HydrophobicContact CD1-CG2 3.97Å; L469-T471 HydrophobicContact CD2-CG2 4.07Å; L469-T471 HydrophobicContact CG-CG2 3.99Å
470	M	30.4	Very low	30.7	Very low	190 Å²	190	129 Å²	129	94%	0.936	76%	0.76	S	S	*	*			trans	-114	123.2	145.5	-102.6	-83.5	168.5	0	0	108
471	T	28.3	Very low	30.6	Very low	99 Å²	99	129.3 Å²	129.3	61%	0.607	76%	0.761	S	S	*	*			trans	-84.6	126.3	-176.6	44.4	0	0	0	0	112.2	L469	L469-T471 HydrophobicContact CD1-CG2 3.97Å; L469-T471 HydrophobicContact CD2-CG2 4.07Å; L469-T471 HydrophobicContact CG-CG2 3.99Å
472	A	32.3	Very low	30.5	Very low	110 Å²	110	129.1 Å²	129.1	91%	0.909	77%	0.765	S	S	*	*			trans	-112.5	76.7	159.8	0	0	0	0	0	109.3
473	S	28.2	Very low	30.6	Very low	100 Å²	100	129.5 Å²	129.5	70%	0.699	77%	0.767	S	S	*	*			trans	-103.6	121.4	-178.4	57.7	0	0	0	0	112.3
474	K	33.9	Very low	30.6	Very low	195 Å²	195	130.6 Å²	130.6	85%	0.848	77%	0.774	S	S	*	*			trans	-133.1	125	149.6	-90.9	-169.6	172.5	-177.2	0	109.8
475	H	30.8	Very low	30.7	Very low	174 Å²	174	130.9 Å²	130.9	81%	0.806	78%	0.78	S	S	*	*			trans	57.2	89.3	168.4	-64	-60.5	0	0	0	119.4
476	S	30	Very low	30.6	Very low	103 Å²	103	129.2 Å²	129.2	72%	0.72	78%	0.777	S	S	*	*				-20.7	156.5	115.1	-8.2	0	0	0	0	115.2
477	S	27.8	Very low	30.7	Very low	94 Å²	94	132.5 Å²	132.5	66%	0.657	78%	0.78	S	S	*	*			cis	174.7	177.3	-5.2	43.2	0	0	0	0	108.4
478	I	34.3	Very low	30.6	Very low	166 Å²	166	131.2 Å²	131.2	85%	0.851	77%	0.772	S	S	*	*			trans	74.7	140.9	170.9	-52.1	161.5	0	0	0	112.5
479	A	31.1	Very low	30	Very low	86 Å²	86	131.1 Å²	131.1	71%	0.711	77%	0.77	S	S	*	*			cis	-160.4	172.2	-24.1	0	0	0	0	0	108
480	P	38.4	Very low	30.1	Very low	117 Å²	117	131.3 Å²	131.3	76%	0.76	78%	0.777	S	S	*	*			trans	-103.3	173.7	-161	39.4	-36.3	0	0	0	117.2
481	L	27.1	Very low	30	Very low	159 Å²	159	128.2 Å²	128.2	83%	0.832	77%	0.769	S	S	*	*			trans	83.7	112.8	154.3	-117.8	75.2	0	0	0	120.6
482	S	30.2	Very low	30.2	Very low	110 Å²	110	130.2 Å²	130.2	77%	0.769	78%	0.781	S	S	*	*			trans	-173.7	118.6	140.1	-76.4	0	0	0	0	107.4
483	T	31	Very low	30	Very low	119 Å²	119	131.4 Å²	131.4	73%	0.73	78%	0.777	S	S	*	*				56.1	92.1	72	61.6	0	0	0	0	116.3
484	T	29.4	Very low	30.2	Very low	138 Å²	138	134.7 Å²	134.7	85%	0.847	78%	0.781	S	S	*	*				52.4	106.8	128.2	-38.9	0	0	0	0	120.2
485	S	30.7	Very low	30	Very low	116 Å²	116	131.1 Å²	131.1	81%	0.811	77%	0.772	S	S	*	*			trans	-156.5	142.4	133.3	60.3	0	0	0	0	113.5
486	T	26.1	Very low	29.9	Very low	113 Å²	113	131.6 Å²	131.6	69%	0.693	77%	0.772	S	S	*	*			trans	-67.3	151	176.6	-31.8	0	0	0	0	112.4
487	F	30.1	Very low	29.9	Very low	206 Å²	206	132 Å²	132	90%	0.904	77%	0.77	S	S	*	*			trans	-141.2	162.2	143.8	-110	-78.5	0	0	0	111
488	T	28.5	Very low	29.7	Very low	102 Å²	102	134.6 Å²	134.6	63%	0.626	78%	0.776	S	S	*	*			trans	-132.9	145.6	-148.1	-26	0	0	0	0	112.5
489	T	25.5	Very low	29.4	Very low	115 Å²	115	134.3 Å²	134.3	71%	0.706	78%	0.776	S	S	*	*			trans	37.7	116	153.6	46.6	0	0	0	0	119.9
490	T	28.7	Very low	29.1	Very low	146 Å²	146	138.1 Å²	138.1	90%	0.896	78%	0.782	S	S	*	*			trans	-113.1	116.5	139	45.1	0	0	0	0	109.4
491	T	27.7	Very low	28.8	Very low	125 Å²	125	139.3 Å²	139.3	77%	0.767	78%	0.781	S	S	*	*			trans	-105.1	115.5	172.8	48.3	0	0	0	0	110.1
492	T	31.5	Very low	28.9	Very low	141 Å²	141	139.9 Å²	139.9	87%	0.865	78%	0.776	S	S	*	*			trans	-131.5	121.6	159.3	39.5	0	0	0	0	109
493	T	28.8	Very low	28.7	Very low	135 Å²	135	141.2 Å²	141.2	83%	0.828	78%	0.78	S	S	*	*			trans	-79.2	136.3	170.5	44.9	0	0	0	0	109.9
494	E	31.9	Very low	28.6	Very low	168 Å²	168	142.1 Å²	142.1	79%	0.785	78%	0.78	S	S	*	*				-168.1	147.6	119.1	-104.2	-161.3	144.8	0	0	114.5
495	N	30.9	Very low	28.4	Very low	120 Å²	120	142.4 Å²	142.4	64%	0.642	78%	0.782	S	S	*	*			trans	42.2	98.8	146.6	-60.5	-40.1	0	0	0	122.7
496	K	28.7	Very low	28.4	Very low	185 Å²	185	141.9 Å²	141.9	80%	0.804	78%	0.778	S	S	*	*				77.3	143.6	107.5	-153	178.6	-174	-177.3	0	120.4
497	T	28.4	Very low	28.7	Very low	111 Å²	111	142 Å²	142	68%	0.681	78%	0.779	S	S	*	*			trans	67.8	104.2	164.5	26.1	0	0	0	0	119.1
498	D	24.4	Very low	28.8	Very low	148 Å²	148	139 Å²	139	79%	0.791	77%	0.772	S	S	*	*				34.2	118	130	-48.7	-27.8	0	0	0	120.2
499	L	28.3	Very low	28.8	Very low	161 Å²	161	139 Å²	139	84%	0.843	78%	0.777	S	S	*	*			trans	-141.6	119.2	140.1	-151.3	79.5	0	0	0	112.1
500	I	25.6	Very low	29.1	Very low	165 Å²	165	140.2 Å²	140.2	85%	0.846	78%	0.778	S	S	*	*			trans	-82.2	129.8	169.4	-65.3	169.3	0	0	0	108.3
501	I	31.5	Very low	29.2	Very low	143 Å²	143	139.6 Å²	139.6	73%	0.733	77%	0.769	S	S	*	*			trans	-101.8	103.8	174.4	-63.2	-177	0	0	0	110.8
502	K	28.2	Very low	29.2	Very low	170 Å²	170	138 Å²	138	74%	0.739	76%	0.764	S	S	*	*			trans	42.5	101.6	149.3	-61.6	-177	177.8	-179.4	0	118.4
503	V	27.5	Very low	29.2	Very low	138 Å²	138	137 Å²	137	84%	0.836	76%	0.757	S	S	*	*				-85.3	138.9	127.9	177.3	0	0	0	0	107
504	N	27.5	Very low	29.3	Very low	139 Å²	139	139.9 Å²	139.9	74%	0.743	76%	0.758	S	S	*	*			trans	-85.7	129.6	178.5	-70	-21.7	0	0	0	111
505	T	27	Very low	29.1	Very low	143 Å²	143	141.1 Å²	141.1	88%	0.877	76%	0.761	S	S	*	*			trans	-132	141.9	160.4	39.1	0	0	0	0	109.2
506	S	30.1	Very low	29.2	Very low	105 Å²	105	143 Å²	143	73%	0.734	77%	0.766	S	S	*	*			trans	-108.4	137.8	-175.8	52.9	0	0	0	0	112.5
507	T	31.5	Very low	29.2	Very low	117 Å²	117	142.7 Å²	142.7	72%	0.718	77%	0.765	S	S	*	*			trans	68.1	122.6	153.2	50.2	0	0	0	0	120.5
508	N	33.8	Very low	29.1	Very low	141 Å²	141	142.5 Å²	142.5	75%	0.754	77%	0.768	S	S	*	*			trans	76	115	153.2	-48.5	-10.4	0	0	0	116.1
509	S	27.9	Very low	29.2	Very low	103 Å²	103	144.1 Å²	144.1	72%	0.72	77%	0.771	S	S	*	*			cis	76.7	139.4	42.2	86.8	0	0	0	0	113.5
510	L	31.8	Very low	29.2	Very low	141 Å²	141	142.2 Å²	142.2	74%	0.738	77%	0.766	S	S	*	*			cis	-159.6	154.2	15.8	-162.8	76.6	0	0	0	111.1
511	N	31.2	Very low	29.2	Very low	133 Å²	133	142.6 Å²	142.6	71%	0.711	76%	0.764	S	S	*	*			trans	62.4	124	162.9	-67.9	-9.4	0	0	0	118.7
512	S	27.5	Very low	29	Very low	92 Å²	92	141 Å²	141	64%	0.643	77%	0.766	S	S	*	*				75	131.8	59.5	81.5	0	0	0	0	114.2
513	T	30.1	Very low	29	Very low	120 Å²	120	140.2 Å²	140.2	74%	0.736	77%	0.768	S	S	*	*			cis	-166.5	160.5	19.4	-14.4	0	0	0	0	114.1
514	K	32	Very low	29.1	Very low	195 Å²	195	140.2 Å²	140.2	85%	0.848	76%	0.763	S	S	*	*			trans	76.8	136.7	157.7	-66.6	173.5	-179.4	174	0	120.5
515	K	28.2	Very low	29	Very low	193 Å²	193	140.6 Å²	140.6	84%	0.839	77%	0.765	S	S	*	*			trans	8.2	147.3	153.2	-56.2	-176.5	175.8	-172.6	0	119.3
516	E	32.1	Very low	29	Very low	160 Å²	160	140.6 Å²	140.6	75%	0.748	76%	0.758	S	S	*	*			cis	-154.4	173.6	33.5	-163.3	150.9	-156.4	0	0	115
517	K	28.4	Very low	28.8	Very low	179 Å²	179	142 Å²	142	78%	0.778	76%	0.758	S	S	*	*			trans	0.9	133.3	174.1	-76.1	177.4	174.5	176.2	0	123.2
518	S	26.9	Very low	28.7	Very low	106 Å²	106	143.1 Å²	143.1	74%	0.741	77%	0.765	S	S	*	*			trans	81.6	124.2	132.6	59.2	0	0	0	0	123.5
519	Q	26.6	Very low	28.5	Very low	183 Å²	183	141.5 Å²	141.5	86%	0.855	76%	0.764	S	S	*	*			trans	84.9	149.7	149.2	-75	-177.6	-17.6	0	0	121.6
520	T	27.2	Very low	28.5	Very low	120 Å²	120	145.7 Å²	145.7	74%	0.736	77%	0.77	S	S	*	*			trans	64.8	102.5	166.6	40.6	0	0	0	0	121.4
521	E	26.1	Very low	28.4	Very low	174 Å²	174	146.8 Å²	146.8	81%	0.813	77%	0.774	S	S	*	*				82.2	139.3	126.6	-64.7	-173.7	161	0	0	123.9
522	S	27.2	Very low	28.2	Very low	110 Å²	110	149.9 Å²	149.9	77%	0.769	78%	0.778	S	S	*	*			trans	66.9	146.6	166.5	81.4	0	0	0	0	116.5
523	L	28.8	Very low	28.6	Very low	152 Å²	152	150.8 Å²	150.8	80%	0.796	78%	0.781	S	S	*	*			cis	-116.4	166.3	-13.9	-75.3	91.6	0	0	0	107.1
524	L	29.9	Very low	28.5	Very low	138 Å²	138	151.6 Å²	151.6	72%	0.723	79%	0.786	S	S	*	*			cis	-160.7	123.9	42.9	-159.6	118.8	0	0	0	110.4	I526	L524-I526 HydrophobicContact CD2-CD1 3.98Å; L524-I526 HydrophobicContact CD2-CG1 3.88Å
525	N	24.8	Very low	28.5	Very low	148 Å²	148	149 Å²	149	79%	0.791	78%	0.782	S	S	*	*			trans	-115.8	110.5	-178.8	-137.9	-5.4	0	0	0	108.7
526	I	27.3	Very low	28.8	Very low	142 Å²	142	146.5 Å²	146.5	73%	0.728	78%	0.777	S	S	*	*			trans	-96.8	92.6	173.2	-59.8	178.2	0	0	0	107.8	L524	L524-I526 HydrophobicContact CD2-CD1 3.98Å; L524-I526 HydrophobicContact CD2-CG1 3.88Å
527	N	26.4	Very low	28.4	Very low	135 Å²	135	144.2 Å²	144.2	72%	0.722	78%	0.778	S	S	*	*			trans	-137.3	101.6	171.5	-106.1	-25.4	0	0	0	109.1	S529	N527-S529 PolarHBondContact O-N 3.33Å; N527-S529 VanDerWaalsContact O-N 3.12Å
528	T	28.5	Very low	28.6	Very low	141 Å²	141	145.4 Å²	145.4	87%	0.865	78%	0.784	S	S	*	*			trans	-80	86.2	172.8	49.7	0	0	0	0	109.9
529	S	29.1	Very low	28.6	Very low	107 Å²	107	146.8 Å²	146.8	75%	0.748	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-72.7	149	168.3	48.5	0	0	0	0	111.1	N527	N527-S529 PolarHBondContact O-N 3.33Å; N527-S529 VanDerWaalsContact O-N 3.12Å
530	K	28	Very low	28.7	Very low	191 Å²	191	146.8 Å²	146.8	83%	0.83	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-79.6	141.1	173.6	-66.2	178	-179.3	176.1	0	109.7
531	I	29.2	Very low	28.9	Very low	164 Å²	164	146.2 Å²	146.2	84%	0.841	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-83.7	119.3	171	-60	173.4	0	0	0	109.2
532	Y	28.8	Very low	29	Very low	198 Å²	198	145.4 Å²	145.4	78%	0.776	79%	0.785	S	S	*	*			trans	-132.4	133.5	150.3	-77.7	-79	0	0	0	106.8
533	P	35.3	Very low	29.2	Very low	111 Å²	111	148.6 Å²	148.6	72%	0.721	79%	0.792	S	S	*	*			trans	-77.8	131.9	177.9	30.9	-32.5	0	0	0	110.5
534	T	28.4	Very low	29.2	Very low	137 Å²	137	152.8 Å²	152.8	84%	0.84	80%	0.797	S	S	*	*			trans	-119.1	102.1	171.3	-52.7	0	0	0	0	107.9
535	D	32.3	Very low	29.1	Very low	141 Å²	141	151.3 Å²	151.3	75%	0.754	80%	0.798	S	S	*	*			trans	-101.1	119.2	177.5	-86.3	-49.2	0	0	0	112.3
536	L	32.9	Very low	29.7	Very low	140 Å²	140	149.3 Å²	149.3	73%	0.733	79%	0.793	S	S	*	*			trans	28.8	116.3	157.4	-73.5	74.3	0	0	0	119.8
537	S	25	Very low	29.8	Very low	111 Å²	111	149.1 Å²	149.1	78%	0.776	79%	0.793	S	S	*	*			trans	-69.8	140.7	145.8	56.8	0	0	0	0	111.6
538	F	31.5	Very low	30.1	Very low	204 Å²	204	150.5 Å²	150.5	90%	0.895	80%	0.795	S	S	*	*			trans	-140.9	155.3	148.3	-116.5	-83.5	0	0	0	110.4
539	N	27.5	Very low	30.3	Very low	136 Å²	136	151.1 Å²	151.1	73%	0.727	79%	0.786	S	S	*	*			trans	-125.2	143.6	-163.9	-144.6	-7.8	0	0	0	110.4
540	Q	28.9	Very low	30.2	Very low	183 Å²	183	153 Å²	153	86%	0.855	78%	0.783	S	S	*	*			trans	66.4	155.9	173	-57.1	168.9	-18.5	0	0	115
541	S	31.2	Very low	30.5	Very low	107 Å²	107	149.4 Å²	149.4	75%	0.748	78%	0.777	S	S	*	*			cis	-139.5	164.3	9.7	57.4	0	0	0	0	113.2
542	N	27.4	Very low	30.5	Very low	158 Å²	158	146.6 Å²	146.6	85%	0.845	77%	0.768	S	S	*	*			trans	-81.8	141.1	163.1	-64.9	-34.9	0	0	0	109.9
543	I	32	Very low	30.5	Very low	177 Å²	177	145.8 Å²	145.8	91%	0.908	77%	0.769	S	S	*	*			trans	-161.1	153	144.6	-105.7	153.5	0	0	0	109.2
544	W	28.7	Very low	30.2	Very low	240 Å²	240	147.2 Å²	147.2	91%	0.909	77%	0.769	S	S	*	*			trans	-133.6	113.6	-161.8	174	10	0	0	0	110.7
