A0A5K4F0H3_SCHMA Loading...

Zn_dep_PLPC domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F0H3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,759 aa.

						>A0A5K4F0H3_SCHMA|A0A5K4F0H3
MTKKVNVYCESNLPSFLSCECHVNEPERVAFVSGIRENSKVCYEEYTEVIKSLKEVVDKCLFTWETFPVQLPKSFLSLAANEDLNVSDVFYDNNVEKCEATARICFRDLNVVNKSQRQEIRTNAQFVVPCTTFTGEVHAWKISPWLLNGTRNIHKHFNRDLYNAFSVVVVTSMNFIENPNFSISRSLVELSIAVHSILDIFFGWPRVNNGDVDLKLLEERLGFLICELSVKSNHKKKVLDFWSICEHLSKLPFGKCEEIPENIPLPYRFLTPNRVSVDLRLHDPVLLERCLHVIGDLENSVRGDWFQDFKEYSVSQLRDEKKSVSEVKRLVLLDGMKQYAIRLFDAIRQSEALHKISPGIAEPLIQEAKFNLIVTEAKELFMQNWLSYCQSYERNLKLNNPVLFNIPKWRSKQWYYAKAEYLQEHKLDIHEYVLSKCISNGLDSYAFLIGRDLAFLRDRECLLRDQIFKSARFPDEEFIFQVSRRCLRNVYVYREDFSLSNHYQLVDTILVSYDSDKGSPDQLPTIKRHIKRNKTQNCTTEVIPLMYRFPRSSFAMNTSKTNKGDNFPSHVGFVTDNTVTSNTDFSNILNSPDHRYRDPLLPPKSSTDQVNYSQSNFVMQSTLVLKASTRYFMWRWLVFFLCTYSWLIRSLQYFFVIIPFQSCVSYVVLFKRTSIYYMYKVDKNSGYVYYDKAYYNHTLISFLRQMWTTLRRNRQKFDHQLLSTGFFRWYIIRPIHWIWTYIIHGVLTTMILVVFWPTLCIICSTTSIVIGVLSIPVIPLLSLLAHLLGLLFWNAYTPVLGSNRLIPLFEIIFYQFLLKSVVQFFVSVLCAFILCPIWFVLHLLFTVTKFLLYTLWDAFVFYLVFKLVTRIPCQENCSVKRSNDPKTVRSICLLARPEDILIILGVQLEYLELNLWKSQMELIAKKPINVYNEFLQSLSSLPLSVLSDNTVADTLNTKTRCWLSLIEKSYNRRAKALEVQTNSRFFRRIKLSDRNLKLTLNLGSELTKCFYELRILPRIHLLKLHIDDWWSKFQLDENDFTGLCSYLLRNAFGEQVFCCITEKNITIPLQIRDASLGQRFRELILSNLSKQICTSSAHSVHGNGVQSVTVGSVDHLEEESCDLIELDNEDESLSLGSDSCASRRERLSQRCTVIAVSSKKDHSDNDINNCNNVNPSSDFPVDPRNSATETSCDPNSVYVSPIVHSSVHPGGYEPNLMKPSIIDPMSLIHIDLPNFPLSVFAPRTVRTLPSPLKSCSRRNVPPADKCTCNHNTSSQCSCISLTKNYLESDFHKHLAETWSDQSFDELNSLESDPLMQRRGATQSYHHTYSAVKRLLSSWTIFTSGNNVTNVDGVSTDENYKDENRELHDKIRSLLRFENEENQWCYCCDHSSTRSSATMSNVDKSIFAFQNVIQHMARVYHPCIITLLMHSRDRENTVLDVNHPLIHKLIHQITRPKAQMKLIKKIHAHENIVVSDLTGYLDSSSHKSDGQYACLRRNNGSNMNSMSLDTMNNASNDILPYFKQPKHSQQFLKSPISTSGLIHHPDSTAHHRWYSNVNVSFNNPHFANISNNDCINNVMNQSLHFQPNWSKIHSSHEGIYDFSHSQQHFIPMDEMAKKSSNNYENQITVTNSNNLLNAYSYRNSKCFWSGLEIPMNDHDDKDFSGGTPTPSLYGTEDAATTDDLDETEDILSMSSSVHHSELVDNLLNITAQEQDILNDISNPTATRPLRLPLAIPELLTISATTAGSGDTQVSGFTMIA
					

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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	28	Very low	25.4	Very low	251 Å²	251	159.8 Å²	159.8	100%	1.236	84%	0.837	S	S	*	*				0	154.8	0	-80.2	178.8	165.8	0	0	109.4
2	T	30.4	Very low	25.3	Very low	142 Å²	142	158.6 Å²	158.6	87%	0.871	83%	0.832	S	S	*	*			trans	-78.5	137	-173.8	42.8	0	0	0	0	113.2
3	K	26.6	Very low	25.4	Very low	210 Å²	210	157 Å²	157	91%	0.913	82%	0.823	S	S	*	*			trans	-149.6	131.8	152.9	-114.5	179	-178.6	179.9	0	109.9
4	K	26.1	Very low	25.5	Very low	190 Å²	190	155 Å²	155	83%	0.826	82%	0.824	S	S	*	*			trans	-75.4	146	170	-64.8	178.7	177.4	-179.7	0	109.4
5	V	25.5	Very low	25.6	Very low	134 Å²	134	150.6 Å²	150.6	81%	0.812	81%	0.811	S	S	*	*			trans	-134.1	117.1	146.9	179.4	0	0	0	0	106.5
6	N	21.7	Very low	25.6	Very low	114 Å²	114	151.6 Å²	151.6	61%	0.61	81%	0.806	S	S	*	*			trans	-85.9	145	165	-73.2	14.5	0	0	0	108.1
7	V	25.3	Very low	25.7	Very low	138 Å²	138	151.9 Å²	151.9	84%	0.836	81%	0.807	S	S	*	*			trans	-123.6	127	153	-179.6	0	0	0	0	106.5
8	Y	23	Very low	26	Very low	176 Å²	176	150.1 Å²	150.1	69%	0.69	81%	0.808	S	S	*	*			trans	-84.3	149	178.2	-84.5	-107.5	0	0	0	110.6
9	C	25.6	Very low	26.6	Very low	134 Å²	134	145.9 Å²	145.9	91%	0.905	79%	0.791	S	S	*	*			trans	-155.6	104.9	142	-130	0	0	0	0	109.4
10	E	22.5	Very low	27.6	Very low	163 Å²	163	146 Å²	146	76%	0.762	79%	0.785	S	S	*	*			trans	-87	138.7	170.1	-63.9	173.2	119.1	0	0	109.6
11	S	24.3	Very low	28.5	Very low	106 Å²	106	139.9 Å²	139.9	74%	0.741	75%	0.754	S	S	*	*				170.7	134.4	125.4	43.2	0	0	0	0	114
12	N	25.1	Very low	29.4	Very low	145 Å²	145	134 Å²	134	78%	0.775	72%	0.723	S	S	*	*			trans	49	92.6	142.6	-54.3	-17.8	0	0	0	120.9
13	L	26.3	Very low	30.6	Very low	138 Å²	138	129 Å²	129	72%	0.723	69%	0.692	S	S	*	*				-160	76.5	129.3	-144	81.7	0	0	0	115.3	S15	L13-S15 PolarHBondContact O-N 3.36Å
14	P	26.6	Very low	32	Very low	129 Å²	129	125.1 Å²	125.1	84%	0.838	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	66	-179.5	37.1	-34.7	0	0	0	113.2
15	S	26.5	Very low	33.8	Very low	89 Å²	89	119.9 Å²	119.9	62%	0.622	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154	1.1	-178.8	57.2	0	0	0	0	118.4	L13	L13-S15 PolarHBondContact O-N 3.36Å
16	F	26.1	Very low	35.7	Very low	167 Å²	167	114.1 Å²	114.1	73%	0.732	63%	0.625	S	S	*	*	S	Bend	trans	-132.9	42.1	-171	-91.1	-81.2	0	0	0	115
17	L	27.4	Very low	37.9	Very low	157 Å²	157	116 Å²	116	82%	0.822	63%	0.63	S	S	*	*			trans	-147.6	77.9	-179.8	-106	155.1	0	0	0	113.7
18	S	31	Very low	40.1	Very low	119 Å²	119	116 Å²	116	83%	0.832	62%	0.615	S	S	*	*			trans	-117.8	49.9	163.1	54.4	0	0	0	0	111.1	E20	S18-E20 PolarHBondContact O-N 3.18Å
19	C	37.8	Very low	42.4	Very low	70 Å²	70	110.4 Å²	110.4	47%	0.473	60%	0.599	S	S	.	*			trans	-72.3	107.1	-178.5	-70.3	0	0	0	0	111.9	C21 H22	C19-C21 HydrophobicContact CB-CB 4.41Å; C19-C21 PolarHBondContact O-N 3.19Å; C19-H22 PolarHBondContact O-N 2.82Å
20	E	46.2	Very low	44.2	Very low	147 Å²	147	106.3 Å²	106.3	69%	0.687	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	4.6	167.8	-60.3	-168.9	122.8	0	0	114	S18 H22 K73	S18-E20 PolarHBondContact O-N 3.18Å; E20-H22 VanDerWaalsContact C-N 3.33Å; E20-K73 IonicContact OE1-NZ 2.64Å; E20-K73 PolarHBondContact OE1-NZ 3.43Å; E20-K73 WeakPolarHBondContact OE2-CE 3.15Å; E20-K73 IonicContact OE2-NZ 3.74Å; E20-K73 PolarHBondContact OE2-NZ 3.48Å
21	C	46.9	Very low	46.1	Very low	18 Å²	18	99.5 Å²	99.5	12%	0.122	54%	0.543	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-19.1	172	-62.9	0	0	0	0	113.2	C19 V23 P1017	C19-C21 HydrophobicContact CB-CB 4.41Å; C19-C21 PolarHBondContact O-N 3.19Å; C21-V23 PolarHBondContact O-N 3.27Å; C21-V23 VanDerWaalsContact O-N 3.1Å; C21-P1017 HydrophobicContact CB-CB 4.49Å
22	H	47.2	Very low	47.5	Very low	128 Å²	128	100.7 Å²	100.7	59%	0.593	55%	0.546	S	S	*	.			trans	-75.2	95.6	173.7	-110.5	-83	0	0	0	110.3	C19 E20 N24	C19-H22 PolarHBondContact O-N 2.82Å; E20-H22 VanDerWaalsContact C-N 3.33Å; H22-N24 PolarHBondContact O-N 3.03Å
23	V	54.3	Low	48.7	Very low	37 Å²	37	94.4 Å²	94.4	22%	0.224	51%	0.513	C	S	.	.			trans	-70.7	110.3	160.4	-178.2	0	0	0	0	106.6	C21 M920	C21-V23 PolarHBondContact O-N 3.27Å; C21-V23 VanDerWaalsContact O-N 3.1Å; V23-M920 HydrophobicContact CB-CE 3.97Å; V23-M920 HydrophobicContact CG1-CE 3.98Å; V23-M920 HydrophobicContact CG1-SD 4.16Å; V23-M920 HydrophobicContact CG2-CE 3.74Å; V23-M920 HydrophobicContact CG2-SD 4.48Å
24	N	57.6	Low	49.6	Very low	128 Å²	128	91.8 Å²	91.8	68%	0.684	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-55.3	140.2	174.4	-69.2	-19	0	0	0	109.6	H22	H22-N24 PolarHBondContact O-N 3.03Å
25	E	62.3	Low	50.4	Low	81 Å²	81	90.7 Å²	90.7	38%	0.379	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-60.8	136.5	171.6	-69.5	-158.3	155.1	0	0	109.2	R28 W64 K926	E25-R28 IonicContact OE2-CZ 3.51Å; E25-R28 IonicContact OE2-NE 3.98Å; E25-R28 PolarHBondContact OE2-NE 3.49Å; E25-R28 IonicContact OE2-NH2 3.48Å; E25-R28 PolarHBondContact OE2-NH2 3.26Å; E25-W64 HydrophobicContact CB-CH2 4.24Å; E25-W64 HydrophobicContact CB-CZ3 4.23Å; E25-K926 IonicContact OE1-NZ 3.22Å; E25-K926 PolarHBondContact OE1-NZ 3.07Å; E25-K926 IonicContact OE2-NZ 2.71Å
26	P	66	Low	51.1	Low	13 Å²	13	96.1 Å²	96.1	8%	0.084	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-60.4	156	177.1	-15.3	25.1	0	0	0	111.4	R28 W64 T66 F67	P26-R28 PolarHBondContact O-N 3.27Å; P26-W64 HydrophobicContact CB-CB 4.06Å; P26-W64 HydrophobicContact CB-CD2 3.95Å; P26-W64 HydrophobicContact CB-CE3 3.64Å; P26-W64 HydrophobicContact CB-CG 4.16Å; P26-W64 HydrophobicContact CB-CZ3 4.3Å; P26-W64 HydrophobicContact CG-CB 4.42Å; P26-W64 HydrophobicContact CG-CD2 3.79Å; P26-W64 HydrophobicContact CG-CE3 3.8Å; P26-W64 HydrophobicContact CG-CG 4.08Å; P26-W64 HydrophobicContact CG-CZ3 4.25Å; P26-W64 VanDerWaalsContact O-CE3 3.25Å; P26-W64 WeakPolarHBondContact O-CZ3 3.16Å; P26-T66 WeakPolarHBondContact CB-O 3.34Å; P26-F67 HydrophobicContact CG-CD2 4.04Å; P26-F67 HydrophobicContact CG-CE2 4.3Å
27	E	68.7	Low	51.6	Low	152 Å²	152	97.5 Å²	97.5	71%	0.71	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-60.9	129.4	178.1	-66.8	-174.4	141.3	0	0	110.6	E65	E27-E65 PolarHBondContact O-N 3.01Å
28	R	71.5	Confident	51.9	Low	139 Å²	139	96 Å²	96	53%	0.525	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	112	-174	-63.3	-173.2	-167.3	173.6	6.9	109.4	E25 P26 F62 W64	E25-R28 IonicContact OE2-CZ 3.51Å; E25-R28 IonicContact OE2-NE 3.98Å; E25-R28 PolarHBondContact OE2-NE 3.49Å; E25-R28 IonicContact OE2-NH2 3.48Å; E25-R28 PolarHBondContact OE2-NH2 3.26Å; P26-R28 PolarHBondContact O-N 3.27Å; R28-F62 HydrophobicContact CB-CB 4.2Å; R28-F62 HydrophobicContact CB-CD2 4.07Å; R28-F62 HydrophobicContact CB-CG 4.3Å; R28-F62 HydrophobicContact CG-CD2 3.73Å; R28-F62 HydrophobicContact CG-CE2 4.1Å; R28-F62 HydrophobicContact CG-CG 4.26Å; R28-W64 HydrophobicContact CG-CE3 4.05Å; R28-W64 HydrophobicContact CG-CZ3 3.59Å
29	V	69.6	Low	52.1	Low	58 Å²	58	94.9 Å²	94.9	35%	0.352	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.9	169.8	168.2	0	0	0	0	109.5	F62 T63 E65	V29-F62 CarbonylContact O-C 3.46Å; V29-F62 WeakPolarHBondContact O-CA 3.42Å; V29-T63 PolarHBondContact N-O 3.33Å; V29-T63 PolarHBondContact O-N 2.9Å; V29-E65 HydrophobicContact CG2-CB 3.79Å; V29-E65 HydrophobicContact CG2-CG 4.18Å; V29-E65 WeakPolarHBondContact CG2-OE2 3.36Å
30	A	63.6	Low	52	Low	49 Å²	49	101.7 Å²	101.7	41%	0.405	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	136.1	174	0	0	0	0	0	110.6	V32 D58	A30-V32 PolarHBondContact O-N 2.9Å; A30-D58 WeakPolarHBondContact CB-O 3.31Å
31	F	62.4	Low	51.7	Low	20 Å²	20	99.3 Å²	99.3	9%	0.088	52%	0.523	C	S	.	.			trans	-77.3	85.6	-175.9	-172.8	-95.1	0	0	0	111	S33 L61 T63 V951 T954 L955	F31-S33 PolarHBondContact O-N 3.12Å; F31-L61 HydrophobicContact CB-CB 3.95Å; F31-L61 WeakPolarHBondContact CB-O 3.4Å; F31-L61 PolarHBondContact N-O 3.01Å; F31-T63 HydrophobicContact CD2-CG2 3.78Å; F31-T63 HydrophobicContact CE2-CG2 4.25Å; F31-V951 HydrophobicContact CD1-CG1 4.29Å; F31-V951 HydrophobicContact CE1-CB 4.29Å; F31-V951 HydrophobicContact CE1-CG1 3.66Å; F31-V951 HydrophobicContact CE1-CG2 4.1Å; F31-V951 HydrophobicContact CZ-CG1 4.11Å; F31-T954 HydrophobicContact CE2-CG2 4.21Å; F31-T954 HydrophobicContact CZ-CG2 4.26Å; F31-L955 HydrophobicContact CE2-CG 4.45Å
32	V	54.5	Low	51.2	Low	130 Å²	130	104.1 Å²	104.1	79%	0.788	56%	0.555	S	S	*	*			trans	-61	94.8	177.5	-176.9	0	0	0	0	110	A30	A30-V32 PolarHBondContact O-N 2.9Å
33	S	50.2	Low	51	Low	14 Å²	14	106.3 Å²	106.3	10%	0.098	56%	0.56	C	S	.	*			trans	-75.9	129.1	-178.9	58.5	0	0	0	0	110.6	F31 I35	F31-S33 PolarHBondContact O-N 3.12Å; S33-I35 PolarHBondContact O-N 3.34Å; S33-I35 WeakPolarHBondContact OG-CD1 3.21Å
34	G	45.2	Very low	50.8	Low	83 Å²	83	112.8 Å²	112.8	86%	0.856	59%	0.587	S	S	*	*			trans	-73.1	38.2	179.8	0	0	0	0	0	114.4	R36	G34-R36 PolarHBondContact O-N 2.95Å
35	I	43.3	Very low	50.5	Low	105 Å²	105	114.3 Å²	114.3	54%	0.538	59%	0.59	S	S	.	*			trans	-65.4	101.1	-179.4	-59.1	173.9	0	0	0	108.6	S33	S33-I35 PolarHBondContact O-N 3.34Å; S33-I35 WeakPolarHBondContact OG-CD1 3.21Å
36	R	40.1	Very low	50	Low	203 Å²	203	117.5 Å²	117.5	77%	0.766	60%	0.6	S	S	*	*			trans	-79.8	133.6	178.2	-166	176.5	-171.5	179.1	4.5	109.4	G34 N38	G34-R36 PolarHBondContact O-N 2.95Å; R36-N38 PolarHBondContact O-N 2.93Å
37	E	37.5	Very low	49.6	Very low	196 Å²	196	120.5 Å²	120.5	92%	0.916	62%	0.618	S	S	*	*			trans	-71.4	61.6	-177.4	-62.8	-176.3	133.7	0	0	113.3
38	N	32.8	Very low	49.1	Very low	127 Å²	127	120.3 Å²	120.3	68%	0.679	62%	0.617	S	S	*	*			trans	-115.8	43.5	-171.8	-87.1	6.9	0	0	0	113.1	R36	R36-N38 PolarHBondContact O-N 2.93Å
39	S	36.8	Very low	48.4	Very low	94 Å²	94	117.5 Å²	117.5	66%	0.657	62%	0.616	S	S	*	*			trans	-137.7	107.9	165.3	65.7	0	0	0	0	112	V41	S39-V41 PolarHBondContact O-N 2.67Å
40	K	34.6	Very low	48	Very low	213 Å²	213	119.4 Å²	119.4	93%	0.926	62%	0.623	S	S	*	*			trans	-69	99.4	163.1	-74.8	-174.4	175.4	-176.3	0	108.7
41	V	40.7	Very low	47.9	Very low	98 Å²	98	124.4 Å²	124.4	59%	0.594	64%	0.635	S	S	*	*			trans	-126	110.7	170.6	-178.3	0	0	0	0	107.6	S39 Y43	S39-V41 PolarHBondContact O-N 2.67Å; V41-Y43 PolarHBondContact O-N 3.04Å; V41-Y43 VanDerWaalsContact O-N 3.15Å
42	C	36.1	Very low	48.1	Very low	118 Å²	118	126.5 Å²	126.5	80%	0.797	65%	0.653	S	S	*	*			trans	-87.6	74.3	-172.7	-65.2	0	0	0	0	112.3
43	Y	43.1	Very low	48.5	Very low	175 Å²	175	122.7 Å²	122.7	69%	0.686	63%	0.628	S	S	*	*			trans	-149	122.6	159.3	-73.2	-66.2	0	0	0	109.8	V41 Y46	V41-Y43 PolarHBondContact O-N 3.04Å; V41-Y43 VanDerWaalsContact O-N 3.15Å; Y43-Y46 PolarHBondContact O-N 3.24Å
44	E	50.5	Low	49.1	Very low	173 Å²	173	126.2 Å²	126.2	81%	0.808	64%	0.641	S	S	*	*	H	α-helix	trans	-67.8	-40	-169.6	-65.8	-179.8	126.3	0	0	112.8	Y46 T47	E44-Y46 PolarHBondContact O-N 3.15Å; E44-T47 WeakPolarHBondContact O-CB 3.37Å; E44-T47 PolarHBondContact O-N 3.48Å; E44-T47 PolarHBondContact O-OG1 2.83Å
45	E	51.5	Low	50.1	Low	160 Å²	160	127.7 Å²	127.7	75%	0.748	63%	0.626	S	S	*	*	H	α-helix	trans	-55.1	-36.1	-179.8	-60.5	-179.6	139.9	0	0	113.2	T47 E48 V49	E45-T47 VanDerWaalsContact C-N 3.27Å; E45-T47 PolarHBondContact O-N 2.73Å; E45-E48 PolarHBondContact O-N 3.02Å; E45-V49 PolarHBondContact O-N 3.38Å
46	Y	52	Low	51.2	Low	147 Å²	147	125.9 Å²	125.9	58%	0.576	62%	0.62	S	S	*	*	H	α-helix	trans	-69.5	-24	178.7	-81.5	-88.3	0	0	0	113	Y43 E44 E48 I50	Y43-Y46 PolarHBondContact O-N 3.24Å; E44-Y46 PolarHBondContact O-N 3.15Å; Y46-E48 VanDerWaalsContact C-N 3.33Å; Y46-I50 WeakPolarHBondContact O-CB 3.32Å; Y46-I50 WeakPolarHBondContact O-CD1 3.5Å; Y46-I50 VanDerWaalsContact O-CG1 3.23Å; Y46-I50 WeakPolarHBondContact O-CG1 3.46Å; Y46-I50 PolarHBondContact O-N 2.98Å
47	T	57.5	Low	52.3	Low	76 Å²	76	116.9 Å²	116.9	47%	0.466	59%	0.587	S	S	.	*	H	α-helix	trans	-71.2	-31.2	-179.9	71.5	0	0	0	0	112.1	E44 E45 K51	E44-T47 WeakPolarHBondContact O-CB 3.37Å; E44-T47 PolarHBondContact O-N 3.48Å; E44-T47 PolarHBondContact O-OG1 2.83Å; E45-T47 VanDerWaalsContact C-N 3.27Å; E45-T47 PolarHBondContact O-N 2.73Å; T47-K51 WeakPolarHBondContact O-CB 3.36Å; T47-K51 WeakPolarHBondContact O-CG 3.27Å; T47-K51 PolarHBondContact O-N 2.99Å
48	E	58.4	Low	53.6	Low	148 Å²	148	110 Å²	110	69%	0.692	56%	0.556	S	S	*	*	H	α-helix	trans	-77.7	-37.4	178.2	-151	169.4	-136	0	0	111.4	E45 Y46 K51 S52	E45-E48 PolarHBondContact O-N 3.02Å; Y46-E48 VanDerWaalsContact C-N 3.33Å; E48-K51 PolarHBondContact O-N 3.28Å; E48-S52 WeakPolarHBondContact O-CB 3.35Å; E48-S52 PolarHBondContact O-N 3.18Å; E48-S52 PolarHBondContact O-OG 2.83Å
49	V	56.6	Low	55.3	Low	81 Å²	81	110.9 Å²	110.9	49%	0.491	55%	0.554	S	S	.	*	H	α-helix	trans	-63.1	-40.8	169.4	179.8	0	0	0	0	111.3	E45 S52 L53	E45-V49 PolarHBondContact O-N 3.38Å; V49-S52 WeakPolarHBondContact CA-OG 3.5Å; V49-S52 PolarHBondContact O-OG 2.75Å; V49-S52 VanDerWaalsContact O-OG 3.13Å; V49-L53 WeakPolarHBondContact O-CB 3.46Å; V49-L53 PolarHBondContact O-N 3.14Å
50	I	59.8	Low	56.6	Low	98 Å²	98	109.1 Å²	109.1	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-69.7	-38	177.2	-70.8	166.5	0	0	0	111.6	Y46 K54	Y46-I50 WeakPolarHBondContact O-CB 3.32Å; Y46-I50 WeakPolarHBondContact O-CD1 3.5Å; Y46-I50 VanDerWaalsContact O-CG1 3.23Å; Y46-I50 WeakPolarHBondContact O-CG1 3.46Å; Y46-I50 PolarHBondContact O-N 2.98Å; I50-K54 WeakPolarHBondContact O-CB 3.43Å; I50-K54 PolarHBondContact O-N 3.45Å
51	K	62.9	Low	58.3	Low	153 Å²	153	99.4 Å²	99.4	67%	0.665	50%	0.499	S	S	*	.	H	α-helix	trans	-63.1	-48.1	173.1	-82.9	178.3	176	175.4	0	112.5	T47 E48 K54 E55	T47-K51 WeakPolarHBondContact O-CB 3.36Å; T47-K51 WeakPolarHBondContact O-CG 3.27Å; T47-K51 PolarHBondContact O-N 2.99Å; E48-K51 PolarHBondContact O-N 3.28Å; K51-K54 WeakPolarHBondContact O-CB 3.32Å; K51-K54 PolarHBondContact O-N 3.36Å; K51-E55 PolarHBondContact O-N 3.26Å
52	S	65.3	Low	60.1	Low	65 Å²	65	95.8 Å²	95.8	46%	0.455	48%	0.475	S	S	.	.	H	α-helix	trans	-67.7	-37	178.7	51.3	0	0	0	0	112.3	E48 V49 K54 E55 V56	E48-S52 WeakPolarHBondContact O-CB 3.35Å; E48-S52 PolarHBondContact O-N 3.18Å; E48-S52 PolarHBondContact O-OG 2.83Å; V49-S52 WeakPolarHBondContact CA-OG 3.5Å; V49-S52 PolarHBondContact O-OG 2.75Å; V49-S52 VanDerWaalsContact O-OG 3.13Å; S52-K54 VanDerWaalsContact C-N 3.35Å; S52-E55 PolarHBondContact O-N 3.41Å; S52-V56 WeakPolarHBondContact O-CG2 3.47Å; S52-V56 PolarHBondContact O-N 3.01Å
53	L	63.6	Low	62.1	Low	50 Å²	50	90.4 Å²	90.4	26%	0.262	44%	0.439	S	S	.	.	H	α-helix	trans	-61.9	-41.7	169.9	-171.1	73.6	0	0	0	111.5	V49 V56 V57 L943	V49-L53 WeakPolarHBondContact O-CB 3.46Å; V49-L53 PolarHBondContact O-N 3.14Å; L53-V56 PolarHBondContact O-N 2.77Å; L53-V57 WeakPolarHBondContact O-CB 3.3Å; L53-V57 WeakPolarHBondContact O-CG2 3.46Å; L53-V57 PolarHBondContact O-N 3.26Å; L53-L943 HydrophobicContact CD2-CD2 3.99Å
54	K	62.1	Low	63.8	Low	88 Å²	88	82.2 Å²	82.2	38%	0.383	41%	0.407	S	S	.	.	H	α-helix	trans	-62.6	-45.3	175.7	-174.2	175	-179.6	178.2	0	111.7	I50 K51 S52 V56 V57 D58	I50-K54 WeakPolarHBondContact O-CB 3.43Å; I50-K54 PolarHBondContact O-N 3.45Å; K51-K54 WeakPolarHBondContact O-CB 3.32Å; K51-K54 PolarHBondContact O-N 3.36Å; S52-K54 VanDerWaalsContact C-N 3.35Å; K54-V56 VanDerWaalsContact C-N 3.28Å; K54-V56 PolarHBondContact O-N 3.12Å; K54-V57 PolarHBondContact O-N 3.46Å; K54-D58 WeakPolarHBondContact O-CB 3.32Å; K54-D58 PolarHBondContact O-N 2.83Å
55	E	66	Low	64.7	Low	113 Å²	113	80.3 Å²	80.3	53%	0.528	40%	0.398	S	S	.	.	H	α-helix	trans	-58.4	-38	172.5	-87.3	-161.7	-149	0	0	113	K51 S52 K59	K51-E55 PolarHBondContact O-N 3.26Å; S52-E55 PolarHBondContact O-N 3.41Å; E55-K59 WeakPolarHBondContact O-CB 3.43Å; E55-K59 WeakPolarHBondContact O-CD 3.27Å; E55-K59 WeakPolarHBondContact O-CG 3.46Å; E55-K59 PolarHBondContact O-N 3.14Å; E55-K59 VanDerWaalsContact O-N 3.13Å; E55-K59 IonicContact OE2-NZ 3.26Å; E55-K59 PolarHBondContact OE2-NZ 3.49Å
56	V	66.5	Low	65.6	Low	68 Å²	68	77.3 Å²	77.3	41%	0.412	39%	0.391	S	S	.	.	H	α-helix	trans	-70.4	-40.5	176.2	170.2	0	0	0	0	111.4	S52 L53 K54 K59 C60 F934	S52-V56 WeakPolarHBondContact O-CG2 3.47Å; S52-V56 PolarHBondContact O-N 3.01Å; L53-V56 PolarHBondContact O-N 2.77Å; K54-V56 VanDerWaalsContact C-N 3.28Å; K54-V56 PolarHBondContact O-N 3.12Å; V56-K59 PolarHBondContact O-N 2.97Å; V56-C60 VanDerWaalsContact O-CB 3.31Å; V56-C60 WeakPolarHBondContact O-CB 3.46Å; V56-C60 PolarHBondContact O-N 3.21Å; V56-C60 PolarHBondContact O-SG 3.02Å; V56-F934 HydrophobicContact CG1-CE2 4.28Å
57	V	64.4	Low	66.7	Low	13 Å²	13	71.4 Å²	71.4	8%	0.079	37%	0.368	C	S	.	.	H	α-helix	trans	-61.2	-49.6	174.9	166.2	0	0	0	0	110.9	L53 K54 K59 C60 L61 F934	L53-V57 WeakPolarHBondContact O-CB 3.3Å; L53-V57 WeakPolarHBondContact O-CG2 3.46Å; L53-V57 PolarHBondContact O-N 3.26Å; K54-V57 PolarHBondContact O-N 3.46Å; V57-K59 PolarHBondContact O-N 3.46Å; V57-C60 PolarHBondContact O-N 2.75Å; V57-L61 HydrophobicContact CG1-CD1 4.08Å; V57-L61 PolarHBondContact O-N 3.4Å; V57-F934 HydrophobicContact CG2-CE1 3.93Å; V57-F934 HydrophobicContact CG2-CZ 3.73Å
58	D	65	Low	67.4	Low	51 Å²	51	70.4 Å²	70.4	27%	0.273	36%	0.363	S	S	.	.	H	α-helix	trans	-67.1	-21.3	-180	-66.2	-21.2	0	0	0	112.1	A30 K54	A30-D58 WeakPolarHBondContact CB-O 3.31Å; K54-D58 WeakPolarHBondContact O-CB 3.32Å; K54-D58 PolarHBondContact O-N 2.83Å
59	K	67.1	Low	68	Low	147 Å²	147	65.5 Å²	65.5	64%	0.639	34%	0.343	S	S	*	.	H	α-helix	trans	-88	-27.9	172.7	-71.1	165.3	-161.8	168.2	0	114.2	E55 V56 V57	E55-K59 WeakPolarHBondContact O-CB 3.43Å; E55-K59 WeakPolarHBondContact O-CD 3.27Å; E55-K59 WeakPolarHBondContact O-CG 3.46Å; E55-K59 PolarHBondContact O-N 3.14Å; E55-K59 VanDerWaalsContact O-N 3.13Å; E55-K59 IonicContact OE2-NZ 3.26Å; E55-K59 PolarHBondContact OE2-NZ 3.49Å; V56-K59 PolarHBondContact O-N 2.97Å; V57-K59 PolarHBondContact O-N 3.46Å
60	C	65.9	Low	68.9	Low	56 Å²	56	68.6 Å²	68.6	38%	0.378	35%	0.352	S	S	.	.	H	α-helix	trans	-98.1	-34.4	-175.5	-64.9	0	0	0	0	113.9	V56 V57 F934	V56-C60 VanDerWaalsContact O-CB 3.31Å; V56-C60 WeakPolarHBondContact O-CB 3.46Å; V56-C60 PolarHBondContact O-N 3.21Å; V56-C60 PolarHBondContact O-SG 3.02Å; V57-C60 PolarHBondContact O-N 2.75Å; C60-F934 HydrophobicContact CB-CD2 4.31Å; C60-F934 HydrophobicContact CB-CE2 4.31Å
61	L	69.2	Low	69.6	Low	9 Å²	9	67 Å²	67	5%	0.047	34%	0.344	C	S	.	.			trans	-96	129.2	-179.3	-60.4	-173	0	0	0	111.2	F31 V57 Y931 F934	F31-L61 HydrophobicContact CB-CB 3.95Å; F31-L61 WeakPolarHBondContact CB-O 3.4Å; F31-L61 PolarHBondContact N-O 3.01Å; V57-L61 HydrophobicContact CG1-CD1 4.08Å; V57-L61 PolarHBondContact O-N 3.4Å; L61-Y931 HydrophobicContact CD1-CD2 3.85Å; L61-Y931 HydrophobicContact CD1-CE2 4.32Å; L61-Y931 HydrophobicContact CD2-CD2 4.05Å; L61-F934 HydrophobicContact CD2-CB 4.38Å; L61-F934 HydrophobicContact CD2-CD1 4.29Å; L61-F934 HydrophobicContact CD2-CG 4.41Å