545	S	29	Very low	30.4	Very low	107 Å²	107	146.7 Å²	146.7	75%	0.748	76%	0.761	S	S	*	*			trans	162.8	153.9	139.4	-77.4	0	0	0	0	113.2
546	P	36.7	Very low	30.4	Very low	105 Å²	105	146.6 Å²	146.6	68%	0.682	76%	0.757	S	S	*	*			trans	-107	165	-177.6	40.5	-34.2	0	0	0	114
547	N	28.6	Very low	30.4	Very low	138 Å²	138	148.1 Å²	148.1	74%	0.738	76%	0.757	S	S	*	*				176.4	162.4	124.1	-92.2	-27	0	0	0	113.6
548	H	33.8	Very low	30.8	Very low	165 Å²	165	146.9 Å²	146.9	76%	0.764	75%	0.749	S	S	*	*			trans	66.6	113.6	175.1	-53.6	-70.8	0	0	0	115.4
549	K	32.1	Very low	30.8	Very low	154 Å²	154	145.5 Å²	145.5	67%	0.67	75%	0.75	S	S	*	*				92.4	117.4	55.2	-91.2	-173.6	162.3	-77.7	0	112.5
550	E	27.6	Very low	31.1	Very low	146 Å²	146	147.6 Å²	147.6	68%	0.682	75%	0.754	S	S	*	*				55.4	130.3	128.8	-68.4	162.3	-177.6	0	0	118.8
551	T	33.2	Very low	31.2	Very low	115 Å²	115	144.5 Å²	144.5	71%	0.706	74%	0.743	S	S	*	*			cis	-155.4	161.1	22.7	50.8	0	0	0	0	115.6
552	T	29.5	Very low	31	Very low	105 Å²	105	149.3 Å²	149.3	64%	0.644	75%	0.75	S	S	*	*			trans	75.1	142.5	135.8	45.8	0	0	0	0	125.7
553	F	29.4	Very low	31.1	Very low	182 Å²	182	148.1 Å²	148.1	80%	0.798	75%	0.749	S	S	*	*			trans	48.8	115.7	155.4	-60.8	-63.9	0	0	0	119.4
554	L	28.7	Very low	30.9	Very low	140 Å²	140	147.1 Å²	147.1	73%	0.733	74%	0.744	S	S	*	*			cis	87.5	95.3	48.6	-168.5	166.6	0	0	0	112.8
555	D	32.5	Very low	30.9	Very low	126 Å²	126	140.5 Å²	140.5	67%	0.674	73%	0.731	S	S	*	*				-160	160.8	123.4	-136.8	-15.4	0	0	0	115.3
556	Q	32.4	Very low	31.1	Very low	140 Å²	140	143 Å²	143	65%	0.654	74%	0.735	S	S	*	*			trans	-10.7	158.4	159.3	-78.7	166.2	78.1	0	0	121
557	K	33	Very low	30.7	Very low	172 Å²	172	144 Å²	144	75%	0.748	73%	0.733	S	S	*	*			cis	-153.9	133.9	26.2	-141.4	165.2	-173.9	169.8	0	115.6
558	S	33	Very low	30.9	Very low	85 Å²	85	145.3 Å²	145.3	59%	0.594	74%	0.739	S	S	*	*			trans	19.6	128.1	149.9	67	0	0	0	0	122.1
559	N	30.8	Very low	30.7	Very low	174 Å²	174	143 Å²	143	93%	0.93	73%	0.733	S	S	*	*			trans	-133	113.4	131.8	-107.2	-31.3	0	0	0	109.7
560	F	33.9	Very low	30.7	Very low	181 Å²	181	145.2 Å²	145.2	79%	0.794	75%	0.745	S	S	*	*			trans	-142.6	152.9	-173.6	-105.7	-38.3	0	0	0	105.6
561	N	31	Very low	30.8	Very low	118 Å²	118	144.1 Å²	144.1	63%	0.631	74%	0.744	S	S	*	*			cis	-162.8	143.4	5.7	-153.6	-21.3	0	0	0	109.6
562	K	28.6	Very low	30.6	Very low	208 Å²	208	145.3 Å²	145.3	90%	0.904	75%	0.746	S	S	*	*			trans	178.5	87.9	139.2	-107.3	-178.5	176.6	179	0	113.8
563	T	29.4	Very low	30.7	Very low	132 Å²	132	148.1 Å²	148.1	81%	0.81	76%	0.757	S	S	*	*			trans	-142.5	141.6	147.1	-11.4	0	0	0	0	109.5	P565	T563-P565 WeakPolarHBondContact O-CD 3.11Å
564	I	28	Very low	31.1	Very low	157 Å²	157	146.2 Å²	146.2	81%	0.805	75%	0.753	S	S	*	*			trans	-72.1	124.4	-162.9	-61.9	155.8	0	0	0	111.8	I566	I564-I566 HydrophobicContact CG2-CG1 4.27Å
565	P	28.6	Very low	31.4	Very low	100 Å²	100	148.3 Å²	148.3	65%	0.649	76%	0.756	S	S	*	*			trans	-92.5	127	159.1	33.9	-26.8	0	0	0	110.1	T563	T563-P565 WeakPolarHBondContact O-CD 3.11Å
566	I	32.3	Very low	31.6	Very low	161 Å²	161	150 Å²	150	83%	0.826	77%	0.765	S	S	*	*			trans	-92.5	106.1	162.3	-63.9	179.6	0	0	0	107	I564	I564-I566 HydrophobicContact CG2-CG1 4.27Å
567	I	28.4	Very low	32	Very low	124 Å²	124	145.8 Å²	145.8	64%	0.636	76%	0.759	S	S	*	*			trans	-85.3	133.6	170.9	-63.1	169.4	0	0	0	108.1	N569	I567-N569 WeakPolarHBondContact CG2-OD1 3.28Å
568	L	33.3	Very low	32.7	Very low	167 Å²	167	142.7 Å²	142.7	87%	0.874	75%	0.75	S	S	*	*			trans	-146.2	118	144.4	-135.2	137.9	0	0	0	108.9
569	N	29.9	Very low	33.8	Very low	117 Å²	117	143.3 Å²	143.3	63%	0.626	75%	0.754	S	S	*	*			trans	-71.7	138	-173.4	-61.5	-5.5	0	0	0	110.5	I567	I567-N569 WeakPolarHBondContact CG2-OD1 3.28Å
570	Q	31.3	Very low	35	Very low	200 Å²	200	139.6 Å²	139.6	94%	0.935	74%	0.738	S	S	*	*			trans	-146.6	77.1	147.7	-146.5	164.5	13.2	0	0	109.9
571	D	28.7	Very low	36.3	Very low	122 Å²	122	137.3 Å²	137.3	65%	0.652	73%	0.73	S	S	*	*			trans	-67.1	147.2	174.6	-76.4	-60.4	0	0	0	112.1
572	N	29.8	Very low	38	Very low	141 Å²	141	140.2 Å²	140.2	75%	0.754	73%	0.733	S	S	*	*	S	Bend	trans	53.3	68.3	148.4	-58.8	-30.6	0	0	0	118.2
573	L	31.5	Very low	39.8	Very low	164 Å²	164	135.6 Å²	135.6	86%	0.859	72%	0.718	S	S	*	*	S	Bend	trans	-153.9	152	134.9	-134.4	71.1	0	0	0	111.1
574	I	38.3	Very low	42.1	Very low	141 Å²	141	132.9 Å²	132.9	72%	0.723	70%	0.701	S	S	*	*			trans	59.3	62.2	177.7	-37.4	178.4	0	0	0	114.5
575	K	34.4	Very low	44.5	Very low	185 Å²	185	128.4 Å²	128.4	80%	0.804	68%	0.684	S	S	*	*			trans	-87.4	163.1	136.7	-90.4	-177.5	176.2	174.7	0	109.2
576	D	37.7	Very low	47	Very low	160 Å²	160	125.4 Å²	125.4	86%	0.856	67%	0.671	S	S	*	*	S	Bend	trans	65.6	106.5	169.6	-49.9	-30	0	0	0	116.2
577	G	40.8	Very low	49.4	Very low	52 Å²	52	122.7 Å²	122.7	54%	0.536	66%	0.658	S	S	.	*	S	Bend	trans	155.6	-50.8	172.5	0	0	0	0	0	113.9
578	I	46.7	Very low	52.1	Low	107 Å²	107	121.8 Å²	121.8	55%	0.549	65%	0.653	S	S	.	*	S	Bend	trans	-92.4	-22.3	-160.9	-61.2	174.8	0	0	0	114.1	T580 Y582	I578-T580 PolarHBondContact O-N 3.32Å; I578-Y582 HydrophobicContact CG2-CD2 3.77Å; I578-Y582 HydrophobicContact CG2-CE2 3.61Å; I578-Y582 WeakPolarHBondContact O-CD2 3.24Å
579	S	57.2	Low	54.7	Low	98 Å²	98	119.6 Å²	119.6	69%	0.685	64%	0.642	S	S	*	*	H	α-helix	trans	-64	-37.7	-174.1	-172.7	0	0	0	0	113.8	L583	S579-L583 WeakPolarHBondContact O-CB 3.48Å; S579-L583 PolarHBondContact O-N 3.45Å
580	T	56.4	Low	57.5	Low	96 Å²	96	118.5 Å²	118.5	59%	0.589	64%	0.635	S	S	*	*	H	α-helix	trans	-74.3	-38.3	-173.3	39.3	0	0	0	0	113.3	I578 L583 T584	I578-T580 PolarHBondContact O-N 3.32Å; T580-L583 PolarHBondContact O-N 2.88Å; T580-T584 WeakPolarHBondContact O-CG2 3.4Å; T580-T584 PolarHBondContact O-N 2.85Å; T580-T584 PolarHBondContact O-OG1 3Å; T580-T584 VanDerWaalsContact O-OG1 3.09Å
581	E	60	Low	60.1	Low	133 Å²	133	111.1 Å²	111.1	62%	0.621	61%	0.609	S	S	*	*	H	α-helix	trans	-71	-37	-176	-62.9	-166.3	146	0	0	113.2	T584 S585	E581-T584 PolarHBondContact O-OG1 3.45Å; E581-T584 VanDerWaalsContact O-OG1 3.14Å; E581-S585 WeakPolarHBondContact O-CB 3.33Å; E581-S585 PolarHBondContact O-N 2.6Å; E581-S585 PolarHBondContact O-OG 2.83Å
582	Y	66.1	Low	63.1	Low	179 Å²	179	109.5 Å²	109.5	70%	0.702	60%	0.599	S	S	*	*	H	α-helix	trans	-70.2	-33.3	172.7	-76	-73.7	0	0	0	112.1	I578 G586	I578-Y582 HydrophobicContact CG2-CD2 3.77Å; I578-Y582 HydrophobicContact CG2-CE2 3.61Å; I578-Y582 WeakPolarHBondContact O-CD2 3.24Å; Y582-G586 PolarHBondContact O-N 3.09Å
583	L	68	Low	66	Low	112 Å²	112	107.1 Å²	107.1	59%	0.586	59%	0.586	S	S	*	*	H	α-helix	trans	-73.8	-40.4	178.6	-162.4	152.6	0	0	0	111.8	S579 T580 G586 L587	S579-L583 WeakPolarHBondContact O-CB 3.48Å; S579-L583 PolarHBondContact O-N 3.45Å; T580-L583 PolarHBondContact O-N 2.88Å; L583-G586 PolarHBondContact O-N 2.79Å; L583-L587 HydrophobicContact CD2-CD1 3.81Å; L583-L587 HydrophobicContact CD2-CG 4.43Å; L583-L587 WeakPolarHBondContact O-CG 3.37Å; L583-L587 PolarHBondContact O-N 2.91Å
584	T	76.2	Confident	68.8	Low	74 Å²	74	103.1 Å²	103.1	45%	0.454	57%	0.565	S	S	.	*	H	α-helix	trans	-67.7	-41.7	171.6	53.9	0	0	0	0	111.8	T580 E581 G586 L587 I588	T580-T584 WeakPolarHBondContact O-CG2 3.4Å; T580-T584 PolarHBondContact O-N 2.85Å; T580-T584 PolarHBondContact O-OG1 3Å; T580-T584 VanDerWaalsContact O-OG1 3.09Å; E581-T584 PolarHBondContact O-OG1 3.45Å; E581-T584 VanDerWaalsContact O-OG1 3.14Å; T584-G586 VanDerWaalsContact C-N 3.32Å; T584-G586 PolarHBondContact O-N 3.21Å; T584-L587 PolarHBondContact O-N 2.6Å; T584-I588 VanDerWaalsContact O-CG1 3.27Å; T584-I588 WeakPolarHBondContact O-CG1 3.28Å; T584-I588 PolarHBondContact O-N 3.16Å
585	S	78.1	Confident	71.3	Confident	63 Å²	63	101 Å²	101	44%	0.441	55%	0.554	S	S	.	*	H	α-helix	trans	-59.9	-42.4	174	-62.6	0	0	0	0	111.8	E581 I588 L589	E581-S585 WeakPolarHBondContact O-CB 3.33Å; E581-S585 PolarHBondContact O-N 2.6Å; E581-S585 PolarHBondContact O-OG 2.83Å; S585-I588 PolarHBondContact O-N 2.74Å; S585-L589 WeakPolarHBondContact O-CB 3.49Å; S585-L589 PolarHBondContact O-N 3.34Å
586	G	81.7	Confident	74.1	Confident	38 Å²	38	96.3 Å²	96.3	39%	0.392	54%	0.538	S	S	.	.	H	α-helix	trans	-62.2	-43	174.6	0	0	0	0	0	113.1	Y582 L583 T584 L589 L590	Y582-G586 PolarHBondContact O-N 3.09Å; L583-G586 PolarHBondContact O-N 2.79Å; T584-G586 VanDerWaalsContact C-N 3.32Å; T584-G586 PolarHBondContact O-N 3.21Å; G586-L589 PolarHBondContact O-N 2.92Å; G586-L590 WeakPolarHBondContact O-CB 3.29Å; G586-L590 PolarHBondContact O-N 3.21Å
587	L	83.5	Confident	76.5	Confident	104 Å²	104	93.5 Å²	93.5	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-64.1	-39.5	174	-79.2	169.8	0	0	0	112.6	L583 T584 L590 A591	L583-L587 HydrophobicContact CD2-CD1 3.81Å; L583-L587 HydrophobicContact CD2-CG 4.43Å; L583-L587 WeakPolarHBondContact O-CG 3.37Å; L583-L587 PolarHBondContact O-N 2.91Å; T584-L587 PolarHBondContact O-N 2.6Å; L587-L590 PolarHBondContact O-N 3.18Å; L587-A591 WeakPolarHBondContact O-CB 3.42Å; L587-A591 PolarHBondContact O-N 3.48Å
588	I	85.6	Confident	79	Confident	104 Å²	104	95.8 Å²	95.8	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-64.3	-45.3	175.6	-69.9	162.8	0	0	0	110.4	T584 S585 L590 A591 I592	T584-I588 VanDerWaalsContact O-CG1 3.27Å; T584-I588 WeakPolarHBondContact O-CG1 3.28Å; T584-I588 PolarHBondContact O-N 3.16Å; S585-I588 PolarHBondContact O-N 2.74Å; I588-L590 PolarHBondContact O-N 3.14Å; I588-A591 PolarHBondContact O-N 3.12Å; I588-I592 HydrophobicContact CG2-CD1 3.84Å; I588-I592 VanDerWaalsContact O-CG1 3.3Å; I588-I592 WeakPolarHBondContact O-CG1 3.48Å; I588-I592 PolarHBondContact O-N 3.45Å
589	L	86.8	Confident	81.1	Confident	121 Å²	121	94.7 Å²	94.7	63%	0.634	52%	0.515	S	S	*	.	H	α-helix	trans	-62.4	-41.6	176.5	-117.6	159.6	0	0	0	112.1	S585 G586 I592 L593	S585-L589 WeakPolarHBondContact O-CB 3.49Å; S585-L589 PolarHBondContact O-N 3.34Å; G586-L589 PolarHBondContact O-N 2.92Å; L589-I592 PolarHBondContact O-N 3.33Å; L589-L593 WeakPolarHBondContact O-CB 3.25Å; L589-L593 PolarHBondContact O-N 2.83Å
590	L	87.9	Confident	82.6	Confident	94 Å²	94	93.3 Å²	93.3	49%	0.492	51%	0.505	S	S	.	.	H	α-helix	trans	-66.4	-38.5	175.9	-170.6	68.8	0	0	0	112.1	G586 L587 I588 L593 N594	G586-L590 WeakPolarHBondContact O-CB 3.29Å; G586-L590 PolarHBondContact O-N 3.21Å; L587-L590 PolarHBondContact O-N 3.18Å; I588-L590 PolarHBondContact O-N 3.14Å; L590-L593 PolarHBondContact O-N 3.43Å; L590-N594 WeakPolarHBondContact O-CB 3.45Å; L590-N594 PolarHBondContact O-N 3.5Å; L590-N594 PolarHBondContact O-ND2 3.17Å
591	A	87.5	Confident	84.3	Confident	46 Å²	46	95.4 Å²	95.4	38%	0.38	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-44.1	174.5	0	0	0	0	0	111.8	L587 I588 N594 I595	L587-A591 WeakPolarHBondContact O-CB 3.42Å; L587-A591 PolarHBondContact O-N 3.48Å; I588-A591 PolarHBondContact O-N 3.12Å; A591-N594 PolarHBondContact O-N 3.29Å; A591-I595 VanDerWaalsContact O-CG1 3.29Å; A591-I595 WeakPolarHBondContact O-CG1 3.47Å; A591-I595 PolarHBondContact O-N 2.86Å
592	I	90.8	Very high	85.9	Confident	87 Å²	87	93.3 Å²	93.3	45%	0.446	50%	0.498	S	S	.	.	H	α-helix	trans	-61.2	-44.7	174.6	-69.1	165.2	0	0	0	110.6	I588 L589 N594 I595 I596	I588-I592 HydrophobicContact CG2-CD1 3.84Å; I588-I592 VanDerWaalsContact O-CG1 3.3Å; I588-I592 WeakPolarHBondContact O-CG1 3.48Å; I588-I592 PolarHBondContact O-N 3.45Å; L589-I592 PolarHBondContact O-N 3.33Å; I592-N594 PolarHBondContact O-N 2.91Å; I592-I595 PolarHBondContact O-N 3.22Å; I592-I596 HydrophobicContact CG2-CD1 3.84Å; I592-I596 WeakPolarHBondContact O-CG1 3.4Å; I592-I596 PolarHBondContact O-N 3.43Å
593	L	90.6	Very high	87.1	Confident	92 Å²	92	89.8 Å²	89.8	48%	0.482	49%	0.49	S	S	.	.	H	α-helix	trans	-59.6	-45.5	176.9	-168.9	76.3	0	0	0	111.7	L589 L590 I596 L597	L589-L593 WeakPolarHBondContact O-CB 3.25Å; L589-L593 PolarHBondContact O-N 2.83Å; L590-L593 PolarHBondContact O-N 3.43Å; L593-I596 PolarHBondContact O-N 2.84Å; L593-L597 HydrophobicContact CG-CD1 4.41Å; L593-L597 WeakPolarHBondContact O-CG 3.29Å; L593-L597 PolarHBondContact O-N 3.12Å
594	N	90.7	Very high	88.1	Confident	79 Å²	79	89 Å²	89	42%	0.422	49%	0.486	S	S	.	.	H	α-helix	trans	-64.5	-39.7	176.5	-79.1	-34.6	0	0	0	112.5	L590 A591 I592 L597 I598	L590-N594 WeakPolarHBondContact O-CB 3.45Å; L590-N594 PolarHBondContact O-N 3.5Å; L590-N594 PolarHBondContact O-ND2 3.17Å; A591-N594 PolarHBondContact O-N 3.29Å; I592-N594 PolarHBondContact O-N 2.91Å; N594-L597 PolarHBondContact O-N 2.68Å; N594-I598 WeakPolarHBondContact O-CB 3.38Å; N594-I598 WeakPolarHBondContact O-CD1 3.38Å; N594-I598 VanDerWaalsContact O-CG1 3.25Å; N594-I598 WeakPolarHBondContact O-CG1 3.1Å; N594-I598 PolarHBondContact O-N 3.15Å
595	I	90.9	Very high	88.8	Confident	96 Å²	96	88.5 Å²	88.5	49%	0.492	48%	0.483	S	S	.	.	H	α-helix	trans	-61.8	-43.6	174.2	-71.1	164.1	0	0	0	110.7	A591 I592 I598 I599	A591-I595 VanDerWaalsContact O-CG1 3.29Å; A591-I595 WeakPolarHBondContact O-CG1 3.47Å; A591-I595 PolarHBondContact O-N 2.86Å; I592-I595 PolarHBondContact O-N 3.22Å; I595-I598 PolarHBondContact O-N 2.96Å; I595-I599 HydrophobicContact CG2-CD1 3.77Å; I595-I599 HydrophobicContact CG2-CG1 4.5Å; I595-I599 WeakPolarHBondContact O-CB 3.1Å; I595-I599 VanDerWaalsContact O-CG1 3.28Å; I595-I599 WeakPolarHBondContact O-CG1 3.43Å; I595-I599 PolarHBondContact O-N 2.92Å
596	I	92.1	Very high	89.3	Confident	88 Å²	88	90.5 Å²	90.5	45%	0.451	49%	0.488	S	S	.	.	H	α-helix	trans	-62.2	-44.3	175.8	-68.7	166	0	0	0	110.8	I592 L593 I598 I599 C600	I592-I596 HydrophobicContact CG2-CD1 3.84Å; I592-I596 WeakPolarHBondContact O-CG1 3.4Å; I592-I596 PolarHBondContact O-N 3.43Å; L593-I596 PolarHBondContact O-N 2.84Å; I596-I598 PolarHBondContact O-N 3.37Å; I596-I599 PolarHBondContact O-N 2.77Å; I596-C600 WeakPolarHBondContact O-CB 3.48Å; I596-C600 PolarHBondContact O-N 3.37Å; I596-C600 PolarHBondContact O-SG 3.32Å
597	L	89.4	Confident	89.5	Confident	100 Å²	100	95.8 Å²	95.8	52%	0.524	50%	0.496	S	S	.	.	H	α-helix	trans	-62.7	-41	176.7	-72.8	170.1	0	0	0	112.4	L593 N594 C600 F601	L593-L597 HydrophobicContact CG-CD1 4.41Å; L593-L597 WeakPolarHBondContact O-CG 3.29Å; L593-L597 PolarHBondContact O-N 3.12Å; N594-L597 PolarHBondContact O-N 2.68Å; L597-C600 PolarHBondContact O-N 2.86Å; L597-F601 WeakPolarHBondContact O-CB 3.47Å; L597-F601 PolarHBondContact O-N 2.8Å
598	I	92	Very high	89.6	Confident	100 Å²	100	94.4 Å²	94.4	51%	0.513	49%	0.489	S	S	.	.	H	α-helix	trans	-64.8	-43.2	175.5	-70.3	163.8	0	0	0	110.9	N594 I595 I596 F601 I602	N594-I598 WeakPolarHBondContact O-CB 3.38Å; N594-I598 WeakPolarHBondContact O-CD1 3.38Å; N594-I598 VanDerWaalsContact O-CG1 3.25Å; N594-I598 WeakPolarHBondContact O-CG1 3.1Å; N594-I598 PolarHBondContact O-N 3.15Å; I595-I598 PolarHBondContact O-N 2.96Å; I596-I598 PolarHBondContact O-N 3.37Å; I598-F601 PolarHBondContact O-N 3.32Å; I598-I602 HydrophobicContact CG2-CD1 3.78Å; I598-I602 HydrophobicContact CG2-CG1 4.46Å; I598-I602 VanDerWaalsContact O-CG1 3.29Å; I598-I602 WeakPolarHBondContact O-CG1 3.47Å; I598-I602 PolarHBondContact O-N 2.81Å
599	I	92.1	Very high	89.5	Confident	85 Å²	85	98.3 Å²	98.3	44%	0.436	50%	0.497	S	S	.	.	H	α-helix	trans	-61.9	-46	175.4	-70.7	166.3	0	0	0	110.6	I595 I596 F601 I602 I603	I595-I599 HydrophobicContact CG2-CD1 3.77Å; I595-I599 HydrophobicContact CG2-CG1 4.5Å; I595-I599 WeakPolarHBondContact O-CB 3.1Å; I595-I599 VanDerWaalsContact O-CG1 3.28Å; I595-I599 WeakPolarHBondContact O-CG1 3.43Å; I595-I599 PolarHBondContact O-N 2.92Å; I596-I599 PolarHBondContact O-N 2.77Å; I599-F601 VanDerWaalsContact C-N 3.34Å; I599-F601 PolarHBondContact O-N 3.44Å; I599-I602 PolarHBondContact O-N 3.46Å; I599-I603 HydrophobicContact CG2-CD1 3.75Å; I599-I603 HydrophobicContact CG2-CG1 4.47Å; I599-I603 WeakPolarHBondContact O-CB 3.41Å; I599-I603 VanDerWaalsContact O-CG1 3.28Å; I599-I603 WeakPolarHBondContact O-CG1 3.46Å; I599-I603 PolarHBondContact O-N 2.89Å
600	C	89.1	Confident	89.2	Confident	69 Å²	69	102.1 Å²	102.1	47%	0.466	50%	0.503	S	S	.	.	H	α-helix	trans	-59.6	-42	174.9	-74.1	0	0	0	0	112.2	I596 L597 I603 L604	I596-C600 WeakPolarHBondContact O-CB 3.48Å; I596-C600 PolarHBondContact O-N 3.37Å; I596-C600 PolarHBondContact O-SG 3.32Å; L597-C600 PolarHBondContact O-N 2.86Å; C600-I603 PolarHBondContact O-N 3.48Å; C600-L604 VanDerWaalsContact O-CB 3.27Å; C600-L604 WeakPolarHBondContact O-CB 3.1Å; C600-L604 PolarHBondContact O-N 2.87Å
601	F	92.2	Very high	88.6	Confident	140 Å²	140	104.6 Å²	104.6	61%	0.614	51%	0.505	S	S	*	.	H	α-helix	trans	-64.5	-44.4	176	-176.2	-100.6	0	0	0	112	L597 I598 I599 I603 L604 V605	L597-F601 WeakPolarHBondContact O-CB 3.47Å; L597-F601 PolarHBondContact O-N 2.8Å; I598-F601 PolarHBondContact O-N 3.32Å; I599-F601 VanDerWaalsContact C-N 3.34Å; I599-F601 PolarHBondContact O-N 3.44Å; F601-I603 PolarHBondContact O-N 3.43Å; F601-L604 PolarHBondContact O-N 3.27Å; F601-V605 HydrophobicContact CD1-CG2 4.13Å; F601-V605 HydrophobicContact CE1-CG2 3.75Å; F601-V605 HydrophobicContact CE2-CG2 4.21Å; F601-V605 HydrophobicContact CZ-CG2 3.8Å; F601-V605 WeakPolarHBondContact O-CB 3.47Å; F601-V605 WeakPolarHBondContact O-CG2 3.33Å; F601-V605 PolarHBondContact O-N 3.5Å
602	I	91.9	Very high	88	Confident	88 Å²	88	107.5 Å²	107.5	45%	0.451	51%	0.514	S	S	.	.	H	α-helix	trans	-61	-45	175.5	-69.8	165.6	0	0	0	110.7	I598 I599 L604 V605 L606	I598-I602 HydrophobicContact CG2-CD1 3.78Å; I598-I602 HydrophobicContact CG2-CG1 4.46Å; I598-I602 VanDerWaalsContact O-CG1 3.29Å; I598-I602 WeakPolarHBondContact O-CG1 3.47Å; I598-I602 PolarHBondContact O-N 2.81Å; I599-I602 PolarHBondContact O-N 3.46Å; I602-L604 VanDerWaalsContact C-N 3.33Å; I602-L604 PolarHBondContact O-N 3.4Å; I602-V605 PolarHBondContact O-N 2.94Å; I602-L606 HydrophobicContact CG2-CD1 3.86Å; I602-L606 HydrophobicContact CG2-CG 4.37Å; I602-L606 WeakPolarHBondContact O-CB 3.35Å; I602-L606 VanDerWaalsContact O-CG 3.24Å; I602-L606 WeakPolarHBondContact O-CG 3.36Å; I602-L606 PolarHBondContact O-N 3.31Å
603	I	91.6	Very high	86.9	Confident	105 Å²	105	110.4 Å²	110.4	54%	0.538	52%	0.523	S	S	.	.	H	α-helix	trans	-60.7	-42.9	175.8	-70.1	167.3	0	0	0	110.8	I599 C600 F601 L606 W607	I599-I603 HydrophobicContact CG2-CD1 3.75Å; I599-I603 HydrophobicContact CG2-CG1 4.47Å; I599-I603 WeakPolarHBondContact O-CB 3.41Å; I599-I603 VanDerWaalsContact O-CG1 3.28Å; I599-I603 WeakPolarHBondContact O-CG1 3.46Å; I599-I603 PolarHBondContact O-N 2.89Å; C600-I603 PolarHBondContact O-N 3.48Å; F601-I603 PolarHBondContact O-N 3.43Å; I603-L606 PolarHBondContact O-N 3.3Å; I603-W607 VanDerWaalsContact O-CB 3.28Å; I603-W607 WeakPolarHBondContact O-CB 3.45Å; I603-W607 PolarHBondContact O-N 3.44Å
604	L	89.8	Confident	85.5	Confident	95 Å²	95	109.6 Å²	109.6	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-67	-43.9	179.8	-166.7	157.6	0	0	0	111.6	C600 F601 I602 W607 I608	C600-L604 VanDerWaalsContact O-CB 3.27Å; C600-L604 WeakPolarHBondContact O-CB 3.1Å; C600-L604 PolarHBondContact O-N 2.87Å; F601-L604 PolarHBondContact O-N 3.27Å; I602-L604 VanDerWaalsContact C-N 3.33Å; I602-L604 PolarHBondContact O-N 3.4Å; L604-W607 PolarHBondContact O-N 3.32Å; L604-I608 HydrophobicContact CD2-CD1 3.55Å; L604-I608 HydrophobicContact CD2-CG1 4.21Å; L604-I608 WeakPolarHBondContact O-CG1 3.1Å; L604-I608 PolarHBondContact O-N 2.88Å
605	V	90.5	Very high	83.6	Confident	65 Å²	65	110.5 Å²	110.5	39%	0.394	53%	0.527	S	S	.	.	H	α-helix	trans	-63.5	-43.2	174.2	170.2	0	0	0	0	111.3	F601 I602 W607 I608 R609	F601-V605 HydrophobicContact CD1-CG2 4.13Å; F601-V605 HydrophobicContact CE1-CG2 3.75Å; F601-V605 HydrophobicContact CE2-CG2 4.21Å; F601-V605 HydrophobicContact CZ-CG2 3.8Å; F601-V605 WeakPolarHBondContact O-CB 3.47Å; F601-V605 WeakPolarHBondContact O-CG2 3.33Å; F601-V605 PolarHBondContact O-N 3.5Å; I602-V605 PolarHBondContact O-N 2.94Å; V605-W607 VanDerWaalsContact C-N 3.34Å; V605-W607 PolarHBondContact O-N 3.49Å; V605-I608 PolarHBondContact O-N 2.93Å; V605-R609 VanDerWaalsContact O-CB 3.28Å; V605-R609 WeakPolarHBondContact O-CB 3.3Å; V605-R609 PolarHBondContact O-N 3.3Å
606	L	87.7	Confident	81.6	Confident	104 Å²	104	109 Å²	109	55%	0.545	52%	0.524	S	S	.	.	H	α-helix	trans	-63.8	-38.9	174.5	-73.5	172.9	0	0	0	111.8	I602 I603 R609 R610	I602-L606 HydrophobicContact CG2-CD1 3.86Å; I602-L606 HydrophobicContact CG2-CG 4.37Å; I602-L606 WeakPolarHBondContact O-CB 3.35Å; I602-L606 VanDerWaalsContact O-CG 3.24Å; I602-L606 WeakPolarHBondContact O-CG 3.36Å; I602-L606 PolarHBondContact O-N 3.31Å; I603-L606 PolarHBondContact O-N 3.3Å; L606-R609 PolarHBondContact O-N 2.92Å; L606-R610 VanDerWaalsContact O-CB 3.23Å; L606-R610 WeakPolarHBondContact O-CB 3.16Å; L606-R610 PolarHBondContact O-N 2.91Å
607	W	87.1	Confident	79.3	Confident	149 Å²	149	112 Å²	112	56%	0.564	53%	0.534	S	S	*	.	H	α-helix	trans	-65.5	-46.4	176.1	-175.9	86.7	0	0	0	111.8	I603 L604 V605 R610 R611	I603-W607 VanDerWaalsContact O-CB 3.28Å; I603-W607 WeakPolarHBondContact O-CB 3.45Å; I603-W607 PolarHBondContact O-N 3.44Å; L604-W607 PolarHBondContact O-N 3.32Å; V605-W607 VanDerWaalsContact C-N 3.34Å; V605-W607 PolarHBondContact O-N 3.49Å; W607-R610 PolarHBondContact O-N 2.87Å; W607-R611 WeakPolarHBondContact O-CB 3.24Å; W607-R611 PolarHBondContact O-N 3Å
608	I	85.5	Confident	77.3	Confident	75 Å²	75	113 Å²	113	39%	0.385	54%	0.54	S	S	.	.	H	α-helix	trans	-58.7	-49.8	172.7	-71.8	178.4	0	0	0	110.4	L604 V605 R610 R611 I612	L604-I608 HydrophobicContact CD2-CD1 3.55Å; L604-I608 HydrophobicContact CD2-CG1 4.21Å; L604-I608 WeakPolarHBondContact O-CG1 3.1Å; L604-I608 PolarHBondContact O-N 2.88Å; V605-I608 PolarHBondContact O-N 2.93Å; I608-R610 VanDerWaalsContact C-N 3.29Å; I608-R610 PolarHBondContact O-N 3.34Å; I608-R611 PolarHBondContact O-N 2.88Å; I608-R611 VanDerWaalsContact O-N 3.14Å; I608-I612 HydrophobicContact CG2-CD1 3.67Å; I608-I612 HydrophobicContact CG2-CG1 4.33Å; I608-I612 WeakPolarHBondContact O-CG1 3.38Å; I608-I612 PolarHBondContact O-N 3.48Å