62	F	77.8	Confident	70.1	Confident	22 Å²	22	60.3 Å²	60.3	10%	0.096	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	158.1	-179.9	67.7	-85.6	0	0	0	111.4	R28 V29 W64 P927 V930	R28-F62 HydrophobicContact CB-CB 4.2Å; R28-F62 HydrophobicContact CB-CD2 4.07Å; R28-F62 HydrophobicContact CB-CG 4.3Å; R28-F62 HydrophobicContact CG-CD2 3.73Å; R28-F62 HydrophobicContact CG-CE2 4.1Å; R28-F62 HydrophobicContact CG-CG 4.26Å; V29-F62 CarbonylContact O-C 3.46Å; V29-F62 WeakPolarHBondContact O-CA 3.42Å; F62-W64 HydrophobicContact CD2-CE3 4.31Å; F62-W64 HydrophobicContact CD2-CZ3 4.3Å; F62-W64 HydrophobicContact CE2-CD2 4.28Å; F62-W64 HydrophobicContact CE2-CE3 4.03Å; F62-W64 AromaticContact CE2-CH2 3.66Å; F62-W64 HydrophobicContact CE2-CH2 3.66Å; F62-W64 AromaticContact CE2-CZ2 3.87Å; F62-W64 HydrophobicContact CE2-CZ2 3.87Å; F62-W64 AromaticContact CE2-CZ3 3.74Å; F62-W64 HydrophobicContact CE2-CZ3 3.74Å; F62-W64 HydrophobicContact CZ-CH2 4.29Å; F62-P927 HydrophobicContact CE2-CB 4.22Å; F62-P927 HydrophobicContact CZ-CB 4.39Å; F62-P927 WeakPolarHBondContact O-CB 3.1Å; F62-V930 HydrophobicContact CE1-CG1 4.43Å; F62-V930 HydrophobicContact CE1-CG2 4.29Å
63	T	78.2	Confident	70.4	Confident	6 Å²	6	63.3 Å²	63.3	4%	0.037	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	151.7	161.5	50.3	0	0	0	0	110.6	V29 F31 L955 K958	V29-T63 PolarHBondContact N-O 3.33Å; V29-T63 PolarHBondContact O-N 2.9Å; F31-T63 HydrophobicContact CD2-CG2 3.78Å; F31-T63 HydrophobicContact CE2-CG2 4.25Å; T63-L955 HydrophobicContact CG2-CD2 3.55Å; T63-K958 HydrophobicContact CG2-CD 4.04Å; T63-K958 PolarHBondContact OG1-NZ 3.27Å
64	W	79.4	Confident	70.5	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.008	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	130.5	169.2	-47.1	126.9	0	0	0	109.3	E25 P26 R28 F62 F67 I923 K926 W962	E25-W64 HydrophobicContact CB-CH2 4.24Å; E25-W64 HydrophobicContact CB-CZ3 4.23Å; P26-W64 HydrophobicContact CB-CB 4.06Å; P26-W64 HydrophobicContact CB-CD2 3.95Å; P26-W64 HydrophobicContact CB-CE3 3.64Å; P26-W64 HydrophobicContact CB-CG 4.16Å; P26-W64 HydrophobicContact CB-CZ3 4.3Å; P26-W64 HydrophobicContact CG-CB 4.42Å; P26-W64 HydrophobicContact CG-CD2 3.79Å; P26-W64 HydrophobicContact CG-CE3 3.8Å; P26-W64 HydrophobicContact CG-CG 4.08Å; P26-W64 HydrophobicContact CG-CZ3 4.25Å; P26-W64 VanDerWaalsContact O-CE3 3.25Å; P26-W64 WeakPolarHBondContact O-CZ3 3.16Å; R28-W64 HydrophobicContact CG-CE3 4.05Å; R28-W64 HydrophobicContact CG-CZ3 3.59Å; F62-W64 HydrophobicContact CD2-CE3 4.31Å; F62-W64 HydrophobicContact CD2-CZ3 4.3Å; F62-W64 HydrophobicContact CE2-CD2 4.28Å; F62-W64 HydrophobicContact CE2-CE3 4.03Å; F62-W64 AromaticContact CE2-CH2 3.66Å; F62-W64 HydrophobicContact CE2-CH2 3.66Å; F62-W64 AromaticContact CE2-CZ2 3.87Å; F62-W64 HydrophobicContact CE2-CZ2 3.87Å; F62-W64 AromaticContact CE2-CZ3 3.74Å; F62-W64 HydrophobicContact CE2-CZ3 3.74Å; F62-W64 HydrophobicContact CZ-CH2 4.29Å; W64-F67 HydrophobicContact CB-CD2 4.42Å; W64-F67 AromaticContact CD1-CD2 3.69Å; W64-F67 AromaticContact CD1-CE2 3.98Å; W64-F67 HydrophobicContact CG-CD2 4.15Å; W64-I923 HydrophobicContact CH2-CG2 4.44Å; W64-I923 HydrophobicContact CZ2-CG2 3.76Å; W64-I923 PolarHBondContact NE1-O 3.29Å; W64-I923 VanDerWaalsContact NE1-O 3.13Å; W64-K926 HydrophobicContact CZ2-CB 4.38Å; W64-K926 HydrophobicContact CZ2-CD 4.44Å; W64-W962 HydrophobicContact CB-CH2 4.06Å; W64-W962 HydrophobicContact CB-CZ2 3.87Å; W64-W962 AromaticContact CD1-CE3 3.83Å; W64-W962 AromaticContact CD1-CH2 3.59Å; W64-W962 AromaticContact CD1-CZ3 3.48Å; W64-W962 VanDerWaalsContact CD1-CZ3 3.48Å; W64-W962 HydrophobicContact CG-CH2 4.14Å; W64-W962 HydrophobicContact CG-CZ2 4.37Å; W64-W962 HydrophobicContact CG-CZ3 4.42Å
65	E	70.1	Confident	70.6	Confident	133 Å²	133	58.6 Å²	58.6	62%	0.621	30%	0.301	S	S	*	.	S	Bend	trans	-73.9	-55.8	178.4	-174.8	171.6	173.7	0	0	111.1	E27 V29	E27-E65 PolarHBondContact O-N 3.01Å; V29-E65 HydrophobicContact CG2-CB 3.79Å; V29-E65 HydrophobicContact CG2-CG 4.18Å; V29-E65 WeakPolarHBondContact CG2-OE2 3.36Å
66	T	69.4	Low	70.2	Confident	97 Å²	97	55 Å²	55	60%	0.595	29%	0.285	S	S	*	.	S	Bend	trans	-119.6	151.6	165.8	63.6	0	0	0	0	109	P26 P68	P26-T66 WeakPolarHBondContact CB-O 3.34Å; T66-P68 WeakPolarHBondContact O-CD 3.44Å
67	F	75.4	Confident	69.5	Low	23 Å²	23	55.3 Å²	55.3	10%	0.101	29%	0.29	C	S	.	.			trans	-117.2	95.4	179.9	-167.2	-91.5	0	0	0	109.5	P26 W64 V69 I923 A924 W962 I966	P26-F67 HydrophobicContact CG-CD2 4.04Å; P26-F67 HydrophobicContact CG-CE2 4.3Å; W64-F67 HydrophobicContact CB-CD2 4.42Å; W64-F67 AromaticContact CD1-CD2 3.69Å; W64-F67 AromaticContact CD1-CE2 3.98Å; W64-F67 HydrophobicContact CG-CD2 4.15Å; F67-V69 HydrophobicContact CD1-CG2 3.81Å; F67-V69 HydrophobicContact CE1-CG2 4.2Å; F67-V69 PolarHBondContact O-N 3.1Å; F67-V69 VanDerWaalsContact O-N 3.11Å; F67-I923 HydrophobicContact CE2-CG2 4.15Å; F67-A924 HydrophobicContact CE2-CB 4.14Å; F67-A924 HydrophobicContact CZ-CB 3.97Å; F67-W962 VanDerWaalsContact CB-CD1 3.49Å; F67-W962 HydrophobicContact CB-CG 4.07Å; F67-W962 HydrophobicContact CD1-CB 4.28Å; F67-W962 HydrophobicContact CD1-CG 4.42Å; F67-W962 HydrophobicContact CD2-CD2 4.28Å; F67-W962 HydrophobicContact CD2-CG 4.2Å; F67-W962 HydrophobicContact CG-CB 4.29Å; F67-W962 AromaticContact CG-CD1 3.88Å; F67-W962 HydrophobicContact CG-CD2 4.46Å; F67-W962 AromaticContact CG-CG 3.97Å; F67-W962 HydrophobicContact CG-CG 3.97Å; F67-I966 HydrophobicContact CE1-CD1 3.83Å; F67-I966 HydrophobicContact CE1-CG1 4.03Å; F67-I966 HydrophobicContact CZ-CD1 4.17Å
68	P	73.1	Confident	68.8	Low	55 Å²	55	61.2 Å²	61.2	36%	0.357	32%	0.32	S	S	.	.			trans	-73.2	101.9	-173.4	28.2	-34.7	0	0	0	111.8	T66 Q70	T66-P68 WeakPolarHBondContact O-CD 3.44Å; P68-Q70 VanDerWaalsContact C-N 3.33Å; P68-Q70 PolarHBondContact O-N 3.45Å
69	V	71.4	Confident	67.8	Low	45 Å²	45	59.9 Å²	59.9	27%	0.273	32%	0.317	S	S	.	.			trans	-83.7	75.9	177.2	-171.3	0	0	0	0	110.3	F67 W916 L965 S969	F67-V69 HydrophobicContact CD1-CG2 3.81Å; F67-V69 HydrophobicContact CE1-CG2 4.2Å; F67-V69 PolarHBondContact O-N 3.1Å; F67-V69 VanDerWaalsContact O-N 3.11Å; V69-W916 HydrophobicContact CG1-CH2 3.67Å; V69-W916 HydrophobicContact CG1-CZ2 3.89Å; V69-L965 HydrophobicContact CG2-CB 4.35Å; V69-S969 VanDerWaalsContact CG1-OG 3.23Å; V69-S969 WeakPolarHBondContact CG1-OG 3.38Å
70	Q	73.6	Confident	66.4	Low	146 Å²	146	57.1 Å²	57.1	68%	0.682	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-88.2	119.9	174	-65.5	-175.8	0.6	0	0	110.6	P68 W916	P68-Q70 VanDerWaalsContact C-N 3.33Å; P68-Q70 PolarHBondContact O-N 3.45Å; Q70-W916 WeakPolarHBondContact O-CZ2 3.25Å; Q70-W916 PolarHBondContact O-NE1 3.01Å
71	L	75	Confident	65.5	Low	64 Å²	64	60.2 Å²	60.2	34%	0.335	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-80.4	152.9	179.1	-69.5	158.3	0	0	0	111.1	L913 W916 R973	L71-L913 HydrophobicContact CD2-CD1 4.07Å; L71-W916 HydrophobicContact CD2-CE3 4.16Å; L71-W916 HydrophobicContact CD2-CH2 3.49Å; L71-W916 VanDerWaalsContact CD2-CH2 3.49Å; L71-W916 HydrophobicContact CD2-CZ2 3.84Å; L71-W916 HydrophobicContact CD2-CZ3 3.66Å; L71-W916 HydrophobicContact CG-CH2 4.34Å; L71-W916 HydrophobicContact CG-CZ2 4.36Å; L71-R973 HydrophobicContact CD1-CB 4.41Å; L71-R973 HydrophobicContact CD2-CB 4.19Å; L71-R973 HydrophobicContact CD2-CG 4.34Å
72	P	73.4	Confident	64.3	Low	14 Å²	14	65.4 Å²	65.4	9%	0.091	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-60.6	136.9	171.7	-19.4	32.4	0	0	0	111.3	W916	P72-W916 HydrophobicContact CG-CB 3.88Å; P72-W916 HydrophobicContact CG-CD2 4.41Å; P72-W916 HydrophobicContact CG-CG 3.7Å
73	K	71.2	Confident	62.8	Low	128 Å²	128	68.5 Å²	68.5	56%	0.557	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-61.5	138.7	173.7	-65.2	179.3	-175.2	169.3	0	110.1	E20 R1014	E20-K73 IonicContact OE1-NZ 2.64Å; E20-K73 PolarHBondContact OE1-NZ 3.43Å; E20-K73 WeakPolarHBondContact OE2-CE 3.15Å; E20-K73 IonicContact OE2-NZ 3.74Å; E20-K73 PolarHBondContact OE2-NZ 3.48Å; K73-R1014 PolarHBondContact O-NH1 2.92Å; K73-R1014 PolarHBondContact O-NH2 3.09Å
74	S	66.4	Low	61.5	Low	14 Å²	14	72 Å²	72	10%	0.098	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-63.5	151.7	178.8	-163.4	0	0	0	0	111.8	L76 S77 E909	S74-L76 PolarHBondContact OG-N 3.05Å; S74-L76 VanDerWaalsContact OG-N 3.08Å; S74-S77 WeakPolarHBondContact CB-OG 3.39Å; S74-S77 PolarHBondContact N-OG 3.35Å; S74-S77 PolarHBondContact O-OG 2.94Å; S74-E909 VanDerWaalsContact CA-OE1 3.27Å; S74-E909 WeakPolarHBondContact CA-OE1 3.3Å; S74-E909 VanDerWaalsContact CA-OE2 3.25Å; S74-E909 WeakPolarHBondContact CA-OE2 3.37Å; S74-E909 WeakPolarHBondContact CB-OE1 3.4Å; S74-E909 WeakPolarHBondContact CB-OE2 3.17Å; S74-E909 VanDerWaalsContact OG-CD 3.31Å; S74-E909 PolarHBondContact OG-OE1 3.41Å; S74-E909 VanDerWaalsContact OG-OE1 3.1Å; S74-E909 PolarHBondContact OG-OE2 3.38Å
75	F	63.6	Low	60.3	Low	25 Å²	25	74.8 Å²	74.8	11%	0.11	41%	0.409	C	S	.	.	S	Bend	trans	-68.4	-25.1	162.4	-171.4	-104.7	0	0	0	111.9	E909 F1010 F1080 L1083	F75-E909 PolarHBondContact N-OE2 2.58Å; F75-F1010 HydrophobicContact CB-CE2 4.2Å; F75-F1010 HydrophobicContact CD2-CD2 4.33Å; F75-F1010 HydrophobicContact CD2-CE2 4.21Å; F75-F1010 HydrophobicContact CG-CE2 4.34Å; F75-F1080 HydrophobicContact CD1-CE2 4.37Å; F75-F1080 HydrophobicContact CE1-CD2 4.29Å; F75-F1080 AromaticContact CE1-CE2 3.76Å; F75-F1080 HydrophobicContact CE1-CE2 3.76Å; F75-L1083 HydrophobicContact CE1-CD1 4.36Å; F75-L1083 HydrophobicContact CE2-CD2 3.96Å; F75-L1083 HydrophobicContact CZ-CD1 4.24Å; F75-L1083 HydrophobicContact CZ-CD2 3.84Å
76	L	57.6	Low	59.6	Low	38 Å²	38	68.9 Å²	68.9	20%	0.199	38%	0.381	C	S	.	.	S	Bend	trans	-98	-11.7	-176.4	-62	-176.4	0	0	0	115	S74 L78 A79 V86 V906 L977 F1080	S74-L76 PolarHBondContact OG-N 3.05Å; S74-L76 VanDerWaalsContact OG-N 3.08Å; L76-L78 PolarHBondContact O-N 3.14Å; L76-A79 PolarHBondContact O-N 3.08Å; L76-A79 VanDerWaalsContact O-N 3.14Å; L76-V86 HydrophobicContact CD1-CG2 4.42Å; L76-V906 HydrophobicContact CD1-CG2 3.47Å; L76-V906 VanDerWaalsContact CD1-CG2 3.47Å; L76-L977 HydrophobicContact CD1-CD2 4.1Å; L76-F1080 HydrophobicContact CD2-CD2 4.28Å
77	S	53.4	Low	58.8	Low	73 Å²	73	65.1 Å²	65.1	51%	0.51	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	27.5	-176.3	65.7	0	0	0	0	114.2	S74 A79	S74-S77 WeakPolarHBondContact CB-OG 3.39Å; S74-S77 PolarHBondContact N-OG 3.35Å; S74-S77 PolarHBondContact O-OG 2.94Å; S77-A79 VanDerWaalsContact C-N 3.29Å
78	L	48.6	Very low	57.7	Low	137 Å²	137	67.7 Å²	67.7	72%	0.717	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-7.5	155.6	-87.3	77.8	0	0	0	111.5	L76 A80	L76-L78 PolarHBondContact O-N 3.14Å; L78-A80 PolarHBondContact O-N 3.3Å
79	A	43.8	Very low	56.9	Low	24 Å²	24	65.5 Å²	65.5	20%	0.198	36%	0.359	C	S	.	.	S	Bend	trans	-75.4	115.3	158.6	0	0	0	0	0	109.1	L76 S77 N81 L84	L76-A79 PolarHBondContact O-N 3.08Å; L76-A79 VanDerWaalsContact O-N 3.14Å; S77-A79 VanDerWaalsContact C-N 3.29Å; A79-N81 PolarHBondContact O-N 3.23Å; A79-L84 HydrophobicContact CB-CD1 4.37Å
80	A	39.1	Very low	56.1	Low	88 Å²	88	65 Å²	65	73%	0.727	35%	0.354	S	S	*	.	S	Bend	trans	-75.7	13	-171	0	0	0	0	0	115.6	L78	L78-A80 PolarHBondContact O-N 3.3Å
81	N	45.1	Very low	54.9	Low	122 Å²	122	64.2 Å²	64.2	65%	0.652	35%	0.346	S	S	*	.			trans	-113	117.3	170.4	-63.8	21.4	0	0	0	106.6	A79 D83	A79-N81 PolarHBondContact O-N 3.23Å; N81-D83 PolarHBondContact O-N 2.81Å; N81-D83 VanDerWaalsContact O-N 3.16Å
82	E	45.8	Very low	53.6	Low	118 Å²	118	63.7 Å²	63.7	55%	0.551	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-3.9	-171.8	-67.8	174.6	123.7	0	0	114.5	I1228 H1229 I1230	E82-I1228 CarbonylContact C-O 3.51Å; E82-I1228 VanDerWaalsContact CB-O 3.28Å; E82-I1228 WeakPolarHBondContact CB-O 3.46Å; E82-I1228 WeakPolarHBondContact OE2-CA 3.25Å; E82-I1228 PolarHBondContact OE2-N 3.16Å; E82-H1229 CarbonylContact O-C 3.01Å; E82-H1229 PolarHBondContact OE2-N 3.38Å; E82-H1229 VanDerWaalsContact OE2-N 3.08Å; E82-I1230 PolarHBondContact O-N 3.4Å; E82-I1230 VanDerWaalsContact O-O 3.06Å
83	D	46.2	Very low	52.4	Low	86 Å²	86	66.2 Å²	66.2	46%	0.46	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	13	-160.7	-142.6	-13.2	0	0	0	113.5	N81 N85 I1228	N81-D83 PolarHBondContact O-N 2.81Å; N81-D83 VanDerWaalsContact O-N 3.16Å; D83-N85 PolarHBondContact O-N 3.35Å; D83-I1228 WeakPolarHBondContact CA-O 3.32Å; D83-I1228 HydrophobicContact CB-CB 4.32Å; D83-I1228 HydrophobicContact CB-CG2 4.38Å; D83-I1228 WeakPolarHBondContact CB-O 3.42Å; D83-I1228 PolarHBondContact N-O 2.76Å; D83-I1228 VanDerWaalsContact OD2-CG2 3.26Å; D83-I1228 WeakPolarHBondContact OD2-CG2 3.5Å
84	L	50.5	Low	51.2	Low	81 Å²	81	62.1 Å²	62.1	42%	0.424	34%	0.34	S	S	.	.			trans	-91.1	73.7	-160	-137.5	166.5	0	0	0	113	A79 V86	A79-L84 HydrophobicContact CB-CD1 4.37Å; L84-V86 PolarHBondContact O-N 2.87Å
85	N	54.1	Low	50.3	Low	60 Å²	60	62.9 Å²	62.9	32%	0.321	34%	0.344	S	S	.	.			trans	-55.9	114.3	175.2	-166.9	7.1	0	0	0	112	D83 S87 D88 A976	D83-N85 PolarHBondContact O-N 3.35Å; N85-S87 VanDerWaalsContact CG-OG 3.25Å; N85-S87 PolarHBondContact ND2-OG 2.98Å; N85-S87 PolarHBondContact O-N 2.86Å; N85-S87 PolarHBondContact OD1-OG 2.82Å; N85-D88 PolarHBondContact O-N 3.41Å; N85-A976 VanDerWaalsContact OD1-C 3.31Å; N85-A976 VanDerWaalsContact OD1-CA 3.24Å; N85-A976 WeakPolarHBondContact OD1-CA 3.36Å; N85-A976 WeakPolarHBondContact OD1-CB 3.47Å; N85-A976 PolarHBondContact OD1-O 3.39Å
86	V	54.9	Low	49.3	Very low	8 Å²	8	68.6 Å²	68.6	5%	0.048	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-73.8	-12.8	-169.7	-178.6	0	0	0	0	113.2	L76 L84 D88 V89 V906 A976 L977	L76-V86 HydrophobicContact CD1-CG2 4.42Å; L84-V86 PolarHBondContact O-N 2.87Å; V86-D88 PolarHBondContact O-N 3.21Å; V86-V89 HydrophobicContact CB-CG2 4.47Å; V86-V89 HydrophobicContact CG1-CG2 3.91Å; V86-V89 PolarHBondContact O-N 3.03Å; V86-V906 HydrophobicContact CG1-CG2 4.11Å; V86-A976 PolarHBondContact N-O 3.06Å; V86-A976 VanDerWaalsContact N-O 3.1Å; V86-L977 HydrophobicContact CB-CD2 4.14Å; V86-L977 HydrophobicContact CG2-CD2 3.31Å; V86-L977 HydrophobicContact CG2-CG 4.36Å
87	S	52.5	Low	48.5	Very low	19 Å²	19	72.3 Å²	72.3	13%	0.133	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-47.4	-31.3	167.1	60.9	0	0	0	0	113.6	N85	N85-S87 VanDerWaalsContact CG-OG 3.25Å; N85-S87 PolarHBondContact ND2-OG 2.98Å; N85-S87 PolarHBondContact O-N 2.86Å; N85-S87 PolarHBondContact OD1-OG 2.82Å
88	D	52.7	Low	47.8	Very low	76 Å²	76	71.3 Å²	71.3	41%	0.406	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-94	-1	-170.5	-83.3	53.8	0	0	0	114.9	N85 V86 F90 R1072	N85-D88 PolarHBondContact O-N 3.41Å; V86-D88 PolarHBondContact O-N 3.21Å; D88-F90 VanDerWaalsContact C-N 3.27Å; D88-F90 PolarHBondContact O-N 2.97Å; D88-R1072 IonicContact OD2-CZ 3.55Å; D88-R1072 IonicContact OD2-NH1 2.76Å; D88-R1072 PolarHBondContact OD2-NH1 2.88Å
89	V	55.9	Low	47.6	Very low	9 Å²	9	69.4 Å²	69.4	6%	0.055	37%	0.365	C	S	.	.	S	Bend	trans	-65.3	-31.6	178.9	174.4	0	0	0	0	112	V86 I1071 L1076	V86-V89 HydrophobicContact CB-CG2 4.47Å; V86-V89 HydrophobicContact CG1-CG2 3.91Å; V86-V89 PolarHBondContact O-N 3.03Å; V89-I1071 HydrophobicContact CG1-CD1 4Å; V89-I1071 HydrophobicContact CG1-CG1 4.41Å; V89-I1071 HydrophobicContact CG1-CG2 4.26Å; V89-L1076 HydrophobicContact CG1-CD2 4.33Å; V89-L1076 HydrophobicContact CG2-CD2 4Å
90	F	53.8	Low	47.3	Very low	34 Å²	34	69.6 Å²	69.6	15%	0.149	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-111.8	95.6	-177.6	-63.1	-81.7	0	0	0	111.1	D88 D899 I903 L1069	D88-F90 VanDerWaalsContact C-N 3.27Å; D88-F90 PolarHBondContact O-N 2.97Å; F90-D899 HydrophobicContact CE1-CB 4.16Å; F90-D899 HydrophobicContact CZ-CB 4.42Å; F90-I903 HydrophobicContact CD2-CD1 4.27Å; F90-I903 HydrophobicContact CE2-CD1 3.39Å; F90-I903 HydrophobicContact CE2-CG1 3.75Å; F90-I903 HydrophobicContact CZ-CD1 3.56Å; F90-I903 HydrophobicContact CZ-CG1 4.03Å; F90-L1069 HydrophobicContact CD1-CD2 3.65Å; F90-L1069 HydrophobicContact CE1-CD2 3.87Å
91	Y	49.2	Very low	47.3	Very low	131 Å²	131	68.7 Å²	68.7	51%	0.514	35%	0.352	S	S	.	.			trans	-101.9	115.4	175.2	-167	-75	0	0	0	110.8	N93	Y91-N93 VanDerWaalsContact C-N 3.26Å; Y91-N93 HydrophobicContact CD1-CB 3.77Å; Y91-N93 WeakPolarHBondContact CD1-ND2 3.43Å; Y91-N93 HydrophobicContact CE1-CB 3.99Å; Y91-N93 WeakPolarHBondContact CE1-ND2 3.24Å; Y91-N93 PolarHBondContact O-N 3.4Å
92	D	48.6	Very low	47	Very low	52 Å²	52	65.3 Å²	65.3	28%	0.278	34%	0.342	S	S	.	.			trans	-78.7	72.7	177.5	-167.2	0.7	0	0	0	112.2	N94 V95 F985	D92-N94 VanDerWaalsContact C-N 3.26Å; D92-N94 PolarHBondContact OD1-N 3.42Å; D92-V95 WeakPolarHBondContact OD1-CB 3.44Å; D92-V95 WeakPolarHBondContact OD1-CG2 3.28Å; D92-V95 PolarHBondContact OD1-N 2.98Å; D92-V95 VanDerWaalsContact OD2-CB 3.31Å; D92-V95 WeakPolarHBondContact OD2-CB 3.33Å; D92-V95 WeakPolarHBondContact OD2-CG2 3.49Å; D92-F985 HydrophobicContact CB-CD2 4.49Å; D92-F985 HydrophobicContact CB-CE2 3.91Å; D92-F985 HydrophobicContact CB-CZ 4.45Å; D92-F985 WeakPolarHBondContact OD2-CD2 3.34Å; D92-F985 VanDerWaalsContact OD2-CE2 3.24Å; D92-F985 WeakPolarHBondContact OD2-CE2 3.31Å
93	N	47	Very low	46.6	Very low	68 Å²	68	64.8 Å²	64.8	36%	0.364	34%	0.335	S	S	.	.	S	Bend	trans	-77.3	-16.8	172.9	-124.7	-64.1	0	0	0	111.6	Y91 K97	Y91-N93 VanDerWaalsContact C-N 3.26Å; Y91-N93 HydrophobicContact CD1-CB 3.77Å; Y91-N93 WeakPolarHBondContact CD1-ND2 3.43Å; Y91-N93 HydrophobicContact CE1-CB 3.99Å; Y91-N93 WeakPolarHBondContact CE1-ND2 3.24Å; Y91-N93 PolarHBondContact O-N 3.4Å; N93-K97 WeakPolarHBondContact O-CB 3.35Å; N93-K97 WeakPolarHBondContact O-CD 3.43Å; N93-K97 WeakPolarHBondContact O-CG 3.42Å; N93-K97 PolarHBondContact O-N 3.47Å; N93-K97 VanDerWaalsContact OD1-CE 3.3Å; N93-K97 WeakPolarHBondContact OD1-CE 3.26Å; N93-K97 PolarHBondContact OD1-NZ 2.92Å
94	N	47.1	Very low	46.2	Very low	42 Å²	42	65.3 Å²	65.3	23%	0.225	34%	0.336	C	S	.	.	S	Bend	trans	-115.7	-23.5	-160.2	-72.3	-14.2	0	0	0	114.9	D92 C98 Q1070	D92-N94 VanDerWaalsContact C-N 3.26Å; D92-N94 PolarHBondContact OD1-N 3.42Å; N94-C98 WeakPolarHBondContact O-CA 3.4Å; N94-C98 WeakPolarHBondContact O-CB 3.39Å; N94-C98 PolarHBondContact O-N 3.04Å; N94-C98 PolarHBondContact O-SG 3.42Å; N94-Q1070 VanDerWaalsContact ND2-CD 3.34Å; N94-Q1070 PolarHBondContact ND2-OE1 3.3Å
95	V	47.1	Very low	45.6	Very low	30 Å²	30	64.7 Å²	64.7	18%	0.182	34%	0.338	C	S	.	.	H	α-helix	trans	-76.9	-43.2	166.5	-173.1	0	0	0	0	109.6	D92 K97 C98 E99 L893	D92-V95 WeakPolarHBondContact OD1-CB 3.44Å; D92-V95 WeakPolarHBondContact OD1-CG2 3.28Å; D92-V95 PolarHBondContact OD1-N 2.98Å; D92-V95 VanDerWaalsContact OD2-CB 3.31Å; D92-V95 WeakPolarHBondContact OD2-CB 3.33Å; D92-V95 WeakPolarHBondContact OD2-CG2 3.49Å; V95-K97 VanDerWaalsContact C-N 3.28Å; V95-K97 PolarHBondContact O-N 3.3Å; V95-C98 PolarHBondContact O-N 2.9Å; V95-E99 VanDerWaalsContact O-CB 3.24Å; V95-E99 WeakPolarHBondContact O-CB 3.44Å; V95-E99 PolarHBondContact O-N 3.03Å; V95-L893 HydrophobicContact CG2-CD1 4.11Å; V95-L893 HydrophobicContact CG2-CD2 3.68Å; V95-L893 HydrophobicContact CG2-CG 4.38Å
96	E	41.6	Very low	45.1	Very low	145 Å²	145	64.5 Å²	64.5	68%	0.678	33%	0.334	S	S	*	.	H	α-helix	trans	-62.2	-37.2	171.7	-71.6	-150.3	143.3	0	0	111.5	A100	E96-A100 WeakPolarHBondContact O-CA 3.2Å; E96-A100 WeakPolarHBondContact O-CB 3.34Å; E96-A100 PolarHBondContact O-N 2.97Å
97	K	40.6	Very low	44.3	Very low	115 Å²	115	73.8 Å²	73.8	50%	0.5	37%	0.369	S	S	.	.	H	α-helix	trans	-75.8	-29.3	171.8	-76	177.3	-176.3	155.7	0	114.9	N93 V95 A100 T101	N93-K97 WeakPolarHBondContact O-CB 3.35Å; N93-K97 WeakPolarHBondContact O-CD 3.43Å; N93-K97 WeakPolarHBondContact O-CG 3.42Å; N93-K97 PolarHBondContact O-N 3.47Å; N93-K97 VanDerWaalsContact OD1-CE 3.3Å; N93-K97 WeakPolarHBondContact OD1-CE 3.26Å; N93-K97 PolarHBondContact OD1-NZ 2.92Å; V95-K97 VanDerWaalsContact C-N 3.28Å; V95-K97 PolarHBondContact O-N 3.3Å; K97-A100 CarbonylContact O-C 3.39Å; K97-T101 WeakPolarHBondContact O-CB 3.3Å; K97-T101 VanDerWaalsContact O-CG2 3.29Å; K97-T101 WeakPolarHBondContact O-CG2 3.28Å; K97-T101 PolarHBondContact O-N 3.45Å; K97-T101 PolarHBondContact O-OG1 2.63Å
98	C	40.3	Very low	43.6	Very low	52 Å²	52	79.5 Å²	79.5	35%	0.351	40%	0.398	S	S	.	.	H	α-helix	trans	-78	-35.7	175.1	-79.2	0	0	0	0	111.7	N94 V95 T101 A102 I1067	N94-C98 WeakPolarHBondContact O-CA 3.4Å; N94-C98 WeakPolarHBondContact O-CB 3.39Å; N94-C98 PolarHBondContact O-N 3.04Å; N94-C98 PolarHBondContact O-SG 3.42Å; V95-C98 PolarHBondContact O-N 2.9Å; C98-T101 WeakPolarHBondContact CA-OG1 3.31Å; C98-T101 PolarHBondContact O-OG1 3.23Å; C98-A102 VanDerWaalsContact O-CB 3.23Å; C98-A102 WeakPolarHBondContact O-CB 3.3Å; C98-A102 PolarHBondContact O-N 3.32Å; C98-I1067 HydrophobicContact CB-CD1 4.1Å
99	E	43.5	Very low	43.2	Very low	97 Å²	97	78.3 Å²	78.3	45%	0.453	39%	0.391	S	S	.	.	H	α-helix	trans	-71.1	-34.5	170.3	-151.8	-178	-95.4	0	0	110.2	V95 R103	V95-E99 VanDerWaalsContact O-CB 3.24Å; V95-E99 WeakPolarHBondContact O-CB 3.44Å; V95-E99 PolarHBondContact O-N 3.03Å; E99-R103 WeakPolarHBondContact O-CG 3.37Å; E99-R103 PolarHBondContact O-N 3.5Å; E99-R103 PolarHBondContact O-NE 3.44Å; E99-R103 IonicContact OE2-CZ 3.94Å; E99-R103 IonicContact OE2-NH2 3.44Å; E99-R103 PolarHBondContact OE2-NH2 2.75Å
100	A	38.8	Very low	42.9	Very low	29 Å²	29	83.8 Å²	83.8	24%	0.24	42%	0.42	C	S	.	.	H	α-helix	trans	-74.8	-31.7	170.8	0	0	0	0	0	114.1	E96 K97 R103 I104	E96-A100 WeakPolarHBondContact O-CA 3.2Å; E96-A100 WeakPolarHBondContact O-CB 3.34Å; E96-A100 PolarHBondContact O-N 2.97Å; K97-A100 CarbonylContact O-C 3.39Å; A100-R103 CarbonylContact O-C 3.46Å; A100-R103 WeakPolarHBondContact O-CA 3.5Å; A100-R103 WeakPolarHBondContact O-CB 3.35Å; A100-R103 PolarHBondContact O-N 3.4Å; A100-I104 WeakPolarHBondContact O-CD1 3.5Å; A100-I104 WeakPolarHBondContact O-CG1 3.49Å; A100-I104 PolarHBondContact O-N 2.89Å
101	T	37.5	Very low	43.1	Very low	68 Å²	68	87.2 Å²	87.2	42%	0.417	44%	0.444	S	S	.	.	H	α-helix	trans	-76.9	-31.4	173.1	52.5	0	0	0	0	111.5	K97 C98 R103 I104 C105	K97-T101 WeakPolarHBondContact O-CB 3.3Å; K97-T101 VanDerWaalsContact O-CG2 3.29Å; K97-T101 WeakPolarHBondContact O-CG2 3.28Å; K97-T101 PolarHBondContact O-N 3.45Å; K97-T101 PolarHBondContact O-OG1 2.63Å; C98-T101 WeakPolarHBondContact CA-OG1 3.31Å; C98-T101 PolarHBondContact O-OG1 3.23Å; T101-R103 VanDerWaalsContact C-N 3.29Å; T101-R103 PolarHBondContact O-N 3.04Å; T101-I104 HydrophobicContact CG2-CD1 4.31Å; T101-I104 CarbonylContact O-C 3.57Å; T101-I104 PolarHBondContact O-N 3.49Å; T101-I104 VanDerWaalsContact O-N 3.07Å; T101-C105 WeakPolarHBondContact O-CB 3.42Å; T101-C105 PolarHBondContact O-N 2.95Å; T101-C105 PolarHBondContact O-SG 2.83Å
102	A	40.4	Very low	43.7	Very low	52 Å²	52	81.5 Å²	81.5	43%	0.43	42%	0.422	S	S	.	.	H	α-helix	trans	-56.8	-43.5	161.8	0	0	0	0	0	111.1	C98 I104 F106	C98-A102 VanDerWaalsContact O-CB 3.23Å; C98-A102 WeakPolarHBondContact O-CB 3.3Å; C98-A102 PolarHBondContact O-N 3.32Å; A102-I104 PolarHBondContact O-N 2.99Å; A102-F106 WeakPolarHBondContact O-CD2 3.4Å
103	R	36.3	Very low	44.7	Very low	107 Å²	107	83.7 Å²	83.7	40%	0.404	43%	0.434	S	S	.	.	H	α-helix	trans	-64.4	-31.9	171.6	-64.8	164.9	-140.3	170.5	0.8	113.2	E99 A100 T101	E99-R103 WeakPolarHBondContact O-CG 3.37Å; E99-R103 PolarHBondContact O-N 3.5Å; E99-R103 PolarHBondContact O-NE 3.44Å; E99-R103 IonicContact OE2-CZ 3.94Å; E99-R103 IonicContact OE2-NH2 3.44Å; E99-R103 PolarHBondContact OE2-NH2 2.75Å; A100-R103 CarbonylContact O-C 3.46Å; A100-R103 WeakPolarHBondContact O-CA 3.5Å; A100-R103 WeakPolarHBondContact O-CB 3.35Å; A100-R103 PolarHBondContact O-N 3.4Å; T101-R103 VanDerWaalsContact C-N 3.29Å; T101-R103 PolarHBondContact O-N 3.04Å
104	I	37.5	Very low	46	Very low	96 Å²	96	88.7 Å²	88.7	49%	0.492	45%	0.452	S	S	.	.	H	α-helix	trans	-80.2	-34.4	179.8	-68.4	157.2	0	0	0	112.4	A100 T101 A102 F106 R107	A100-I104 WeakPolarHBondContact O-CD1 3.5Å; A100-I104 WeakPolarHBondContact O-CG1 3.49Å; A100-I104 PolarHBondContact O-N 2.89Å; T101-I104 HydrophobicContact CG2-CD1 4.31Å; T101-I104 CarbonylContact O-C 3.57Å; T101-I104 PolarHBondContact O-N 3.49Å; T101-I104 VanDerWaalsContact O-N 3.07Å; A102-I104 PolarHBondContact O-N 2.99Å; I104-F106 PolarHBondContact O-N 3.48Å; I104-F106 VanDerWaalsContact O-N 3.14Å; I104-R107 WeakPolarHBondContact O-CB 3.38Å; I104-R107 PolarHBondContact O-N 3.31Å
105	C	38.4	Very low	47.3	Very low	68 Å²	68	90.3 Å²	90.3	46%	0.459	47%	0.467	S	S	.	.	H	α-helix	trans	-62.8	-17.3	176.4	-73.5	0	0	0	0	112.9	T101 R107	T101-C105 WeakPolarHBondContact O-CB 3.42Å; T101-C105 PolarHBondContact O-N 2.95Å; T101-C105 PolarHBondContact O-SG 2.83Å; C105-R107 VanDerWaalsContact C-N 3.26Å; C105-R107 PolarHBondContact O-N 3.32Å
106	F	44.3	Very low	48.6	Very low	56 Å²	56	90.3 Å²	90.3	25%	0.246	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	14.9	167.9	-69	-69.3	0	0	0	114.3	A102 I104 L109 I871 C873	A102-F106 WeakPolarHBondContact O-CD2 3.4Å; I104-F106 PolarHBondContact O-N 3.48Å; I104-F106 VanDerWaalsContact O-N 3.14Å; F106-L109 WeakPolarHBondContact O-CD2 3.16Å; F106-L109 WeakPolarHBondContact O-CG 3.46Å; F106-I871 HydrophobicContact CD1-CG2 4.48Å; F106-I871 HydrophobicContact CE1-CG2 3.88Å; F106-C873 HydrophobicContact CB-CB 4.42Å; F106-C873 WeakPolarHBondContact CB-SG 3.14Å; F106-C873 HydrophobicContact CD2-CB 3.94Å; F106-C873 HydrophobicContact CG-CB 4.35Å
107	R	37.8	Very low	50.2	Low	203 Å²	203	87 Å²	87	77%	0.766	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-40.8	171.7	-96.2	-174.6	163.9	-179.3	-4.7	112.7	I104 C105 L109	I104-R107 WeakPolarHBondContact O-CB 3.38Å; I104-R107 PolarHBondContact O-N 3.31Å; C105-R107 VanDerWaalsContact C-N 3.26Å; C105-R107 PolarHBondContact O-N 3.32Å; R107-L109 VanDerWaalsContact C-N 3.31Å; R107-L109 PolarHBondContact O-N 3.14Å
108	D	37.8	Very low	52.1	Low	139 Å²	139	87.8 Å²	87.8	74%	0.743	45%	0.452	S	S	*	.	S	Bend	trans	-87.9	75.9	-179	-65.9	-25	0	0	0	110.5	N110	D108-N110 VanDerWaalsContact C-N 3.3Å; D108-N110 PolarHBondContact O-N 2.64Å
109	L	43.7	Very low	54	Low	51 Å²	51	89 Å²	89	27%	0.267	45%	0.453	S	S	.	.			trans	-72.8	76.3	-172.9	-66.3	158	0	0	0	112.2	F106 R107 R870	F106-L109 WeakPolarHBondContact O-CD2 3.16Å; F106-L109 WeakPolarHBondContact O-CG 3.46Å; R107-L109 VanDerWaalsContact C-N 3.31Å; R107-L109 PolarHBondContact O-N 3.14Å; L109-R870 HydrophobicContact CB-CG 4.03Å; L109-R870 VanDerWaalsContact CB-CZ 3.44Å; L109-R870 HydrophobicContact CD2-CB 4.41Å; L109-R870 PolarHBondContact O-NE 2.89Å; L109-R870 PolarHBondContact O-NH2 3.12Å
110	N	50.3	Low	55.8	Low	125 Å²	125	84.5 Å²	84.5	67%	0.668	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-60.2	146.6	176.2	-78.6	-32.7	0	0	0	113.2	D108	D108-N110 VanDerWaalsContact C-N 3.3Å; D108-N110 PolarHBondContact O-N 2.64Å
111	V	57.7	Low	57.9	Low	106 Å²	106	87.1 Å²	87.1	64%	0.642	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-86	139.6	-177.4	-179.3	0	0	0	0	110.6	N113	V111-N113 PolarHBondContact O-N 3.09Å
112	V	61.5	Low	60.1	Low	10 Å²	10	86.5 Å²	86.5	6%	0.061	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-57.2	131.6	-175	-179	0	0	0	0	112.1	Q116 R117 I120 T869	V112-Q116 HydrophobicContact CG1-CB 3.71Å; V112-R117 HydrophobicContact CG1-CG 4.29Å; V112-R117 PolarHBondContact O-NE 3.45Å; V112-R117 PolarHBondContact O-NH2 3.4Å; V112-I120 HydrophobicContact CG1-CD1 4.17Å; V112-T869 WeakPolarHBondContact CG2-OG1 3.01Å
113	N	69.1	Low	62	Low	99 Å²	99	87.3 Å²	87.3	53%	0.529	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-70.5	165.1	-171.5	-154.7	-12.9	0	0	0	112.4	V111 Q116 R117	V111-N113 PolarHBondContact O-N 3.09Å; N113-Q116 HydrophobicContact CB-CG 4.31Å; N113-Q116 VanDerWaalsContact CB-OE1 3.25Å; N113-R117 PolarHBondContact O-N 2.9Å; N113-R117 VanDerWaalsContact O-N 3.12Å; N113-R117 PolarHBondContact O-NE 2.8Å
114	K	74.2	Confident	64.2	Low	172 Å²	172	82.6 Å²	82.6	75%	0.748	41%	0.412	S	S	*	.	H	α-helix	trans	-70.4	-36.9	-173.7	-145	178.9	-175.1	-176	0	112.3	Q118	K114-Q118 PolarHBondContact O-N 3.34Å
115	S	74.8	Confident	66.3	Low	76 Å²	76	81.9 Å²	81.9	53%	0.531	41%	0.407	S	S	.	.	H	α-helix	trans	-67.7	-47.1	173.2	48.2	0	0	0	0	112.5	R117 Q118 E119	S115-R117 PolarHBondContact O-N 3.22Å; S115-Q118 WeakPolarHBondContact O-CA 3.4Å; S115-Q118 WeakPolarHBondContact O-CB 3.24Å; S115-Q118 PolarHBondContact O-N 3.32Å; S115-E119 PolarHBondContact O-N 2.99Å
116	Q	74	Confident	68.2	Low	30 Å²	30	79.6 Å²	79.6	14%	0.14	39%	0.389	C	S	.	.	H	α-helix	trans	-55.5	-39.3	174.6	-70.5	169.2	-33.2	0	0	111.5	V112 N113 Q118 E119 I120 V127	V112-Q116 HydrophobicContact CG1-CB 3.71Å; N113-Q116 HydrophobicContact CB-CG 4.31Å; N113-Q116 VanDerWaalsContact CB-OE1 3.25Å; Q116-Q118 PolarHBondContact O-N 2.86Å; Q116-E119 PolarHBondContact O-N 3.06Å; Q116-I120 VanDerWaalsContact O-CG1 3.23Å; Q116-I120 WeakPolarHBondContact O-CG1 3.26Å; Q116-I120 PolarHBondContact O-N 3.19Å; Q116-V127 PolarHBondContact NE2-O 3.4Å
117	R	76.4	Confident	69.5	Low	77 Å²	77	79.6 Å²	79.6	29%	0.291	39%	0.394	S	S	.	.	H	α-helix	trans	-63.1	-25.3	172.6	-87.9	177.4	-83.9	178.3	-9.7	114.1	V112 N113 S115 R121 F861	V112-R117 HydrophobicContact CG1-CG 4.29Å; V112-R117 PolarHBondContact O-NE 3.45Å; V112-R117 PolarHBondContact O-NH2 3.4Å; N113-R117 PolarHBondContact O-N 2.9Å; N113-R117 VanDerWaalsContact O-N 3.12Å; N113-R117 PolarHBondContact O-NE 2.8Å; S115-R117 PolarHBondContact O-N 3.22Å; R117-R121 PolarHBondContact O-N 2.99Å; R117-F861 WeakPolarHBondContact O-CE2 3.4Å; R117-F861 WeakPolarHBondContact O-CZ 3.45Å
118	Q	79.3	Confident	70.8	Confident	131 Å²	131	70.9 Å²	70.9	61%	0.612	36%	0.363	S	S	*	.	H	α-helix	trans	-73.6	-44.3	173.4	-156.3	83	-13.8	0	0	111.1	K114 S115 Q116 R121 T122	K114-Q118 PolarHBondContact O-N 3.34Å; S115-Q118 WeakPolarHBondContact O-CA 3.4Å; S115-Q118 WeakPolarHBondContact O-CB 3.24Å; S115-Q118 PolarHBondContact O-N 3.32Å; Q116-Q118 PolarHBondContact O-N 2.86Å; Q118-R121 PolarHBondContact O-N 2.92Å; Q118-T122 PolarHBondContact O-N 2.87Å; Q118-T122 PolarHBondContact O-OG1 3.09Å
119	E	80.6	Confident	71.9	Confident	78 Å²	78	68.4 Å²	68.4	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-61.5	-42.8	176.1	-57.2	-174.1	123.1	0	0	112.3	S115 Q116 R121 T122 N123 Q125 V127	S115-E119 PolarHBondContact O-N 2.99Å; Q116-E119 PolarHBondContact O-N 3.06Å; E119-R121 VanDerWaalsContact C-N 3.27Å; E119-R121 PolarHBondContact O-N 2.92Å; E119-T122 PolarHBondContact O-N 3.03Å; E119-T122 PolarHBondContact O-OG1 2.79Å; E119-N123 PolarHBondContact O-N 2.91Å; E119-Q125 CarbonylContact C-O 3.58Å; E119-Q125 WeakPolarHBondContact CB-O 3.4Å; E119-V127 PolarHBondContact OE2-N 3.35Å
120	I	81.6	Confident	72.3	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-53.5	-45.9	174.9	-72.8	173.2	0	0	0	110.2	V112 Q116 A124 F126 I142 L147 F861 F865	V112-I120 HydrophobicContact CG1-CD1 4.17Å; Q116-I120 VanDerWaalsContact O-CG1 3.23Å; Q116-I120 WeakPolarHBondContact O-CG1 3.26Å; Q116-I120 PolarHBondContact O-N 3.19Å; I120-A124 VanDerWaalsContact O-CA 3.31Å; I120-A124 WeakPolarHBondContact O-CA 3.37Å; I120-A124 PolarHBondContact O-N 2.96Å; I120-F126 HydrophobicContact CD1-CB 4.23Å; I120-F126 HydrophobicContact CD1-CD1 4.03Å; I120-F126 HydrophobicContact CD1-CG 4.09Å; I120-F126 HydrophobicContact CG1-CB 3.82Å; I120-F126 HydrophobicContact CG1-CD1 3.93Å; I120-F126 HydrophobicContact CG1-CG 4.08Å; I120-I142 HydrophobicContact CB-CD1 4.39Å; I120-I142 HydrophobicContact CD1-CD1 4.46Å; I120-I142 HydrophobicContact CG1-CD1 4Å; I120-I142 HydrophobicContact CG2-CD1 3.8Å; I120-L147 HydrophobicContact CG2-CD2 3.33Å; I120-L147 WeakPolarHBondContact O-CD2 3.42Å; I120-F861 HydrophobicContact CG2-CD2 4.25Å; I120-F861 HydrophobicContact CG2-CE2 4.27Å; I120-F865 HydrophobicContact CD1-CD1 4.24Å; I120-F865 HydrophobicContact CD1-CE1 4.38Å; I120-F865 HydrophobicContact CG2-CD1 4.17Å; I120-F865 HydrophobicContact CG2-CE1 4.47Å
121	R	82.6	Confident	72.3	Confident	85 Å²	85	67.3 Å²	67.3	32%	0.321	36%	0.355	S	S	.	.	H	α-helix	trans	-68.9	-34.4	-178	-170.8	-178.7	174.7	98.8	-8	113.9	R117 Q118 E119 G149 T150 F861 Y862	R117-R121 PolarHBondContact O-N 2.99Å; Q118-R121 PolarHBondContact O-N 2.92Å; E119-R121 VanDerWaalsContact C-N 3.27Å; E119-R121 PolarHBondContact O-N 2.92Å; R121-G149 WeakPolarHBondContact O-CA 3.38Å; R121-T150 PolarHBondContact O-N 3.12Å; R121-F861 HydrophobicContact CB-CD2 4.15Å; R121-F861 HydrophobicContact CB-CE2 3.75Å; R121-F861 HydrophobicContact CB-CZ 3.97Å; R121-F861 HydrophobicContact CG-CD2 4.5Å; R121-F861 HydrophobicContact CG-CE1 4.5Å; R121-F861 HydrophobicContact CG-CE2 4.38Å; R121-F861 HydrophobicContact CG-CZ 4.36Å; R121-F861 VanDerWaalsContact NH1-CD1 3.3Å; R121-Y862 VanDerWaalsContact NH1-CZ 3.32Å; R121-Y862 PolarHBondContact NH1-OH 3.39Å; R121-Y862 VanDerWaalsContact NH1-OH 3.13Å; R121-Y862 PolarHBondContact NH2-OH 3.05Å
122	T	84	Confident	71.7	Confident	55 Å²	55	66.1 Å²	66.1	34%	0.337	35%	0.348	S	S	.	.	H	α-helix	trans	-86.7	-41.4	-175.5	52.3	0	0	0	0	112.7	Q118 E119 G149 T150 R151	Q118-T122 PolarHBondContact O-N 2.87Å; Q118-T122 PolarHBondContact O-OG1 3.09Å; E119-T122 PolarHBondContact O-N 3.03Å; E119-T122 PolarHBondContact O-OG1 2.79Å; T122-G149 CarbonylContact O-C 3.56Å; T122-G149 WeakPolarHBondContact O-CA 3.05Å; T122-T150 PolarHBondContact O-N 3.36Å; T122-R151 PolarHBondContact O-N 2.98Å
123	N	80.5	Confident	70.9	Confident	69 Å²	69	69.9 Å²	69.9	37%	0.369	36%	0.364	S	S	.	.	H	α-helix	trans	-128.8	-4	-165.1	-64.5	-23	0	0	0	114.8	E119 Q125	E119-N123 PolarHBondContact O-N 2.91Å; N123-Q125 PolarHBondContact O-N 2.87Å; N123-Q125 PolarHBondContact O-NE2 2.86Å
124	A	81.9	Confident	69.7	Low	7 Å²	7	72.1 Å²	72.1	6%	0.058	38%	0.382	C	S	.	.	S	Bend	trans	53.9	26.1	-173.8	0	0	0	0	0	115.6	I120 I142 L147 N148	I120-A124 VanDerWaalsContact O-CA 3.31Å; I120-A124 WeakPolarHBondContact O-CA 3.37Å; I120-A124 PolarHBondContact O-N 2.96Å; A124-I142 WeakPolarHBondContact O-CB 3.13Å; A124-I142 PolarHBondContact O-N 3.06Å; A124-L147 HydrophobicContact CB-CB 4.3Å; A124-L147 VanDerWaalsContact CB-O 3.32Å; A124-L147 WeakPolarHBondContact CB-O 3.31Å; A124-N148 VanDerWaalsContact CB-C 3.45Å
125	Q	81.7	Confident	68.6	Low	82 Å²	82	67.7 Å²	67.7	38%	0.383	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	147.3	179.9	-71	157	82.5	0	0	108.1	E119 N123 K141	E119-Q125 CarbonylContact C-O 3.58Å; E119-Q125 WeakPolarHBondContact CB-O 3.4Å; N123-Q125 PolarHBondContact O-N 2.87Å; N123-Q125 PolarHBondContact O-NE2 2.86Å; Q125-K141 HydrophobicContact CG-CG 4.3Å
126	F	77.8	Confident	67.4	Low	19 Å²	19	64.9 Å²	64.9	8%	0.083	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	149.8	176.2	66.5	-78.2	0	0	0	111.9	I120 V128 W140 I142	I120-F126 HydrophobicContact CD1-CB 4.23Å; I120-F126 HydrophobicContact CD1-CD1 4.03Å; I120-F126 HydrophobicContact CD1-CG 4.09Å; I120-F126 HydrophobicContact CG1-CB 3.82Å; I120-F126 HydrophobicContact CG1-CD1 3.93Å; I120-F126 HydrophobicContact CG1-CG 4.08Å; F126-V128 HydrophobicContact CD2-CG2 3.63Å; F126-V128 HydrophobicContact CE2-CG2 3.5Å; F126-W140 HydrophobicContact CD1-CB 4.13Å; F126-W140 HydrophobicContact CD2-CB 4.49Å; F126-W140 HydrophobicContact CE1-CB 3.66Å; F126-W140 HydrophobicContact CE2-CB 4.07Å; F126-W140 HydrophobicContact CE2-CG 4.27Å; F126-W140 HydrophobicContact CZ-CB 3.63Å; F126-W140 HydrophobicContact CZ-CG 4.09Å; F126-W140 PolarHBondContact N-O 2.86Å; F126-W140 VanDerWaalsContact N-O 3.13Å; F126-W140 PolarHBondContact O-N 3.04Å; F126-I142 HydrophobicContact CD1-CD1 4.26Å; F126-I142 HydrophobicContact CD1-CG1 4.18Å; F126-I142 HydrophobicContact CE1-CD1 4.36Å; F126-I142 HydrophobicContact CE1-CG1 3.94Å
127	V	73.2	Confident	66.6	Low	57 Å²	57	66.6 Å²	66.6	35%	0.345	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.9	-175	-173.6	0	0	0	0	110.8	Q116 E119 V137	Q116-V127 PolarHBondContact NE2-O 3.4Å; E119-V127 PolarHBondContact OE2-N 3.35Å; V127-V137 HydrophobicContact CG1-CB 3.55Å; V127-V137 HydrophobicContact CG1-CG1 3.72Å; V127-V137 HydrophobicContact CG1-CG2 4.39Å
128	V	65.3	Low	65.9	Low	20 Å²	20	64.5 Å²	64.5	12%	0.121	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123	-178.2	-180	0	0	0	0	110.3	F126 V137 H138 I871	F126-V128 HydrophobicContact CD2-CG2 3.63Å; F126-V128 HydrophobicContact CE2-CG2 3.5Å; V128-V137 WeakPolarHBondContact O-CA 3.35Å; V128-H138 PolarHBondContact N-O 3.5Å; V128-H138 PolarHBondContact O-N 3.07Å; V128-I871 HydrophobicContact CG1-CD1 4.1Å
129	P	59.4	Low	65.3	Low	86 Å²	86	59.5 Å²	59.5	56%	0.558	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	144.8	174.6	30.3	-34.3	0	0	0	111.7	E136 V137	P129-E136 CarbonylContact C-O 3.57Å; P129-E136 WeakPolarHBondContact CA-O 3.28Å; P129-V137 HydrophobicContact CB-CG1 4.13Å
130	C	51.8	Low	64.8	Low	28 Å²	28	56.2 Å²	56.2	19%	0.189	33%	0.334	C	S	.	.			trans	-87.3	128.7	179.9	-159.6	0	0	0	0	111	E136	C130-E136 HydrophobicContact CB-CB 3.96Å; C130-E136 PolarHBondContact N-O 3.07Å
131	T	50.9	Low	64.4	Low	125 Å²	125	60.7 Å²	60.7	77%	0.767	35%	0.354	S	S	*	.	S	Bend	trans	-79.4	-22.4	-175.7	48	0	0	0	0	114.1
132	T	44.6	Very low	64.2	Low	82 Å²	82	56.9 Å²	56.9	50%	0.503	34%	0.339	S	S	.	.	S	Bend	trans	-88.9	-15.6	177	47.6	0	0	0	0	114
133	F	44.6	Very low	63.8	Low	88 Å²	88	55.3 Å²	55.3	39%	0.386	33%	0.331	S	S	.	.	S	Bend	trans	-135.8	95.4	-178.5	-61.8	-69.4	0	0	0	109.7	G135 E136 I1065	F133-G135 PolarHBondContact O-N 3.24Å; F133-E136 HydrophobicContact CB-CB 4.29Å; F133-E136 HydrophobicContact CB-CG 4.07Å; F133-E136 PolarHBondContact O-N 3.38Å; F133-E136 VanDerWaalsContact O-N 3.08Å; F133-I1065 HydrophobicContact CD2-CD1 4.11Å; F133-I1065 HydrophobicContact CE1-CD1 4.39Å; F133-I1065 HydrophobicContact CE1-CG2 3.99Å; F133-I1065 HydrophobicContact CE2-CD1 3.93Å; F133-I1065 HydrophobicContact CE2-CG2 4.49Å; F133-I1065 HydrophobicContact CG-CD1 4.44Å; F133-I1065 HydrophobicContact CZ-CD1 4.08Å; F133-I1065 HydrophobicContact CZ-CG2 3.7Å
134	T	44.4	Very low	63.4	Low	147 Å²	147	56.1 Å²	56.1	90%	0.902	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	119.9	-178.6	37.2	0	0	0	0	111.1
135	G	51.5	Low	63.1	Low	78 Å²	78	65.1 Å²	65.1	80%	0.804	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.1	-7.4	-178.6	0	0	0	0	0	115.7	F133	F133-G135 PolarHBondContact O-N 3.24Å
136	E	49.3	Very low	62.6	Low	18 Å²	18	62.8 Å²	62.8	8%	0.084	36%	0.362	C	S	.	.			trans	-81.2	139.2	169	-72.6	-158.9	170	0	0	112.3	P129 C130 F133 H138 R889	P129-E136 CarbonylContact C-O 3.57Å; P129-E136 WeakPolarHBondContact CA-O 3.28Å; C130-E136 HydrophobicContact CB-CB 3.96Å; C130-E136 PolarHBondContact N-O 3.07Å; F133-E136 HydrophobicContact CB-CB 4.29Å; F133-E136 HydrophobicContact CB-CG 4.07Å; F133-E136 PolarHBondContact O-N 3.38Å; F133-E136 VanDerWaalsContact O-N 3.08Å; E136-H138 IonicContact OE2-CE1 3.88Å; E136-R889 VanDerWaalsContact CG-NH1 3.31Å; E136-R889 WeakPolarHBondContact OE1-CD 3.24Å; E136-R889 WeakPolarHBondContact OE1-CG 3.35Å; E136-R889 IonicContact OE1-CZ 3.83Å; E136-R889 IonicContact OE1-NE 2.59Å; E136-R889 IonicContact OE1-NH1 2.66Å; E136-R889 PolarHBondContact OE1-NH1 3.43Å
137	V	57.9	Low	62.8	Low	65 Å²	65	62 Å²	62	39%	0.394	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	120.8	177.1	-92.1	0	0	0	0	110.4	V127 V128 P129	V127-V137 HydrophobicContact CG1-CB 3.55Å; V127-V137 HydrophobicContact CG1-CG1 3.72Å; V127-V137 HydrophobicContact CG1-CG2 4.39Å; V128-V137 WeakPolarHBondContact O-CA 3.35Å; P129-V137 HydrophobicContact CB-CG1 4.13Å
138	H	60.8	Low	63	Low	34 Å²	34	60.7 Å²	60.7	16%	0.157	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	123	175.8	-63.7	-34	0	0	0	110.1	V128 E136 W140 R881	V128-H138 PolarHBondContact N-O 3.5Å; V128-H138 PolarHBondContact O-N 3.07Å; E136-H138 IonicContact OE2-CE1 3.88Å; H138-W140 VanDerWaalsContact O-CD1 3.29Å; H138-R881 PolarHBondContact CD2-NH2 2.88Å; H138-R881 PolarHBondContact NE2-NH1 2.72Å; H138-R881 PolarHBondContact NE2-NH2 3.26Å
139	A	66	Low	63.9	Low	26 Å²	26	59.8 Å²	59.8	22%	0.215	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	125.7	170	0	0	0	0	0	110	S882	A139-S882 WeakPolarHBondContact O-CB 3.39Å; A139-S882 PolarHBondContact O-N 3.35Å
140	W	70.1	Confident	65.1	Low	9 Å²	9	59.3 Å²	59.3	3%	0.034	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.5	176.7	-64.7	84.6	0	0	0	109.6	F126 H138 I871 P872 V879 R881	F126-W140 HydrophobicContact CD1-CB 4.13Å; F126-W140 HydrophobicContact CD2-CB 4.49Å; F126-W140 HydrophobicContact CE1-CB 3.66Å; F126-W140 HydrophobicContact CE2-CB 4.07Å; F126-W140 HydrophobicContact CE2-CG 4.27Å; F126-W140 HydrophobicContact CZ-CB 3.63Å; F126-W140 HydrophobicContact CZ-CG 4.09Å; F126-W140 PolarHBondContact N-O 2.86Å; F126-W140 VanDerWaalsContact N-O 3.13Å; F126-W140 PolarHBondContact O-N 3.04Å; H138-W140 VanDerWaalsContact O-CD1 3.29Å; W140-I871 HydrophobicContact CZ2-CG2 4.15Å; W140-P872 HydrophobicContact CH2-CG 4.42Å; W140-P872 HydrophobicContact CZ3-CG 4.03Å; W140-V879 HydrophobicContact CB-CG1 4.28Å; W140-V879 HydrophobicContact CE3-CG1 3.91Å; W140-R881 HydrophobicContact CD2-CG 4.33Å; W140-R881 HydrophobicContact CE3-CG 3.96Å; W140-R881 HydrophobicContact CH2-CG 4.09Å; W140-R881 HydrophobicContact CZ2-CG 4.39Å; W140-R881 HydrophobicContact CZ3-CG 3.84Å
141	K	75.2	Confident	66.6	Low	95 Å²	95	67.2 Å²	67.2	41%	0.413	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.5	176.7	-169.7	167.4	-176.8	171.2	0	108.5	Q125 K880	Q125-K141 HydrophobicContact CG-CG 4.3Å; K141-K880 PolarHBondContact N-O 3.45Å; K141-K880 PolarHBondContact O-N 2.86Å
142	I	76.7	Confident	68.2	Low	4 Å²	4	63.7 Å²	63.7	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	141.1	172.2	-59.2	166	0	0	0	107.1	I120 A124 F126 L146 L147 F865	I120-I142 HydrophobicContact CB-CD1 4.39Å; I120-I142 HydrophobicContact CD1-CD1 4.46Å; I120-I142 HydrophobicContact CG1-CD1 4Å; I120-I142 HydrophobicContact CG2-CD1 3.8Å; A124-I142 WeakPolarHBondContact O-CB 3.13Å; A124-I142 PolarHBondContact O-N 3.06Å; F126-I142 HydrophobicContact CD1-CD1 4.26Å; F126-I142 HydrophobicContact CD1-CG1 4.18Å; F126-I142 HydrophobicContact CE1-CD1 4.36Å; F126-I142 HydrophobicContact CE1-CG1 3.94Å; I142-L146 HydrophobicContact CG2-CB 3.74Å; I142-L147 HydrophobicContact CD1-CD2 4.42Å; I142-L147 HydrophobicContact CG2-CB 4.15Å; I142-F865 HydrophobicContact CD1-CE1 3.81Å; I142-F865 HydrophobicContact CD1-CZ 3.84Å; I142-F865 HydrophobicContact CG1-CE1 4.46Å; I142-F865 HydrophobicContact CG1-CZ 4.26Å; I142-F865 HydrophobicContact CG2-CZ 4.08Å