609	R	82.9	Confident	74.8	Confident	186 Å²	186	114.7 Å²	114.7	70%	0.702	54%	0.544	S	S	*	.	H	α-helix	trans	-61.8	-36.8	-179.8	-162.8	174.7	-169.5	-177.7	4.4	111.8	V605 L606 K613	V605-R609 VanDerWaalsContact O-CB 3.28Å; V605-R609 WeakPolarHBondContact O-CB 3.3Å; V605-R609 PolarHBondContact O-N 3.3Å; L606-R609 PolarHBondContact O-N 2.92Å; R609-K613 VanDerWaalsContact O-CB 3.29Å; R609-K613 WeakPolarHBondContact O-CB 3.17Å; R609-K613 PolarHBondContact O-N 3.26Å
610	R	80.1	Confident	72.3	Confident	201 Å²	201	117.5 Å²	117.5	76%	0.758	56%	0.559	S	S	*	*	H	α-helix	trans	-68.7	-41.1	174.7	-160.9	172	-169	169	2.5	111.6	L606 W607 I608 K613 T614	L606-R610 VanDerWaalsContact O-CB 3.23Å; L606-R610 WeakPolarHBondContact O-CB 3.16Å; L606-R610 PolarHBondContact O-N 2.91Å; W607-R610 PolarHBondContact O-N 2.87Å; I608-R610 VanDerWaalsContact C-N 3.29Å; I608-R610 PolarHBondContact O-N 3.34Å; R610-K613 PolarHBondContact O-N 2.89Å; R610-T614 PolarHBondContact O-N 3.31Å; R610-T614 PolarHBondContact O-OG1 3.44Å
611	R	76.4	Confident	69.9	Low	146 Å²	146	118.6 Å²	118.6	55%	0.551	56%	0.564	S	S	*	*	H	α-helix	trans	-67.8	-37.8	176.9	-163.9	177.9	-171	-163.6	2.6	112.9	W607 I608 T614 N615	W607-R611 WeakPolarHBondContact O-CB 3.24Å; W607-R611 PolarHBondContact O-N 3Å; I608-R611 PolarHBondContact O-N 2.88Å; I608-R611 VanDerWaalsContact O-N 3.14Å; R611-T614 WeakPolarHBondContact CA-OG1 3.5Å; R611-T614 PolarHBondContact O-OG1 2.92Å; R611-N615 WeakPolarHBondContact O-CB 3.21Å; R611-N615 PolarHBondContact O-N 3.05Å
612	I	75	Confident	67.2	Low	108 Å²	108	117 Å²	117	55%	0.554	56%	0.562	S	S	*	*	H	α-helix	trans	-64.6	-44.5	170.6	-67.5	169.2	0	0	0	109.9	I608 T614 N615 S616	I608-I612 HydrophobicContact CG2-CD1 3.67Å; I608-I612 HydrophobicContact CG2-CG1 4.33Å; I608-I612 WeakPolarHBondContact O-CG1 3.38Å; I608-I612 PolarHBondContact O-N 3.48Å; I612-T614 VanDerWaalsContact C-N 3.33Å; I612-T614 PolarHBondContact O-N 2.97Å; I612-N615 PolarHBondContact O-N 3.28Å; I612-S616 PolarHBondContact O-N 3.42Å; I612-S616 PolarHBondContact O-OG 2.92Å
613	K	67.5	Low	64.5	Low	148 Å²	148	119.8 Å²	119.8	64%	0.643	57%	0.571	S	S	*	*	H	α-helix	trans	-70.8	-21.9	-178.9	-157.9	170.1	-171.8	177.3	0	114.2	R609 R610 S616	R609-K613 VanDerWaalsContact O-CB 3.29Å; R609-K613 WeakPolarHBondContact O-CB 3.17Å; R609-K613 PolarHBondContact O-N 3.26Å; R610-K613 PolarHBondContact O-N 2.89Å; K613-S616 PolarHBondContact O-OG 3.46Å
614	T	60.2	Low	61.7	Low	74 Å²	74	122.7 Å²	122.7	45%	0.454	58%	0.581	S	S	.	*	H	α-helix	trans	-78.5	-41.6	166.2	48.8	0	0	0	0	111.8	R610 R611 I612 S616 K617 N618	R610-T614 PolarHBondContact O-N 3.31Å; R610-T614 PolarHBondContact O-OG1 3.44Å; R611-T614 WeakPolarHBondContact CA-OG1 3.5Å; R611-T614 PolarHBondContact O-OG1 2.92Å; I612-T614 VanDerWaalsContact C-N 3.33Å; I612-T614 PolarHBondContact O-N 2.97Å; T614-S616 PolarHBondContact O-N 3.34Å; T614-K617 PolarHBondContact O-N 3.08Å; T614-N618 PolarHBondContact O-N 2.84Å; T614-N618 VanDerWaalsContact O-N 3.16Å; T614-N618 PolarHBondContact O-OD1 3.43Å
615	N	51.7	Low	59.1	Low	99 Å²	99	124.8 Å²	124.8	53%	0.529	59%	0.593	S	S	.	*	H	α-helix	trans	-69	-30.7	178.4	-76.4	7.5	0	0	0	113.1	R611 I612 K619	R611-N615 WeakPolarHBondContact O-CB 3.21Å; R611-N615 PolarHBondContact O-N 3.05Å; I612-N615 PolarHBondContact O-N 3.28Å; N615-K619 WeakPolarHBondContact O-CB 3.18Å; N615-K619 PolarHBondContact O-N 3.29Å; N615-K619 VanDerWaalsContact O-N 3.07Å
616	S	49.5	Very low	56.3	Low	63 Å²	63	128.4 Å²	128.4	44%	0.441	61%	0.61	S	S	.	*	H	α-helix	trans	-71.4	-40.5	176.1	65.8	0	0	0	0	112.1	I612 K613 T614 N618 K619 L620	I612-S616 PolarHBondContact O-N 3.42Å; I612-S616 PolarHBondContact O-OG 2.92Å; K613-S616 PolarHBondContact O-OG 3.46Å; T614-S616 PolarHBondContact O-N 3.34Å; S616-N618 VanDerWaalsContact C-N 3.33Å; S616-N618 PolarHBondContact O-N 2.73Å; S616-K619 PolarHBondContact O-N 2.87Å; S616-K619 VanDerWaalsContact O-N 3.17Å; S616-L620 PolarHBondContact O-N 3.2Å
617	K	44	Very low	53.4	Low	152 Å²	152	134.3 Å²	134.3	66%	0.661	63%	0.626	S	S	*	*	H	α-helix	trans	-59.8	-42	172.3	-78	-164.6	168.7	-157.4	0	112.2	T614 K619	T614-K617 PolarHBondContact O-N 3.08Å; K617-K619 VanDerWaalsContact C-N 3.29Å; K617-K619 PolarHBondContact O-N 3.21Å
618	N	45.6	Very low	50.6	Low	120 Å²	120	135.5 Å²	135.5	64%	0.642	64%	0.638	S	S	*	*	H	α-helix	trans	-80.3	-3.5	178.1	-67.6	24.7	0	0	0	114.2	T614 S616	T614-N618 PolarHBondContact O-N 2.84Å; T614-N618 VanDerWaalsContact O-N 3.16Å; T614-N618 PolarHBondContact O-OD1 3.43Å; S616-N618 VanDerWaalsContact C-N 3.33Å; S616-N618 PolarHBondContact O-N 2.73Å
619	K	40.9	Very low	47.8	Very low	136 Å²	136	138.1 Å²	138.1	59%	0.591	65%	0.653	S	S	*	*	H	α-helix	trans	-98.4	-34.7	170.1	-97.9	-165	169.2	-167.2	0	112.8	N615 S616 K617 T621 N622 F623	N615-K619 WeakPolarHBondContact O-CB 3.18Å; N615-K619 PolarHBondContact O-N 3.29Å; N615-K619 VanDerWaalsContact O-N 3.07Å; S616-K619 PolarHBondContact O-N 2.87Å; S616-K619 VanDerWaalsContact O-N 3.17Å; K617-K619 VanDerWaalsContact C-N 3.29Å; K617-K619 PolarHBondContact O-N 3.21Å; K619-T621 PolarHBondContact O-N 3.4Å; K619-N622 CarbonylContact O-C 3.6Å; K619-N622 PolarHBondContact O-N 3.24Å; K619-F623 HydrophobicContact CD-CE2 4.34Å; K619-F623 PolarHBondContact O-N 3.34Å
620	L	38.1	Very low	45.1	Very low	144 Å²	144	141.1 Å²	141.1	75%	0.754	67%	0.666	S	S	*	*	H	α-helix	trans	-67.5	-26.7	-175.8	-150.6	71.9	0	0	0	112.7	S616 N622	S616-L620 PolarHBondContact O-N 3.2Å; L620-N622 VanDerWaalsContact C-N 3.33Å
621	T	38.9	Very low	42.7	Very low	93 Å²	93	137 Å²	137	57%	0.571	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-14	171.5	53.4	0	0	0	0	114.2	K619	K619-T621 PolarHBondContact O-N 3.4Å
622	N	36.3	Very low	40.3	Very low	106 Å²	106	133.9 Å²	133.9	57%	0.567	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	13.1	-175	-71.4	54.3	0	0	0	112.2	K619 L620	K619-N622 CarbonylContact O-C 3.6Å; K619-N622 PolarHBondContact O-N 3.24Å; L620-N622 VanDerWaalsContact C-N 3.33Å
623	F	34.6	Very low	38.1	Very low	147 Å²	147	136.4 Å²	136.4	65%	0.645	69%	0.694	S	S	*	*	S	Bend	trans	-113	-3.8	177.6	-105.3	-92.5	0	0	0	113.6	K619	K619-F623 HydrophobicContact CD-CE2 4.34Å; K619-F623 PolarHBondContact O-N 3.34Å
624	H	33.5	Very low	36.2	Very low	165 Å²	165	135.7 Å²	135.7	76%	0.764	70%	0.697	S	S	*	*	S	Bend	trans	-93.5	-18.6	177.4	-128.7	-62.2	0	0	0	113.7	L626	H624-L626 PolarHBondContact O-N 2.92Å
625	D	34.4	Very low	34.7	Very low	140 Å²	140	138.9 Å²	138.9	75%	0.749	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	15.6	-175.6	-59.4	-19.6	0	0	0	113.9
626	L	31.9	Very low	33.5	Very low	140 Å²	140	141 Å²	141	73%	0.733	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133	8.5	-171.4	-93.1	167	0	0	0	115.2	H624	H624-L626 PolarHBondContact O-N 2.92Å
627	Y	26.5	Very low	32.4	Very low	229 Å²	229	141 Å²	141	90%	0.898	74%	0.737	S	S	*	*	S	Bend	trans	-140.9	63	172.2	-94.9	-78	0	0	0	111.8
628	Q	29.1	Very low	31.6	Very low	174 Å²	174	142 Å²	142	81%	0.813	75%	0.749	S	S	*	*	S	Bend	trans	-132.8	146.5	152.5	-119	173.6	-29.9	0	0	109.5
629	D	27.5	Very low	30.8	Very low	130 Å²	130	143.7 Å²	143.7	70%	0.695	76%	0.758	S	S	*	*			trans	58.1	72.8	165.1	-54.3	-11.8	0	0	0	118.7
630	Y	26.6	Very low	30.2	Very low	248 Å²	248	141.8 Å²	141.8	97%	0.973	76%	0.762	S	S	*	*			trans	-134.3	59.9	146.3	-103.2	-71.9	0	0	0	112.3
631	S	27.8	Very low	29.8	Very low	116 Å²	116	142 Å²	142	81%	0.811	76%	0.763	S	S	*	*			trans	-154.2	125	166	58.6	0	0	0	0	110.9
632	G	27.2	Very low	29.2	Very low	79 Å²	79	148 Å²	148	81%	0.814	78%	0.777	S	S	*	*			trans	123.9	43.9	161.3	0	0	0	0	0	119.5
633	I	29.4	Very low	28.9	Very low	162 Å²	162	146.8 Å²	146.8	83%	0.831	78%	0.781	S	S	*	*			trans	-131.7	115.3	147	-44.7	-179.7	0	0	0	103.9
634	D	26.7	Very low	28.5	Very low	133 Å²	133	145.3 Å²	145.3	71%	0.711	79%	0.785	S	S	*	*				-154.4	140.6	88.2	-99.6	-20.2	0	0	0	114.4
635	I	28	Very low	28.2	Very low	141 Å²	141	143.6 Å²	143.6	72%	0.723	78%	0.781	S	S	*	*			trans	44	131.4	135.8	-29	158.1	0	0	0	117.3
636	V	26.2	Very low	28	Very low	144 Å²	144	145.5 Å²	145.5	87%	0.873	79%	0.785	S	S	*	*			cis	-153.7	148.5	41.7	-168.4	0	0	0	0	108.6
637	G	26.7	Very low	27.7	Very low	63 Å²	63	144.7 Å²	144.7	65%	0.649	79%	0.789	S	S	*	*			cis	172.1	166.2	-5.1	0	0	0	0	0	110.7
638	N	27.1	Very low	28	Very low	172 Å²	172	138.9 Å²	138.9	92%	0.92	78%	0.78	S	S	*	*			trans	-85	156.7	-176.9	-93.1	-19.9	0	0	0	113.7
639	N	30.5	Very low	27.8	Very low	156 Å²	156	137.8 Å²	137.8	83%	0.834	78%	0.779	S	S	*	*			trans	-67.4	134.1	177.6	-82.6	-35.6	0	0	0	113.2
640	S	28	Very low	27.8	Very low	96 Å²	96	139.1 Å²	139.1	67%	0.671	79%	0.785	S	S	*	*			trans	54.4	101.9	142.2	69.4	0	0	0	0	119.5
641	L	29.6	Very low	27.9	Very low	147 Å²	147	133.9 Å²	133.9	77%	0.77	77%	0.773	S	S	*	*				167.2	116	99.9	-83.9	162.7	0	0	0	112.5
642	Y	26.4	Very low	27.6	Very low	220 Å²	220	133.7 Å²	133.7	86%	0.863	77%	0.771	S	S	*	*			trans	51.8	145.8	155.5	-69.7	-81.8	0	0	0	124.5
643	A	28.9	Very low	27.8	Very low	81 Å²	81	135.7 Å²	135.7	67%	0.669	77%	0.768	S	S	*	*			trans	90.4	86.1	147.3	0	0	0	0	0	121.8
644	T	27	Very low	27.9	Very low	116 Å²	116	135.3 Å²	135.3	71%	0.712	77%	0.766	S	S	*	*				62.7	122.4	126.7	54.8	0	0	0	0	123.5
645	N	26.6	Very low	27.9	Very low	128 Å²	128	134.7 Å²	134.7	68%	0.684	77%	0.772	S	S	*	*			trans	56.8	113.5	135.4	-47.4	-10.8	0	0	0	118.6
646	H	30.5	Very low	27.9	Very low	181 Å²	181	131.4 Å²	131.4	84%	0.838	77%	0.773	S	S	*	*				-170.1	152.5	62.1	-87.4	-78	0	0	0	113.6
647	C	25.6	Very low	27.9	Very low	122 Å²	122	130.1 Å²	130.1	82%	0.824	77%	0.77	S	S	*	*			trans	-70.8	170	165.3	-83.3	0	0	0	0	112.4
648	P	32.1	Very low	28.1	Very low	108 Å²	108	138.3 Å²	138.3	70%	0.701	78%	0.783	S	S	*	*			cis	-156.9	161.2	41	43.5	-21.3	0	0	0	122.8
649	L	25	Very low	28.1	Very low	150 Å²	150	138.3 Å²	138.3	79%	0.785	78%	0.782	S	S	*	*			trans	49.7	124.7	137.7	-65.7	166.8	0	0	0	122.2
650	L	29.1	Very low	27.9	Very low	159 Å²	159	136.6 Å²	136.6	83%	0.832	78%	0.783	S	S	*	*				-169.4	98	103.4	-104	165.2	0	0	0	115.5
651	I	27.1	Very low	27.9	Very low	138 Å²	138	135.4 Å²	135.4	71%	0.708	79%	0.786	S	S	*	*			trans	34	119.7	141.5	-54	173.7	0	0	0	119.8
652	S	22.6	Very low	27.9	Very low	111 Å²	111	133.7 Å²	133.7	78%	0.776	79%	0.786	S	S	*	*			trans	-113.2	160.3	148.3	69.2	0	0	0	0	110.4
653	T	31.1	Very low	27.8	Very low	121 Å²	121	132.2 Å²	132.2	74%	0.742	79%	0.786	S	S	*	*			trans	167.7	147.8	157.8	34.9	0	0	0	0	109
654	I	31.9	Very low	28	Very low	154 Å²	154	134.1 Å²	134.1	79%	0.79	79%	0.792	S	S	*	*			cis	-147.4	143.4	-18.9	-106.9	162	0	0	0	106.6
655	S	25.4	Very low	27.9	Very low	120 Å²	120	138 Å²	138	84%	0.839	80%	0.799	S	S	*	*			trans	-133.8	113.9	159.8	55.4	0	0	0	0	107.7
656	G	29.1	Very low	28	Very low	72 Å²	72	139.9 Å²	139.9	74%	0.742	81%	0.808	S	S	*	*			trans	-105.6	113	-172.3	0	0	0	0	0	112.8