143	S	75.9	Confident	70.2	Confident	22 Å²	22	60.3 Å²	60.3	15%	0.154	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-61.4	136.9	175.4	54.9	0	0	0	0	110.3	W145 L146 L147 S878	S143-W145 PolarHBondContact O-N 3.04Å; S143-L146 PolarHBondContact O-N 3Å; S143-L147 PolarHBondContact O-N 3.19Å; S143-S878 WeakPolarHBondContact CB-O 3.44Å; S143-S878 PolarHBondContact N-O 3Å; S143-S878 PolarHBondContact OG-O 3.39Å
144	P	71.8	Confident	72.2	Confident	86 Å²	86	61 Å²	61	56%	0.558	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	5.4	-175.1	28.9	-36.8	0	0	0	114.4	N148	P144-N148 WeakPolarHBondContact CA-OD1 3.37Å; P144-N148 WeakPolarHBondContact CB-OD1 3.41Å; P144-N148 PolarHBondContact O-ND2 3.02Å; P144-N148 PolarHBondContact O-OD1 3.23Å
145	W	75.3	Confident	74.1	Confident	196 Å²	196	61.7 Å²	61.7	74%	0.742	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-29.5	169.4	178.7	72.1	0	0	0	112.4	S143 W856	S143-W145 PolarHBondContact O-N 3.04Å; W145-W856 PolarHBondContact O-NE1 2.86Å
146	L	72.2	Confident	75.7	Confident	34 Å²	34	61.8 Å²	61.8	18%	0.178	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-44.2	179.7	-95.4	157.2	0	0	0	112.5	I142 S143 V860 F865	I142-L146 HydrophobicContact CG2-CB 3.74Å; S143-L146 PolarHBondContact O-N 3Å; L146-V860 HydrophobicContact CD2-CG1 4.27Å; L146-V860 WeakPolarHBondContact O-CG1 3.21Å; L146-F865 HydrophobicContact CD2-CE2 4.3Å
147	L	81	Confident	77.7	Confident	2 Å²	2	63 Å²	63	1%	0.01	30%	0.3	C	S	.	.			trans	-158.4	144.6	179.7	-153.5	76.9	0	0	0	110.3	I120 A124 I142 S143 D857 V860 F861	I120-L147 HydrophobicContact CG2-CD2 3.33Å; I120-L147 WeakPolarHBondContact O-CD2 3.42Å; A124-L147 HydrophobicContact CB-CB 4.3Å; A124-L147 VanDerWaalsContact CB-O 3.32Å; A124-L147 WeakPolarHBondContact CB-O 3.31Å; I142-L147 HydrophobicContact CD1-CD2 4.42Å; I142-L147 HydrophobicContact CG2-CB 4.15Å; S143-L147 PolarHBondContact O-N 3.19Å; L147-D857 WeakPolarHBondContact CA-OD1 3.42Å; L147-D857 HydrophobicContact CD1-CB 3.92Å; L147-V860 HydrophobicContact CD1-CB 4.4Å; L147-V860 HydrophobicContact CD1-CG1 4.4Å; L147-F861 HydrophobicContact CD1-CB 4.46Å
148	N	77.9	Confident	79	Confident	30 Å²	30	63 Å²	63	16%	0.16	30%	0.298	C	S	.	.			trans	-119.3	-25.2	178.5	-80.7	-60.7	0	0	0	115.2	A124 P144 N152 I153 D857	A124-N148 VanDerWaalsContact CB-C 3.45Å; P144-N148 WeakPolarHBondContact CA-OD1 3.37Å; P144-N148 WeakPolarHBondContact CB-OD1 3.41Å; P144-N148 PolarHBondContact O-ND2 3.02Å; P144-N148 PolarHBondContact O-OD1 3.23Å; N148-N152 WeakPolarHBondContact O-CB 3.18Å; N148-N152 PolarHBondContact O-ND2 2.97Å; N148-I153 HydrophobicContact CB-CG1 4.2Å; N148-D857 PolarHBondContact N-OD1 3.35Å; N148-D857 VanDerWaalsContact N-OD1 3.12Å; N148-D857 PolarHBondContact N-OD2 2.86Å; N148-D857 VanDerWaalsContact N-OD2 3.1Å
149	G	84	Confident	80.2	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	31%	0.307	C	S	.	.			trans	87.2	135.1	-179.1	0	0	0	0	0	113	R121 T122 R151 N152 I153 D857	R121-G149 WeakPolarHBondContact O-CA 3.38Å; T122-G149 CarbonylContact O-C 3.56Å; T122-G149 WeakPolarHBondContact O-CA 3.05Å; G149-R151 VanDerWaalsContact C-N 3.3Å; G149-R151 PolarHBondContact O-N 3.27Å; G149-N152 PolarHBondContact O-N 3.45Å; G149-I153 WeakPolarHBondContact O-CG1 3.37Å; G149-I153 PolarHBondContact O-N 2.9Å; G149-D857 PolarHBondContact N-OD2 3.46Å
150	T	85.5	Confident	81.3	Confident	76 Å²	76	65.4 Å²	65.4	47%	0.466	30%	0.302	S	S	.	.	H	α-helix	trans	-57.5	-36.7	-170.3	51.2	0	0	0	0	114.2	R121 T122 N152 I153 H154	R121-T150 PolarHBondContact O-N 3.12Å; T122-T150 PolarHBondContact O-N 3.36Å; T150-N152 VanDerWaalsContact C-N 3.34Å; T150-I153 PolarHBondContact O-N 3.38Å; T150-H154 PolarHBondContact O-N 3.28Å
151	R	83.5	Confident	82.2	Confident	195 Å²	195	66.9 Å²	66.9	74%	0.736	31%	0.31	S	S	*	.	H	α-helix	trans	-71.9	-30.4	-178.9	-157.9	173.2	-169.2	170.2	3.5	112.3	T122 G149 K155	T122-R151 PolarHBondContact O-N 2.98Å; G149-R151 VanDerWaalsContact C-N 3.3Å; G149-R151 PolarHBondContact O-N 3.27Å; R151-K155 PolarHBondContact O-N 3.5Å
152	N	83.7	Confident	82.8	Confident	51 Å²	51	66.6 Å²	66.6	27%	0.273	31%	0.307	S	S	.	.	H	α-helix	trans	-74.3	-43.5	173.8	-64.1	-32.5	0	0	0	111	N148 G149 T150 H154 K155 H156	N148-N152 WeakPolarHBondContact O-CB 3.18Å; N148-N152 PolarHBondContact O-ND2 2.97Å; G149-N152 PolarHBondContact O-N 3.45Å; T150-N152 VanDerWaalsContact C-N 3.34Å; N152-H154 VanDerWaalsContact C-N 3.29Å; N152-H154 PolarHBondContact O-N 3.3Å; N152-K155 PolarHBondContact O-N 2.94Å; N152-H156 PolarHBondContact O-CD2 3.23Å; N152-H156 PolarHBondContact O-N 2.81Å
153	I	86	Confident	83.2	Confident	10 Å²	10	68.9 Å²	68.9	5%	0.051	32%	0.319	C	S	.	.	H	α-helix	trans	-54.2	-45	177	-67.7	169.9	0	0	0	111.1	N148 G149 T150 H156 F157 F850 D857	N148-I153 HydrophobicContact CB-CG1 4.2Å; G149-I153 WeakPolarHBondContact O-CG1 3.37Å; G149-I153 PolarHBondContact O-N 2.9Å; T150-I153 PolarHBondContact O-N 3.38Å; I153-H156 PolarHBondContact O-N 2.84Å; I153-F157 PolarHBondContact O-N 3.37Å; I153-F850 HydrophobicContact CG2-CD2 3.68Å; I153-F850 HydrophobicContact CG2-CE2 3.85Å; I153-D857 HydrophobicContact CD1-CB 4.09Å
154	H	86.6	Confident	83.8	Confident	102 Å²	102	67.9 Å²	67.9	47%	0.472	31%	0.312	S	S	.	.	H	α-helix	trans	-71.6	-35.6	-179.6	-155.5	69.6	0	0	0	113.3	T150 N152 F157 N158 F850	T150-H154 PolarHBondContact O-N 3.28Å; N152-H154 VanDerWaalsContact C-N 3.29Å; N152-H154 PolarHBondContact O-N 3.3Å; H154-F157 PolarHBondContact O-N 2.91Å; H154-N158 PolarHBondContact O-N 2.98Å; H154-F850 AromaticContact ND1-CE2 3.86Å
155	K	85.3	Confident	84.6	Confident	163 Å²	163	67.6 Å²	67.6	71%	0.709	30%	0.302	S	S	*	.	H	α-helix	trans	-60.4	-44.1	168.6	-93	-169	170.9	-170.8	0	111.8	R151 N152 R159	R151-K155 PolarHBondContact O-N 3.5Å; N152-K155 PolarHBondContact O-N 2.94Å; K155-R159 WeakPolarHBondContact O-CB 3.13Å; K155-R159 PolarHBondContact O-N 2.8Å; K155-R159 VanDerWaalsContact O-N 3.1Å
156	H	85.5	Confident	85.1	Confident	79 Å²	79	58.4 Å²	58.4	37%	0.366	27%	0.267	S	S	.	.	H	α-helix	trans	-64.6	-41.5	178.3	-77.5	-60.9	0	0	0	112.2	N152 I153 N158 R159 D160	N152-H156 PolarHBondContact O-CD2 3.23Å; N152-H156 PolarHBondContact O-N 2.81Å; I153-H156 PolarHBondContact O-N 2.84Å; H156-N158 PolarHBondContact O-N 2.76Å; H156-R159 PolarHBondContact O-N 2.75Å; H156-D160 WeakPolarHBondContact O-CB 3.16Å; H156-D160 PolarHBondContact O-N 3.08Å
157	F	90	Very high	85.8	Confident	44 Å²	44	57.7 Å²	57.7	19%	0.193	26%	0.264	C	S	.	.	H	α-helix	trans	-56.6	-52	176.3	176.1	-108	0	0	0	112.3	I153 H154 R159 D160 L161 V847 F850	I153-F157 PolarHBondContact O-N 3.37Å; H154-F157 PolarHBondContact O-N 2.91Å; F157-R159 PolarHBondContact O-N 3.24Å; F157-D160 PolarHBondContact O-N 3.41Å; F157-L161 HydrophobicContact CZ-CD1 4.36Å; F157-L161 WeakPolarHBondContact O-CB 3.22Å; F157-L161 PolarHBondContact O-N 2.88Å; F157-V847 HydrophobicContact CE2-CG2 4.3Å; F157-F850 HydrophobicContact CB-CB 4.5Å; F157-F850 HydrophobicContact CB-CD2 3.76Å; F157-F850 HydrophobicContact CB-CE2 4.35Å; F157-F850 HydrophobicContact CB-CG 4.31Å; F157-F850 HydrophobicContact CD2-CB 3.67Å; F157-F850 HydrophobicContact CD2-CD2 4.25Å; F157-F850 AromaticContact CD2-CG 3.93Å; F157-F850 HydrophobicContact CD2-CG 3.93Å; F157-F850 HydrophobicContact CE2-CB 4.26Å; F157-F850 HydrophobicContact CG-CB 4.3Å; F157-F850 HydrophobicContact CG-CD2 4.02Å; F157-F850 HydrophobicContact CG-CG 4.13Å
158	N	86.5	Confident	86	Confident	64 Å²	64	60.1 Å²	60.1	34%	0.342	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-40	179.5	-71.4	-17.6	0	0	0	112	H154 H156 D160 L161 Y162	H154-N158 PolarHBondContact O-N 2.98Å; H156-N158 PolarHBondContact O-N 2.76Å; N158-D160 VanDerWaalsContact C-N 3.35Å; N158-D160 PolarHBondContact O-N 3.31Å; N158-L161 PolarHBondContact O-N 2.81Å; N158-Y162 WeakPolarHBondContact O-CD2 3.28Å; N158-Y162 PolarHBondContact O-N 2.69Å; N158-Y162 VanDerWaalsContact O-N 3.12Å
159	R	86.4	Confident	86.4	Confident	92 Å²	92	60.7 Å²	60.7	35%	0.347	28%	0.284	S	S	.	.	H	α-helix	trans	-62.7	-42	175.8	-166.2	169.7	84.1	165.1	7.9	111.8	K155 H156 F157 Y162 N163 E1380	K155-R159 WeakPolarHBondContact O-CB 3.13Å; K155-R159 PolarHBondContact O-N 2.8Å; K155-R159 VanDerWaalsContact O-N 3.1Å; H156-R159 PolarHBondContact O-N 2.75Å; F157-R159 PolarHBondContact O-N 3.24Å; R159-Y162 PolarHBondContact O-N 3.16Å; R159-N163 WeakPolarHBondContact O-CB 3.28Å; R159-N163 VanDerWaalsContact O-CG 3.31Å; R159-N163 PolarHBondContact O-N 3.41Å; R159-N163 PolarHBondContact O-ND2 3.03Å; R159-E1380 IonicContact CZ-OE2 2.8Å; R159-E1380 IonicContact NH1-OE1 3.24Å; R159-E1380 PolarHBondContact NH1-OE1 3.27Å; R159-E1380 IonicContact NH1-OE2 2.67Å; R159-E1380 PolarHBondContact NH1-OE2 3.45Å
160	D	87.3	Confident	86.3	Confident	20 Å²	20	61.2 Å²	61.2	11%	0.107	29%	0.287	C	S	.	.	H	α-helix	trans	-74.6	-27.6	-179.1	-64.1	-13.5	0	0	0	112.4	H156 F157 N158 N163 A164 T846 K849	H156-D160 WeakPolarHBondContact O-CB 3.16Å; H156-D160 PolarHBondContact O-N 3.08Å; F157-D160 PolarHBondContact O-N 3.41Å; N158-D160 VanDerWaalsContact C-N 3.35Å; N158-D160 PolarHBondContact O-N 3.31Å; D160-N163 PolarHBondContact O-N 3.48Å; D160-A164 PolarHBondContact O-N 3.34Å; D160-T846 HydrophobicContact CB-CG2 3.51Å; D160-K849 IonicContact OD2-NZ 3.72Å; D160-K849 PolarHBondContact OD2-NZ 3.42Å
161	L	89.4	Confident	86.3	Confident	40 Å²	40	59.9 Å²	59.9	21%	0.209	28%	0.279	C	S	.	.	H	α-helix	trans	-65.4	-48.7	170.3	-166.8	86.9	0	0	0	111.6	F157 N158 N163 A164 F165 L843	F157-L161 HydrophobicContact CZ-CD1 4.36Å; F157-L161 WeakPolarHBondContact O-CB 3.22Å; F157-L161 PolarHBondContact O-N 2.88Å; N158-L161 PolarHBondContact O-N 2.81Å; L161-N163 VanDerWaalsContact C-N 3.27Å; L161-N163 PolarHBondContact O-N 3.13Å; L161-A164 WeakPolarHBondContact O-CB 3.26Å; L161-A164 PolarHBondContact O-N 3.02Å; L161-A164 VanDerWaalsContact O-N 3.12Å; L161-F165 HydrophobicContact CG-CE2 4.41Å; L161-F165 PolarHBondContact O-N 2.88Å; L161-F165 VanDerWaalsContact O-N 3.13Å; L161-L843 HydrophobicContact CD1-CD1 3.77Å
162	Y	87.9	Confident	86.3	Confident	89 Å²	89	51.8 Å²	51.8	35%	0.349	25%	0.252	S	S	.	.	H	α-helix	trans	-65.3	-32.3	174.7	-63.8	-53.5	0	0	0	112.1	N158 R159 S166 N405	N158-Y162 WeakPolarHBondContact O-CD2 3.28Å; N158-Y162 PolarHBondContact O-N 2.69Å; N158-Y162 VanDerWaalsContact O-N 3.12Å; R159-Y162 PolarHBondContact O-N 3.16Å; Y162-S166 PolarHBondContact O-N 3.16Å; Y162-N405 HydrophobicContact CD1-CB 4.28Å; Y162-N405 HydrophobicContact CE1-CB 3.76Å
163	N	85.4	Confident	86.3	Confident	52 Å²	52	52.9 Å²	52.9	28%	0.278	26%	0.257	S	S	.	.	H	α-helix	trans	-63.1	-40.6	170.3	-78.4	-36.8	0	0	0	112.1	R159 D160 L161 S166 V167	R159-N163 WeakPolarHBondContact O-CB 3.28Å; R159-N163 VanDerWaalsContact O-CG 3.31Å; R159-N163 PolarHBondContact O-N 3.41Å; R159-N163 PolarHBondContact O-ND2 3.03Å; D160-N163 PolarHBondContact O-N 3.48Å; L161-N163 VanDerWaalsContact C-N 3.27Å; L161-N163 PolarHBondContact O-N 3.13Å; N163-S166 WeakPolarHBondContact O-CB 3.49Å; N163-S166 PolarHBondContact O-N 3.26Å; N163-S166 PolarHBondContact O-OG 3.04Å; N163-V167 PolarHBondContact O-N 3.07Å
164	A	89.4	Confident	86.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.2	-53.6	175	0	0	0	0	0	111.2	D160 L161 S166 V167 F839	D160-A164 PolarHBondContact O-N 3.34Å; L161-A164 WeakPolarHBondContact O-CB 3.26Å; L161-A164 PolarHBondContact O-N 3.02Å; L161-A164 VanDerWaalsContact O-N 3.12Å; A164-S166 PolarHBondContact O-N 2.88Å; A164-V167 WeakPolarHBondContact O-CB 3.3Å; A164-V167 PolarHBondContact O-N 3.44Å; A164-F839 HydrophobicContact CB-CD2 4.13Å; A164-F839 HydrophobicContact CB-CE2 4.19Å; A164-F839 WeakPolarHBondContact O-CD2 3.49Å
165	F	86.9	Confident	85.9	Confident	81 Å²	81	51.8 Å²	51.8	36%	0.355	25%	0.252	S	S	.	.	H	α-helix	trans	-58.3	-32.1	175.9	-81.8	-75.1	0	0	0	113.1	L161 V167 V168 V169 I406 F839	L161-F165 HydrophobicContact CG-CE2 4.41Å; L161-F165 PolarHBondContact O-N 2.88Å; L161-F165 VanDerWaalsContact O-N 3.13Å; F165-V167 PolarHBondContact O-N 3.39Å; F165-V168 PolarHBondContact O-N 3.44Å; F165-V169 WeakPolarHBondContact O-CG2 3.29Å; F165-V169 PolarHBondContact O-N 2.84Å; F165-V169 VanDerWaalsContact O-N 3.11Å; F165-I406 HydrophobicContact CB-CD1 3.8Å; F165-I406 HydrophobicContact CB-CG1 4.39Å; F165-F839 AromaticContact CD1-CE2 3.98Å; F165-F839 HydrophobicContact CD1-CE2 3.98Å; F165-F839 HydrophobicContact CD1-CZ 4.05Å; F165-F839 HydrophobicContact CE1-CE2 4.2Å; F165-F839 AromaticContact CE1-CZ 3.83Å; F165-F839 HydrophobicContact CE1-CZ 3.83Å; F165-F839 HydrophobicContact CG-CE2 4.15Å; F165-F839 HydrophobicContact CZ-CZ 4.2Å
166	S	86.9	Confident	85.8	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.014	23%	0.231	C	C	.	.	H	α-helix	trans	-61.6	-24.4	175.1	85.3	0	0	0	0	113.8	Y162 N163 A164 V170 T171 K408	Y162-S166 PolarHBondContact O-N 3.16Å; N163-S166 WeakPolarHBondContact O-CB 3.49Å; N163-S166 PolarHBondContact O-N 3.26Å; N163-S166 PolarHBondContact O-OG 3.04Å; A164-S166 PolarHBondContact O-N 2.88Å; S166-V170 WeakPolarHBondContact O-CA 3.49Å; S166-V170 VanDerWaalsContact O-CB 3.32Å; S166-V170 WeakPolarHBondContact O-CB 3.44Å; S166-V170 PolarHBondContact O-N 2.83Å; S166-T171 PolarHBondContact O-N 2.97Å; S166-T171 VanDerWaalsContact O-N 3.15Å; S166-K408 PolarHBondContact OG-NZ 3.43Å
167	V	86.4	Confident	85.4	Confident	19 Å²	19	47.3 Å²	47.3	12%	0.115	24%	0.235	C	C	.	.	I	π-helix	trans	-67	-49.6	176.5	-177.6	0	0	0	0	111	N163 A164 F165 T171 S172 C835	N163-V167 PolarHBondContact O-N 3.07Å; A164-V167 WeakPolarHBondContact O-CB 3.3Å; A164-V167 PolarHBondContact O-N 3.44Å; F165-V167 PolarHBondContact O-N 3.39Å; V167-T171 CarbonylContact O-C 3.6Å; V167-T171 WeakPolarHBondContact O-CA 3.27Å; V167-T171 VanDerWaalsContact O-CB 3.26Å; V167-T171 WeakPolarHBondContact O-CB 3.48Å; V167-T171 PolarHBondContact O-N 3.22Å; V167-T171 VanDerWaalsContact O-N 3.16Å; V167-S172 PolarHBondContact O-N 3.13Å; V167-C835 HydrophobicContact CG1-CB 4.3Å
168	V	85.8	Confident	84.7	Confident	54 Å²	54	47.8 Å²	47.8	33%	0.327	24%	0.24	S	C	.	.	I	π-helix	trans	-68.9	-48.4	-179.7	-174	0	0	0	0	110.3	F165 S172 F839	F165-V168 PolarHBondContact O-N 3.44Å; V168-S172 WeakPolarHBondContact O-CB 3.45Å; V168-S172 PolarHBondContact O-OG 3.26Å; V168-F839 HydrophobicContact CG2-CB 3.41Å; V168-F839 VanDerWaalsContact CG2-CB 3.41Å; V168-F839 HydrophobicContact CG2-CD1 3.71Å; V168-F839 HydrophobicContact CG2-CD2 3.71Å; V168-F839 HydrophobicContact CG2-CE1 4.39Å; V168-F839 HydrophobicContact CG2-CE2 4.38Å; V168-F839 HydrophobicContact CG2-CG 3.31Å
169	V	85.4	Confident	83.8	Confident	42 Å²	42	48.8 Å²	48.8	26%	0.255	25%	0.25	S	C	.	.	I	π-helix	trans	-77.8	-36.4	-170	-179.8	0	0	0	0	112.9	F165 L403 I406 W409	F165-V169 WeakPolarHBondContact O-CG2 3.29Å; F165-V169 PolarHBondContact O-N 2.84Å; F165-V169 VanDerWaalsContact O-N 3.11Å; V169-L403 HydrophobicContact CG1-CD2 4.15Å; V169-L403 HydrophobicContact CG2-CD2 3.88Å; V169-I406 HydrophobicContact CB-CD1 4.34Å; V169-I406 HydrophobicContact CG2-CD1 4.08Å; V169-W409 HydrophobicContact CG1-CB 4.35Å; V169-W409 VanDerWaalsContact CG1-CD1 3.45Å; V169-W409 HydrophobicContact CG1-CG 4Å
170	V	83.5	Confident	83	Confident	11 Å²	11	49.2 Å²	49.2	7%	0.067	26%	0.259	C	S	.	.	I	π-helix	trans	-109.8	-47.3	-173.9	-171.2	0	0	0	0	111.6	S166 N174 K408 W409	S166-V170 WeakPolarHBondContact O-CA 3.49Å; S166-V170 VanDerWaalsContact O-CB 3.32Å; S166-V170 WeakPolarHBondContact O-CB 3.44Å; S166-V170 PolarHBondContact O-N 2.83Å; V170-N174 WeakPolarHBondContact O-CB 3.37Å; V170-N174 PolarHBondContact O-N 3.02Å; V170-N174 PolarHBondContact O-ND2 3.37Å; V170-N174 PolarHBondContact O-OD1 3.49Å; V170-K408 HydrophobicContact CG1-CB 4.45Å; V170-K408 HydrophobicContact CG2-CB 4.17Å; V170-W409 HydrophobicContact CG2-CB 3.73Å
171	T	83.8	Confident	82.3	Confident	48 Å²	48	51.8 Å²	51.8	29%	0.294	27%	0.269	S	S	.	.	I	π-helix	trans	-71.7	-39	-174.7	-46.2	0	0	0	0	112.5	S166 V167 N174 F175	S166-T171 PolarHBondContact O-N 2.97Å; S166-T171 VanDerWaalsContact O-N 3.15Å; V167-T171 CarbonylContact O-C 3.6Å; V167-T171 WeakPolarHBondContact O-CA 3.27Å; V167-T171 VanDerWaalsContact O-CB 3.26Å; V167-T171 WeakPolarHBondContact O-CB 3.48Å; V167-T171 PolarHBondContact O-N 3.22Å; V167-T171 VanDerWaalsContact O-N 3.16Å; T171-N174 PolarHBondContact O-N 3.48Å; T171-F175 HydrophobicContact CG2-CD2 4.42Å; T171-F175 HydrophobicContact CG2-CE2 3.81Å; T171-F175 HydrophobicContact CG2-CZ 4.47Å; T171-F175 WeakPolarHBondContact O-CD2 3.27Å; T171-F175 PolarHBondContact O-N 2.99Å
172	S	85.1	Confident	82	Confident	25 Å²	25	49.9 Å²	49.9	18%	0.175	26%	0.259	C	S	.	.	H	α-helix	trans	-62.4	-47.9	176.2	81.6	0	0	0	0	112.1	V167 V168 N174 F175	V167-S172 PolarHBondContact O-N 3.13Å; V168-S172 WeakPolarHBondContact O-CB 3.45Å; V168-S172 PolarHBondContact O-OG 3.26Å; S172-N174 VanDerWaalsContact C-N 3.25Å; S172-N174 PolarHBondContact O-N 2.66Å; S172-F175 WeakPolarHBondContact O-CB 3.45Å; S172-F175 PolarHBondContact O-N 2.97Å
173	M	82.2	Confident	81.8	Confident	74 Å²	74	47.2 Å²	47.2	37%	0.365	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-31.4	178.3	-160.2	70.9	-166.2	0	0	112.1	F175 I176 E177	M173-F175 VanDerWaalsContact C-N 3.31Å; M173-F175 PolarHBondContact O-N 3.04Å; M173-I176 WeakPolarHBondContact O-CB 3.49Å; M173-I176 PolarHBondContact O-N 3.34Å; M173-I176 HydrophobicContact SD-CD1 4.08Å; M173-E177 HydrophobicContact CE-CG 3.99Å; M173-E177 VanDerWaalsContact CE-OE1 3.23Å; M173-E177 WeakPolarHBondContact CE-OE1 3.43Å; M173-E177 PolarHBondContact O-N 3.35Å; M173-E177 VanDerWaalsContact O-N 3.07Å
174	N	81.5	Confident	81.6	Confident	44 Å²	44	47.7 Å²	47.7	24%	0.235	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-34.6	171.8	-72.9	-8.2	0	0	0	112	V170 T171 S172 I176 E177 N178 K412	V170-N174 WeakPolarHBondContact O-CB 3.37Å; V170-N174 PolarHBondContact O-N 3.02Å; V170-N174 PolarHBondContact O-ND2 3.37Å; V170-N174 PolarHBondContact O-OD1 3.49Å; T171-N174 PolarHBondContact O-N 3.48Å; S172-N174 VanDerWaalsContact C-N 3.25Å; S172-N174 PolarHBondContact O-N 2.66Å; N174-I176 PolarHBondContact O-N 2.82Å; N174-E177 PolarHBondContact O-N 3.28Å; N174-N178 HydrophobicContact CB-CB 3.99Å; N174-N178 WeakPolarHBondContact O-CB 3.35Å; N174-N178 PolarHBondContact O-N 2.94Å; N174-K412 PolarHBondContact OD1-NZ 3.47Å
175	F	83.7	Confident	81.4	Confident	44 Å²	44	48.5 Å²	48.5	19%	0.193	26%	0.261	C	S	.	.	H	α-helix	trans	-66.3	-14.2	172	-70.8	-65.1	0	0	0	113.7	T171 S172 M173 F181 S182 I183 C830 A831	T171-F175 HydrophobicContact CG2-CD2 4.42Å; T171-F175 HydrophobicContact CG2-CE2 3.81Å; T171-F175 HydrophobicContact CG2-CZ 4.47Å; T171-F175 WeakPolarHBondContact O-CD2 3.27Å; T171-F175 PolarHBondContact O-N 2.99Å; S172-F175 WeakPolarHBondContact O-CB 3.45Å; S172-F175 PolarHBondContact O-N 2.97Å; M173-F175 VanDerWaalsContact C-N 3.31Å; M173-F175 PolarHBondContact O-N 3.04Å; F175-F181 AromaticContact CD1-CD1 3.78Å; F175-F181 HydrophobicContact CD1-CD1 3.78Å; F175-F181 AromaticContact CD1-CE1 3.99Å; F175-F181 HydrophobicContact CD1-CE1 3.99Å; F175-F181 AromaticContact CE1-CD1 3.81Å; F175-F181 HydrophobicContact CE1-CD1 3.81Å; F175-F181 AromaticContact CE1-CE1 3.92Å; F175-F181 HydrophobicContact CE1-CE1 3.92Å; F175-S182 WeakPolarHBondContact O-CA 3.07Å; F175-I183 PolarHBondContact O-N 2.9Å; F175-I183 VanDerWaalsContact O-N 3.11Å; F175-C830 HydrophobicContact CD1-CB 3.94Å; F175-C830 HydrophobicContact CD2-CB 3.74Å; F175-C830 HydrophobicContact CE1-CB 3.87Å; F175-C830 HydrophobicContact CE2-CB 3.66Å; F175-C830 HydrophobicContact CG-CB 3.89Å; F175-C830 HydrophobicContact CZ-CB 3.74Å; F175-A831 HydrophobicContact CB-CB 3.92Å
176	I	82.9	Confident	81.3	Confident	53 Å²	53	44.7 Å²	44.7	27%	0.272	25%	0.245	S	C	.	.	H	α-helix	trans	-91.7	-44.3	176.7	-56	177.3	0	0	0	111.3	M173 N174 I183 S184 A831 F832	M173-I176 WeakPolarHBondContact O-CB 3.49Å; M173-I176 PolarHBondContact O-N 3.34Å; M173-I176 HydrophobicContact SD-CD1 4.08Å; N174-I176 PolarHBondContact O-N 2.82Å; I176-I183 HydrophobicContact CG1-CD1 4.33Å; I176-S184 PolarHBondContact O-OG 2.96Å; I176-A831 HydrophobicContact CG1-CB 4.31Å; I176-F832 HydrophobicContact CD1-CZ 4.27Å
177	E	76.6	Confident	81.2	Confident	95 Å²	95	49.5 Å²	49.5	44%	0.444	27%	0.27	S	S	.	.	H	α-helix	trans	-120.3	-14.3	-166.4	-61	175.8	148.5	0	0	116.5	M173 N174 K412	M173-E177 HydrophobicContact CE-CG 3.99Å; M173-E177 VanDerWaalsContact CE-OE1 3.23Å; M173-E177 WeakPolarHBondContact CE-OE1 3.43Å; M173-E177 PolarHBondContact O-N 3.35Å; M173-E177 VanDerWaalsContact O-N 3.07Å; N174-E177 PolarHBondContact O-N 3.28Å; E177-K412 IonicContact OE2-NZ 2.74Å
178	N	75.3	Confident	81.1	Confident	54 Å²	54	50 Å²	50	29%	0.289	27%	0.272	S	S	.	.			trans	-63	132.4	-168.9	-179.9	14.3	0	0	0	112	N174 N180 S182	N174-N178 HydrophobicContact CB-CB 3.99Å; N174-N178 WeakPolarHBondContact O-CB 3.35Å; N174-N178 PolarHBondContact O-N 2.94Å; N178-N180 PolarHBondContact O-N 2.72Å; N178-S182 WeakPolarHBondContact O-CB 3.38Å; N178-S182 PolarHBondContact O-OG 2.89Å
179	P	67.5	Low	80.8	Confident	85 Å²	85	48 Å²	48	55%	0.552	26%	0.26	S	S	*	.	S	Bend	trans	-55.5	-25.3	-179.6	18.2	-33.6	0	0	0	115.4	R185	P179-R185 WeakPolarHBondContact O-CD 3.27Å