657	S	26.6	Very low	27.7	Very low	118 Å²	118	137.9 Å²	137.9	83%	0.825	80%	0.803	S	S	*	*			trans	-113.8	136.3	161.7	48.9	0	0	0	0	108.9
658	Y	29	Very low	27.9	Very low	235 Å²	235	141.2 Å²	141.2	92%	0.922	81%	0.807	S	S	*	*			trans	-100.5	133.3	177.6	-78.7	-83.5	0	0	0	110.5
659	L	27.2	Very low	27.5	Very low	171 Å²	171	146.6 Å²	146.6	90%	0.895	81%	0.813	S	S	*	*			trans	-121.5	128.3	167.9	-100.6	170.8	0	0	0	110.2
660	S	26.5	Very low	27.8	Very low	121 Å²	121	147.7 Å²	147.7	85%	0.846	81%	0.814	S	S	*	*			trans	27.1	118.3	158.4	-157.7	0	0	0	0	120.1
661	G	27.6	Very low	27.6	Very low	71 Å²	71	148.7 Å²	148.7	73%	0.732	81%	0.814	S	S	*	*			trans	-126.7	104.2	164.2	0	0	0	0	0	112.2
662	S	30	Very low	27.7	Very low	110 Å²	110	147.7 Å²	147.7	77%	0.769	82%	0.819	S	S	*	*			trans	38.4	111.7	158	59.4	0	0	0	0	120.2
663	H	24.2	Very low	27.8	Very low	190 Å²	190	151.7 Å²	151.7	88%	0.88	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-64.9	142	154.7	-68.6	-86	0	0	0	111.8
664	P	33.6	Very low	28	Very low	120 Å²	120	151.9 Å²	151.9	78%	0.779	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-96.9	133.2	138.5	32.8	-27.5	0	0	0	110
665	K	25.5	Very low	27.7	Very low	199 Å²	199	151.1 Å²	151.1	87%	0.865	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-75.2	139.4	162.7	-65.5	175.3	179.7	175.5	0	108.5
666	L	28.1	Very low	27.8	Very low	167 Å²	167	150.7 Å²	150.7	87%	0.874	82%	0.82	S	S	*	*			trans	-162.6	152.7	135.9	-110	163	0	0	0	111.5
667	N	24.7	Very low	27.7	Very low	139 Å²	139	152 Å²	152	74%	0.743	82%	0.819	S	S	*	*			trans	-76.9	159.1	-176.4	-48.6	-54.5	0	0	0	111.1
668	Q	29.6	Very low	27.7	Very low	191 Å²	191	153.9 Å²	153.9	89%	0.893	82%	0.818	S	S	*	*				-163.9	124.4	110.5	-105.3	160.6	2.5	0	0	113.2
669	R	24.1	Very low	27.5	Very low	222 Å²	222	147.2 Å²	147.2	84%	0.838	81%	0.806	S	S	*	*			trans	-85.2	172	139.2	-79.3	-176.6	173	177.7	-2.4	107.8
670	H	31.1	Very low	27.5	Very low	173 Å²	173	149.6 Å²	149.6	80%	0.801	81%	0.805	S	S	*	*			trans	94.1	127.5	172.2	-58.6	-80.3	0	0	0	116.7
671	H	25	Very low	27.4	Very low	180 Å²	180	148.6 Å²	148.6	83%	0.833	80%	0.798	S	S	*	*			trans	-67.8	140.6	-178.9	-40.6	-99.4	0	0	0	111.9
672	S	28.9	Very low	27.6	Very low	117 Å²	117	153.4 Å²	153.4	82%	0.818	80%	0.801	S	S	*	*				-176.9	136.6	122.9	30.5	0	0	0	0	111.5
673	F	24.3	Very low	27.3	Very low	195 Å²	195	154.6 Å²	154.6	86%	0.855	80%	0.799	S	S	*	*			trans	-78.1	151.8	155.1	-80.3	-90.1	0	0	0	108.4
674	P	34.6	Very low	27.5	Very low	124 Å²	124	154.5 Å²	154.5	81%	0.805	80%	0.796	S	S	*	*				-138.4	173.8	97	37.5	-25.2	0	0	0	115.1
675	N	27.3	Very low	27	Very low	139 Å²	139	155.1 Å²	155.1	74%	0.743	79%	0.793	S	S	*	*			trans	-81.2	162.9	-171.3	-67.1	-48.6	0	0	0	115.5
676	S	27	Very low	27.3	Very low	110 Å²	110	151.1 Å²	151.1	77%	0.769	79%	0.785	S	S	*	*				106.5	135.1	126	72.8	0	0	0	0	121.8
677	S	26.2	Very low	27.1	Very low	101 Å²	101	152.4 Å²	152.4	71%	0.706	79%	0.785	S	S	*	*			trans	87.8	117	143.6	70.8	0	0	0	0	121.2
678	L	27.5	Very low	27.2	Very low	156 Å²	156	153.2 Å²	153.2	82%	0.817	79%	0.788	S	S	*	*			trans	70.7	108.4	134.5	-80.1	158.6	0	0	0	121.7
679	S	24.7	Very low	27.1	Very low	96 Å²	96	149.5 Å²	149.5	67%	0.671	78%	0.78	S	S	*	*			trans	56.2	119.4	133.5	61.7	0	0	0	0	120.9
680	Y	27.2	Very low	27.1	Very low	221 Å²	221	147.1 Å²	147.1	87%	0.867	78%	0.781	S	S	*	*				-146.6	147.9	110.8	-127.9	-87.4	0	0	0	111.3
681	S	25.1	Very low	26.9	Very low	99 Å²	99	144 Å²	144	69%	0.692	78%	0.778	S	S	*	*			trans	-101	136.2	172.4	48.3	0	0	0	0	110.3
682	Q	30.3	Very low	26.9	Very low	172 Å²	172	140.9 Å²	140.9	80%	0.804	77%	0.772	S	S	*	*			trans	-134.8	124.3	161.7	-73.5	-163.7	-12.6	0	0	110
683	N	25.2	Very low	27	Very low	136 Å²	136	146.2 Å²	146.2	73%	0.727	78%	0.776	S	S	*	*			trans	-77.3	141.8	173.7	-61.8	-53.6	0	0	0	109.7
684	F	27.1	Very low	27	Very low	187 Å²	187	146.1 Å²	146.1	82%	0.82	78%	0.775	S	S	*	*			trans	-124.2	88.4	148.9	-93	-79.2	0	0	0	109.7
685	N	24.5	Very low	26.9	Very low	134 Å²	134	147.1 Å²	147.1	72%	0.717	78%	0.779	S	S	*	*			trans	-72.7	119.4	162.5	-78.8	-33.9	0	0	0	108.6
686	T	30.2	Very low	27.1	Very low	114 Å²	114	145.9 Å²	145.9	70%	0.699	78%	0.777	S	S	*	*			trans	-137.7	71.5	164.3	-31.7	0	0	0	0	110.8
687	F	24.7	Very low	27.1	Very low	195 Å²	195	146.8 Å²	146.8	86%	0.855	77%	0.773	S	S	*	*			trans	-66.1	136	155.7	-77.7	-95.4	0	0	0	108.6
688	L	27.2	Very low	27.3	Very low	155 Å²	155	148.5 Å²	148.5	81%	0.812	78%	0.775	S	S	*	*			trans	-123.6	143.6	157.5	-80.8	173.5	0	0	0	109.4
689	P	28.1	Very low	27.5	Very low	113 Å²	113	147.6 Å²	147.6	73%	0.734	77%	0.77	S	S	*	*			trans	-105.7	174.1	-152.3	39.9	-35.2	0	0	0	114.7
690	M	22.1	Very low	27.7	Very low	172 Å²	172	151.7 Å²	151.7	85%	0.847	78%	0.776	S	S	*	*			trans	-45.3	131.7	166.3	-155.6	76.8	155.5	0	0	112.2	T692	M690-T692 HydrophobicContact CG-CG2 4.31Å
691	S	28.2	Very low	27.7	Very low	107 Å²	107	151.2 Å²	151.2	75%	0.748	77%	0.774	S	S	*	*			trans	-116.9	106.8	161.9	51.9	0	0	0	0	110.3
692	T	25.2	Very low	27.9	Very low	116 Å²	116	152.9 Å²	152.9	71%	0.712	78%	0.775	S	S	*	*			trans	-87.9	124.3	173.3	47	0	0	0	0	110.3	M690	M690-T692 HydrophobicContact CG-CG2 4.31Å
693	Y	29.7	Very low	27.8	Very low	228 Å²	228	148.5 Å²	148.5	89%	0.894	76%	0.764	S	S	*	*			trans	-112.6	118.2	159.8	-90.4	-81.8	0	0	0	110.2
694	K	25.2	Very low	27.8	Very low	193 Å²	193	149.2 Å²	149.2	84%	0.839	77%	0.768	S	S	*	*			trans	-94.6	136.5	163.9	-77.3	-177.1	174.6	-178.6	0	108.8
695	T	33.3	Very low	28	Very low	145 Å²	145	149.1 Å²	149.1	89%	0.89	77%	0.77	S	S	*	*			trans	-135.8	153.8	145	40.1	0	0	0	0	107.9
696	T	29.6	Very low	28.2	Very low	114 Å²	114	147.9 Å²	147.9	70%	0.699	77%	0.772	S	S	*	*			trans	-113.5	154.7	-154.9	6.5	0	0	0	0	114.3
697	D	27.6	Very low	27.9	Very low	129 Å²	129	150.9 Å²	150.9	69%	0.69	78%	0.778	S	S	*	*			trans	47.2	112.6	149	-48.1	-35	0	0	0	119.8
698	N	31.5	Very low	27.9	Very low	137 Å²	137	150.8 Å²	150.8	73%	0.733	78%	0.78	S	S	*	*				-173.5	127.4	93.1	-103.1	-77.6	0	0	0	115.7
699	N	30.2	Very low	27.8	Very low	136 Å²	136	152.6 Å²	152.6	73%	0.727	78%	0.782	S	S	*	*			trans	46.1	133.8	137	-82.2	-65.3	0	0	0	124.9
700	K	29.2	Very low	27.7	Very low	182 Å²	182	154.9 Å²	154.9	79%	0.791	79%	0.787	S	S	*	*			trans	85.3	120.2	144.3	-82.9	176.9	172.9	173.2	0	122.3
701	Y	28.3	Very low	28	Very low	211 Å²	211	155 Å²	155	83%	0.827	79%	0.79	S	S	*	*			trans	-1.2	149.4	133.6	-55.3	-90.8	0	0	0	118.1
702	N	29.4	Very low	27.8	Very low	134 Å²	134	153.3 Å²	153.3	72%	0.717	79%	0.789	S	S	*	*			cis	-161.4	156.2	30.7	-148	1.9	0	0	0	115.7
703	S	27.4	Very low	27.7	Very low	81 Å²	81	159.4 Å²	159.4	57%	0.566	80%	0.799	S	S	*	*			trans	41.3	130	147.7	65.1	0	0	0	0	123.5
704	N	25.1	Very low	27.5	Very low	151 Å²	151	153.7 Å²	153.7	81%	0.807	79%	0.793	S	S	*	*			trans	72.9	103.1	146.8	-56.6	-19	0	0	0	120.3
705	Q	30.6	Very low	27.5	Very low	185 Å²	185	149.9 Å²	149.9	86%	0.864	79%	0.786	S	S	*	*				-169.1	152.7	103.1	-102.5	175.3	15.2	0	0	114.1
706	S	29.2	Very low	27	Very low	108 Å²	108	148.5 Å²	148.5	76%	0.755	78%	0.782	S	S	*	*			trans	38.2	111.6	162.9	55.3	0	0	0	0	120.2	Q708	S706-Q708 PolarHBondContact O-N 3.33Å
707	Q	24.2	Very low	26.8	Very low	176 Å²	176	153 Å²	153	82%	0.822	79%	0.787	S	S	*	*			trans	-67.6	125.4	164.3	-64.7	161.3	-28.1	0	0	111.5	F709	Q707-F709 HydrophobicContact CB-CD2 4.47Å
708	Q	25.1	Very low	26.7	Very low	193 Å²	193	150.4 Å²	150.4	90%	0.902	78%	0.78	S	S	*	*			trans	-128.6	76.6	152.8	-74.3	-167.6	-3.2	0	0	108.3	S706 L710	S706-Q708 PolarHBondContact O-N 3.33Å; Q708-L710 PolarHBondContact O-N 2.92Å
709	F	25.8	Very low	26.4	Very low	194 Å²	194	147.1 Å²	147.1	85%	0.851	77%	0.767	S	S	*	*			trans	-71.3	120.5	174	-92.2	-84.5	0	0	0	109.9	Q707	Q707-F709 HydrophobicContact CB-CD2 4.47Å
710	L	25.8	Very low	26.2	Very low	160 Å²	160	144.6 Å²	144.6	84%	0.838	76%	0.76	S	S	*	*			trans	-44.5	146.5	170.1	-71.3	148.9	0	0	0	111.2	Q708 G712	Q708-L710 PolarHBondContact O-N 2.92Å; L710-G712 PolarHBondContact O-N 3.29Å
711	L	26.9	Very low	26.1	Very low	175 Å²	175	144.8 Å²	144.8	92%	0.916	77%	0.766	S	S	*	*			trans	-55.7	110	171.3	-73.8	95	0	0	0	109.1	R713	L711-R713 PolarHBondContact O-N 2.88Å
712	G	24.8	Very low	26.1	Very low	71 Å²	71	143.6 Å²	143.6	73%	0.732	76%	0.76	S	S	*	*			trans	-57.3	124.8	177.4	0	0	0	0	0	109.4	L710 S714	L710-G712 PolarHBondContact O-N 3.29Å; G712-S714 PolarHBondContact O-N 3.48Å
713	R	23.5	Very low	26	Very low	245 Å²	245	143.3 Å²	143.3	93%	0.925	76%	0.759	S	S	*	*			trans	-49.1	110.9	178.6	-76.8	176.2	168.1	167.7	-5.6	109.2	L711 T715	L711-R713 PolarHBondContact O-N 2.88Å; R713-T715 PolarHBondContact O-N 3.43Å
714	S	24.2	Very low	25.9	Very low	108 Å²	108	142.1 Å²	142.1	76%	0.755	76%	0.76	S	S	*	*			trans	-61.6	109.6	173.4	54.8	0	0	0	0	108.2	G712 S716	G712-S714 PolarHBondContact O-N 3.48Å; S714-S716 PolarHBondContact O-N 3.39Å
715	T	25.4	Very low	25.9	Very low	113 Å²	113	141.1 Å²	141.1	69%	0.693	76%	0.764	S	S	*	*			trans	-59	109.1	170.2	38.4	0	0	0	0	107.5	R713 Y717	R713-T715 PolarHBondContact O-N 3.43Å; T715-Y717 PolarHBondContact O-N 2.92Å
716	S	22.8	Very low	25.7	Very low	115 Å²	115	138.3 Å²	138.3	80%	0.804	76%	0.755	S	S	*	*			trans	-74.4	74.5	-176.1	52.8	0	0	0	0	109.5	S714 S718	S714-S716 PolarHBondContact O-N 3.39Å; S716-S718 PolarHBondContact O-N 2.99Å
717	Y	26	Very low	25.5	Very low	208 Å²	208	144.4 Å²	144.4	82%	0.816	76%	0.761	S	S	*	*			trans	-61.7	89.6	162.2	-80.1	-79.2	0	0	0	107.9	T715 S719	T715-Y717 PolarHBondContact O-N 2.92Å; Y717-S719 PolarHBondContact O-N 2.89Å
718	S	25.4	Very low	25.8	Very low	76 Å²	76	143.8 Å²	143.8	53%	0.531	76%	0.763	S	S	.	*			trans	-55.7	137.6	173.7	-177.5	0	0	0	0	108.8	S716 S720	S716-S718 PolarHBondContact O-N 2.99Å; S718-S720 VanDerWaalsContact CB-OG 3.26Å; S718-S720 WeakPolarHBondContact CB-OG 3.48Å; S718-S720 PolarHBondContact O-N 2.8Å; S718-S720 WeakPolarHBondContact OG-CB 3.27Å; S718-S720 PolarHBondContact OG-OG 3.45Å
719	S	25.6	Very low	25.8	Very low	67 Å²	67	138.1 Å²	138.1	47%	0.469	76%	0.756	S	S	.	*	S	Bend	trans	-76.3	40.6	172.5	50.5	0	0	0	0	111.4	R318 Y717	R318-S719 PolarHBondContact NH2-OG 3.24Å; Y717-S719 PolarHBondContact O-N 2.89Å
720	S	24.9	Very low	26	Very low	83 Å²	83	136.8 Å²	136.8	58%	0.58	76%	0.758	S	S	*	*			trans	-122.6	54.3	-175.4	65.8	0	0	0	0	110.7	S718	S718-S720 VanDerWaalsContact CB-OG 3.26Å; S718-S720 WeakPolarHBondContact CB-OG 3.48Å; S718-S720 PolarHBondContact O-N 2.8Å; S718-S720 WeakPolarHBondContact OG-CB 3.27Å; S718-S720 PolarHBondContact OG-OG 3.45Å
721	M	27.8	Very low	25.9	Very low	186 Å²	186	135.9 Å²	135.9	92%	0.916	75%	0.754	S	S	*	*			trans	-109	44	158.2	-68.4	-165.3	73	0	0	110.2
722	W	29.1	Very low	26.1	Very low	186 Å²	186	134.8 Å²	134.8	71%	0.705	75%	0.748	S	S	*	*			trans	-92.5	84.5	157.3	-78.9	91.4	0	0	0	107.7	F230	F230-W722 HydrophobicContact CD2-CH2 4.36Å; F230-W722 AromaticContact CE2-CH2 3.47Å; F230-W722 HydrophobicContact CE2-CH2 3.47Å; F230-W722 VanDerWaalsContact CE2-CH2 3.47Å; F230-W722 AromaticContact CE2-CZ2 3.56Å; F230-W722 HydrophobicContact CE2-CZ2 3.56Å; F230-W722 HydrophobicContact CE2-CZ3 4.1Å; F230-W722 HydrophobicContact CZ-CH2 4.11Å; F230-W722 HydrophobicContact CZ-CZ2 4.29Å; F230-W722 HydrophobicContact CZ-CZ3 4.3Å