180	N	71.2	Confident	80.8	Confident	102 Å²	102	49 Å²	49	55%	0.545	26%	0.263	S	S	.	.	S	Bend	trans	-90.1	-43.5	-175	-67.2	11.2	0	0	0	114.3	N178	N178-N180 PolarHBondContact O-N 2.72Å
181	F	71.4	Confident	80.8	Confident	73 Å²	73	51.6 Å²	51.6	32%	0.32	28%	0.282	S	S	.	.	S	Bend	trans	-150.8	99.9	-172.9	-169.3	-85.2	0	0	0	109.1	F175 Q823 V826	F175-F181 AromaticContact CD1-CD1 3.78Å; F175-F181 HydrophobicContact CD1-CD1 3.78Å; F175-F181 AromaticContact CD1-CE1 3.99Å; F175-F181 HydrophobicContact CD1-CE1 3.99Å; F175-F181 AromaticContact CE1-CD1 3.81Å; F175-F181 HydrophobicContact CE1-CD1 3.81Å; F175-F181 AromaticContact CE1-CE1 3.92Å; F175-F181 HydrophobicContact CE1-CE1 3.92Å; F181-Q823 HydrophobicContact CD1-CG 4.48Å; F181-Q823 HydrophobicContact CD2-CG 3.87Å; F181-Q823 VanDerWaalsContact CD2-OE1 3.3Å; F181-Q823 HydrophobicContact CE1-CG 4.21Å; F181-Q823 HydrophobicContact CE2-CB 4.07Å; F181-Q823 HydrophobicContact CE2-CG 3.57Å; F181-Q823 HydrophobicContact CG-CG 4.33Å; F181-Q823 HydrophobicContact CZ-CB 4.26Å; F181-Q823 HydrophobicContact CZ-CG 3.76Å; F181-V826 HydrophobicContact CE1-CG1 4.44Å; F181-V826 HydrophobicContact CZ-CG1 4.12Å
182	S	82.6	Confident	80.7	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.278	C	S	.	.	S	Bend	trans	-160.3	167.5	-174.6	59.1	0	0	0	0	112.5	F175 N178 S184 R185 S186 Q823	F175-S182 WeakPolarHBondContact O-CA 3.07Å; N178-S182 WeakPolarHBondContact O-CB 3.38Å; N178-S182 PolarHBondContact O-OG 2.89Å; S182-S184 PolarHBondContact OG-OG 3.18Å; S182-R185 PolarHBondContact O-N 3.01Å; S182-R185 WeakPolarHBondContact OG-CB 3.46Å; S182-R185 PolarHBondContact OG-N 3.45Å; S182-S186 PolarHBondContact O-N 2.91Å; S182-Q823 PolarHBondContact O-NE2 3.41Å
183	I	84.3	Confident	80.5	Confident	33 Å²	33	50 Å²	50	17%	0.169	27%	0.269	C	S	.	.	H	α-helix	trans	-57.7	-53.3	173	-61.5	169.9	0	0	0	110.1	F175 I176 R185 S186 L187 F824 S827 V828	F175-I183 PolarHBondContact O-N 2.9Å; F175-I183 VanDerWaalsContact O-N 3.11Å; I176-I183 HydrophobicContact CG1-CD1 4.33Å; I183-R185 VanDerWaalsContact C-N 3.34Å; I183-R185 PolarHBondContact O-N 2.98Å; I183-S186 PolarHBondContact O-N 3.43Å; I183-S186 VanDerWaalsContact O-N 3.16Å; I183-S186 PolarHBondContact O-OG 2.89Å; I183-L187 PolarHBondContact O-N 3.34Å; I183-F824 HydrophobicContact CG2-CD2 4.07Å; I183-F824 HydrophobicContact CG2-CE2 3.82Å; I183-S827 WeakPolarHBondContact CG1-OG 3.3Å; I183-V828 HydrophobicContact CD1-CG2 3.79Å; I183-V828 HydrophobicContact CG1-CG2 4.02Å
184	S	81.8	Confident	80.5	Confident	63 Å²	63	50.1 Å²	50.1	44%	0.441	27%	0.274	S	S	.	.	H	α-helix	trans	-59.8	-42.9	179.9	59.6	0	0	0	0	112	I176 S182 S186 L187	I176-S184 PolarHBondContact O-OG 2.96Å; S182-S184 PolarHBondContact OG-OG 3.18Å; S184-S186 VanDerWaalsContact C-N 3.34Å; S184-S186 PolarHBondContact O-N 2.78Å; S184-L187 PolarHBondContact O-N 3.19Å
185	R	84	Confident	80.5	Confident	17 Å²	17	52.1 Å²	52.1	6%	0.064	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-40	176.4	-172.9	65.2	-131.3	159.9	-9.1	112.5	P179 S182 I183 L187 V188 E189 I1719 S1720 P1722	P179-R185 WeakPolarHBondContact O-CD 3.27Å; S182-R185 PolarHBondContact O-N 3.01Å; S182-R185 WeakPolarHBondContact OG-CB 3.46Å; S182-R185 PolarHBondContact OG-N 3.45Å; I183-R185 VanDerWaalsContact C-N 3.34Å; I183-R185 PolarHBondContact O-N 2.98Å; R185-L187 VanDerWaalsContact C-N 3.28Å; R185-L187 PolarHBondContact O-N 2.8Å; R185-V188 VanDerWaalsContact NH1-CG1 3.33Å; R185-V188 PolarHBondContact O-N 3.45Å; R185-E189 HydrophobicContact CG-CG 4.2Å; R185-E189 IonicContact CZ-OE1 3.82Å; R185-E189 VanDerWaalsContact CZ-OE1 3.22Å; R185-E189 IonicContact NE-OE1 3.9Å; R185-E189 PolarHBondContact NE-OE1 3.14Å; R185-E189 IonicContact NH2-OE1 3.67Å; R185-E189 PolarHBondContact NH2-OE1 3.39Å; R185-E189 WeakPolarHBondContact O-CG 3.49Å; R185-E189 PolarHBondContact O-N 3.41Å; R185-I1719 PolarHBondContact NH1-O 2.96Å; R185-S1720 PolarHBondContact NH2-O 2.6Å; R185-P1722 VanDerWaalsContact NE-CG 3.34Å
186	S	86.4	Confident	80.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.5	-31.9	-177.2	71.7	0	0	0	0	113.9	S182 I183 S184 L190 S820	S182-S186 PolarHBondContact O-N 2.91Å; I183-S186 PolarHBondContact O-N 3.43Å; I183-S186 VanDerWaalsContact O-N 3.16Å; I183-S186 PolarHBondContact O-OG 2.89Å; S184-S186 VanDerWaalsContact C-N 3.34Å; S184-S186 PolarHBondContact O-N 2.78Å; S186-L190 PolarHBondContact O-N 3.06Å; S186-S820 WeakPolarHBondContact O-CB 3.4Å; S186-S820 PolarHBondContact O-OG 3.42Å
187	L	83.6	Confident	80.2	Confident	103 Å²	103	50.7 Å²	50.7	54%	0.539	28%	0.277	S	S	.	.	H	α-helix	trans	-70.9	-33.2	174.4	-65	174.1	0	0	0	112	I183 S184 R185 L190	I183-L187 PolarHBondContact O-N 3.34Å; S184-L187 PolarHBondContact O-N 3.19Å; R185-L187 VanDerWaalsContact C-N 3.28Å; R185-L187 PolarHBondContact O-N 2.8Å; L187-L190 VanDerWaalsContact O-CB 3.31Å; L187-L190 WeakPolarHBondContact O-CB 3.41Å; L187-L190 PolarHBondContact O-N 2.92Å
188	V	83.6	Confident	80.3	Confident	29 Å²	29	49.7 Å²	49.7	18%	0.176	28%	0.275	C	S	.	.	H	α-helix	trans	-76.6	-39.4	176.4	-172	0	0	0	0	111.2	R185 L190 S191 I192 I1719	R185-V188 VanDerWaalsContact NH1-CG1 3.33Å; R185-V188 PolarHBondContact O-N 3.45Å; V188-L190 PolarHBondContact O-N 2.79Å; V188-S191 PolarHBondContact O-N 2.94Å; V188-S191 VanDerWaalsContact O-N 3.15Å; V188-I192 HydrophobicContact CG1-CD1 4.02Å; V188-I192 WeakPolarHBondContact O-CD1 3.46Å; V188-I192 WeakPolarHBondContact O-CG1 3.49Å; V188-I192 PolarHBondContact O-N 3.41Å; V188-I192 VanDerWaalsContact O-N 3.13Å; V188-I1719 HydrophobicContact CB-CG2 4.46Å; V188-I1719 HydrophobicContact CG1-CG2 3.98Å; V188-I1719 HydrophobicContact CG2-CG2 3.58Å
189	E	81.3	Confident	80.6	Confident	13 Å²	13	47.3 Å²	47.3	6%	0.061	26%	0.262	C	S	.	.	H	α-helix	trans	-57.9	-31.6	171.6	-65	-68.3	133.7	0	0	111.9	R185 I192 A193 K819	R185-E189 HydrophobicContact CG-CG 4.2Å; R185-E189 IonicContact CZ-OE1 3.82Å; R185-E189 VanDerWaalsContact CZ-OE1 3.22Å; R185-E189 IonicContact NE-OE1 3.9Å; R185-E189 PolarHBondContact NE-OE1 3.14Å; R185-E189 IonicContact NH2-OE1 3.67Å; R185-E189 PolarHBondContact NH2-OE1 3.39Å; R185-E189 WeakPolarHBondContact O-CG 3.49Å; R185-E189 PolarHBondContact O-N 3.41Å; E189-I192 PolarHBondContact O-N 3.29Å; E189-A193 WeakPolarHBondContact O-CB 3.22Å; E189-A193 PolarHBondContact O-N 3.43Å; E189-K819 HydrophobicContact CB-CB 4.24Å; E189-K819 HydrophobicContact CG-CB 4.2Å; E189-K819 IonicContact OE1-NZ 2.71Å; E189-K819 VanDerWaalsContact OE2-CE 3.24Å; E189-K819 WeakPolarHBondContact OE2-CE 3.45Å; E189-K819 IonicContact OE2-NZ 2.7Å; E189-K819 PolarHBondContact OE2-NZ 3.02Å
190	L	84.7	Confident	81.1	Confident	63 Å²	63	43.5 Å²	43.5	33%	0.33	24%	0.237	S	C	.	.	H	α-helix	trans	-59.8	-50.2	173.4	-168.7	60.2	0	0	0	111.9	S186 L187 V188 I192 A193 V194 F816 S820	S186-L190 PolarHBondContact O-N 3.06Å; L187-L190 VanDerWaalsContact O-CB 3.31Å; L187-L190 WeakPolarHBondContact O-CB 3.41Å; L187-L190 PolarHBondContact O-N 2.92Å; V188-L190 PolarHBondContact O-N 2.79Å; L190-I192 VanDerWaalsContact C-N 3.29Å; L190-I192 PolarHBondContact O-N 3.16Å; L190-A193 PolarHBondContact O-N 2.93Å; L190-V194 WeakPolarHBondContact O-CG2 3.32Å; L190-V194 PolarHBondContact O-N 3.26Å; L190-F816 HydrophobicContact CD1-CD2 3.66Å; L190-F816 HydrophobicContact CD1-CE2 3.54Å; L190-S820 WeakPolarHBondContact CB-OG 3.34Å
191	S	82.2	Confident	81.5	Confident	65 Å²	65	43.2 Å²	43.2	46%	0.455	23%	0.231	S	C	.	.	H	α-helix	trans	-62.1	-38.9	179.8	-168.3	0	0	0	0	111.7	V188 H195	V188-S191 PolarHBondContact O-N 2.94Å; V188-S191 VanDerWaalsContact O-N 3.15Å; S191-H195 PolarHBondContact O-N 3.15Å; S191-H195 VanDerWaalsContact O-N 3.12Å
192	I	81.8	Confident	81.9	Confident	41 Å²	41	43.8 Å²	43.8	21%	0.21	23%	0.234	C	C	.	.	H	α-helix	trans	-69.7	-41	177.9	-64.3	157.4	0	0	0	111	V188 E189 L190 H195 S196 S1720	V188-I192 HydrophobicContact CG1-CD1 4.02Å; V188-I192 WeakPolarHBondContact O-CD1 3.46Å; V188-I192 WeakPolarHBondContact O-CG1 3.49Å; V188-I192 PolarHBondContact O-N 3.41Å; V188-I192 VanDerWaalsContact O-N 3.13Å; E189-I192 PolarHBondContact O-N 3.29Å; L190-I192 VanDerWaalsContact C-N 3.29Å; L190-I192 PolarHBondContact O-N 3.16Å; I192-H195 PolarHBondContact O-N 3.39Å; I192-S196 VanDerWaalsContact O-CB 3.26Å; I192-S196 WeakPolarHBondContact O-CB 3.17Å; I192-S196 PolarHBondContact O-N 3.05Å; I192-S196 PolarHBondContact O-OG 2.78Å; I192-S1720 WeakPolarHBondContact CD1-O 3.48Å
193	A	82.8	Confident	81.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.8	-45.2	177.1	0	0	0	0	0	111	E189 L190 H195 S196 I197 Q815 F816	E189-A193 WeakPolarHBondContact O-CB 3.22Å; E189-A193 PolarHBondContact O-N 3.43Å; L190-A193 PolarHBondContact O-N 2.93Å; A193-H195 PolarHBondContact O-N 3.47Å; A193-S196 PolarHBondContact O-N 3.46Å; A193-I197 WeakPolarHBondContact O-CG1 3.28Å; A193-I197 PolarHBondContact O-N 2.91Å; A193-Q815 HydrophobicContact CB-CB 3.92Å; A193-F816 HydrophobicContact CB-CB 4.01Å
194	V	81.9	Confident	81.2	Confident	75 Å²	75	47.3 Å²	47.3	46%	0.455	25%	0.245	S	C	.	.	H	α-helix	trans	-60	-46.4	176.3	173.1	0	0	0	0	111.6	L190 S196 I197 L198	L190-V194 WeakPolarHBondContact O-CG2 3.32Å; L190-V194 PolarHBondContact O-N 3.26Å; V194-S196 VanDerWaalsContact C-N 3.32Å; V194-S196 PolarHBondContact O-N 3.36Å; V194-I197 PolarHBondContact O-N 3.33Å; V194-L198 PolarHBondContact O-N 2.91Å
195	H	80.6	Confident	80.9	Confident	87 Å²	87	46.7 Å²	46.7	40%	0.403	24%	0.239	S	C	.	.	H	α-helix	trans	-63	-39.2	176.3	-171.7	74.2	0	0	0	112.1	S191 I192 A193 I197 L198 D199 W204	S191-H195 PolarHBondContact O-N 3.15Å; S191-H195 VanDerWaalsContact O-N 3.12Å; I192-H195 PolarHBondContact O-N 3.39Å; A193-H195 PolarHBondContact O-N 3.47Å; H195-I197 PolarHBondContact O-N 3.31Å; H195-L198 PolarHBondContact O-N 3.32Å; H195-D199 PolarHBondContact O-N 3.11Å; H195-D199 VanDerWaalsContact O-N 3.1Å; H195-W204 AromaticContact CE1-CD1 3.76Å; H195-W204 AromaticContact CE1-CD2 3.97Å; H195-W204 AromaticContact CE1-CE2 3.78Å; H195-W204 AromaticContact CE1-CG 4Å; H195-W204 AromaticContact CE1-NE1 3.63Å; H195-W204 AromaticContact NE2-CD1 3.84Å
196	S	78.3	Confident	80.1	Confident	18 Å²	18	50.1 Å²	50.1	13%	0.126	25%	0.252	C	S	.	.	H	α-helix	trans	-71.9	-27.2	-179.1	-53.9	0	0	0	0	113	I192 A193 V194 I200 I811	I192-S196 VanDerWaalsContact O-CB 3.26Å; I192-S196 WeakPolarHBondContact O-CB 3.17Å; I192-S196 PolarHBondContact O-N 3.05Å; I192-S196 PolarHBondContact O-OG 2.78Å; A193-S196 PolarHBondContact O-N 3.46Å; V194-S196 VanDerWaalsContact C-N 3.32Å; V194-S196 PolarHBondContact O-N 3.36Å; S196-I200 PolarHBondContact O-N 2.97Å; S196-I200 VanDerWaalsContact O-N 3.1Å; S196-I811 WeakPolarHBondContact O-CD1 3.11Å
197	I	81.6	Confident	79.1	Confident	48 Å²	48	52.6 Å²	52.6	25%	0.246	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-47.7	169.2	-69.2	169.5	0	0	0	110.2	A193 V194 H195 D199 I200 F201 I811	A193-I197 WeakPolarHBondContact O-CG1 3.28Å; A193-I197 PolarHBondContact O-N 2.91Å; V194-I197 PolarHBondContact O-N 3.33Å; H195-I197 PolarHBondContact O-N 3.31Å; I197-D199 PolarHBondContact O-N 3.19Å; I197-I200 PolarHBondContact O-N 2.67Å; I197-F201 HydrophobicContact CG2-CD2 4.01Å; I197-F201 HydrophobicContact CG2-CE2 4.04Å; I197-F201 WeakPolarHBondContact O-CD2 3.5Å; I197-F201 PolarHBondContact O-N 2.91Å; I197-I811 HydrophobicContact CD1-CG2 4.37Å; I197-I811 HydrophobicContact CG1-CG2 3.57Å
198	L	80.3	Confident	78.2	Confident	74 Å²	74	52.4 Å²	52.4	39%	0.387	27%	0.267	S	S	.	.	H	α-helix	trans	-63.3	-40.3	179.7	-64.5	171.2	0	0	0	111.9	V194 H195 I200 F201 F202	V194-L198 PolarHBondContact O-N 2.91Å; H195-L198 PolarHBondContact O-N 3.32Å; L198-I200 PolarHBondContact O-N 3.5Å; L198-F201 PolarHBondContact O-N 2.7Å; L198-F202 HydrophobicContact CD2-CE2 4.49Å; L198-F202 PolarHBondContact O-N 2.81Å; L198-F202 VanDerWaalsContact O-N 3.11Å
199	D	80.3	Confident	77.1	Confident	5 Å²	5	52.5 Å²	52.5	3%	0.027	27%	0.266	C	S	.	.	H	α-helix	trans	-65	-32.4	175.1	177.7	48.5	0	0	0	113.7	H195 I197 G203 W204 R206 R635	H195-D199 PolarHBondContact O-N 3.11Å; H195-D199 VanDerWaalsContact O-N 3.1Å; I197-D199 PolarHBondContact O-N 3.19Å; D199-G203 WeakPolarHBondContact O-CA 3.49Å; D199-G203 PolarHBondContact O-N 3.09Å; D199-W204 HydrophobicContact CB-CB 3.91Å; D199-W204 PolarHBondContact OD1-N 3.41Å; D199-R206 IonicContact OD1-NE 2.69Å; D199-R206 IonicContact OD2-CZ 3.55Å; D199-R206 IonicContact OD2-NE 3.69Å; D199-R206 PolarHBondContact OD2-NE 3.21Å; D199-R206 IonicContact OD2-NH2 2.7Å; D199-R206 PolarHBondContact OD2-NH2 2.78Å; D199-R635 PolarHBondContact O-NE 2.77Å
200	I	78.3	Confident	76.2	Confident	5 Å²	5	52.9 Å²	52.9	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-67.3	-45.9	173.1	-79	-160.8	0	0	0	111.8	S196 I197 L198 R635 L790 P807 L808 I811	S196-I200 PolarHBondContact O-N 2.97Å; S196-I200 VanDerWaalsContact O-N 3.1Å; I197-I200 PolarHBondContact O-N 2.67Å; L198-I200 PolarHBondContact O-N 3.5Å; I200-R635 WeakPolarHBondContact O-CD 3.34Å; I200-R635 PolarHBondContact O-NE 2.76Å; I200-L790 HydrophobicContact CG2-CD2 3.73Å; I200-L790 VanDerWaalsContact O-CD2 3.26Å; I200-L790 WeakPolarHBondContact O-CD2 3.42Å; I200-P807 HydrophobicContact CD1-CB 3.79Å; I200-P807 HydrophobicContact CD1-CG 4.34Å; I200-L808 HydrophobicContact CG2-CD2 4.31Å; I200-L808 HydrophobicContact CG2-CG 4.13Å; I200-I811 HydrophobicContact CD1-CD1 3.34Å; I200-I811 HydrophobicContact CD1-CG1 4.18Å; I200-I811 HydrophobicContact CG1-CD1 3.7Å
201	F	79.8	Confident	75.4	Confident	95 Å²	95	54.5 Å²	54.5	42%	0.417	28%	0.283	S	S	.	.	H	α-helix	trans	-74.1	-39.3	-173.6	-82.4	-71.6	0	0	0	114	I197 L198 W636 L808	I197-F201 HydrophobicContact CG2-CD2 4.01Å; I197-F201 HydrophobicContact CG2-CE2 4.04Å; I197-F201 WeakPolarHBondContact O-CD2 3.5Å; I197-F201 PolarHBondContact O-N 2.91Å; L198-F201 PolarHBondContact O-N 2.7Å; F201-W636 PolarHBondContact O-NE1 3.25Å; F201-L808 HydrophobicContact CE2-CD2 3.87Å; F201-L808 HydrophobicContact CZ-CD1 4.05Å; F201-L808 HydrophobicContact CZ-CD2 4.05Å
202	F	79	Confident	74.6	Confident	86 Å²	86	52.2 Å²	52.2	38%	0.377	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-36.4	-177	-58	-55.1	0	0	0	112.7	L198 F632 M633	L198-F202 HydrophobicContact CD2-CE2 4.49Å; L198-F202 PolarHBondContact O-N 2.81Å; L198-F202 VanDerWaalsContact O-N 3.11Å; F202-F632 HydrophobicContact CB-CE2 4.26Å; F202-F632 HydrophobicContact CB-CZ 4.35Å; F202-M633 HydrophobicContact CB-CE 4.48Å; F202-M633 HydrophobicContact CD1-CE 3.57Å; F202-M633 HydrophobicContact CE1-CE 4.23Å; F202-M633 HydrophobicContact CG-CE 4.38Å; F202-M633 CarbonylContact O-C 3.58Å; F202-M633 VanDerWaalsContact O-CA 3.25Å; F202-M633 WeakPolarHBondContact O-CA 3.46Å
203	G	75.1	Confident	73.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.268	C	S	.	.			trans	83.3	94	-161	0	0	0	0	0	109	D199 M633	D199-G203 WeakPolarHBondContact O-CA 3.49Å; D199-G203 PolarHBondContact O-N 3.09Å; G203-M633 PolarHBondContact O-N 3.4Å
204	W	78.5	Confident	72.6	Confident	107 Å²	107	54.4 Å²	54.4	41%	0.405	28%	0.278	S	S	.	.			trans	-74	150.2	172.6	-156	-95.9	0	0	0	108.6	H195 D199 R206 F632 W634	H195-W204 AromaticContact CE1-CD1 3.76Å; H195-W204 AromaticContact CE1-CD2 3.97Å; H195-W204 AromaticContact CE1-CE2 3.78Å; H195-W204 AromaticContact CE1-CG 4Å; H195-W204 AromaticContact CE1-NE1 3.63Å; H195-W204 AromaticContact NE2-CD1 3.84Å; D199-W204 HydrophobicContact CB-CB 3.91Å; D199-W204 PolarHBondContact OD1-N 3.41Å; W204-R206 PolarHBondContact O-N 3.48Å; W204-F632 HydrophobicContact CE3-CE2 4.29Å; W204-F632 HydrophobicContact CZ3-CE2 4.37Å; W204-W634 PolarHBondContact O-NE1 3.16Å
205	P	74.6	Confident	71.8	Confident	49 Å²	49	53.8 Å²	53.8	32%	0.318	27%	0.269	S	S	.	.			trans	-57.3	107.6	175.1	-27.9	37.3	0	0	0	110.9	V207 F632	P205-V207 HydrophobicContact CB-CG2 4.36Å; P205-F632 HydrophobicContact CG-CB 4.4Å
206	R	67.7	Low	71.3	Confident	89 Å²	89	50.1 Å²	50.1	34%	0.336	25%	0.252	S	S	.	.			trans	-99.2	114.6	177.1	-80.5	-171.6	176.2	-119.5	1.5	109.2	D199 W204 D475 T629	D199-R206 IonicContact OD1-NE 2.69Å; D199-R206 IonicContact OD2-CZ 3.55Å; D199-R206 IonicContact OD2-NE 3.69Å; D199-R206 PolarHBondContact OD2-NE 3.21Å; D199-R206 IonicContact OD2-NH2 2.7Å; D199-R206 PolarHBondContact OD2-NH2 2.78Å; W204-R206 PolarHBondContact O-N 3.48Å; R206-D475 HydrophobicContact CB-CB 4.18Å; R206-D475 PolarHBondContact O-N 3.29Å; R206-T629 PolarHBondContact N-O 2.9Å; R206-T629 PolarHBondContact O-OG1 2.92Å
207	V	65.5	Low	70.5	Confident	53 Å²	53	51 Å²	51	32%	0.321	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	108.7	-164.1	-177.7	0	0	0	0	108.8	P205 R472 F473 D475	P205-V207 HydrophobicContact CB-CG2 4.36Å; V207-R472 HydrophobicContact CG1-CB 3.4Å; V207-R472 VanDerWaalsContact CG1-CB 3.4Å; V207-R472 HydrophobicContact CG1-CG 3.63Å; V207-F473 CarbonylContact C-O 3.35Å; V207-F473 WeakPolarHBondContact CA-O 3.37Å; V207-F473 WeakPolarHBondContact CG1-O 3.32Å; V207-D475 PolarHBondContact N-OD1 3.48Å
208	N	65.4	Low	69.8	Low	98 Å²	98	50 Å²	50	52%	0.524	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	120.3	176.9	-170.3	12.4	0	0	0	109.7	G210 F473 D475	N208-G210 PolarHBondContact O-N 3.43Å; N208-F473 PolarHBondContact N-O 3.27Å; N208-F473 PolarHBondContact O-N 3.14Å; N208-F473 VanDerWaalsContact O-N 3.12Å; N208-D475 PolarHBondContact N-OD1 2.79Å
209	N	60.5	Low	69.4	Low	32 Å²	32	50.6 Å²	50.6	17%	0.171	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	102.3	165	-74	-11.2	0	0	0	107.6	V212 F468 A471 R472	N209-V212 HydrophobicContact CB-CG2 4.35Å; N209-F468 HydrophobicContact CB-CD2 4.44Å; N209-F468 HydrophobicContact CB-CE2 4.49Å; N209-F468 WeakPolarHBondContact ND2-CD1 3.11Å; N209-F468 WeakPolarHBondContact ND2-CD2 3.26Å; N209-F468 WeakPolarHBondContact ND2-CE1 3.31Å; N209-F468 WeakPolarHBondContact ND2-CE2 3.34Å; N209-F468 WeakPolarHBondContact ND2-CG 3.22Å; N209-F468 WeakPolarHBondContact ND2-CZ 3.48Å; N209-F468 PolarHBondContact ND2-O 3.45Å; N209-F468 PolarHBondContact OD1-O 3.05Å; N209-A471 WeakPolarHBondContact CA-O 3.17Å; N209-R472 WeakPolarHBondContact OD1-CG 3.25Å
210	G	61.8	Low	69	Low	20 Å²	20	51.6 Å²	51.6	21%	0.206	25%	0.254	C	S	.	.			trans	-57.6	165.4	174.7	0	0	0	0	0	111.9	N208 V212	N208-G210 PolarHBondContact O-N 3.43Å; G210-V212 WeakPolarHBondContact O-CG2 3.47Å; G210-V212 PolarHBondContact O-N 2.82Å
211	D	67	Low	68.5	Low	98 Å²	98	52.8 Å²	52.8	52%	0.524	26%	0.26	S	S	.	.			trans	-48.5	102.3	-164.2	-164.7	-27.9	0	0	0	113.6	D213 L214 K215	D211-D213 VanDerWaalsContact C-N 3.33Å; D211-D213 PolarHBondContact OD1-N 3.06Å; D211-L214 HydrophobicContact CB-CB 3.81Å; D211-L214 HydrophobicContact CB-CD2 4.28Å; D211-L214 PolarHBondContact OD1-N 3.3Å; D211-K215 PolarHBondContact O-N 2.94Å
212	V	66.3	Low	68.1	Low	17 Å²	17	49 Å²	49	10%	0.103	25%	0.248	C	C	.	.	H	α-helix	trans	-72.7	-31.6	-176.4	178.4	0	0	0	0	110.3	N209 G210 L216 R464 I467	N209-V212 HydrophobicContact CB-CG2 4.35Å; G210-V212 WeakPolarHBondContact O-CG2 3.47Å; G210-V212 PolarHBondContact O-N 2.82Å; V212-L216 WeakPolarHBondContact O-CB 3.46Å; V212-L216 PolarHBondContact O-N 2.92Å; V212-R464 HydrophobicContact CG1-CG 4.22Å; V212-I467 HydrophobicContact CB-CG2 4.37Å; V212-I467 HydrophobicContact CG1-CB 4.31Å; V212-I467 HydrophobicContact CG1-CG2 3.9Å; V212-I467 HydrophobicContact CG2-CG2 4.33Å
213	D	60	Low	68	Low	49 Å²	49	46.4 Å²	46.4	26%	0.262	24%	0.236	S	C	.	.	H	α-helix	trans	-78.6	-32.1	-177	-55.8	-72.3	0	0	0	111.2	D211 L217 R464 R1729	D211-D213 VanDerWaalsContact C-N 3.33Å; D211-D213 PolarHBondContact OD1-N 3.06Å; D213-L217 WeakPolarHBondContact O-CB 3.32Å; D213-L217 PolarHBondContact O-N 3.17Å; D213-L217 VanDerWaalsContact O-N 3.08Å; D213-R464 IonicContact OD1-CZ 3.65Å; D213-R464 IonicContact OD1-NH1 3.73Å; D213-R464 PolarHBondContact OD1-NH1 3.2Å; D213-R464 IonicContact OD1-NH2 3.75Å; D213-R1729 VanDerWaalsContact CG-NH1 3.32Å; D213-R1729 IonicContact OD1-CZ 2.67Å; D213-R1729 IonicContact OD1-NH1 2.79Å; D213-R1729 PolarHBondContact OD1-NH1 3.25Å; D213-R1729 IonicContact OD2-CZ 2.91Å; D213-R1729 IonicContact OD2-NH1 3.77Å; D213-R1729 PolarHBondContact OD2-NH1 3.05Å; D213-R1729 IonicContact OD2-NH2 3.86Å; D213-R1729 PolarHBondContact OD2-NH2 3.5Å
214	L	61.3	Low	67.8	Low	37 Å²	37	46.6 Å²	46.6	19%	0.194	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-58.1	166.7	176.9	61.8	0	0	0	111	D211 L216 L217 E218 L1737 T1739	D211-L214 HydrophobicContact CB-CB 3.81Å; D211-L214 HydrophobicContact CB-CD2 4.28Å; D211-L214 PolarHBondContact OD1-N 3.3Å; L214-L216 VanDerWaalsContact C-N 3.33Å; L214-L216 PolarHBondContact O-N 2.96Å; L214-L217 WeakPolarHBondContact O-CB 3.3Å; L214-L217 PolarHBondContact O-N 3.15Å; L214-L217 VanDerWaalsContact O-N 3.07Å; L214-E218 WeakPolarHBondContact O-CG 3.36Å; L214-E218 PolarHBondContact O-N 3.27Å; L214-L1737 HydrophobicContact CD1-CD2 3.96Å; L214-L1737 HydrophobicContact CD1-CG 4.18Å; L214-T1739 WeakPolarHBondContact CD2-O 3.08Å
215	K	66.7	Low	67.4	Low	62 Å²	62	41.7 Å²	41.7	27%	0.27	22%	0.219	S	C	.	.	H	α-helix	trans	-59.1	-40.8	179.3	-73.8	-173.6	172.6	-169.2	0	113.2	D211 L217 E218 E219 I467 A471	D211-K215 PolarHBondContact O-N 2.94Å; K215-L217 VanDerWaalsContact C-N 3.3Å; K215-L217 PolarHBondContact O-N 3.05Å; K215-E218 PolarHBondContact O-N 3.12Å; K215-E218 VanDerWaalsContact O-N 3.16Å; K215-E219 PolarHBondContact O-N 3.48Å; K215-I467 HydrophobicContact CB-CD1 4.25Å; K215-I467 HydrophobicContact CB-CG2 4.05Å; K215-I467 HydrophobicContact CD-CG2 3.95Å; K215-A471 HydrophobicContact CD-CB 4.32Å
216	L	68.6	Low	67.1	Low	10 Å²	10	42.6 Å²	42.6	5%	0.052	23%	0.226	C	C	.	.	H	α-helix	trans	-65.8	-32.9	177.6	-179.7	67.8	0	0	0	112.3	V212 L214 R220 F455 E460 L463 R464 I467	V212-L216 WeakPolarHBondContact O-CB 3.46Å; V212-L216 PolarHBondContact O-N 2.92Å; L214-L216 VanDerWaalsContact C-N 3.33Å; L214-L216 PolarHBondContact O-N 2.96Å; L216-R220 WeakPolarHBondContact O-CB 3.27Å; L216-R220 PolarHBondContact O-N 3.29Å; L216-F455 HydrophobicContact CD1-CE1 4.33Å; L216-F455 HydrophobicContact CD1-CZ 4.07Å; L216-E460 HydrophobicContact CD1-CG 4.36Å; L216-E460 HydrophobicContact CD2-CG 3.87Å; L216-E460 HydrophobicContact CG-CG 4.44Å; L216-L463 HydrophobicContact CD1-CB 3.87Å; L216-R464 HydrophobicContact CD2-CB 4.41Å; L216-R464 VanDerWaalsContact CD2-CZ 3.41Å; L216-I467 HydrophobicContact CB-CD1 4.11Å; L216-I467 HydrophobicContact CD1-CD1 4.28Å
217	L	63	Low	67.3	Low	37 Å²	37	42.2 Å²	42.2	19%	0.194	23%	0.228	C	C	.	.	H	α-helix	trans	-71.4	-33.1	172.4	179.8	54.1	0	0	0	111.6	D213 L214 K215 R220 L221 L1737	D213-L217 WeakPolarHBondContact O-CB 3.32Å; D213-L217 PolarHBondContact O-N 3.17Å; D213-L217 VanDerWaalsContact O-N 3.08Å; L214-L217 WeakPolarHBondContact O-CB 3.3Å; L214-L217 PolarHBondContact O-N 3.15Å; L214-L217 VanDerWaalsContact O-N 3.07Å; K215-L217 VanDerWaalsContact C-N 3.3Å; K215-L217 PolarHBondContact O-N 3.05Å; L217-R220 WeakPolarHBondContact O-CB 3.24Å; L217-R220 PolarHBondContact O-N 3.47Å; L217-L221 WeakPolarHBondContact O-CB 3.5Å; L217-L221 VanDerWaalsContact O-CG 3.24Å; L217-L221 WeakPolarHBondContact O-CG 3.45Å; L217-L221 PolarHBondContact O-N 3.37Å; L217-L1737 HydrophobicContact CD2-CD1 3.69Å; L217-L1737 HydrophobicContact CD2-CD2 3.6Å; L217-L1737 HydrophobicContact CD2-CG 4.29Å; L217-L1737 HydrophobicContact CG-CD2 4.04Å
218	E	67.2	Low	67.8	Low	28 Å²	28	39.9 Å²	39.9	13%	0.131	21%	0.214	C	C	.	.	H	α-helix	trans	-70.3	-41.2	173.5	-65.9	176	111.4	0	0	112.2	L214 K215 R220 L221 G222 S1741	L214-E218 WeakPolarHBondContact O-CG 3.36Å; L214-E218 PolarHBondContact O-N 3.27Å; K215-E218 PolarHBondContact O-N 3.12Å; K215-E218 VanDerWaalsContact O-N 3.16Å; E218-R220 VanDerWaalsContact C-N 3.31Å; E218-R220 PolarHBondContact O-N 2.91Å; E218-L221 WeakPolarHBondContact O-CB 3.42Å; E218-L221 PolarHBondContact O-N 3.12Å; E218-G222 PolarHBondContact O-N 3.28Å; E218-S1741 WeakPolarHBondContact CB-OG 3.28Å; E218-S1741 WeakPolarHBondContact OE1-CB 3.26Å; E218-S1741 PolarHBondContact OE1-N 3.41Å; E218-S1741 PolarHBondContact OE1-OG 3.06Å; E218-S1741 WeakPolarHBondContact OE2-CB 3.49Å
219	E	71	Confident	68.4	Low	86 Å²	86	37.6 Å²	37.6	40%	0.402	21%	0.205	S	C	.	.	H	α-helix	trans	-61.6	-37.2	169.3	-72.6	-59.8	151.7	0	0	112.2	K215 G222 F223 L463 I467	K215-E219 PolarHBondContact O-N 3.48Å; E219-G222 PolarHBondContact O-N 3.42Å; E219-F223 WeakPolarHBondContact O-CB 3.46Å; E219-F223 PolarHBondContact O-N 3.41Å; E219-L463 HydrophobicContact CB-CD1 4.33Å; E219-I467 HydrophobicContact CG-CD1 4.19Å
220	R	72.7	Confident	69.1	Low	25 Å²	25	36.7 Å²	36.7	9%	0.094	20%	0.201	C	C	.	.	H	α-helix	trans	-64.9	-45.5	173.2	-173.8	174.5	173	-170.9	-2	111.7	L216 L217 E218 G222 F223 L224 D452 F455	L216-R220 WeakPolarHBondContact O-CB 3.27Å; L216-R220 PolarHBondContact O-N 3.29Å; L217-R220 WeakPolarHBondContact O-CB 3.24Å; L217-R220 PolarHBondContact O-N 3.47Å; E218-R220 VanDerWaalsContact C-N 3.31Å; E218-R220 PolarHBondContact O-N 2.91Å; R220-G222 VanDerWaalsContact C-N 3.34Å; R220-F223 PolarHBondContact O-N 3.5Å; R220-L224 HydrophobicContact CG-CD1 4.22Å; R220-L224 WeakPolarHBondContact O-CB 3.27Å; R220-L224 VanDerWaalsContact O-CG 3.26Å; R220-L224 WeakPolarHBondContact O-CG 3.45Å; R220-L224 PolarHBondContact O-N 3.49Å; R220-D452 IonicContact CZ-OD1 2.64Å; R220-D452 IonicContact CZ-OD2 3.29Å; R220-D452 IonicContact NE-OD1 2.87Å; R220-D452 PolarHBondContact NE-OD1 3.25Å; R220-D452 IonicContact NH2-OD1 3.72Å; R220-D452 PolarHBondContact NH2-OD1 3.45Å; R220-D452 IonicContact NH2-OD2 2.86Å; R220-D452 PolarHBondContact NH2-OD2 3.48Å; R220-F455 HydrophobicContact CB-CD1 4.04Å; R220-F455 HydrophobicContact CB-CE1 3.57Å; R220-F455 HydrophobicContact CB-CE2 4.09Å; R220-F455 HydrophobicContact CB-CG 4.5Å; R220-F455 HydrophobicContact CB-CZ 3.59Å; R220-F455 HydrophobicContact CG-CD1 3.72Å; R220-F455 HydrophobicContact CG-CE1 3.78Å; R220-F455 HydrophobicContact CG-CG 4.14Å; R220-F455 HydrophobicContact CG-CZ 4.21Å
221	L	67.4	Low	69.7	Low	31 Å²	31	40.4 Å²	40.4	16%	0.162	21%	0.211	C	C	.	.	H	α-helix	trans	-58.7	-46.2	174.4	-76.1	166.6	0	0	0	110.9	L217 E218 I225 V1418 L1427	L217-L221 WeakPolarHBondContact O-CB 3.5Å; L217-L221 VanDerWaalsContact O-CG 3.24Å; L217-L221 WeakPolarHBondContact O-CG 3.45Å; L217-L221 PolarHBondContact O-N 3.37Å; E218-L221 WeakPolarHBondContact O-CB 3.42Å; E218-L221 PolarHBondContact O-N 3.12Å; L221-I225 WeakPolarHBondContact O-CB 3.47Å; L221-I225 PolarHBondContact O-N 3.13Å; L221-V1418 HydrophobicContact CD2-CB 3.91Å; L221-V1418 HydrophobicContact CD2-CG1 3.8Å; L221-V1418 HydrophobicContact CD2-CG2 3.49Å; L221-V1418 VanDerWaalsContact CD2-CG2 3.49Å; L221-L1427 HydrophobicContact CB-CD1 4.22Å
222	G	70.1	Confident	70	Confident	15 Å²	15	40 Å²	40	16%	0.155	22%	0.216	C	C	.	.	H	α-helix	trans	-55.9	-59.9	173.1	0	0	0	0	0	111.6	E218 E219 R220 L224 I225 C226	E218-G222 PolarHBondContact O-N 3.28Å; E219-G222 PolarHBondContact O-N 3.42Å; R220-G222 VanDerWaalsContact C-N 3.34Å; G222-L224 VanDerWaalsContact C-N 3.29Å; G222-L224 PolarHBondContact O-N 3.37Å; G222-I225 CarbonylContact O-C 3.53Å; G222-I225 PolarHBondContact O-N 3.44Å; G222-C226 VanDerWaalsContact C-SG 3.59Å; G222-C226 PolarHBondContact O-N 3.32Å; G222-C226 PolarHBondContact O-SG 3.46Å
223	F	78.2	Confident	70.2	Confident	31 Å²	31	45.8 Å²	45.8	14%	0.136	25%	0.247	C	C	.	.	H	α-helix	trans	-58.7	-34.3	-175.7	178.9	-102.6	0	0	0	114.3	E219 R220 I225 R451 F455 R459	E219-F223 WeakPolarHBondContact O-CB 3.46Å; E219-F223 PolarHBondContact O-N 3.41Å; R220-F223 PolarHBondContact O-N 3.5Å; F223-I225 VanDerWaalsContact C-N 3.27Å; F223-I225 PolarHBondContact O-N 3.1Å; F223-R451 HydrophobicContact CE1-CB 4.38Å; F223-R451 PolarHBondContact O-NE 2.84Å; F223-R451 VanDerWaalsContact O-NE 3.14Å; F223-R451 PolarHBondContact O-NH2 3.4Å; F223-F455 HydrophobicContact CB-CD2 3.83Å; F223-F455 HydrophobicContact CB-CE2 4.12Å; F223-F455 HydrophobicContact CD1-CB 3.81Å; F223-F455 AromaticContact CD1-CD2 3.6Å; F223-F455 HydrophobicContact CD1-CD2 3.6Å; F223-F455 HydrophobicContact CD1-CG 4.16Å; F223-F455 HydrophobicContact CE1-CB 4.01Å; F223-F455 HydrophobicContact CE1-CD2 4.39Å; F223-F455 AromaticContact CG-CD2 3.84Å; F223-F455 HydrophobicContact CG-CD2 3.84Å; F223-R459 VanDerWaalsContact CE2-CZ 3.43Å
224	L	69.6	Low	70.8	Confident	5 Å²	5	46 Å²	46	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-66.5	-28.5	174.3	-72.8	171	0	0	0	113	R220 G222 R451 D452 V1418	R220-L224 HydrophobicContact CG-CD1 4.22Å; R220-L224 WeakPolarHBondContact O-CB 3.27Å; R220-L224 VanDerWaalsContact O-CG 3.26Å; R220-L224 WeakPolarHBondContact O-CG 3.45Å; R220-L224 PolarHBondContact O-N 3.49Å; G222-L224 VanDerWaalsContact C-N 3.29Å; G222-L224 PolarHBondContact O-N 3.37Å; L224-R451 HydrophobicContact CD2-CB 3.92Å; L224-D452 HydrophobicContact CD2-CB 3.86Å; L224-V1418 HydrophobicContact CD1-CG1 3.88Å
225	I	70.8	Confident	71.5	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-110.3	-22.7	-167.9	-69.9	167.1	0	0	0	113.2	L221 G222 F223 E227 L228 I1424 L1427	L221-I225 WeakPolarHBondContact O-CB 3.47Å; L221-I225 PolarHBondContact O-N 3.13Å; G222-I225 CarbonylContact O-C 3.53Å; G222-I225 PolarHBondContact O-N 3.44Å; F223-I225 VanDerWaalsContact C-N 3.27Å; F223-I225 PolarHBondContact O-N 3.1Å; I225-E227 PolarHBondContact O-N 3.38Å; I225-L228 HydrophobicContact CG1-CD1 4.37Å; I225-L228 WeakPolarHBondContact O-CB 3.41Å; I225-L228 PolarHBondContact O-N 3.45Å; I225-I1424 HydrophobicContact CD1-CG1 3.83Å; I225-I1424 HydrophobicContact CG1-CG1 4.19Å; I225-I1424 HydrophobicContact CG2-CB 4.5Å; I225-I1424 HydrophobicContact CG2-CG2 4.04Å; I225-L1427 HydrophobicContact CB-CD1 4.44Å; I225-L1427 HydrophobicContact CD1-CD1 3.6Å; I225-L1427 HydrophobicContact CG2-CB 3.99Å; I225-L1427 HydrophobicContact CG2-CD1 4.43Å
226	C	68.4	Low	72.1	Confident	69 Å²	69	54.5 Å²	54.5	47%	0.466	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-36.4	-176	-80.9	0	0	0	0	114.8	G222 R1431	G222-C226 VanDerWaalsContact C-SG 3.59Å; G222-C226 PolarHBondContact O-N 3.32Å; G222-C226 PolarHBondContact O-SG 3.46Å; C226-R1431 PolarHBondContact O-NH1 2.93Å
227	E	71.6	Confident	72.5	Confident	80 Å²	80	58.6 Å²	58.6	37%	0.374	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-1.8	-176.9	-79.6	169.1	-133.1	0	0	114.5	I225 P272 R451	I225-E227 PolarHBondContact O-N 3.38Å; E227-P272 HydrophobicContact CB-CG 3.78Å; E227-P272 HydrophobicContact CG-CG 4.15Å; E227-P272 WeakPolarHBondContact OE2-CG 3.45Å; E227-R451 VanDerWaalsContact CD-CZ 3.49Å; E227-R451 IonicContact OE1-CZ 3.58Å; E227-R451 IonicContact OE1-NH1 2.83Å; E227-R451 PolarHBondContact OE1-NH1 3.36Å; E227-R451 IonicContact OE1-NH2 3.9Å; E227-R451 PolarHBondContact OE1-NH2 3.04Å; E227-R451 IonicContact OE2-CZ 2.67Å; E227-R451 IonicContact OE2-NH1 2.73Å; E227-R451 PolarHBondContact OE2-NH1 3.34Å; E227-R451 IonicContact OE2-NH2 3.13Å
228	L	75.7	Confident	73.2	Confident	5 Å²	5	57.1 Å²	57.1	3%	0.026	29%	0.291	C	S	.	.			trans	-75.3	138.1	176.3	-67.6	175.8	0	0	0	111.2	I225 F269 T271 V277 I1424 R1431	I225-L228 HydrophobicContact CG1-CD1 4.37Å; I225-L228 WeakPolarHBondContact O-CB 3.41Å; I225-L228 PolarHBondContact O-N 3.45Å; L228-F269 HydrophobicContact CD2-CB 4.44Å; L228-T271 HydrophobicContact CD2-CG2 4.42Å; L228-V277 HydrophobicContact CD2-CG2 4.47Å; L228-I1424 HydrophobicContact CD1-CD1 4.39Å; L228-I1424 HydrophobicContact CD1-CG2 4.09Å; L228-R1431 PolarHBondContact O-NH1 3.48Å
229	S	77.7	Confident	73.8	Confident	49 Å²	49	59.5 Å²	59.5	34%	0.343	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	163	179.9	66.9	0	0	0	0	111.5	F269 L270	S229-F269 CarbonylContact O-C 3.56Å; S229-F269 VanDerWaalsContact O-CA 3.3Å; S229-F269 WeakPolarHBondContact O-CA 3.31Å; S229-L270 PolarHBondContact N-O 2.68Å; S229-L270 PolarHBondContact O-N 3.48Å; S229-L270 WeakPolarHBondContact OG-CB 3.24Å; S229-L270 PolarHBondContact OG-O 2.94Å; S229-L270 VanDerWaalsContact OG-O 3.12Å
230	V	76.1	Confident	74.3	Confident	13 Å²	13	58.1 Å²	58.1	8%	0.079	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.4	-176.2	173	0	0	0	0	110.4	H234 V238 F269 M1428	V230-H234 HydrophobicContact CG1-CB 3.53Å; V230-V238 HydrophobicContact CB-CG2 4.33Å; V230-V238 HydrophobicContact CG1-CG2 3.96Å; V230-V238 HydrophobicContact CG2-CG2 4.19Å; V230-F269 HydrophobicContact CG2-CD1 3.51Å; V230-F269 HydrophobicContact CG2-CE1 3.64Å; V230-F269 HydrophobicContact CG2-CG 4.5Å; V230-M1428 HydrophobicContact CG2-CE 3.9Å; V230-M1428 HydrophobicContact CG2-SD 3.97Å
231	K	74.2	Confident	74.7	Confident	99 Å²	99	57 Å²	57	43%	0.43	30%	0.295	S	S	.	.			trans	-55.5	142.7	176.8	-72.6	-176.3	179	-177.5	0	110.9	N233 H234 K235 L270	K231-N233 PolarHBondContact O-N 3.11Å; K231-H234 PolarHBondContact O-N 3.1Å; K231-K235 PolarHBondContact O-N 3.32Å; K231-L270 HydrophobicContact CD-CD1 4.36Å; K231-L270 HydrophobicContact CG-CD1 3.52Å; K231-L270 HydrophobicContact CG-CG 4.05Å
232	S	72.6	Confident	75.4	Confident	89 Å²	89	56 Å²	56	62%	0.622	29%	0.29	S	S	*	.	H	α-helix	trans	-40	-49.6	179	47.3	0	0	0	0	113.5	H234 K235	S232-H234 PolarHBondContact O-N 3.03Å; S232-K235 WeakPolarHBondContact O-CB 3.43Å; S232-K235 PolarHBondContact O-N 3.38Å
233	N	71.9	Confident	75.9	Confident	139 Å²	139	58.4 Å²	58.4	74%	0.743	30%	0.304	S	S	*	.	H	α-helix	trans	-67.6	-7	-175.6	-56	15.3	0	0	0	114	K231	K231-N233 PolarHBondContact O-N 3.11Å
234	H	72.6	Confident	75.9	Confident	52 Å²	52	58.6 Å²	58.6	24%	0.241	31%	0.306	C	S	.	.	H	α-helix	trans	-115.5	-7.3	176.2	-62.5	-23.7	0	0	0	112.9	V230 K231 S232 K236 K237 V238	V230-H234 HydrophobicContact CG1-CB 3.53Å; K231-H234 PolarHBondContact O-N 3.1Å; S232-H234 PolarHBondContact O-N 3.03Å; H234-K236 PolarHBondContact O-N 3.19Å; H234-K237 WeakPolarHBondContact O-CB 3.39Å; H234-K237 PolarHBondContact O-N 2.93Å; H234-K237 VanDerWaalsContact O-N 3.12Å; H234-V238 PolarHBondContact O-N 2.77Å
235	K	75.4	Confident	76.2	Confident	129 Å²	129	58.4 Å²	58.4	56%	0.561	31%	0.305	S	S	*	.	H	α-helix	trans	-59.6	-31	175.9	-70.7	-165.1	173.4	-163.9	0	113.2	K231 S232 V238 L239	K231-K235 PolarHBondContact O-N 3.32Å; S232-K235 WeakPolarHBondContact O-CB 3.43Å; S232-K235 PolarHBondContact O-N 3.38Å; K235-V238 WeakPolarHBondContact O-CB 3.43Å; K235-V238 PolarHBondContact O-N 3.5Å; K235-L239 WeakPolarHBondContact O-CG 3.41Å; K235-L239 PolarHBondContact O-N 3.25Å
236	K	79.2	Confident	76.5	Confident	149 Å²	149	59.4 Å²	59.4	65%	0.648	31%	0.31	S	S	*	.	H	α-helix	trans	-60.9	-48.8	173.9	-166.2	-172	171.4	-178.4	0	111.5	H234 V238 L239 D240	H234-K236 PolarHBondContact O-N 3.19Å; K236-V238 VanDerWaalsContact C-N 3.28Å; K236-V238 PolarHBondContact O-N 3.42Å; K236-L239 WeakPolarHBondContact O-CB 3.38Å; K236-L239 PolarHBondContact O-N 3.03Å; K236-D240 PolarHBondContact O-N 3.4Å
237	K	76.9	Confident	76.9	Confident	96 Å²	96	61.4 Å²	61.4	42%	0.417	31%	0.312	S	S	.	.	H	α-helix	trans	-57.3	-40	177.3	-75.5	-163.7	173.2	-161.7	0	113	H234 D240 F241 P264	H234-K237 WeakPolarHBondContact O-CB 3.39Å; H234-K237 PolarHBondContact O-N 2.93Å; H234-K237 VanDerWaalsContact O-N 3.12Å; K237-D240 PolarHBondContact O-N 3.35Å; K237-F241 WeakPolarHBondContact O-CB 3.49Å; K237-F241 PolarHBondContact O-N 2.95Å; K237-P264 WeakPolarHBondContact CB-O 3.4Å; K237-P264 HydrophobicContact CG-CB 4.44Å
238	V	77.7	Confident	77	Confident	6 Å²	6	58 Å²	58	4%	0.036	30%	0.296	C	S	.	.	H	α-helix	trans	-58.4	-51.4	173.1	176.4	0	0	0	0	110.8	V230 H234 K235 K236 D240 F241 W242 P266	V230-V238 HydrophobicContact CB-CG2 4.33Å; V230-V238 HydrophobicContact CG1-CG2 3.96Å; V230-V238 HydrophobicContact CG2-CG2 4.19Å; H234-V238 PolarHBondContact O-N 2.77Å; K235-V238 WeakPolarHBondContact O-CB 3.43Å; K235-V238 PolarHBondContact O-N 3.5Å; K236-V238 VanDerWaalsContact C-N 3.28Å; K236-V238 PolarHBondContact O-N 3.42Å; V238-D240 PolarHBondContact O-N 3.4Å; V238-F241 PolarHBondContact O-N 3.16Å; V238-W242 HydrophobicContact CG1-CD2 3.73Å; V238-W242 HydrophobicContact CG1-CE3 4.11Å; V238-W242 HydrophobicContact CG1-CG 4.44Å; V238-W242 HydrophobicContact CG1-CH2 3.64Å; V238-W242 HydrophobicContact CG1-CZ2 3.23Å; V238-W242 HydrophobicContact CG1-CZ3 4.07Å; V238-W242 WeakPolarHBondContact O-CB 3.24Å; V238-W242 PolarHBondContact O-N 2.71Å; V238-P266 HydrophobicContact CG2-CB 4.26Å; V238-P266 HydrophobicContact CG2-CG 3.86Å
239	L	80.9	Confident	76.8	Confident	78 Å²	78	59.4 Å²	59.4	41%	0.408	31%	0.306	S	S	.	.	H	α-helix	trans	-63.6	-40.2	178.8	-68.5	163.3	0	0	0	112.6	K235 K236 W242 S243	K235-L239 WeakPolarHBondContact O-CG 3.41Å; K235-L239 PolarHBondContact O-N 3.25Å; K236-L239 WeakPolarHBondContact O-CB 3.38Å; K236-L239 PolarHBondContact O-N 3.03Å; L239-W242 HydrophobicContact CD2-CE3 3.88Å; L239-W242 HydrophobicContact CD2-CZ3 4Å; L239-W242 PolarHBondContact O-N 3.06Å; L239-S243 PolarHBondContact O-N 2.86Å
240	D	80.1	Confident	76.5	Confident	58 Å²	58	64.5 Å²	64.5	31%	0.31	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-48	175.8	-59.5	-31.6	0	0	0	109.6	K236 K237 V238 S243 I244 P264	K236-D240 PolarHBondContact O-N 3.4Å; K237-D240 PolarHBondContact O-N 3.35Å; V238-D240 PolarHBondContact O-N 3.4Å; D240-S243 PolarHBondContact O-N 2.92Å; D240-S243 PolarHBondContact O-OG 3.49Å; D240-I244 PolarHBondContact O-N 3.15Å; D240-P264 HydrophobicContact CB-CG 3.85Å
241	F	81.8	Confident	76.1	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.5	-42.9	176.4	176	-105.9	0	0	0	113.2	K237 V238 S243 I244 C245 I263 P264 L265 T1425 L1426 L1448	K237-F241 WeakPolarHBondContact O-CB 3.49Å; K237-F241 PolarHBondContact O-N 2.95Å; V238-F241 PolarHBondContact O-N 3.16Å; F241-S243 VanDerWaalsContact C-N 3.32Å; F241-S243 PolarHBondContact O-N 2.86Å; F241-I244 PolarHBondContact O-N 3.39Å; F241-C245 PolarHBondContact O-N 2.97Å; F241-C245 VanDerWaalsContact O-N 3.11Å; F241-C245 PolarHBondContact O-SG 3.12Å; F241-I263 HydrophobicContact CD2-CG2 3.53Å; F241-I263 HydrophobicContact CE2-CG2 3.67Å; F241-P264 HydrophobicContact CB-CG 4.36Å; F241-L265 HydrophobicContact CD2-CD2 3.99Å; F241-L265 HydrophobicContact CE1-CD2 4.44Å; F241-L265 HydrophobicContact CE2-CD2 3.89Å; F241-L265 HydrophobicContact CG-CD2 4.31Å; F241-L265 HydrophobicContact CZ-CD2 4.13Å; F241-T1425 VanDerWaalsContact CE1-OG1 3.27Å; F241-T1425 WeakPolarHBondContact CE1-OG1 3.37Å; F241-L1426 HydrophobicContact CE1-CD2 4.07Å; F241-L1426 HydrophobicContact CE1-CG 4.15Å; F241-L1426 HydrophobicContact CZ-CD2 4.34Å; F241-L1426 HydrophobicContact CZ-CG 4.38Å; F241-L1448 HydrophobicContact CE2-CD2 4.22Å; F241-L1448 HydrophobicContact CZ-CD2 4.36Å
242	W	81.3	Confident	75.5	Confident	12 Å²	12	64 Å²	64	5%	0.045	33%	0.328	C	S	.	.	H	α-helix	trans	-61.8	-39.2	174.8	-67.6	-14.6	0	0	0	112.2	V238 L239 I244 C245 E246 T1425 M1428 H1429 D1432 R1433	V238-W242 HydrophobicContact CG1-CD2 3.73Å; V238-W242 HydrophobicContact CG1-CE3 4.11Å; V238-W242 HydrophobicContact CG1-CG 4.44Å; V238-W242 HydrophobicContact CG1-CH2 3.64Å; V238-W242 HydrophobicContact CG1-CZ2 3.23Å; V238-W242 HydrophobicContact CG1-CZ3 4.07Å; V238-W242 WeakPolarHBondContact O-CB 3.24Å; V238-W242 PolarHBondContact O-N 2.71Å; L239-W242 HydrophobicContact CD2-CE3 3.88Å; L239-W242 HydrophobicContact CD2-CZ3 4Å; L239-W242 PolarHBondContact O-N 3.06Å; W242-I244 VanDerWaalsContact C-N 3.28Å; W242-I244 PolarHBondContact O-N 3.48Å; W242-C245 PolarHBondContact O-N 3.32Å; W242-E246 WeakPolarHBondContact O-CB 3.23Å; W242-E246 WeakPolarHBondContact O-CG 3.27Å; W242-E246 PolarHBondContact O-N 2.84Å; W242-T1425 PolarHBondContact NE1-O 3.22Å; W242-M1428 HydrophobicContact CZ2-CB 4.16Å; W242-H1429 AromaticContact CD1-CD2 3.83Å; W242-H1429 HydrophobicContact CD2-CB 4.35Å; W242-H1429 AromaticContact CD2-CD2 3.81Å; W242-H1429 HydrophobicContact CG-CB 4.32Å; W242-H1429 AromaticContact CG-CD2 3.57Å; W242-H1429 HydrophobicContact CZ2-CB 4.4Å; W242-D1432 HydrophobicContact CH2-CB 3.52Å; W242-D1432 HydrophobicContact CZ2-CB 4.27Å; W242-D1432 HydrophobicContact CZ3-CB 4.17Å; W242-R1433 HydrophobicContact CE3-CG 4.49Å; W242-R1433 HydrophobicContact CZ3-CG 4.42Å
243	S	80.3	Confident	74.6	Confident	64 Å²	64	66.4 Å²	66.4	45%	0.448	33%	0.327	S	S	.	.	H	α-helix	trans	-63.5	-33.9	177.1	77.7	0	0	0	0	112.7	L239 D240 F241 H247	L239-S243 PolarHBondContact O-N 2.86Å; D240-S243 PolarHBondContact O-N 2.92Å; D240-S243 PolarHBondContact O-OG 3.49Å; F241-S243 VanDerWaalsContact C-N 3.32Å; F241-S243 PolarHBondContact O-N 2.86Å; S243-H247 WeakPolarHBondContact O-CB 3.31Å; S243-H247 PolarHBondContact O-N 3.44Å
244	I	79.6	Confident	73.8	Confident	36 Å²	36	62.9 Å²	62.9	19%	0.185	32%	0.324	C	S	.	.	H	α-helix	trans	-67.2	-45.2	173.1	-63.7	165.2	0	0	0	110.2	D240 F241 W242 E246 H247 L248 P260 P264 L1448	D240-I244 PolarHBondContact O-N 3.15Å; F241-I244 PolarHBondContact O-N 3.39Å; W242-I244 VanDerWaalsContact C-N 3.28Å; W242-I244 PolarHBondContact O-N 3.48Å; I244-E246 PolarHBondContact O-N 3.45Å; I244-H247 PolarHBondContact O-N 2.84Å; I244-L248 HydrophobicContact CG2-CD1 4.01Å; I244-L248 HydrophobicContact CG2-CG 4.42Å; I244-L248 WeakPolarHBondContact O-CB 3.35Å; I244-L248 VanDerWaalsContact O-CG 3.31Å; I244-L248 WeakPolarHBondContact O-CG 3.25Å; I244-L248 PolarHBondContact O-N 3.12Å; I244-P260 HydrophobicContact CD1-CG 4.47Å; I244-P260 HydrophobicContact CG2-CG 4.34Å; I244-P264 HydrophobicContact CD1-CG 4.33Å; I244-L1448 HydrophobicContact CG2-CD1 4.48Å
245	C	75.3	Confident	73	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-63.3	-43.1	178.2	-60.6	0	0	0	0	112	F241 W242 H247 L248 S249 L1438	F241-C245 PolarHBondContact O-N 2.97Å; F241-C245 VanDerWaalsContact O-N 3.11Å; F241-C245 PolarHBondContact O-SG 3.12Å; W242-C245 PolarHBondContact O-N 3.32Å; C245-H247 VanDerWaalsContact C-N 3.33Å; C245-H247 PolarHBondContact O-N 3.12Å; C245-L248 PolarHBondContact O-N 2.74Å; C245-S249 PolarHBondContact O-N 3.37Å; C245-L1438 HydrophobicContact CB-CD1 3.88Å; C245-L1438 HydrophobicContact CB-CD2 4.26Å