723	N	26	Very low	26.2	Very low	129 Å²	129	138.2 Å²	138.2	69%	0.69	75%	0.75	S	S	*	*			trans	-140.8	107.5	164.8	-151	3.1	0	0	0	108.3
724	G	25.3	Very low	26.5	Very low	56 Å²	56	131.9 Å²	131.9	58%	0.577	74%	0.743	S	S	*	*			trans	-67.6	155.3	174.7	0	0	0	0	0	110.5	L726	G724-L726 PolarHBondContact O-N 3.27Å
725	S	25	Very low	26.8	Very low	129 Å²	129	132.3 Å²	132.3	90%	0.902	75%	0.747	S	S	*	*			trans	-63.2	100.5	177.8	-173.7	0	0	0	0	110.8	R727	S725-R727 PolarHBondContact O-N 3.37Å
726	L	27.4	Very low	26.9	Very low	127 Å²	127	131.6 Å²	131.6	67%	0.665	75%	0.746	S	S	*	*			trans	-74.2	118.1	171.2	-88.4	169.5	0	0	0	109.4	G724 N728	G724-L726 PolarHBondContact O-N 3.27Å; L726-N728 PolarHBondContact O-N 2.9Å
727	R	25.6	Very low	27.2	Very low	235 Å²	235	134 Å²	134	89%	0.887	75%	0.75	S	S	*	*			trans	-60.2	120.7	169.9	-70.2	174	163.7	-158.9	-2.6	109.7	S725	S725-R727 PolarHBondContact O-N 3.37Å
728	N	29.8	Very low	27.2	Very low	163 Å²	163	127.8 Å²	127.8	87%	0.872	75%	0.749	S	S	*	*			trans	-89.7	115.5	146.6	-91.3	-3.7	0	0	0	108.1	L726 L730	L726-N728 PolarHBondContact O-N 2.9Å; N728-L730 PolarHBondContact O-N 2.82Å
729	G	24	Very low	27.2	Very low	74 Å²	74	132.7 Å²	132.7	76%	0.763	76%	0.763	S	S	*	*			trans	-77.3	113	168.6	0	0	0	0	0	109.8
730	L	30	Very low	27.5	Very low	167 Å²	167	138.1 Å²	138.1	87%	0.874	78%	0.781	S	S	*	*			trans	-104.4	95.4	156.1	-87.7	170.9	0	0	0	108	N728 N732	N728-L730 PolarHBondContact O-N 2.82Å; L730-N732 PolarHBondContact O-N 3.32Å
731	N	25	Very low	27.5	Very low	141 Å²	141	141.7 Å²	141.7	75%	0.754	79%	0.793	S	S	*	*			trans	-65.8	124.2	170	-171.3	14.9	0	0	0	108.6
732	N	30.4	Very low	27.5	Very low	151 Å²	151	141.9 Å²	141.9	81%	0.807	79%	0.792	S	S	*	*			trans	-151.3	120.4	170.3	-122.3	-16.1	0	0	0	110.6	L730	L730-N732 PolarHBondContact O-N 3.32Å
733	N	26.4	Very low	27.3	Very low	143 Å²	143	144.1 Å²	144.1	77%	0.765	80%	0.8	S	S	*	*			trans	-75.2	130.3	-176.6	-67	-47	0	0	0	111
734	S	31.5	Very low	27.5	Very low	112 Å²	112	143.8 Å²	143.8	78%	0.783	80%	0.803	S	S	*	*			trans	-155	107.3	161.2	-72.4	0	0	0	0	111.4
735	S	29.9	Very low	27.5	Very low	118 Å²	118	148.5 Å²	148.5	83%	0.825	81%	0.814	S	S	*	*			trans	25.9	120.3	149	56.9	0	0	0	0	120.6
736	S	28.1	Very low	27.7	Very low	98 Å²	98	150.1 Å²	150.1	69%	0.685	81%	0.812	S	S	*	*			trans	-51.7	166.6	155.6	54	0	0	0	0	116.4
737	N	27.2	Very low	27.8	Very low	165 Å²	165	148.7 Å²	148.7	88%	0.882	81%	0.808	S	S	*	*			trans	83.7	134.2	158.4	-57.6	-20.5	0	0	0	118.3
738	G	27.5	Very low	27.9	Very low	77 Å²	77	144.7 Å²	144.7	79%	0.794	80%	0.804	S	S	*	*			trans	158.3	79.2	176.1	0	0	0	0	0	113.7
739	H	25.4	Very low	27.9	Very low	179 Å²	179	148.1 Å²	148.1	83%	0.829	81%	0.805	S	S	*	*			trans	-73.5	148.2	159.9	-77.7	-37.5	0	0	0	109.7
740	H	30.5	Very low	28.3	Very low	182 Å²	182	152.1 Å²	152.1	84%	0.843	81%	0.808	S	S	*	*				176.1	151.3	106.5	-96.7	-79.2	0	0	0	111.5
741	N	25.2	Very low	28.2	Very low	158 Å²	158	151.5 Å²	151.5	85%	0.845	81%	0.806	S	S	*	*			trans	-86.8	140.3	161.9	-67.8	-53.6	0	0	0	108.7
742	E	29.2	Very low	28.4	Very low	190 Å²	190	150.5 Å²	150.5	89%	0.888	81%	0.81	S	S	*	*			trans	-157.3	160.9	137.9	-128.8	174.3	-171.1	0	0	113.7
743	R	24.8	Very low	28.5	Very low	232 Å²	232	152 Å²	152	88%	0.875	81%	0.809	S	S	*	*			trans	-104.7	133.4	171.3	-70.1	173.6	171.9	170.5	-3.6	108.8
744	V	28.4	Very low	28.7	Very low	123 Å²	123	156.3 Å²	156.3	75%	0.745	82%	0.815	S	S	*	*			trans	-133.5	123.6	155.9	179.9	0	0	0	0	109.1
745	L	25.4	Very low	28.5	Very low	154 Å²	154	159.5 Å²	159.5	81%	0.806	82%	0.817	S	S	*	*			trans	-83.1	138	159.9	-100	84.7	0	0	0	108.4
746	L	30.9	Very low	28.6	Very low	164 Å²	164	161.3 Å²	161.3	86%	0.859	82%	0.817	S	S	*	*			trans	-146.8	135.8	153.5	-111	165.2	0	0	0	110
747	T	28.8	Very low	28.4	Very low	97 Å²	97	163.7 Å²	163.7	60%	0.595	82%	0.821	S	S	*	*			trans	-113.4	175.9	-170.1	46.9	0	0	0	0	112
748	N	28.4	Very low	28.5	Very low	150 Å²	150	167 Å²	167	80%	0.802	82%	0.823	S	S	*	*			trans	82.7	97.2	161.2	-53.5	-34.3	0	0	0	119.1
749	R	30.1	Very low	28.6	Very low	235 Å²	235	168 Å²	168	89%	0.887	82%	0.818	S	S	*	*				-158	140.6	122.2	-89.1	-173.4	179.5	170.1	-0.7	107.2
750	L	31.6	Very low	28.6	Very low	159 Å²	159	163.6 Å²	163.6	83%	0.832	81%	0.808	S	S	*	*			cis	-157	147.3	-14.4	-122.5	169	0	0	0	107.7
751	N	27.1	Very low	28.5	Very low	154 Å²	154	162.9 Å²	162.9	82%	0.824	81%	0.81	S	S	*	*			trans	-95.9	147.1	178.4	-92.2	-48.9	0	0	0	112.1
752	S	30.6	Very low	28.6	Very low	119 Å²	119	159.2 Å²	159.2	83%	0.832	81%	0.81	S	S	*	*			trans	-148	163	152.3	-164.3	0	0	0	0	110.9
753	K	31.6	Very low	28.4	Very low	183 Å²	183	158.5 Å²	158.5	80%	0.796	81%	0.811	S	S	*	*			trans	-135.1	169.4	-161.7	-72	-176.3	175.3	-179.3	0	113.8
754	R	31.4	Very low	28.6	Very low	233 Å²	233	152.3 Å²	152.3	88%	0.879	80%	0.803	S	S	*	*			trans	98.1	117	162.7	-58.2	172	177.7	167.1	-1.1	113.2
755	H	26.8	Very low	28.7	Very low	179 Å²	179	154.1 Å²	154.1	83%	0.829	81%	0.807	S	S	*	*				70.6	112.3	64	-91.5	-85.4	0	0	0	114.1
756	L	30.9	Very low	28.6	Very low	157 Å²	157	154.9 Å²	154.9	82%	0.822	81%	0.806	S	S	*	*				-166.5	144.4	121.9	-104.8	163.1	0	0	0	110.2
757	N	24.9	Very low	28.5	Very low	147 Å²	147	152.5 Å²	152.5	79%	0.786	80%	0.803	S	S	*	*			trans	-94.5	146.9	166.9	-72	-14.4	0	0	0	108.7
758	Y	28.8	Very low	28.3	Very low	235 Å²	235	152.5 Å²	152.5	92%	0.922	81%	0.807	S	S	*	*			trans	-144.1	161.7	150.6	-110.9	-80.7	0	0	0	110.4
759	S	29.6	Very low	28.3	Very low	97 Å²	97	153.9 Å²	153.9	68%	0.678	81%	0.809	S	S	*	*			trans	-117.6	154.4	-158.8	-174.5	0	0	0	0	113.6
760	S	26	Very low	28	Very low	88 Å²	88	150.1 Å²	150.1	62%	0.615	80%	0.801	S	S	*	*			trans	39.7	115.2	145.8	58.8	0	0	0	0	119.7
761	N	28.6	Very low	27.8	Very low	167 Å²	167	149.1 Å²	149.1	89%	0.893	80%	0.796	S	S	*	*				-175.4	152.4	105.5	-89.9	-22.7	0	0	0	111.8
762	G	27.5	Very low	27.6	Very low	81 Å²	81	147.7 Å²	147.7	84%	0.835	79%	0.792	S	S	*	*			trans	156.7	50.9	-178.7	0	0	0	0	0	114.7
763	L	24.2	Very low	27.4	Very low	175 Å²	175	147.7 Å²	147.7	92%	0.916	79%	0.792	S	S	*	*			trans	-136.4	109.5	-176.9	-136.5	178.1	0	0	0	110.5
764	S	29.4	Very low	27.5	Very low	101 Å²	101	145 Å²	145	71%	0.706	79%	0.792	S	S	*	*			trans	-173.3	150.8	170.6	55.4	0	0	0	0	110
765	I	30	Very low	27.6	Very low	161 Å²	161	138.8 Å²	138.8	83%	0.826	78%	0.781	S	S	*	*			cis	-154	165.5	-19.8	-116.8	160.7	0	0	0	107.5
766	E	23.9	Very low	27.5	Very low	170 Å²	170	140 Å²	140	79%	0.794	78%	0.78	S	S	*	*			trans	-76.8	147.1	-177.4	-59.2	152.8	103	0	0	114.7
767	S	28	Very low	27.3	Very low	114 Å²	114	137.9 Å²	137.9	80%	0.797	77%	0.768	S	S	*	*			trans	-177.3	133.7	131.9	25.8	0	0	0	0	108.6
768	S	25	Very low	27.3	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	76%	0.763	S	S	*	*			cis	86.3	114.3	34.7	-62.1	0	0	0	0	114.1
769	Q	27.9	Very low	27.4	Very low	180 Å²	180	136.5 Å²	136.5	84%	0.841	76%	0.76	S	S	*	*			trans	68.8	159.8	157.2	-68.9	171.9	1	0	0	116.9
770	Q	24.7	Very low	27.3	Very low	155 Å²	155	138.6 Å²	138.6	72%	0.724	76%	0.757	S	S	*	*			cis	-169.8	-169.5	-29.7	-165.4	175.1	-7.9	0	0	106.5
771	I	26.8	Very low	27.6	Very low	139 Å²	139	139.5 Å²	139.5	71%	0.713	76%	0.755	S	S	*	*			trans	74.2	100	155.8	-61.2	166.2	0	0	0	116.8
772	T	23.1	Very low	27.8	Very low	123 Å²	123	138.1 Å²	138.1	76%	0.755	74%	0.743	S	S	*	*			trans	-6.9	134.8	141	52.8	0	0	0	0	119
773	S	26.8	Very low	28	Very low	119 Å²	119	141 Å²	141	83%	0.832	74%	0.735	S	S	*	*				-175.6	128	113.5	35	0	0	0	0	113.4
774	T	32.8	Very low	28	Very low	128 Å²	128	138.9 Å²	138.9	79%	0.785	72%	0.724	S	S	*	*			trans	-70.2	159.5	142.4	47.8	0	0	0	0	107.2
775	P	33.5	Very low	28.1	Very low	102 Å²	102	140.9 Å²	140.9	66%	0.662	73%	0.725	S	S	*	*			cis	-168.8	-159.9	49.1	48.6	-25.3	0	0	0	118.9
776	Y	25.4	Very low	28	Very low	203 Å²	203	140 Å²	140	80%	0.796	72%	0.721	S	S	*	*			trans	65.7	153.5	154.7	-89.1	-105.9	0	0	0	120.5
777	I	25.7	Very low	28.2	Very low	113 Å²	113	139.5 Å²	139.5	58%	0.579	72%	0.724	S	S	*	*			cis	-170.9	158.8	-44.8	-130	163.4	0	0	0	112.3
778	N	26.3	Very low	28.3	Very low	127 Å²	127	139.3 Å²	139.3	68%	0.679	72%	0.72	S	S	*	*			trans	63.7	165	165.2	-76.5	-22.9	0	0	0	116.8
779	R	29.6	Very low	28.8	Very low	227 Å²	227	142.4 Å²	142.4	86%	0.857	73%	0.728	S	S	*	*			cis	-123.2	139.9	16.9	-94.3	-168.3	163.2	121.6	-5.7	111.7
780	K	28.5	Very low	29	Very low	141 Å²	141	138.9 Å²	138.9	61%	0.613	72%	0.72	S	S	*	*				69.5	142.1	77.3	-81.1	179.1	151	-83.6	0	113.4
781	D	32.2	Very low	29	Very low	107 Å²	107	142.7 Å²	142.7	57%	0.572	73%	0.73	S	S	*	*			cis	-131.1	-154.4	2.1	-123.1	-71.5	0	0	0	108.5
782	H	32.5	Very low	29.1	Very low	137 Å²	137	144.5 Å²	144.5	63%	0.634	74%	0.735	S	S	*	*			cis	-167.2	158.2	3.1	-129.1	14.8	0	0	0	104.8
783	Q	31.1	Very low	29.4	Very low	142 Å²	142	143.9 Å²	143.9	66%	0.664	73%	0.733	S	S	*	*			cis	-143.8	166.7	-3.6	-85.4	177.5	-0.3	0	0	106.8
784	L	25.3	Very low	29.5	Very low	131 Å²	131	146.2 Å²	146.2	69%	0.686	73%	0.728	S	S	*	*			cis	89.7	93.4	18.3	-154.4	-169.6	0	0	0	115.7
785	I	30.4	Very low	29.4	Very low	142 Å²	142	146.5 Å²	146.5	73%	0.728	72%	0.72	S	S	*	*			trans	-170.5	117.3	139.8	-96.3	154.3	0	0	0	113
786	N	28.2	Very low	29.3	Very low	142 Å²	142	148 Å²	148	76%	0.759	72%	0.721	S	S	*	*			trans	50.3	130.9	142.5	-54.4	-7.4	0	0	0	125.9
787	L	28.2	Very low	29.4	Very low	160 Å²	160	143.9 Å²	143.9	84%	0.838	71%	0.714	S	S	*	*			trans	-65.5	159.2	143.8	-109.5	76.8	0	0	0	110.7
788	P	29.8	Very low	29.5	Very low	111 Å²	111	147.3 Å²	147.3	72%	0.721	72%	0.72	S	S	*	*				-155.8	180	63	42.6	-21.8	0	0	0	118
789	L	36.6	Very low	29.6	Very low	161 Å²	161	150.3 Å²	150.3	84%	0.843	73%	0.727	S	S	*	*			trans	-92.8	145.6	150.2	-79.3	86.2	0	0	0	109
790	P	31.4	Very low	29.3	Very low	106 Å²	106	150.1 Å²	150.1	69%	0.688	73%	0.728	S	S	*	*				-150.5	142.9	111.7	32.6	-13.8	0	0	0	117.5
791	Y	25.6	Very low	29.1	Very low	236 Å²	236	148.6 Å²	148.6	93%	0.925	74%	0.735	S	S	*	*			trans	69.1	147.6	145.8	-84.4	-100.9	0	0	0	123.4
792	H	28.2	Very low	28.8	Very low	177 Å²	177	148.1 Å²	148.1	82%	0.819	74%	0.74	S	S	*	*			trans	-83.1	162.8	178.1	-90.4	-75	0	0	0	113.3
793	P	30.4	Very low	28.4	Very low	109 Å²	109	149.7 Å²	149.7	71%	0.708	75%	0.748	S	S	*	*				-133.9	157.7	105.5	39.4	-31.6	0	0	0	115.3
794	K	29	Very low	28.1	Very low	169 Å²	169	148.8 Å²	148.8	74%	0.735	75%	0.752	S	S	*	*			trans	23	145.4	134.1	-67.6	169.4	157.9	-124.6	0	119.8
795	E	30.2	Very low	28.1	Very low	133 Å²	133	149.2 Å²	149.2	62%	0.621	75%	0.754	S	S	*	*			cis	-165	165.9	18.8	-126.4	157.5	-146.1	0	0	113.6
796	I	30.7	Very low	28	Very low	133 Å²	133	149 Å²	149	68%	0.682	76%	0.755	S	S	*	*			trans	73.1	110.7	144.9	-77.5	160.3	0	0	0	122.1
797	N	27.9	Very low	28.3	Very low	118 Å²	118	148 Å²	148	63%	0.631	76%	0.756	S	S	*	*			trans	93.1	112.3	135.8	-75.2	-2.9	0	0	0	126.2
798	Y	28.2	Very low	28.3	Very low	184 Å²	184	145.3 Å²	145.3	72%	0.722	75%	0.751	S	S	*	*				83	105.2	126.2	-68	-38.9	0	0	0	124.7
799	K	28	Very low	28.4	Very low	191 Å²	191	147.2 Å²	147.2	83%	0.83	75%	0.754	S	S	*	*				77.9	151.7	120.3	-84.9	179.6	175.3	178.3	0	121.5
800	Y	24.2	Very low	28.1	Very low	223 Å²	223	146.5 Å²	146.5	88%	0.875	75%	0.749	S	S	*	*			trans	-72	161	172.7	-79.2	-101.6	0	0	0	113.7
801	S	24.3	Very low	28	Very low	108 Å²	108	145.9 Å²	145.9	76%	0.755	75%	0.748	S	S	*	*			trans	97	127.8	143.6	73.8	0	0	0	0	120.1
802	S	24.7	Very low	28.2	Very low	98 Å²	98	140.1 Å²	140.1	69%	0.685	74%	0.742	S	S	*	*			trans	74.3	108.4	143.6	-57	0	0	0	0	121.8
803	Q	24.5	Very low	28.3	Very low	170 Å²	170	136.5 Å²	136.5	79%	0.794	74%	0.736	S	S	*	*				72.6	128.4	129.2	-65.6	178.4	-38.2	0	0	121.4
804	T	24.2	Very low	28.2	Very low	123 Å²	123	136.2 Å²	136.2	76%	0.755	74%	0.737	S	S	*	*			trans	70.5	157.7	142.7	51.6	0	0	0	0	119.2
805	L	24.9	Very low	28.1	Very low	139 Å²	139	135.4 Å²	135.4	73%	0.728	74%	0.74	S	S	*	*			cis	-146.4	157.7	7.1	-110.5	130.3	0	0	0	110.6
806	N	29.5	Very low	27.9	Very low	139 Å²	139	134.5 Å²	134.5	74%	0.743	74%	0.744	S	S	*	*				16.4	155.3	128.4	-68	17.9	0	0	0	120.9
807	P	34.9	Very low	27.9	Very low	120 Å²	120	135.1 Å²	135.1	78%	0.779	75%	0.754	S	S	*	*				-140	-175.4	56.3	37.3	-14.4	0	0	0	114.7
808	S	27.7	Very low	27.8	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	76%	0.758	S	S	*	*			cis	-156.4	-173.7	27	-39.9	0	0	0	0	110.1
809	L	30.8	Very low	27.7	Very low	151 Å²	151	133.3 Å²	133.3	79%	0.791	76%	0.761	S	S	*	*			cis	-166.2	-179.5	-7.1	-133.4	175.2	0	0	0	108.4
810	I	30.8	Very low	27.9	Very low	146 Å²	146	130.5 Å²	130.5	75%	0.749	76%	0.759	S	S	*	*			trans	67.3	126.2	163.4	-65	170.7	0	0	0	116.9
811	S	28.9	Very low	28.1	Very low	94 Å²	94	125.9 Å²	125.9	66%	0.657	75%	0.754	S	S	*	*			cis	-166.1	155.1	-9.6	-98.1	0	0	0	0	113.1
812	S	29.8	Very low	28.4	Very low	115 Å²	115	128.7 Å²	128.7	80%	0.804	76%	0.756	S	S	*	*			trans	58.6	151.2	156	46.3	0	0	0	0	119.9
813	S	31.1	Very low	28.7	Very low	100 Å²	100	130 Å²	130	70%	0.699	75%	0.754	S	S	*	*			cis	-165	135	1.2	30	0	0	0	0	108.3
814	S	27.6	Very low	28.9	Very low	103 Å²	103	128.8 Å²	128.8	72%	0.72	75%	0.752	S	S	*	*				51.4	132.6	83.9	66.4	0	0	0	0	116.4
815	L	27.6	Very low	29.3	Very low	152 Å²	152	125.8 Å²	125.8	80%	0.796	75%	0.746	S	S	*	*			cis	-163	168	5.2	-116.6	170.7	0	0	0	114.1
816	T	25.3	Very low	29.5	Very low	114 Å²	114	126.7 Å²	126.7	70%	0.699	75%	0.747	S	S	*	*			trans	4.5	144.1	162.4	45.5	0	0	0	0	124.9
817	T	30.2	Very low	29.6	Very low	147 Å²	147	127.6 Å²	127.6	90%	0.902	74%	0.744	S	S	*	*			trans	-158.9	179.5	143.2	5	0	0	0	0	111.6
818	V	26.8	Very low	29.6	Very low	118 Å²	118	127.3 Å²	127.3	72%	0.715	73%	0.732	S	S	*	*			trans	-148.1	148.3	-150.6	150	0	0	0	0	116.3
819	N	26.4	Very low	29.6	Very low	145 Å²	145	133 Å²	133	78%	0.775	74%	0.738	S	S	*	*			trans	70.1	159.8	164.7	-72.9	-4.7	0	0	0	118.4
820	V	31.5	Very low	29.6	Very low	133 Å²	133	129.2 Å²	129.2	81%	0.806	74%	0.736	S	S	*	*			cis	-136.7	158	34.6	172.9	0	0	0	0	114.3
821	T	28.2	Very low	29.6	Very low	125 Å²	125	129.7 Å²	129.7	77%	0.767	73%	0.734	S	S	*	*			trans	-122.9	128.4	174.8	52.4	0	0	0	0	113.2
822	E	30.3	Very low	29.7	Very low	168 Å²	168	133.1 Å²	133.1	79%	0.785	74%	0.737	S	S	*	*			trans	-162.4	161.3	166.4	-85.6	-145.6	116.2	0	0	110.5
823	I	31.3	Very low	29.5	Very low	126 Å²	126	132 Å²	132	65%	0.646	73%	0.729	S	S	*	*			cis	-163.3	148.9	-41.3	-128.9	170.7	0	0	0	110.1
824	N	29.8	Very low	29.4	Very low	143 Å²	143	133.4 Å²	133.4	77%	0.765	73%	0.728	S	S	*	*			trans	59.5	155.7	169.7	-69.2	-29.8	0	0	0	119.9
825	G	32.1	Very low	29.5	Very low	60 Å²	60	138.4 Å²	138.4	62%	0.619	73%	0.732	S	S	*	*			cis	-132.8	164.1	-4.8	0	0	0	0	0	111.7
826	Q	29.1	Very low	29.6	Very low	158 Å²	158	136.1 Å²	136.1	74%	0.738	73%	0.729	S	S	*	*				51.3	123.3	70.4	-68	-159.3	26.9	0	0	112
827	K	31.3	Very low	29.7	Very low	158 Å²	158	135.6 Å²	135.6	69%	0.687	73%	0.73	S	S	*	*			cis	-167.2	164.4	35.4	-106.7	149.8	170.7	-75.7	0	110
828	E	34.2	Very low	29.5	Very low	115 Å²	115	139.8 Å²	139.8	54%	0.537	73%	0.729	S	S	.	*			cis	-157.8	163.9	-13	-138.2	-176.2	100	0	0	112.9
829	R	28.5	Very low	29.6	Very low	222 Å²	222	141.6 Å²	141.6	84%	0.838	74%	0.735	S	S	*	*			trans	-0.2	142.6	161.5	-68.2	168.5	-173	147	-13.2	124.4
830	G	30.6	Very low	29.6	Very low	72 Å²	72	145.3 Å²	145.3	74%	0.742	74%	0.738	S	S	*	*			trans	145.7	144.3	133.2	0	0	0	0	0	116.2
831	H	31.2	Very low	29.5	Very low	155 Å²	155	146.3 Å²	146.3	72%	0.718	74%	0.738	S	S	*	*			cis	-168.3	135.6	-18.8	-147.5	10.5	0	0	0	110.8
832	K	30.1	Very low	29.3	Very low	166 Å²	166	144.3 Å²	144.3	72%	0.722	73%	0.729	S	S	*	*			trans	62.1	164.2	157.8	-68.2	160.9	175.4	158.2	0	120
833	S	26.5	Very low	29.3	Very low	91 Å²	91	144 Å²	144	64%	0.636	73%	0.733	S	S	*	*				174	161.4	-62.7	50.7	0	0	0	0	112.6
834	I	28.3	Very low	29.1	Very low	131 Å²	131	141.3 Å²	141.3	67%	0.672	74%	0.736	S	S	*	*			trans	78.1	144.5	160.1	-18	-177.5	0	0	0	119.9
835	Y	30	Very low	29.1	Very low	207 Å²	207	144 Å²	144	81%	0.812	74%	0.744	S	S	*	*			trans	76.5	137.2	168.7	-60.4	-70.2	0	0	0	118.1
836	S	29.8	Very low	29	Very low	105 Å²	105	146 Å²	146	73%	0.734	75%	0.746	S	S	*	*			cis	-146.1	168.2	8.4	-137.3	0	0	0	0	116.1
837	S	27.5	Very low	28.7	Very low	102 Å²	102	143.7 Å²	143.7	71%	0.713	75%	0.747	S	S	*	*			trans	-67.5	144.5	-178.3	39.8	0	0	0	0	114.8
838	R	25.7	Very low	28.9	Very low	236 Å²	236	141.7 Å²	141.7	89%	0.891	75%	0.751	S	S	*	*				54.8	107.9	80.2	-100.5	-170.8	-174.5	-179.5	3.5	115.7
839	N	29.6	Very low	28.7	Very low	156 Å²	156	141.9 Å²	141.9	83%	0.834	76%	0.76	S	S	*	*			trans	-159.5	136.1	134.9	-91.3	-29.4	0	0	0	106.9
840	R	25.9	Very low	28.8	Very low	222 Å²	222	136.6 Å²	136.6	84%	0.838	75%	0.754	S	S	*	*			cis	91	134.6	25.9	-138.1	-173.4	-161.3	-164.4	2.7	113.7
841	L	29.6	Very low	29.3	Very low	155 Å²	155	138.2 Å²	138.2	81%	0.812	75%	0.752	S	S	*	*			trans	73.5	150.9	171.7	-57.4	161.9	0	0	0	116.4
842	S	24.8	Very low	29.2	Very low	83 Å²	83	138.3 Å²	138.3	58%	0.58	76%	0.757	S	S	*	*			cis	-170.9	166.1	-22.7	50.6	0	0	0	0	111.7
843	N	29	Very low	29.3	Very low	162 Å²	162	140 Å²	140	87%	0.866	76%	0.759	S	S	*	*			trans	74	136.7	163.8	-53.8	-13.6	0	0	0	117.7
844	G	28.4	Very low	29.4	Very low	68 Å²	68	142.4 Å²	142.4	70%	0.701	76%	0.759	S	S	*	*			cis	-172.9	142.3	-7.6	0	0	0	0	0	116.7
845	Q	28	Very low	29.8	Very low	199 Å²	199	143 Å²	143	93%	0.93	76%	0.763	S	S	*	*			trans	53.6	159.5	149.1	-72	-178.2	-90.7	0	0	123.3
846	P	29.9	Very low	29.9	Very low	102 Å²	102	142 Å²	142	66%	0.662	76%	0.762	S	S	*	*			trans	-139.2	164.6	-154	41.6	-23	0	0	0	119.2
847	S	23.5	Very low	30.1	Very low	110 Å²	110	146.9 Å²	146.9	77%	0.769	77%	0.771	S	S	*	*			trans	63.1	173.7	152.5	69.1	0	0	0	0	118.8
848	P	35.5	Very low	30.1	Very low	116 Å²	116	147.3 Å²	147.3	75%	0.753	77%	0.773	S	S	*	*			cis	-105.2	-138.8	-8.3	18.5	7.3	0	0	0	111.1
849	T	30.3	Very low	30.7	Very low	120 Å²	120	141.5 Å²	141.5	74%	0.736	77%	0.766	S	S	*	*			cis	-156.5	148.7	5.4	-43.2	0	0	0	0	111.2
850	P	30	Very low	30.8	Very low	111 Å²	111	140.6 Å²	140.6	72%	0.721	77%	0.766	S	S	*	*			trans	-116.9	-159.8	176.4	45.4	-35.9	0	0	0	112.6
851	P	41.9	Very low	31	Very low	105 Å²	105	136.4 Å²	136.4	68%	0.682	77%	0.765	S	S	*	*			cis	-131.4	-160.9	-27.4	26	-0.9	0	0	0	113.9
852	L	28.9	Very low	30.9	Very low	157 Å²	157	136.3 Å²	136.3	82%	0.822	77%	0.765	S	S	*	*			trans	83.8	149.4	164	-51.7	169.1	0	0	0	116.3
853	R	32.7	Very low	31	Very low	203 Å²	203	141.7 Å²	141.7	77%	0.766	77%	0.774	S	S	*	*			cis	-148.6	161.5	9.3	-150.1	173.2	-177.9	159.7	4.2	113.5
854	E	27.7	Very low	31.1	Very low	140 Å²	140	145.8 Å²	145.8	65%	0.654	78%	0.778	S	S	*	*			trans	-10.4	146.4	167.9	-57.4	147.2	-134.2	0	0	122.1
855	I	36.2	Very low	31.3	Very low	144 Å²	144	151.1 Å²	151.1	74%	0.738	78%	0.781	S	S	*	*				172.9	123.1	109.3	-88.5	173.6	0	0	0	114.4
856	K	32.5	Very low	31.6	Very low	185 Å²	185	147 Å²	147	80%	0.804	77%	0.774	S	S	*	*			trans	48.5	141.1	148.6	-65.4	174.9	-177.9	168.6	0	124.6
857	K	34.2	Very low	31.8	Very low	209 Å²	209	150.3 Å²	150.3	91%	0.909	78%	0.778	S	S	*	*			trans	84.6	139.8	154.3	-73.6	174.7	179.1	-176.7	0	119.6
858	S	27.5	Very low	32.2	Very low	110 Å²	110	154.5 Å²	154.5	77%	0.769	78%	0.777	S	S	*	*			trans	-129.8	-175.8	-173.3	59.4	0	0	0	0	109.1
859	P	38.6	Very low	32.1	Very low	114 Å²	114	158.4 Å²	158.4	74%	0.74	78%	0.782	S	S	*	*			cis	-125.5	140.5	-20.7	31.6	-15.1	0	0	0	112.8
860	V	32.5	Very low	32	Very low	138 Å²	138	160.2 Å²	160.2	84%	0.836	79%	0.786	S	S	*	*			trans	-137.5	137.8	166.3	-177.1	0	0	0	0	110.6	N862	V860-N862 PolarHBondContact O-N 2.77Å
861	V	28.5	Very low	31.9	Very low	134 Å²	134	158.4 Å²	158.4	81%	0.812	79%	0.788	S	S	*	*			trans	-57.1	130.2	176.2	177	0	0	0	0	110.7
862	N	28.8	Very low	31.2	Very low	152 Å²	152	159.7 Å²	159.7	81%	0.813	80%	0.799	S	S	*	*			trans	-150.3	141.3	172.8	-132.8	-34.8	0	0	0	114.7	V860	V860-N862 PolarHBondContact O-N 2.77Å
863	Y	27.6	Very low	31.2	Very low	197 Å²	197	155.5 Å²	155.5	77%	0.773	79%	0.794	S	S	*	*			trans	-87.9	127	-178.6	-97.2	-109.1	0	0	0	111.9
864	R	30.6	Very low	31	Very low	248 Å²	248	157.7 Å²	157.7	94%	0.936	80%	0.802	S	S	*	*			trans	-134.6	122.7	152.6	-84	-177.6	168.4	172.3	-3.8	107
865	K	32.2	Very low	31.4	Very low	180 Å²	180	156.6 Å²	156.6	78%	0.783	81%	0.807	S	S	*	*			cis	75	73.1	21.6	-85.1	-177	179.1	171.2	0	117
866	S	34	Very low	31.2	Very low	111 Å²	111	155.6 Å²	155.6	78%	0.776	81%	0.81	S	S	*	*			trans	-143.9	119.1	136.4	48.3	0	0	0	0	106.6
867	K	34.3	Very low	31	Very low	172 Å²	172	155.2 Å²	155.2	75%	0.748	82%	0.816	S	S	*	*				52.4	127.4	58.6	-68.5	-172.1	176.5	178.6	0	111.7
868	R	31.7	Very low	30.7	Very low	199 Å²	199	149.9 Å²	149.9	75%	0.751	81%	0.811	S	S	*	*			cis	-150.3	159	-6	-97	168	171.1	168.6	-7.8	105.2
869	K	32.6	Very low	30.7	Very low	198 Å²	198	149.2 Å²	149.2	86%	0.861	81%	0.812	S	S	*	*				-153.1	141.3	57.1	-61.8	172.2	179	176.4	0	106.7
870	I	29.1	Very low	30.5	Very low	157 Å²	157	149.5 Å²	149.5	81%	0.805	82%	0.817	S	S	*	*				47.7	82.2	56.2	-51.5	-176.8	0	0	0	112.6
871	G	28.8	Very low	30.4	Very low	74 Å²	74	150.8 Å²	150.8	76%	0.763	82%	0.817	S	S	*	*			trans	-152.4	118.5	167.4	0	0	0	0	0	108.5
872	S	26.8	Very low	30.6	Very low	131 Å²	131	153.9 Å²	153.9	92%	0.916	82%	0.82	S	S	*	*			trans	-79.2	131.6	-175	48.3	0	0	0	0	112
873	G	28.6	Very low	30.9	Very low	70 Å²	70	155.2 Å²	155.2	72%	0.722	82%	0.818	S	S	*	*			trans	-169.4	117.6	170.9	0	0	0	0	0	112.6
874	R	27.6	Very low	31.3	Very low	249 Å²	249	151.6 Å²	151.6	94%	0.94	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-73.6	127.9	161.8	-82.4	177.1	166.6	171.3	-5.8	108.3
875	P	36.2	Very low	31.6	Very low	117 Å²	117	148.3 Å²	148.3	76%	0.76	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-76.5	139.3	154.2	32	-30.7	0	0	0	109.4
876	P	32.6	Very low	31.6	Very low	122 Å²	122	145.9 Å²	145.9	79%	0.792	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-77.1	163.2	170.1	33.1	-34.6	0	0	0	111.5