246	E	77.3	Confident	71.7	Confident	25 Å²	25	64.5 Å²	64.5	12%	0.117	34%	0.342	C	S	.	.	H	α-helix	trans	-68	-29.5	176.2	-74.7	173	-166.7	0	0	113.2	W242 I244 S249 K250 H1429 R1433 L1438	W242-E246 WeakPolarHBondContact O-CB 3.23Å; W242-E246 WeakPolarHBondContact O-CG 3.27Å; W242-E246 PolarHBondContact O-N 2.84Å; I244-E246 PolarHBondContact O-N 3.45Å; E246-S249 WeakPolarHBondContact CA-OG 3.42Å; E246-S249 PolarHBondContact O-OG 3.26Å; E246-K250 VanDerWaalsContact O-CD 3.24Å; E246-K250 WeakPolarHBondContact O-CD 3.37Å; E246-K250 WeakPolarHBondContact O-CE 3.39Å; E246-K250 VanDerWaalsContact O-CG 3.32Å; E246-K250 WeakPolarHBondContact O-CG 3.46Å; E246-H1429 IonicContact OE1-CD2 3.82Å; E246-H1429 IonicContact OE1-CE1 3.52Å; E246-H1429 IonicContact OE1-NE2 2.81Å; E246-H1429 PolarHBondContact OE1-NE2 2.99Å; E246-R1433 VanDerWaalsContact OE1-CD 3.27Å; E246-R1433 WeakPolarHBondContact OE1-CD 3.1Å; E246-R1433 IonicContact OE1-CZ 2.75Å; E246-R1433 IonicContact OE1-NE 2.76Å; E246-R1433 IonicContact OE1-NH1 3.18Å; E246-R1433 PolarHBondContact OE1-NH1 3.22Å; E246-R1433 IonicContact OE2-NH1 3.9Å; E246-R1433 PolarHBondContact OE2-NH1 3.44Å; E246-L1438 HydrophobicContact CB-CD2 4.46Å; E246-L1438 HydrophobicContact CG-CD2 3.88Å
247	H	77.1	Confident	70.7	Confident	110 Å²	110	61.5 Å²	61.5	51%	0.509	33%	0.33	S	S	.	.	H	α-helix	trans	-69.8	-49	170.7	-175.2	48.4	0	0	0	110.9	S243 I244 C245 S249 K250	S243-H247 WeakPolarHBondContact O-CB 3.31Å; S243-H247 PolarHBondContact O-N 3.44Å; I244-H247 PolarHBondContact O-N 2.84Å; C245-H247 VanDerWaalsContact C-N 3.33Å; C245-H247 PolarHBondContact O-N 3.12Å; H247-S249 VanDerWaalsContact C-N 3.27Å; H247-S249 PolarHBondContact O-N 2.87Å; H247-K250 PolarHBondContact O-N 3.31Å; H247-K250 VanDerWaalsContact O-N 3.07Å
248	L	73.4	Confident	69.7	Low	9 Å²	9	66 Å²	66	5%	0.047	35%	0.353	C	S	.	.	H	α-helix	trans	-62.2	-29.9	178.4	-69.6	174	0	0	0	113.4	I244 C245 K250 L251 H1442 L1444 I1445 L1448	I244-L248 HydrophobicContact CG2-CD1 4.01Å; I244-L248 HydrophobicContact CG2-CG 4.42Å; I244-L248 WeakPolarHBondContact O-CB 3.35Å; I244-L248 VanDerWaalsContact O-CG 3.31Å; I244-L248 WeakPolarHBondContact O-CG 3.25Å; I244-L248 PolarHBondContact O-N 3.12Å; C245-L248 PolarHBondContact O-N 2.74Å; L248-K250 VanDerWaalsContact C-N 3.29Å; L248-K250 PolarHBondContact O-N 3.27Å; L248-L251 HydrophobicContact CD2-CD1 4.05Å; L248-H1442 PolarHBondContact O-CE1 3.21Å; L248-H1442 PolarHBondContact O-ND1 2.76Å; L248-L1444 HydrophobicContact CB-CB 4.49Å; L248-L1444 HydrophobicContact CD2-CB 4.22Å; L248-L1444 HydrophobicContact CD2-CD1 4.08Å; L248-I1445 HydrophobicContact CB-CG1 4.2Å; L248-L1448 HydrophobicContact CD1-CD1 3.59Å
249	S	71.7	Confident	69	Low	35 Å²	35	66.4 Å²	66.4	25%	0.245	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-17.2	175.4	70.8	0	0	0	0	114.7	C245 E246 H247	C245-S249 PolarHBondContact O-N 3.37Å; E246-S249 WeakPolarHBondContact CA-OG 3.42Å; E246-S249 PolarHBondContact O-OG 3.26Å; H247-S249 VanDerWaalsContact C-N 3.27Å; H247-S249 PolarHBondContact O-N 2.87Å
250	K	71.4	Confident	68.2	Low	155 Å²	155	65.5 Å²	65.5	67%	0.674	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	0.8	-176.8	-68.7	166.9	-170.5	164.4	0	113.1	E246 H247 L248	E246-K250 VanDerWaalsContact O-CD 3.24Å; E246-K250 WeakPolarHBondContact O-CD 3.37Å; E246-K250 WeakPolarHBondContact O-CE 3.39Å; E246-K250 VanDerWaalsContact O-CG 3.32Å; E246-K250 WeakPolarHBondContact O-CG 3.46Å; H247-K250 PolarHBondContact O-N 3.31Å; H247-K250 VanDerWaalsContact O-N 3.07Å; L248-K250 VanDerWaalsContact C-N 3.29Å; L248-K250 PolarHBondContact O-N 3.27Å
251	L	67.9	Low	67.2	Low	24 Å²	24	71.6 Å²	71.6	13%	0.126	38%	0.38	C	S	.	.	S	Bend	trans	-85.7	146.5	178.3	-67.4	171.9	0	0	0	110.7	L248 E257 H1442 L1444	L248-L251 HydrophobicContact CD2-CD1 4.05Å; L251-E257 VanDerWaalsContact CD1-OE2 3.28Å; L251-E257 WeakPolarHBondContact CD1-OE2 3.35Å; L251-H1442 PolarHBondContact O-NE2 3.22Å; L251-L1444 HydrophobicContact CB-CD1 4.25Å; L251-L1444 HydrophobicContact CD1-CD1 3.65Å
252	P	61.2	Low	66.4	Low	77 Å²	77	78.8 Å²	78.8	50%	0.5	42%	0.418	S	S	.	.			trans	-74.1	140.7	179	29.7	-34.8	0	0	0	112.1	G254 K255	P252-G254 PolarHBondContact O-N 2.91Å; P252-K255 HydrophobicContact CG-CD 4.05Å; P252-K255 HydrophobicContact CG-CG 4.24Å; P252-K255 PolarHBondContact O-N 3.24Å
253	F	54.4	Low	65.7	Low	140 Å²	140	79.6 Å²	79.6	61%	0.614	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	98.1	177.7	-66.2	-86.4	0	0	0	112.4	H1442 P1443	F253-H1442 AromaticContact CD1-CD2 3.79Å; F253-H1442 AromaticContact CE1-CD2 3.54Å; F253-H1442 AromaticContact CZ-CD2 3.89Å; F253-P1443 HydrophobicContact CD1-CG 4.03Å
254	G	53.6	Low	65.2	Low	66 Å²	66	78 Å²	78	68%	0.68	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	137	-13.6	175.5	0	0	0	0	0	115.6	P252	P252-G254 PolarHBondContact O-N 2.91Å
255	K	55.8	Low	64.8	Low	116 Å²	116	76.5 Å²	76.5	50%	0.504	40%	0.404	S	S	.	.			trans	-77.9	124.9	169.7	-76.5	-171.1	175	-173.8	0	110.9	P252	P252-K255 HydrophobicContact CG-CD 4.05Å; P252-K255 HydrophobicContact CG-CG 4.24Å; P252-K255 PolarHBondContact O-N 3.24Å
256	C	49.4	Very low	64.8	Low	99 Å²	99	76.6 Å²	76.6	67%	0.669	40%	0.404	S	S	*	.			trans	-94.8	92.2	167.3	-75.3	0	0	0	0	109.5
257	E	57.7	Low	64.7	Low	86 Å²	86	77.8 Å²	77.8	40%	0.402	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-82.5	154.6	158.8	-73.2	-179.9	167	0	0	110	L251	L251-E257 VanDerWaalsContact CD1-OE2 3.28Å; L251-E257 WeakPolarHBondContact CD1-OE2 3.35Å
258	E	55.6	Low	64.8	Low	190 Å²	190	76.8 Å²	76.8	89%	0.888	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-76.3	123.8	176.1	-65.9	-176.3	152	0	0	109.5
259	I	62.8	Low	65.2	Low	15 Å²	15	76.4 Å²	76.4	8%	0.077	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-67.6	125.4	177.1	-67.4	164.9	0	0	0	107.4	E261 I263 K1447 L1448	I259-E261 PolarHBondContact O-N 2.77Å; I259-I263 HydrophobicContact CG2-CD1 3.91Å; I259-K1447 HydrophobicContact CD1-CB 4.26Å; I259-K1447 HydrophobicContact CD1-CD 3.89Å; I259-K1447 HydrophobicContact CD1-CG 3.81Å; I259-L1448 HydrophobicContact CD1-CB 4.13Å; I259-L1448 HydrophobicContact CG2-CD1 4.09Å; I259-L1448 HydrophobicContact CG2-CG 4.43Å
260	P	63.9	Low	65.6	Low	59 Å²	59	76.2 Å²	76.2	38%	0.383	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-60.7	127.4	-173.1	23.1	-34.1	0	0	0	111.4	I244 N262 I263	I244-P260 HydrophobicContact CD1-CG 4.47Å; I244-P260 HydrophobicContact CG2-CG 4.34Å; P260-N262 VanDerWaalsContact C-N 3.27Å; P260-N262 PolarHBondContact O-N 3Å; P260-I263 WeakPolarHBondContact O-CG1 3.47Å
261	E	59.6	Low	66.1	Low	186 Å²	186	68.9 Å²	68.9	87%	0.869	36%	0.362	S	S	*	.	S	Bend	trans	-59.1	-35.1	-171.2	-59.8	-171.8	130.3	0	0	113.8	I259 I263	I259-E261 PolarHBondContact O-N 2.77Å; E261-I263 PolarHBondContact O-N 2.94Å
262	N	64.5	Low	66.4	Low	150 Å²	150	71 Å²	71	80%	0.802	38%	0.377	S	S	*	.			trans	-97.5	80.7	-179.5	-85.5	-73.9	0	0	0	111.6	P260	P260-N262 VanDerWaalsContact C-N 3.27Å; P260-N262 PolarHBondContact O-N 3Å
263	I	68.1	Low	67.2	Low	30 Å²	30	73.4 Å²	73.4	15%	0.154	39%	0.386	C	S	.	.			trans	-79.5	119.2	177.4	-53.8	-177	0	0	0	109.9	F241 I259 P260 E261 L265 L1448 I1452	F241-I263 HydrophobicContact CD2-CG2 3.53Å; F241-I263 HydrophobicContact CE2-CG2 3.67Å; I259-I263 HydrophobicContact CG2-CD1 3.91Å; P260-I263 WeakPolarHBondContact O-CG1 3.47Å; E261-I263 PolarHBondContact O-N 2.94Å; I263-L265 VanDerWaalsContact C-N 3.3Å; I263-L265 HydrophobicContact CG2-CG 4.26Å; I263-L265 PolarHBondContact O-N 3.19Å; I263-L1448 HydrophobicContact CD1-CD1 4.19Å; I263-L1448 HydrophobicContact CD1-CG 4.24Å; I263-I1452 HydrophobicContact CD1-CD1 3.74Å; I263-I1452 HydrophobicContact CD1-CG1 3.91Å; I263-I1452 HydrophobicContact CG2-CD1 4.33Å
264	P	68.4	Low	68.2	Low	29 Å²	29	76.9 Å²	76.9	19%	0.188	40%	0.395	C	S	.	.			trans	-82.2	63.1	-167.8	33.8	-37.2	0	0	0	113.2	K237 D240 F241 I244	K237-P264 WeakPolarHBondContact CB-O 3.4Å; K237-P264 HydrophobicContact CG-CB 4.44Å; D240-P264 HydrophobicContact CB-CG 3.85Å; F241-P264 HydrophobicContact CB-CG 4.36Å; I244-P264 HydrophobicContact CD1-CG 4.33Å
265	L	71.8	Confident	69.3	Low	5 Å²	5	75.7 Å²	75.7	3%	0.026	37%	0.374	C	S	.	.			trans	-68.5	142.6	-180	-70	172	0	0	0	113.3	F241 I263 Y267 C1422 I1452	F241-L265 HydrophobicContact CD2-CD2 3.99Å; F241-L265 HydrophobicContact CE1-CD2 4.44Å; F241-L265 HydrophobicContact CE2-CD2 3.89Å; F241-L265 HydrophobicContact CG-CD2 4.31Å; F241-L265 HydrophobicContact CZ-CD2 4.13Å; I263-L265 VanDerWaalsContact C-N 3.3Å; I263-L265 HydrophobicContact CG2-CG 4.26Å; I263-L265 PolarHBondContact O-N 3.19Å; L265-Y267 HydrophobicContact CB-CE2 4.13Å; L265-C1422 HydrophobicContact CD1-CB 4.3Å; L265-C1422 HydrophobicContact CD2-CB 4.15Å; L265-I1452 HydrophobicContact CD1-CG2 3.85Å
266	P	75.4	Confident	70.3	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.013	37%	0.371	C	S	.	.			trans	-84.7	128.8	164.8	35	-32	0	0	0	110.1	V238 F269 T1425	V238-P266 HydrophobicContact CG2-CB 4.26Å; V238-P266 HydrophobicContact CG2-CG 3.86Å; P266-F269 HydrophobicContact CG-CE1 4.37Å; P266-F269 HydrophobicContact CG-CZ 4.01Å; P266-F269 VanDerWaalsContact O-CE2 3.32Å; P266-F269 WeakPolarHBondContact O-CE2 3.23Å; P266-F269 WeakPolarHBondContact O-CZ 3.26Å; P266-T1425 HydrophobicContact CG-CG2 3.29Å
267	Y	75.8	Confident	71.6	Confident	51 Å²	51	69 Å²	69	20%	0.2	34%	0.342	C	S	.	.			trans	-106.8	8.7	179.2	-64.7	-78.9	0	0	0	113.3	L265 D278 L279 R280 D283 P1421	L265-Y267 HydrophobicContact CB-CE2 4.13Å; Y267-D278 CarbonylContact O-C 2.89Å; Y267-L279 WeakPolarHBondContact CD1-O 3.23Å; Y267-L279 PolarHBondContact O-N 3.31Å; Y267-R280 HydrophobicContact CG-CG 4.39Å; Y267-D283 HydrophobicContact CE1-CB 4.06Å; Y267-D283 HydrophobicContact CE2-CB 4.43Å; Y267-P1421 HydrophobicContact CD1-CB 4.29Å; Y267-P1421 HydrophobicContact CD1-CG 3.81Å; Y267-P1421 HydrophobicContact CE1-CG 3.75Å
268	R	78.4	Confident	72.4	Confident	89 Å²	89	66.3 Å²	66.3	34%	0.336	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	110.9	-174.3	-81.4	177.9	165.5	173.5	-5.1	111.3	V277 D278	R268-V277 WeakPolarHBondContact CA-O 3.33Å; R268-D278 HydrophobicContact CG-CB 4.41Å; R268-D278 IonicContact CZ-OD2 3.89Å; R268-D278 IonicContact NE-OD1 2.79Å; R268-D278 IonicContact NE-OD2 3.38Å; R268-D278 PolarHBondContact NE-OD2 2.96Å; R268-D278 IonicContact NH2-OD2 2.7Å; R268-D278 PolarHBondContact NH2-OD2 2.74Å; R268-D278 VanDerWaalsContact NH2-OD2 3.09Å
269	F	81.8	Confident	73.4	Confident	1 Å²	1	58.2 Å²	58.2	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	168.1	-179.4	-57.9	-92.6	0	0	0	110.4	L228 S229 V230 P266 S276 V277 L279 P1421 I1424 T1425 M1428	L228-F269 HydrophobicContact CD2-CB 4.44Å; S229-F269 CarbonylContact O-C 3.56Å; S229-F269 VanDerWaalsContact O-CA 3.3Å; S229-F269 WeakPolarHBondContact O-CA 3.31Å; V230-F269 HydrophobicContact CG2-CD1 3.51Å; V230-F269 HydrophobicContact CG2-CE1 3.64Å; V230-F269 HydrophobicContact CG2-CG 4.5Å; P266-F269 HydrophobicContact CG-CE1 4.37Å; P266-F269 HydrophobicContact CG-CZ 4.01Å; P266-F269 VanDerWaalsContact O-CE2 3.32Å; P266-F269 WeakPolarHBondContact O-CE2 3.23Å; P266-F269 WeakPolarHBondContact O-CZ 3.26Å; F269-S276 CarbonylContact O-C 3.47Å; F269-S276 WeakPolarHBondContact O-CA 3.21Å; F269-V277 HydrophobicContact CB-CB 4.43Å; F269-V277 PolarHBondContact N-O 3.28Å; F269-V277 PolarHBondContact O-N 3.12Å; F269-L279 HydrophobicContact CD2-CD1 3.83Å; F269-L279 HydrophobicContact CD2-CG 4.49Å; F269-L279 HydrophobicContact CE2-CD1 3.84Å; F269-P1421 HydrophobicContact CE2-CB 4.23Å; F269-P1421 HydrophobicContact CZ-CB 4.44Å; F269-I1424 HydrophobicContact CD1-CG2 3.88Å; F269-I1424 HydrophobicContact CE1-CB 4.37Å; F269-I1424 HydrophobicContact CE1-CG2 3.42Å; F269-I1424 VanDerWaalsContact CE1-CG2 3.42Å; F269-I1424 HydrophobicContact CE2-CG2 4.39Å; F269-I1424 HydrophobicContact CZ-CB 4.21Å; F269-I1424 HydrophobicContact CZ-CG2 3.72Å; F269-T1425 HydrophobicContact CZ-CG2 4.37Å; F269-M1428 HydrophobicContact CD1-SD 4.18Å; F269-M1428 HydrophobicContact CE1-SD 3.92Å
270	L	81.3	Confident	74.1	Confident	30 Å²	30	58.4 Å²	58.4	16%	0.157	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	131.8	177	-77	171.8	0	0	0	109.3	S229 K231 R274 V275	S229-L270 PolarHBondContact N-O 2.68Å; S229-L270 PolarHBondContact O-N 3.48Å; S229-L270 WeakPolarHBondContact OG-CB 3.24Å; S229-L270 PolarHBondContact OG-O 2.94Å; S229-L270 VanDerWaalsContact OG-O 3.12Å; K231-L270 HydrophobicContact CD-CD1 4.36Å; K231-L270 HydrophobicContact CG-CD1 3.52Å; K231-L270 HydrophobicContact CG-CG 4.05Å; L270-R274 VanDerWaalsContact CD2-O 3.3Å; L270-R274 WeakPolarHBondContact CD2-O 3.49Å; L270-V275 WeakPolarHBondContact CA-O 3.4Å
271	T	80.2	Confident	74.5	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.012	28%	0.279	C	S	.	.			trans	-73.4	166.8	165	70.3	0	0	0	0	110.4	L228 N273 R274 V275 V277 F447	L228-T271 HydrophobicContact CD2-CG2 4.42Å; T271-N273 PolarHBondContact O-N 3.44Å; T271-N273 PolarHBondContact OG1-N 2.86Å; T271-R274 WeakPolarHBondContact O-CA 3.14Å; T271-R274 PolarHBondContact O-N 3.48Å; T271-V275 HydrophobicContact CG2-CB 4.36Å; T271-V275 PolarHBondContact N-O 3.36Å; T271-V275 WeakPolarHBondContact OG1-CB 3.45Å; T271-V275 PolarHBondContact OG1-N 3.04Å; T271-V277 HydrophobicContact CG2-CG2 3.88Å; T271-F447 HydrophobicContact CG2-CD1 3.48Å; T271-F447 VanDerWaalsContact CG2-CD1 3.48Å; T271-F447 HydrophobicContact CG2-CD2 4.43Å; T271-F447 HydrophobicContact CG2-CE1 3.61Å; T271-F447 HydrophobicContact CG2-CG 3.92Å; T271-F447 HydrophobicContact CG2-CZ 4.16Å
272	P	75.6	Confident	75	Confident	68 Å²	68	48.9 Å²	48.9	44%	0.442	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-37.1	172.9	-27.4	36.4	0	0	0	112.9	E227 R274	E227-P272 HydrophobicContact CB-CG 3.78Å; E227-P272 HydrophobicContact CG-CG 4.15Å; E227-P272 WeakPolarHBondContact OE2-CG 3.45Å; P272-R274 PolarHBondContact O-N 2.85Å
273	N	77.1	Confident	75.4	Confident	127 Å²	127	43.5 Å²	43.5	68%	0.679	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	8.6	175.4	-63.1	-0.1	0	0	0	113.3	T271 V275	T271-N273 PolarHBondContact O-N 3.44Å; T271-N273 PolarHBondContact OG1-N 2.86Å; N273-V275 HydrophobicContact CB-CG2 4.27Å; N273-V275 PolarHBondContact O-N 3.39Å; N273-V275 VanDerWaalsContact O-N 3.12Å
274	R	76.4	Confident	75.5	Confident	214 Å²	214	45.4 Å²	45.4	81%	0.808	23%	0.23	S	C	*	.			trans	60.7	13.9	-178.8	-54.6	-179.1	178.5	-177.5	-0.2	115	L270 T271 P272 S276	L270-R274 VanDerWaalsContact CD2-O 3.3Å; L270-R274 WeakPolarHBondContact CD2-O 3.49Å; T271-R274 WeakPolarHBondContact O-CA 3.14Å; T271-R274 PolarHBondContact O-N 3.48Å; P272-R274 PolarHBondContact O-N 2.85Å; R274-S276 PolarHBondContact O-N 3.37Å
275	V	75.7	Confident	75.8	Confident	41 Å²	41	48 Å²	48	25%	0.248	25%	0.245	C	C	.	.			trans	-67.3	128.8	170.3	-176.1	0	0	0	0	108.1	L270 T271 N273 D443	L270-V275 WeakPolarHBondContact CA-O 3.4Å; T271-V275 HydrophobicContact CG2-CB 4.36Å; T271-V275 PolarHBondContact N-O 3.36Å; T271-V275 WeakPolarHBondContact OG1-CB 3.45Å; T271-V275 PolarHBondContact OG1-N 3.04Å; N273-V275 HydrophobicContact CB-CG2 4.27Å; N273-V275 PolarHBondContact O-N 3.39Å; N273-V275 VanDerWaalsContact O-N 3.12Å; V275-D443 HydrophobicContact CG1-CB 4.06Å; V275-D443 HydrophobicContact CG2-CB 4.48Å
276	S	76.4	Confident	76	Confident	63 Å²	63	48.9 Å²	48.9	44%	0.441	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	116.6	-179.4	56.1	0	0	0	0	111.8	F269 R274	F269-S276 CarbonylContact O-C 3.47Å; F269-S276 WeakPolarHBondContact O-CA 3.21Å; R274-S276 PolarHBondContact O-N 3.37Å
277	V	76.3	Confident	76.1	Confident	10 Å²	10	49 Å²	49	6%	0.061	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	114.9	171.2	-170	0	0	0	0	107.8	L228 R268 F269 T271 L279	L228-V277 HydrophobicContact CD2-CG2 4.47Å; R268-V277 WeakPolarHBondContact CA-O 3.33Å; F269-V277 HydrophobicContact CB-CB 4.43Å; F269-V277 PolarHBondContact N-O 3.28Å; F269-V277 PolarHBondContact O-N 3.12Å; T271-V277 HydrophobicContact CG2-CG2 3.88Å; V277-L279 HydrophobicContact CG1-CD2 4.02Å; V277-L279 HydrophobicContact CG1-CG 4.06Å
278	D	76.4	Confident	76	Confident	31 Å²	31	51.5 Å²	51.5	17%	0.166	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	92.5	-173.4	-162.3	-33.7	0	0	0	110.8	Y267 R268 R280 P363	Y267-D278 CarbonylContact O-C 2.89Å; R268-D278 HydrophobicContact CG-CB 4.41Å; R268-D278 IonicContact CZ-OD2 3.89Å; R268-D278 IonicContact NE-OD1 2.79Å; R268-D278 IonicContact NE-OD2 3.38Å; R268-D278 PolarHBondContact NE-OD2 2.96Å; R268-D278 IonicContact NH2-OD2 2.7Å; R268-D278 PolarHBondContact NH2-OD2 2.74Å; R268-D278 VanDerWaalsContact NH2-OD2 3.09Å; D278-R280 VanDerWaalsContact C-N 3.27Å; D278-R280 PolarHBondContact O-N 2.84Å; D278-R280 WeakPolarHBondContact OD1-CB 3.21Å; D278-R280 VanDerWaalsContact OD1-CG 3.28Å; D278-R280 WeakPolarHBondContact OD1-CG 3.35Å; D278-R280 IonicContact OD1-CZ 3.6Å; D278-R280 PolarHBondContact OD1-N 3.33Å; D278-R280 IonicContact OD1-NE 2.66Å; D278-R280 PolarHBondContact OD1-NE 2.91Å; D278-R280 IonicContact OD1-NH2 2.8Å; D278-R280 IonicContact OD2-CZ 3.31Å; D278-R280 IonicContact OD2-NE 2.69Å; D278-R280 PolarHBondContact OD2-NE 2.91Å; D278-R280 IonicContact OD2-NH2 2.81Å; D278-R280 PolarHBondContact OD2-NH2 2.95Å; D278-P363 HydrophobicContact CB-CG 4.18Å
279	L	76.3	Confident	76.1	Confident	20 Å²	20	54.8 Å²	54.8	11%	0.105	28%	0.276	C	S	.	.			trans	-88.4	19.8	-174.7	-61.6	173.9	0	0	0	112.9	Y267 F269 V277 L281 H282 Y1419 I1424	Y267-L279 WeakPolarHBondContact CD1-O 3.23Å; Y267-L279 PolarHBondContact O-N 3.31Å; F269-L279 HydrophobicContact CD2-CD1 3.83Å; F269-L279 HydrophobicContact CD2-CG 4.49Å; F269-L279 HydrophobicContact CE2-CD1 3.84Å; V277-L279 HydrophobicContact CG1-CD2 4.02Å; V277-L279 HydrophobicContact CG1-CG 4.06Å; L279-L281 PolarHBondContact O-N 2.8Å; L279-H282 PolarHBondContact O-N 3.43Å; L279-Y1419 WeakPolarHBondContact CD1-O 3.49Å; L279-I1424 HydrophobicContact CD1-CD1 3.46Å; L279-I1424 VanDerWaalsContact CD1-CD1 3.46Å
280	R	77.3	Confident	76	Confident	19 Å²	19	54.8 Å²	54.8	7%	0.072	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-55.8	-21	177.9	-84.4	-178.5	-67.6	156.5	6.9	113.8	Y267 D278 H282 D283 S357 P358 G359 I360	Y267-R280 HydrophobicContact CG-CG 4.39Å; D278-R280 VanDerWaalsContact C-N 3.27Å; D278-R280 PolarHBondContact O-N 2.84Å; D278-R280 WeakPolarHBondContact OD1-CB 3.21Å; D278-R280 VanDerWaalsContact OD1-CG 3.28Å; D278-R280 WeakPolarHBondContact OD1-CG 3.35Å; D278-R280 IonicContact OD1-CZ 3.6Å; D278-R280 PolarHBondContact OD1-N 3.33Å; D278-R280 IonicContact OD1-NE 2.66Å; D278-R280 PolarHBondContact OD1-NE 2.91Å; D278-R280 IonicContact OD1-NH2 2.8Å; D278-R280 IonicContact OD2-CZ 3.31Å; D278-R280 IonicContact OD2-NE 2.69Å; D278-R280 PolarHBondContact OD2-NE 2.91Å; D278-R280 IonicContact OD2-NH2 2.81Å; D278-R280 PolarHBondContact OD2-NH2 2.95Å; R280-H282 PolarHBondContact O-N 2.83Å; R280-D283 WeakPolarHBondContact O-CB 3.19Å; R280-D283 PolarHBondContact O-N 2.9Å; R280-S357 PolarHBondContact NH1-OG 3.49Å; R280-P358 PolarHBondContact NH1-O 2.9Å; R280-G359 PolarHBondContact NH2-O 3.18Å; R280-I360 HydrophobicContact CB-CD1 3.89Å
281	L	71.3	Confident	75.8	Confident	15 Å²	15	54.1 Å²	54.1	8%	0.079	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-68.2	-15.4	176.6	-56.1	-176.9	0	0	0	113.9	L279 D283 I360 P363 L364 E367	L279-L281 PolarHBondContact O-N 2.8Å; L281-D283 VanDerWaalsContact C-N 3.33Å; L281-I360 HydrophobicContact CD2-CD1 3.96Å; L281-I360 HydrophobicContact CD2-CG1 4.5Å; L281-P363 HydrophobicContact CD1-CB 4.45Å; L281-L364 HydrophobicContact CD2-CD2 3.54Å; L281-L364 HydrophobicContact CD2-CG 3.87Å; L281-E367 HydrophobicContact CD1-CB 3.62Å; L281-E367 HydrophobicContact CD1-CG 3.92Å
282	H	70.2	Confident	75.8	Confident	29 Å²	29	60.1 Å²	60.1	13%	0.134	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-81.5	-9.1	173	-68.3	-94.6	0	0	0	113.4	L279 R280 P284 H1420 P1421	L279-H282 PolarHBondContact O-N 3.43Å; R280-H282 PolarHBondContact O-N 2.83Å; H282-P284 VanDerWaalsContact O-CD 3.31Å; H282-P284 WeakPolarHBondContact O-CD 3.45Å; H282-H1420 AromaticContact ND1-CD2 3.85Å; H282-P1421 HydrophobicContact CB-CG 4.02Å
283	D	74	Confident	76	Confident	38 Å²	38	58 Å²	58	20%	0.203	29%	0.286	C	S	.	.			trans	-74.5	112.6	167.7	178.4	-26.4	0	0	0	109	Y267 R280 L281 V285 L286 L287	Y267-D283 HydrophobicContact CE1-CB 4.06Å; Y267-D283 HydrophobicContact CE2-CB 4.43Å; R280-D283 WeakPolarHBondContact O-CB 3.19Å; R280-D283 PolarHBondContact O-N 2.9Å; L281-D283 VanDerWaalsContact C-N 3.33Å; D283-V285 VanDerWaalsContact C-N 3.29Å; D283-V285 PolarHBondContact O-N 3.33Å; D283-V285 WeakPolarHBondContact OD1-CA 3.45Å; D283-V285 WeakPolarHBondContact OD1-CB 3.41Å; D283-V285 PolarHBondContact OD1-N 3.22Å; D283-L286 HydrophobicContact CB-CB 3.85Å; D283-L286 PolarHBondContact O-N 3.07Å; D283-L286 PolarHBondContact OD1-N 2.98Å; D283-L287 WeakPolarHBondContact O-CB 3.39Å; D283-L287 PolarHBondContact O-N 3.35Å
284	P	68.9	Low	76.2	Confident	70 Å²	70	52.8 Å²	52.8	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-68.4	-28.6	-174.8	28.8	-35	0	0	0	112.7	H282 E288 A1457	H282-P284 VanDerWaalsContact O-CD 3.31Å; H282-P284 WeakPolarHBondContact O-CD 3.45Å; P284-E288 WeakPolarHBondContact O-CB 3.32Å; P284-E288 PolarHBondContact O-N 3.08Å; P284-E288 VanDerWaalsContact O-N 3.1Å; P284-A1457 HydrophobicContact CB-CB 3.84Å