877	L	28.1	Very low	31.7	Very low	177 Å²	177	146.6 Å²	146.6	93%	0.927	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-77.7	130.1	167.5	-64.4	93.1	0	0	0	110.2
878	A	27.7	Very low	31.7	Very low	97 Å²	97	144 Å²	144	80%	0.802	81%	0.807	S	S	*	*			trans	174.1	162.1	140.1	0	0	0	0	0	112.2
879	A	27.6	Very low	32.2	Very low	96 Å²	96	139.9 Å²	139.9	79%	0.793	80%	0.795	S	S	*	*			trans	57.5	70.5	155.9	0	0	0	0	0	118.5
880	S	34.2	Very low	32.3	Very low	121 Å²	121	139.6 Å²	139.6	85%	0.846	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-75.6	131.4	146.6	49.7	0	0	0	0	109.8	K882	S880-K882 PolarHBondContact O-N 2.76Å
881	I	31.5	Very low	33.1	Very low	165 Å²	165	137.8 Å²	137.8	85%	0.846	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-70.5	122.9	-172	-64.5	159.5	0	0	0	110.6
882	K	32.1	Very low	33.7	Very low	199 Å²	199	142.2 Å²	142.2	87%	0.865	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71.1	132.8	163	-74.7	-173.2	175.9	-175.9	0	109.2	S880	S880-K882 PolarHBondContact O-N 2.76Å
883	K	35.9	Very low	34.8	Very low	179 Å²	179	140 Å²	140	78%	0.778	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-77.1	143.4	161.5	-66.6	-176.2	177.2	-176	0	109
884	P	36.1	Very low	36	Very low	121 Å²	121	143.3 Å²	143.3	79%	0.786	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-67.6	148	163.7	30.8	-33.6	0	0	0	109.6
885	H	35.1	Very low	37.5	Very low	179 Å²	179	138.9 Å²	138.9	83%	0.829	76%	0.764	S	S	*	*			trans	-96.5	113.8	168.3	-72.4	-97.4	0	0	0	108.1	L887	H885-L887 PolarHBondContact O-N 2.77Å
886	T	32.5	Very low	38.6	Very low	129 Å²	129	141.7 Å²	141.7	79%	0.791	76%	0.764	S	S	*	*			trans	-72.7	112.5	170.9	-48.4	0	0	0	0	108.6
887	L	36.8	Very low	40	Very low	127 Å²	127	139.6 Å²	139.6	67%	0.665	74%	0.741	S	S	*	*			trans	-81	128.9	164.3	-73	166.9	0	0	0	108.4	H885 F889	H885-L887 PolarHBondContact O-N 2.77Å; L887-F889 HydrophobicContact CB-CD2 4.48Å; L887-F889 HydrophobicContact CB-CE2 3.84Å; L887-F889 HydrophobicContact CB-CZ 4.09Å; L887-F889 HydrophobicContact CD1-CE2 4.47Å; L887-F889 HydrophobicContact CD1-CZ 4.07Å
888	V	34.3	Very low	42	Very low	118 Å²	118	134.4 Å²	134.4	72%	0.715	72%	0.719	S	S	*	*			trans	-106.3	127.9	168.1	179.8	0	0	0	0	106.3	E890	V888-E890 HydrophobicContact CG1-CG 4.49Å
889	F	41.7	Very low	43.9	Very low	112 Å²	112	135.5 Å²	135.5	49%	0.491	71%	0.708	S	S	.	*			trans	-110.1	113.6	176.2	-64.2	-82.7	0	0	0	108.3	L887 D891 W897	L887-F889 HydrophobicContact CB-CD2 4.48Å; L887-F889 HydrophobicContact CB-CE2 3.84Å; L887-F889 HydrophobicContact CB-CZ 4.09Å; L887-F889 HydrophobicContact CD1-CE2 4.47Å; L887-F889 HydrophobicContact CD1-CZ 4.07Å; F889-D891 PolarHBondContact O-N 3.44Å; F889-W897 HydrophobicContact CD2-CH2 4.49Å; F889-W897 HydrophobicContact CG-CH2 4.43Å
890	E	35.6	Very low	45.9	Very low	192 Å²	192	136.9 Å²	136.9	90%	0.897	70%	0.702	S	S	*	*			trans	-90.5	76.4	174	-66.1	-177	148.5	0	0	109.4	V888	V888-E890 HydrophobicContact CG1-CG 4.49Å
891	D	46.1	Very low	47.3	Very low	118 Å²	118	135.8 Å²	135.8	63%	0.631	68%	0.682	S	S	*	*			trans	-159.1	111.5	170	-145	-13.4	0	0	0	112	F889 N893	F889-D891 PolarHBondContact O-N 3.44Å; D891-N893 PolarHBondContact O-N 2.71Å
892	D	40.5	Very low	48.9	Very low	168 Å²	168	131.2 Å²	131.2	90%	0.898	66%	0.656	S	S	*	*	S	Bend	trans	-77.9	35.5	-167.2	-81.1	-42.3	0	0	0	115
893	N	49.3	Very low	50.5	Low	84 Å²	84	125 Å²	125	45%	0.449	63%	0.634	S	S	.	*			trans	-134.5	47.7	-173.2	-90.8	-80.7	0	0	0	115.3	D891 N895 K896	D891-N893 PolarHBondContact O-N 2.71Å; N893-N895 PolarHBondContact O-N 3.43Å; N893-K896 PolarHBondContact O-N 2.94Å
894	Q	53.8	Low	51.8	Low	140 Å²	140	119.8 Å²	119.8	65%	0.654	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-51.4	-24.2	175.1	-62	-177.9	7.2	0	0	114.6	K896 W897	Q894-K896 VanDerWaalsContact C-N 3.25Å; Q894-K896 PolarHBondContact O-N 2.88Å; Q894-W897 PolarHBondContact O-N 3.46Å
895	N	59.8	Low	52.8	Low	155 Å²	155	116.9 Å²	116.9	83%	0.829	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-72.4	-9.8	178.5	-72.6	-17.9	0	0	0	114.6	N893	N893-N895 PolarHBondContact O-N 3.43Å
896	K	58.4	Low	53.8	Low	176 Å²	176	116.5 Å²	116.5	77%	0.765	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-96.2	-6.6	175.9	-74.4	-176.7	177.3	174.7	0	114.6	N893 Q894	N893-K896 PolarHBondContact O-N 2.94Å; Q894-K896 VanDerWaalsContact C-N 3.25Å; Q894-K896 PolarHBondContact O-N 2.88Å
897	W	61.9	Low	54.8	Low	78 Å²	78	118.9 Å²	118.9	30%	0.295	60%	0.596	S	S	.	*	S	Bend	trans	-77.8	140.3	179.4	-60.3	-3.6	0	0	0	111.2	F889 Q894 F901 K902 L905	F889-W897 HydrophobicContact CD2-CH2 4.49Å; F889-W897 HydrophobicContact CG-CH2 4.43Å; Q894-W897 PolarHBondContact O-N 3.46Å; W897-F901 HydrophobicContact CB-CD1 4.21Å; W897-F901 HydrophobicContact CD2-CD1 4.09Å; W897-F901 HydrophobicContact CD2-CE1 4.11Å; W897-F901 AromaticContact CE3-CD1 3.96Å; W897-F901 HydrophobicContact CE3-CD1 3.96Å; W897-F901 AromaticContact CE3-CE1 3.98Å; W897-F901 HydrophobicContact CE3-CE1 3.98Å; W897-F901 HydrophobicContact CG-CD1 4.22Å; W897-F901 HydrophobicContact CZ3-CE1 4.32Å; W897-K902 HydrophobicContact CB-CG 4.25Å; W897-K902 WeakPolarHBondContact O-CE 3.37Å; W897-K902 PolarHBondContact O-NZ 3.47Å; W897-L905 HydrophobicContact CE3-CD1 4.25Å; W897-L905 HydrophobicContact CZ3-CD1 3.84Å
898	S	72.1	Confident	55.1	Low	68 Å²	68	122.7 Å²	122.7	48%	0.476	62%	0.616	S	S	.	*			trans	-68.6	151.7	176.9	59.6	0	0	0	0	112.1	D900 F901 K902	S898-D900 PolarHBondContact O-N 3.14Å; S898-F901 WeakPolarHBondContact O-CB 3.24Å; S898-F901 PolarHBondContact O-N 3.37Å; S898-F901 WeakPolarHBondContact OG-CB 3.31Å; S898-K902 PolarHBondContact O-N 2.89Å
899	E	67.2	Low	56.1	Low	121 Å²	121	122.9 Å²	122.9	57%	0.565	61%	0.611	S	S	*	*	H	α-helix	trans	-58.2	-36.8	176.5	-74.4	-59.5	117.6	0	0	112.3	F901 K902 T903	E899-F901 VanDerWaalsContact C-N 3.29Å; E899-F901 PolarHBondContact O-N 3.31Å; E899-K902 PolarHBondContact O-N 3.23Å; E899-K902 WeakPolarHBondContact OE1-CD 3.27Å; E899-K902 IonicContact OE1-NZ 3.61Å; E899-K902 PolarHBondContact OE1-NZ 3.41Å; E899-K902 VanDerWaalsContact OE1-NZ 3.15Å; E899-T903 WeakPolarHBondContact O-CB 3.47Å; E899-T903 WeakPolarHBondContact O-CG2 3.44Å; E899-T903 PolarHBondContact O-N 2.84Å; E899-T903 PolarHBondContact O-OG1 3.38Å
900	D	68.7	Low	56.9	Low	124 Å²	124	123.5 Å²	123.5	66%	0.663	62%	0.617	S	S	*	*	H	α-helix	trans	-62.6	-35	175.3	-58.4	-47.5	0	0	0	112.4	S898 T903 S904	S898-D900 PolarHBondContact O-N 3.14Å; D900-T903 WeakPolarHBondContact CA-OG1 3.42Å; D900-T903 PolarHBondContact O-OG1 3.09Å; D900-S904 VanDerWaalsContact O-CB 3.22Å; D900-S904 WeakPolarHBondContact O-CB 3.45Å; D900-S904 PolarHBondContact O-N 2.89Å; D900-S904 VanDerWaalsContact O-N 3.08Å; D900-S904 PolarHBondContact O-OG 3.37Å
901	F	63.4	Low	58	Low	99 Å²	99	119.7 Å²	119.7	43%	0.434	60%	0.602	S	S	.	*	H	α-helix	trans	-74.4	-44.3	176.8	-170.4	-105.9	0	0	0	111.3	W897 S898 E899 S904 L905	W897-F901 HydrophobicContact CB-CD1 4.21Å; W897-F901 HydrophobicContact CD2-CD1 4.09Å; W897-F901 HydrophobicContact CD2-CE1 4.11Å; W897-F901 AromaticContact CE3-CD1 3.96Å; W897-F901 HydrophobicContact CE3-CD1 3.96Å; W897-F901 AromaticContact CE3-CE1 3.98Å; W897-F901 HydrophobicContact CE3-CE1 3.98Å; W897-F901 HydrophobicContact CG-CD1 4.22Å; W897-F901 HydrophobicContact CZ3-CE1 4.32Å; S898-F901 WeakPolarHBondContact O-CB 3.24Å; S898-F901 PolarHBondContact O-N 3.37Å; S898-F901 WeakPolarHBondContact OG-CB 3.31Å; E899-F901 VanDerWaalsContact C-N 3.29Å; E899-F901 PolarHBondContact O-N 3.31Å; F901-S904 PolarHBondContact O-N 3.44Å; F901-L905 HydrophobicContact CD1-CD1 3.93Å; F901-L905 HydrophobicContact CE1-CD1 3.55Å; F901-L905 HydrophobicContact CZ-CD1 4.11Å; F901-L905 PolarHBondContact O-N 3.28Å
902	K	65.4	Low	58.7	Low	69 Å²	69	119.8 Å²	119.8	30%	0.3	60%	0.6	S	S	.	*	H	α-helix	trans	-60.6	-46.9	175.3	-66.9	175.2	-171.9	165.9	0	112	W897 S898 E899 S904 L905 H906	W897-K902 HydrophobicContact CB-CG 4.25Å; W897-K902 WeakPolarHBondContact O-CE 3.37Å; W897-K902 PolarHBondContact O-NZ 3.47Å; S898-K902 PolarHBondContact O-N 2.89Å; E899-K902 PolarHBondContact O-N 3.23Å; E899-K902 WeakPolarHBondContact OE1-CD 3.27Å; E899-K902 IonicContact OE1-NZ 3.61Å; E899-K902 PolarHBondContact OE1-NZ 3.41Å; E899-K902 VanDerWaalsContact OE1-NZ 3.15Å; K902-S904 VanDerWaalsContact C-N 3.31Å; K902-S904 PolarHBondContact O-N 3.29Å; K902-L905 PolarHBondContact O-N 2.93Å; K902-H906 WeakPolarHBondContact O-CB 3.21Å; K902-H906 PolarHBondContact O-N 3.4Å
903	T	66.5	Low	59.9	Low	67 Å²	67	116.8 Å²	116.8	41%	0.411	58%	0.581	S	S	.	*	H	α-helix	trans	-71.5	-23.3	178.8	55.8	0	0	0	0	113.4	E899 D900	E899-T903 WeakPolarHBondContact O-CB 3.47Å; E899-T903 WeakPolarHBondContact O-CG2 3.44Å; E899-T903 PolarHBondContact O-N 2.84Å; E899-T903 PolarHBondContact O-OG1 3.38Å; D900-T903 WeakPolarHBondContact CA-OG1 3.42Å; D900-T903 PolarHBondContact O-OG1 3.09Å
904	S	62.9	Low	60.6	Low	71 Å²	71	118.9 Å²	118.9	50%	0.497	59%	0.59	S	S	.	*	H	α-helix	trans	-74.6	-42.1	169.8	-63.9	0	0	0	0	112.1	D900 F901 K902 H906 K907	D900-S904 VanDerWaalsContact O-CB 3.22Å; D900-S904 WeakPolarHBondContact O-CB 3.45Å; D900-S904 PolarHBondContact O-N 2.89Å; D900-S904 VanDerWaalsContact O-N 3.08Å; D900-S904 PolarHBondContact O-OG 3.37Å; F901-S904 PolarHBondContact O-N 3.44Å; K902-S904 VanDerWaalsContact C-N 3.31Å; K902-S904 PolarHBondContact O-N 3.29Å; S904-H906 VanDerWaalsContact C-N 3.29Å; S904-H906 PolarHBondContact O-N 3.02Å; S904-K907 PolarHBondContact O-N 2.89Å
905	L	57.5	Low	61.1	Low	59 Å²	59	117.4 Å²	117.4	31%	0.309	59%	0.586	S	S	.	*	H	α-helix	trans	-60.7	-38.4	171.6	-92.7	163.4	0	0	0	112	W897 F901 K902 K907 L908	W897-L905 HydrophobicContact CE3-CD1 4.25Å; W897-L905 HydrophobicContact CZ3-CD1 3.84Å; F901-L905 HydrophobicContact CD1-CD1 3.93Å; F901-L905 HydrophobicContact CE1-CD1 3.55Å; F901-L905 HydrophobicContact CZ-CD1 4.11Å; F901-L905 PolarHBondContact O-N 3.28Å; K902-L905 PolarHBondContact O-N 2.93Å; L905-K907 PolarHBondContact O-N 3.48Å; L905-L908 PolarHBondContact O-N 3.42Å
906	H	55.6	Low	61.2	Low	171 Å²	171	114.5 Å²	114.5	79%	0.792	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	3.5	179.4	-144.9	-48.2	0	0	0	114.5	K902 S904	K902-H906 WeakPolarHBondContact O-CB 3.21Å; K902-H906 PolarHBondContact O-N 3.4Å; S904-H906 VanDerWaalsContact C-N 3.29Å; S904-H906 PolarHBondContact O-N 3.02Å
907	K	53.7	Low	61.4	Low	180 Å²	180	109.4 Å²	109.4	78%	0.783	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	2	176.6	-86.1	176.7	176.7	167.3	0	114	S904 L905	S904-K907 PolarHBondContact O-N 2.89Å; L905-K907 PolarHBondContact O-N 3.48Å
908	L	42.1	Very low	61.4	Low	206 Å²	206	112.3 Å²	112.3	100%	1.079	57%	0.573	S	S	*	*			trans	-100.9	0	178.2	-77.1	165.1	0	0	0	112.2	L905	L905-L908 PolarHBondContact O-N 3.42Å

Retrieved 908 of 908 residues in 198.2 ms (Link to these results)

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