285	V	75.2	Confident	76.3	Confident	82 Å²	82	43.5 Å²	43.5	50%	0.497	23%	0.228	S	C	.	.	H	α-helix	trans	-77.3	-38.8	-179	-176.2	0	0	0	0	110.2	D283 R289	D283-V285 VanDerWaalsContact C-N 3.29Å; D283-V285 PolarHBondContact O-N 3.33Å; D283-V285 WeakPolarHBondContact OD1-CA 3.45Å; D283-V285 WeakPolarHBondContact OD1-CB 3.41Å; D283-V285 PolarHBondContact OD1-N 3.22Å; V285-R289 WeakPolarHBondContact O-CG 3.37Å; V285-R289 PolarHBondContact O-N 3.33Å
286	L	76.4	Confident	76.4	Confident	25 Å²	25	45.8 Å²	45.8	13%	0.131	24%	0.239	C	C	.	.	H	α-helix	trans	-69	-43.5	174.1	-171.2	151	0	0	0	111.3	D283 R289 C290 I360	D283-L286 HydrophobicContact CB-CB 3.85Å; D283-L286 PolarHBondContact O-N 3.07Å; D283-L286 PolarHBondContact OD1-N 2.98Å; L286-R289 PolarHBondContact O-N 3.45Å; L286-C290 PolarHBondContact O-N 2.86Å; L286-C290 PolarHBondContact O-SG 3.34Å; L286-I360 HydrophobicContact CD2-CD1 3.75Å; L286-I360 HydrophobicContact CD2-CG1 3.97Å
287	L	76.2	Confident	76.6	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-63.3	-41.7	179	-177.5	60.4	0	0	0	112	D283 R289 C290 L291 L364 A1457 Q1458	D283-L287 WeakPolarHBondContact O-CB 3.39Å; D283-L287 PolarHBondContact O-N 3.35Å; L287-R289 VanDerWaalsContact C-N 3.35Å; L287-R289 PolarHBondContact O-N 2.83Å; L287-C290 PolarHBondContact O-N 3.05Å; L287-L291 HydrophobicContact CG-CD1 4.21Å; L287-L291 WeakPolarHBondContact O-CB 3.36Å; L287-L291 PolarHBondContact O-N 3.2Å; L287-L364 HydrophobicContact CD1-CD2 4.48Å; L287-A1457 HydrophobicContact CD2-CB 4.06Å; L287-Q1458 HydrophobicContact CD2-CG 4.43Å
288	E	75.6	Confident	76.5	Confident	105 Å²	105	45 Å²	45	49%	0.491	23%	0.229	S	C	.	.	H	α-helix	trans	-65.3	-35.8	178.4	-174.6	146.4	-114	0	0	112.8	P284 L291 H292 K1460	P284-E288 WeakPolarHBondContact O-CB 3.32Å; P284-E288 PolarHBondContact O-N 3.08Å; P284-E288 VanDerWaalsContact O-N 3.1Å; E288-L291 PolarHBondContact O-N 2.94Å; E288-H292 PolarHBondContact O-N 3.04Å; E288-K1460 IonicContact OE1-NZ 2.74Å; E288-K1460 PolarHBondContact OE1-NZ 3.11Å
289	R	78.9	Confident	76.5	Confident	158 Å²	158	48.5 Å²	48.5	60%	0.596	25%	0.248	S	C	*	.	H	α-helix	trans	-66.4	-42.1	172.9	-68.8	172.8	-173.9	-167.4	2.5	112.3	V285 L286 L287 H292 I356	V285-R289 WeakPolarHBondContact O-CG 3.37Å; V285-R289 PolarHBondContact O-N 3.33Å; L286-R289 PolarHBondContact O-N 3.45Å; L287-R289 VanDerWaalsContact C-N 3.35Å; L287-R289 PolarHBondContact O-N 2.83Å; R289-H292 PolarHBondContact O-N 3.49Å; R289-I356 HydrophobicContact CB-CD1 4.24Å; R289-I356 HydrophobicContact CB-CG2 4.36Å
290	C	80.4	Confident	76.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.6	-40.5	175.8	-63.3	0	0	0	0	111.5	L286 L287 H292 V293 I294 L353 L364	L286-C290 PolarHBondContact O-N 2.86Å; L286-C290 PolarHBondContact O-SG 3.34Å; L287-C290 PolarHBondContact O-N 3.05Å; C290-H292 VanDerWaalsContact C-N 3.28Å; C290-H292 PolarHBondContact O-N 3.48Å; C290-V293 PolarHBondContact O-N 3.02Å; C290-I294 VanDerWaalsContact O-CG1 3.28Å; C290-I294 WeakPolarHBondContact O-CG1 3.49Å; C290-I294 PolarHBondContact O-N 3.27Å; C290-L353 HydrophobicContact CB-CD2 4.01Å; C290-L364 HydrophobicContact CB-CD1 4.19Å
291	L	77.1	Confident	76.3	Confident	17 Å²	17	52.1 Å²	52.1	9%	0.089	28%	0.277	C	S	.	.	H	α-helix	trans	-59.7	-32.2	176.9	-93.2	170.5	0	0	0	114.1	L287 E288 G295 L1461 K1464	L287-L291 HydrophobicContact CG-CD1 4.21Å; L287-L291 WeakPolarHBondContact O-CB 3.36Å; L287-L291 PolarHBondContact O-N 3.2Å; E288-L291 PolarHBondContact O-N 2.94Å; L291-G295 PolarHBondContact O-N 3.19Å; L291-L1461 HydrophobicContact CD1-CB 4.44Å; L291-L1461 HydrophobicContact CD2-CD1 3.58Å; L291-L1461 HydrophobicContact CG-CD1 4.3Å; L291-K1464 HydrophobicContact CD2-CD 4.32Å
292	H	79.8	Confident	76.2	Confident	128 Å²	128	55.5 Å²	55.5	59%	0.593	29%	0.288	S	S	*	.	H	α-helix	trans	-66.6	-51.7	174.2	-174.3	-12.6	0	0	0	110.7	E288 R289 C290 I294 G295 D296	E288-H292 PolarHBondContact O-N 3.04Å; R289-H292 PolarHBondContact O-N 3.49Å; C290-H292 VanDerWaalsContact C-N 3.28Å; C290-H292 PolarHBondContact O-N 3.48Å; H292-I294 VanDerWaalsContact C-N 3.32Å; H292-I294 PolarHBondContact O-N 3.46Å; H292-G295 PolarHBondContact O-N 3.1Å; H292-G295 VanDerWaalsContact O-N 3.13Å; H292-D296 IonicContact CE1-OD1 3.87Å; H292-D296 IonicContact CE1-OD2 3.36Å; H292-D296 PolarHBondContact CE1-OD2 3.07Å; H292-D296 IonicContact ND1-OD1 2.68Å; H292-D296 IonicContact ND1-OD2 3.19Å; H292-D296 PolarHBondContact ND1-OD2 2.62Å; H292-D296 PolarHBondContact O-N 2.87Å
293	V	80.2	Confident	76.1	Confident	23 Å²	23	55.8 Å²	55.8	14%	0.139	30%	0.3	C	S	.	.	H	α-helix	trans	-64.1	-35.9	-178.9	176.4	0	0	0	0	111.8	C290 G295 D296 L297 A352 L353 I356	C290-V293 PolarHBondContact O-N 3.02Å; V293-G295 VanDerWaalsContact C-N 3.34Å; V293-G295 PolarHBondContact O-N 2.82Å; V293-D296 PolarHBondContact O-N 3.32Å; V293-L297 HydrophobicContact CG1-CD1 4.1Å; V293-L297 HydrophobicContact CG1-CG 4.45Å; V293-L297 WeakPolarHBondContact O-CG 3.45Å; V293-L297 PolarHBondContact O-N 3.17Å; V293-A352 HydrophobicContact CG1-CB 3.62Å; V293-A352 HydrophobicContact CG2-CB 4.18Å; V293-L353 HydrophobicContact CB-CD2 3.81Å; V293-L353 HydrophobicContact CB-CG 4.43Å; V293-L353 HydrophobicContact CG1-CD2 3.8Å; V293-L353 HydrophobicContact CG1-CG 3.85Å; V293-L353 HydrophobicContact CG2-CD2 4.49Å; V293-I356 HydrophobicContact CG2-CD1 3.7Å
294	I	80.8	Confident	75.8	Confident	17 Å²	17	60.5 Å²	60.5	9%	0.087	33%	0.325	C	S	.	.	H	α-helix	trans	-62.1	-41.8	174.5	-68.1	163.3	0	0	0	110.8	C290 H292 D296 L297 E298 L353 L364	C290-I294 VanDerWaalsContact O-CG1 3.28Å; C290-I294 WeakPolarHBondContact O-CG1 3.49Å; C290-I294 PolarHBondContact O-N 3.27Å; H292-I294 VanDerWaalsContact C-N 3.32Å; H292-I294 PolarHBondContact O-N 3.46Å; I294-D296 VanDerWaalsContact C-N 3.29Å; I294-D296 PolarHBondContact O-N 3.38Å; I294-L297 PolarHBondContact O-N 3.48Å; I294-L297 VanDerWaalsContact O-N 3.16Å; I294-E298 HydrophobicContact CG2-CG 4.3Å; I294-E298 WeakPolarHBondContact CG2-OE1 3.49Å; I294-E298 WeakPolarHBondContact O-CG 3.35Å; I294-E298 PolarHBondContact O-N 2.94Å; I294-L353 HydrophobicContact CG1-CD1 4.5Å; I294-L364 HydrophobicContact CD1-CD1 4.21Å; I294-L364 HydrophobicContact CD1-CD2 4.17Å
295	G	78.3	Confident	76.3	Confident	19 Å²	19	59 Å²	59	20%	0.196	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-37.1	175.8	0	0	0	0	0	113.3	L291 H292 V293 N299	L291-G295 PolarHBondContact O-N 3.19Å; H292-G295 PolarHBondContact O-N 3.1Å; H292-G295 VanDerWaalsContact O-N 3.13Å; V293-G295 VanDerWaalsContact C-N 3.34Å; V293-G295 PolarHBondContact O-N 2.82Å; G295-N299 PolarHBondContact O-N 3.34Å; G295-N299 PolarHBondContact O-ND2 3.31Å; G295-N299 VanDerWaalsContact O-ND2 3.11Å
296	D	79.3	Confident	76.4	Confident	89 Å²	89	56.1 Å²	56.1	48%	0.476	29%	0.291	S	S	.	.	H	α-helix	trans	-69.8	-38.3	175.6	-56.5	-37.9	0	0	0	111.6	H292 V293 I294 S300	H292-D296 IonicContact CE1-OD1 3.87Å; H292-D296 IonicContact CE1-OD2 3.36Å; H292-D296 PolarHBondContact CE1-OD2 3.07Å; H292-D296 IonicContact ND1-OD1 2.68Å; H292-D296 IonicContact ND1-OD2 3.19Å; H292-D296 PolarHBondContact ND1-OD2 2.62Å; H292-D296 PolarHBondContact O-N 2.87Å; V293-D296 PolarHBondContact O-N 3.32Å; I294-D296 VanDerWaalsContact C-N 3.29Å; I294-D296 PolarHBondContact O-N 3.38Å; D296-S300 PolarHBondContact O-N 3.1Å
297	L	80.6	Confident	76.4	Confident	31 Å²	31	57.6 Å²	57.6	16%	0.162	30%	0.297	C	S	.	.	H	α-helix	trans	-68.2	-40.9	175.4	-68.4	168	0	0	0	112.6	V293 I294 N299 S300 V301 I347 L353	V293-L297 HydrophobicContact CG1-CD1 4.1Å; V293-L297 HydrophobicContact CG1-CG 4.45Å; V293-L297 WeakPolarHBondContact O-CG 3.45Å; V293-L297 PolarHBondContact O-N 3.17Å; I294-L297 PolarHBondContact O-N 3.48Å; I294-L297 VanDerWaalsContact O-N 3.16Å; L297-N299 VanDerWaalsContact C-N 3.28Å; L297-N299 PolarHBondContact O-N 3.41Å; L297-S300 CarbonylContact O-C 3.5Å; L297-S300 WeakPolarHBondContact O-CA 3.45Å; L297-S300 WeakPolarHBondContact O-CB 3.19Å; L297-S300 PolarHBondContact O-N 2.92Å; L297-V301 WeakPolarHBondContact O-CG2 3.38Å; L297-V301 PolarHBondContact O-N 3.42Å; L297-I347 HydrophobicContact CD1-CG1 4.17Å; L297-L353 HydrophobicContact CD1-CD1 4.4Å
298	E	73.7	Confident	76.6	Confident	26 Å²	26	63 Å²	63	12%	0.121	33%	0.326	C	S	.	.	H	α-helix	trans	-57.9	-41.8	175.8	-77.1	179.2	-146	0	0	111.7	I294 S300 V301 R302 L343 H1468	I294-E298 HydrophobicContact CG2-CG 4.3Å; I294-E298 WeakPolarHBondContact CG2-OE1 3.49Å; I294-E298 WeakPolarHBondContact O-CG 3.35Å; I294-E298 PolarHBondContact O-N 2.94Å; E298-S300 VanDerWaalsContact C-N 3.32Å; E298-S300 PolarHBondContact O-N 2.85Å; E298-V301 PolarHBondContact O-N 3.18Å; E298-R302 WeakPolarHBondContact O-CG 3.38Å; E298-R302 PolarHBondContact O-N 2.9Å; E298-R302 VanDerWaalsContact O-N 3.15Å; E298-L343 HydrophobicContact CG-CD1 3.82Å; E298-L343 HydrophobicContact CG-CD2 4.11Å; E298-H1468 IonicContact OE2-CE1 3.09Å; E298-H1468 IonicContact OE2-CG 2.78Å; E298-H1468 IonicContact OE2-ND1 3.21Å; E298-H1468 PolarHBondContact OE2-ND1 3.35Å
299	N	76.3	Confident	77	Confident	105 Å²	105	59.8 Å²	59.8	56%	0.561	31%	0.31	S	S	*	.	H	α-helix	trans	-62.7	-38.2	174.3	-69.8	-33.6	0	0	0	111.8	G295 L297 V301	G295-N299 PolarHBondContact O-N 3.34Å; G295-N299 PolarHBondContact O-ND2 3.31Å; G295-N299 VanDerWaalsContact O-ND2 3.11Å; L297-N299 VanDerWaalsContact C-N 3.28Å; L297-N299 PolarHBondContact O-N 3.41Å; N299-V301 VanDerWaalsContact C-N 3.32Å; N299-V301 PolarHBondContact O-N 3.05Å
300	S	73.7	Confident	77	Confident	99 Å²	99	52.9 Å²	52.9	69%	0.692	29%	0.285	S	S	*	.	H	α-helix	trans	-70.3	-24.2	175.3	-169.7	0	0	0	0	114	D296 L297 E298	D296-S300 PolarHBondContact O-N 3.1Å; L297-S300 CarbonylContact O-C 3.5Å; L297-S300 WeakPolarHBondContact O-CA 3.45Å; L297-S300 WeakPolarHBondContact O-CB 3.19Å; L297-S300 PolarHBondContact O-N 2.92Å; E298-S300 VanDerWaalsContact C-N 3.32Å; E298-S300 PolarHBondContact O-N 2.85Å
301	V	74.6	Confident	77.1	Confident	15 Å²	15	58.1 Å²	58.1	9%	0.091	31%	0.309	C	S	.	.	H	α-helix	trans	-89.3	-16.7	-179.8	175	0	0	0	0	112.4	L297 E298 N299 G303 W305 Y339 R342 L343 A346	L297-V301 WeakPolarHBondContact O-CG2 3.38Å; L297-V301 PolarHBondContact O-N 3.42Å; E298-V301 PolarHBondContact O-N 3.18Å; N299-V301 VanDerWaalsContact C-N 3.32Å; N299-V301 PolarHBondContact O-N 3.05Å; V301-G303 PolarHBondContact O-N 2.82Å; V301-W305 PolarHBondContact O-NE1 3.43Å; V301-Y339 HydrophobicContact CB-CE2 4.31Å; V301-Y339 HydrophobicContact CG1-CD2 3.86Å; V301-Y339 HydrophobicContact CG1-CE2 3.73Å; V301-R342 HydrophobicContact CG1-CB 3.78Å; V301-L343 HydrophobicContact CG2-CD1 4.41Å; V301-A346 HydrophobicContact CG2-CB 3.68Å
302	R	70	Confident	77.6	Confident	86 Å²	86	64.7 Å²	64.7	33%	0.325	33%	0.334	S	S	.	.			trans	-72.2	1.8	178.6	-85	174.9	174.3	-101.4	4.4	116.1	E298 Y339 I1471 D1475	E298-R302 WeakPolarHBondContact O-CG 3.38Å; E298-R302 PolarHBondContact O-N 2.9Å; E298-R302 VanDerWaalsContact O-N 3.15Å; R302-Y339 HydrophobicContact CG-CE2 4.44Å; R302-I1471 VanDerWaalsContact NH2-CG2 3.32Å; R302-D1475 IonicContact CZ-OD2 2.76Å; R302-D1475 IonicContact NH1-OD2 2.77Å; R302-D1475 PolarHBondContact NH1-OD2 3.25Å
303	G	67.9	Low	77.5	Confident	36 Å²	36	59.1 Å²	59.1	37%	0.371	31%	0.309	S	S	.	.	S	Bend	trans	-62.8	173.3	-177.2	0	0	0	0	0	115.3	V301 W305	V301-G303 PolarHBondContact O-N 2.82Å; G303-W305 PolarHBondContact O-N 3.47Å
304	D	67.1	Low	77.6	Confident	136 Å²	136	59.5 Å²	59.5	73%	0.727	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-8.6	-161	-54.4	-54.6	0	0	0	117.5	F306 Q307	D304-F306 PolarHBondContact O-N 3.41Å; D304-Q307 PolarHBondContact O-N 2.87Å
305	W	80.5	Confident	77.7	Confident	38 Å²	38	61.3 Å²	61.3	14%	0.144	33%	0.326	C	S	.	.	H	α-helix	trans	-51.4	-26	-177.6	73	-94.3	0	0	0	114.6	V301 G303 Q307 D308 F309 Q338 Y339 R342	V301-W305 PolarHBondContact O-NE1 3.43Å; G303-W305 PolarHBondContact O-N 3.47Å; W305-Q307 VanDerWaalsContact C-N 3.27Å; W305-Q307 PolarHBondContact O-N 3.22Å; W305-D308 PolarHBondContact O-N 2.76Å; W305-F309 HydrophobicContact CE3-CB 3.89Å; W305-F309 HydrophobicContact CE3-CG 4.4Å; W305-F309 HydrophobicContact CZ3-CB 3.96Å; W305-F309 HydrophobicContact CZ3-CD1 4.14Å; W305-F309 AromaticContact CZ3-CG 3.98Å; W305-F309 HydrophobicContact CZ3-CG 3.98Å; W305-F309 WeakPolarHBondContact O-CB 3.34Å; W305-F309 PolarHBondContact O-N 2.98Å; W305-Q338 HydrophobicContact CH2-CB 3.79Å; W305-Q338 HydrophobicContact CZ3-CB 3.86Å; W305-Y339 HydrophobicContact CZ2-CD2 4.31Å; W305-R342 VanDerWaalsContact CD2-NH1 3.34Å
306	F	77	Confident	78	Confident	23 Å²	23	64.7 Å²	64.7	10%	0.101	34%	0.337	C	S	.	.	H	α-helix	trans	-64.2	-33.6	179.6	179.5	-102.3	0	0	0	111.8	D304 F309 K310 L1476	D304-F306 PolarHBondContact O-N 3.41Å; F306-F309 HydrophobicContact CD2-CD1 4.19Å; F306-F309 HydrophobicContact CE2-CD1 4.14Å; F306-K310 HydrophobicContact CE1-CB 4.16Å; F306-K310 HydrophobicContact CE1-CD 3.87Å; F306-K310 HydrophobicContact CE1-CG 4.27Å; F306-K310 HydrophobicContact CZ-CB 4.15Å; F306-K310 HydrophobicContact CZ-CD 4.28Å; F306-K310 HydrophobicContact CZ-CG 4.23Å; F306-K310 WeakPolarHBondContact O-CB 3.13Å; F306-K310 PolarHBondContact O-N 2.8Å; F306-L1476 HydrophobicContact CD1-CG 4.27Å; F306-L1476 HydrophobicContact CD2-CD2 4.31Å; F306-L1476 HydrophobicContact CD2-CG 4.38Å; F306-L1476 HydrophobicContact CE1-CB 4.44Å; F306-L1476 HydrophobicContact CE1-CD2 4.25Å; F306-L1476 HydrophobicContact CE1-CG 3.71Å; F306-L1476 HydrophobicContact CE2-CD2 3.52Å; F306-L1476 HydrophobicContact CE2-CG 3.84Å; F306-L1476 HydrophobicContact CZ-CB 4.37Å; F306-L1476 HydrophobicContact CZ-CD2 3.5Å; F306-L1476 VanDerWaalsContact CZ-CD2 3.5Å; F306-L1476 HydrophobicContact CZ-CG 3.49Å; F306-L1476 VanDerWaalsContact CZ-CG 3.49Å
307	Q	76.6	Confident	78.1	Confident	55 Å²	55	61.3 Å²	61.3	26%	0.257	32%	0.318	S	S	.	.	H	α-helix	trans	-66.6	-48.1	178.8	-175.8	70.5	12.9	0	0	111	D304 W305 F309 K310 E311	D304-Q307 PolarHBondContact O-N 2.87Å; W305-Q307 VanDerWaalsContact C-N 3.27Å; W305-Q307 PolarHBondContact O-N 3.22Å; Q307-F309 PolarHBondContact O-N 3.04Å; Q307-K310 WeakPolarHBondContact O-CB 3.45Å; Q307-K310 PolarHBondContact O-N 2.8Å; Q307-E311 PolarHBondContact NE2-OE1 3.28Å; Q307-E311 WeakPolarHBondContact O-CG 3.31Å; Q307-E311 PolarHBondContact O-N 3.02Å
308	D	80.7	Confident	77.9	Confident	117 Å²	117	67.6 Å²	67.6	63%	0.626	34%	0.34	S	S	*	.	H	α-helix	trans	-59.3	-46.8	176.3	-55.6	-32.3	0	0	0	111.2	W305 K310 E311 Y312	W305-D308 PolarHBondContact O-N 2.76Å; D308-K310 VanDerWaalsContact C-N 3.32Å; D308-K310 PolarHBondContact O-N 2.94Å; D308-E311 PolarHBondContact O-N 3.34Å; D308-Y312 WeakPolarHBondContact O-CB 3.45Å; D308-Y312 PolarHBondContact O-N 2.9Å
309	F	82.7	Confident	78.2	Confident	37 Å²	37	72.7 Å²	72.7	16%	0.162	37%	0.368	C	S	.	.	H	α-helix	trans	-61.2	-40.1	177.1	171	-97.7	0	0	0	112.1	W305 F306 Q307 S313 D334 Q338	W305-F309 HydrophobicContact CE3-CB 3.89Å; W305-F309 HydrophobicContact CE3-CG 4.4Å; W305-F309 HydrophobicContact CZ3-CB 3.96Å; W305-F309 HydrophobicContact CZ3-CD1 4.14Å; W305-F309 AromaticContact CZ3-CG 3.98Å; W305-F309 HydrophobicContact CZ3-CG 3.98Å; W305-F309 WeakPolarHBondContact O-CB 3.34Å; W305-F309 PolarHBondContact O-N 2.98Å; F306-F309 HydrophobicContact CD2-CD1 4.19Å; F306-F309 HydrophobicContact CE2-CD1 4.14Å; Q307-F309 PolarHBondContact O-N 3.04Å; F309-S313 WeakPolarHBondContact CE2-OG 3.48Å; F309-S313 VanDerWaalsContact CZ-OG 3.3Å; F309-S313 WeakPolarHBondContact CZ-OG 3.47Å; F309-S313 VanDerWaalsContact O-CB 3.23Å; F309-S313 WeakPolarHBondContact O-CB 3.2Å; F309-S313 PolarHBondContact O-N 2.87Å; F309-S313 PolarHBondContact O-OG 2.92Å; F309-D334 HydrophobicContact CZ-CB 4.26Å; F309-Q338 HydrophobicContact CD2-CG 4.31Å; F309-Q338 HydrophobicContact CE2-CG 3.76Å; F309-Q338 HydrophobicContact CZ-CG 3.93Å
310	K	79.7	Confident	78.4	Confident	13 Å²	13	71.5 Å²	71.5	6%	0.057	36%	0.359	C	S	.	.	H	α-helix	trans	-65.3	-44.5	177	-172.1	-168.7	92	-164.8	0	110.9	F306 Q307 D308 S313 V314 V331 Y1479 L1480	F306-K310 HydrophobicContact CE1-CB 4.16Å; F306-K310 HydrophobicContact CE1-CD 3.87Å; F306-K310 HydrophobicContact CE1-CG 4.27Å; F306-K310 HydrophobicContact CZ-CB 4.15Å; F306-K310 HydrophobicContact CZ-CD 4.28Å; F306-K310 HydrophobicContact CZ-CG 4.23Å; F306-K310 WeakPolarHBondContact O-CB 3.13Å; F306-K310 PolarHBondContact O-N 2.8Å; Q307-K310 WeakPolarHBondContact O-CB 3.45Å; Q307-K310 PolarHBondContact O-N 2.8Å; D308-K310 VanDerWaalsContact C-N 3.32Å; D308-K310 PolarHBondContact O-N 2.94Å; K310-S313 PolarHBondContact O-N 2.98Å; K310-V314 HydrophobicContact CG-CG2 4.32Å; K310-V314 VanDerWaalsContact O-CB 3.22Å; K310-V314 WeakPolarHBondContact O-CB 3.44Å; K310-V314 WeakPolarHBondContact O-CG2 3.24Å; K310-V314 PolarHBondContact O-N 3.31Å; K310-V331 HydrophobicContact CB-CG1 4.41Å; K310-V331 HydrophobicContact CG-CG1 3.88Å; K310-Y1479 PolarHBondContact NZ-O 3.46Å; K310-L1480 HydrophobicContact CD-CD2 3.81Å; K310-L1480 HydrophobicContact CD-CG 4.23Å; K310-L1480 HydrophobicContact CG-CD2 4.18Å
311	E	82.6	Confident	78.7	Confident	111 Å²	111	76 Å²	76	52%	0.519	37%	0.366	S	S	.	.	H	α-helix	trans	-68	-40.3	179.8	-71.4	-177.9	-159.5	0	0	112.1	Q307 D308 S315	Q307-E311 PolarHBondContact NE2-OE1 3.28Å; Q307-E311 WeakPolarHBondContact O-CG 3.31Å; Q307-E311 PolarHBondContact O-N 3.02Å; D308-E311 PolarHBondContact O-N 3.34Å; E311-S315 PolarHBondContact O-N 3.2Å; E311-S315 PolarHBondContact O-OG 2.84Å
312	Y	86.7	Confident	78.7	Confident	154 Å²	154	77.9 Å²	77.9	60%	0.604	37%	0.373	S	S	*	.	H	α-helix	trans	-61.6	-47.8	170.6	-178.5	-95.2	0	0	0	112.3	D308 S315 Q316	D308-Y312 WeakPolarHBondContact O-CB 3.45Å; D308-Y312 PolarHBondContact O-N 2.9Å; Y312-S315 PolarHBondContact O-N 3.42Å; Y312-S315 PolarHBondContact O-OG 3.42Å; Y312-Q316 PolarHBondContact O-N 2.98Å
313	S	79.3	Confident	79.2	Confident	11 Å²	11	76.7 Å²	76.7	8%	0.077	38%	0.378	C	S	.	.	H	α-helix	trans	-69.8	-36.1	-178.3	-56.3	0	0	0	0	112.5	F309 K310 L317	F309-S313 WeakPolarHBondContact CE2-OG 3.48Å; F309-S313 VanDerWaalsContact CZ-OG 3.3Å; F309-S313 WeakPolarHBondContact CZ-OG 3.47Å; F309-S313 VanDerWaalsContact O-CB 3.23Å; F309-S313 WeakPolarHBondContact O-CB 3.2Å; F309-S313 PolarHBondContact O-N 2.87Å; F309-S313 PolarHBondContact O-OG 2.92Å; K310-S313 PolarHBondContact O-N 2.98Å; S313-L317 VanDerWaalsContact O-CB 3.28Å; S313-L317 WeakPolarHBondContact O-CB 3.46Å; S313-L317 WeakPolarHBondContact O-CD1 3.48Å; S313-L317 WeakPolarHBondContact O-CG 3.32Å; S313-L317 PolarHBondContact O-N 3.27Å
314	V	81.8	Confident	79.5	Confident	31 Å²	31	79.9 Å²	79.9	19%	0.188	39%	0.39	C	S	.	.	H	α-helix	trans	-70.5	-34.9	176.7	168.8	0	0	0	0	111.7	K310 R318 V327 V331	K310-V314 HydrophobicContact CG-CG2 4.32Å; K310-V314 VanDerWaalsContact O-CB 3.22Å; K310-V314 WeakPolarHBondContact O-CB 3.44Å; K310-V314 WeakPolarHBondContact O-CG2 3.24Å; K310-V314 PolarHBondContact O-N 3.31Å; V314-R318 HydrophobicContact CG1-CG 4.48Å; V314-R318 VanDerWaalsContact O-CB 3.31Å; V314-R318 WeakPolarHBondContact O-CB 3.4Å; V314-R318 WeakPolarHBondContact O-CD 3.41Å; V314-R318 WeakPolarHBondContact O-CG 3.37Å; V314-R318 PolarHBondContact O-N 3.41Å; V314-R318 VanDerWaalsContact O-N 3.13Å; V314-V327 HydrophobicContact CG2-CG1 4.15Å; V314-V331 HydrophobicContact CG2-CG2 3.91Å
315	S	82.3	Confident	79.8	Confident	56 Å²	56	77.5 Å²	77.5	39%	0.392	38%	0.384	S	S	.	.	H	α-helix	trans	-67.6	-53.8	173	42.7	0	0	0	0	110.8	E311 Y312 L317 R318 D319	E311-S315 PolarHBondContact O-N 3.2Å; E311-S315 PolarHBondContact O-OG 2.84Å; Y312-S315 PolarHBondContact O-N 3.42Å; Y312-S315 PolarHBondContact O-OG 3.42Å; S315-L317 VanDerWaalsContact C-N 3.33Å; S315-L317 PolarHBondContact O-N 3.21Å; S315-R318 WeakPolarHBondContact O-CB 3.49Å; S315-R318 PolarHBondContact O-N 2.97Å; S315-D319 PolarHBondContact O-N 3.22Å
316	Q	85.5	Confident	79.6	Confident	89 Å²	89	78.1 Å²	78.1	42%	0.416	39%	0.389	S	S	.	.	H	α-helix	trans	-53.6	-45.7	177.3	-174.4	-177.9	-5.2	0	0	113	Y312 R318 D319 E320	Y312-Q316 PolarHBondContact O-N 2.98Å; Q316-R318 VanDerWaalsContact C-N 3.34Å; Q316-R318 PolarHBondContact O-N 3.06Å; Q316-D319 PolarHBondContact O-N 3.45Å; Q316-E320 PolarHBondContact O-N 3.12Å; Q316-E320 VanDerWaalsContact O-N 3.16Å
317	L	80.7	Confident	79.4	Confident	18 Å²	18	77.5 Å²	77.5	9%	0.094	39%	0.387	C	S	.	.	H	α-helix	trans	-76.4	-18	-178.8	-66.5	167.6	0	0	0	113.8	S313 S315 K322 V327 L330 V331	S313-L317 VanDerWaalsContact O-CB 3.28Å; S313-L317 WeakPolarHBondContact O-CB 3.46Å; S313-L317 WeakPolarHBondContact O-CD1 3.48Å; S313-L317 WeakPolarHBondContact O-CG 3.32Å; S313-L317 PolarHBondContact O-N 3.27Å; S315-L317 VanDerWaalsContact C-N 3.33Å; S315-L317 PolarHBondContact O-N 3.21Å; L317-K322 HydrophobicContact CD2-CD 3.78Å; L317-K322 PolarHBondContact O-N 3.31Å; L317-V327 HydrophobicContact CB-CG1 4.07Å; L317-V327 HydrophobicContact CB-CG2 4.01Å; L317-V327 HydrophobicContact CD1-CG1 4.37Å; L317-L330 HydrophobicContact CD1-CB 3.91Å; L317-L330 HydrophobicContact CD2-CD1 4.03Å; L317-V331 HydrophobicContact CD1-CG2 3.71Å
318	R	76	Confident	79.3	Confident	164 Å²	164	78.5 Å²	78.5	62%	0.619	39%	0.39	S	S	*	.	H	α-helix	trans	-75.5	-39.3	168.1	-80.8	169.8	179.5	-107.1	5.3	111.4	V314 S315 Q316 E320 K321	V314-R318 HydrophobicContact CG1-CG 4.48Å; V314-R318 VanDerWaalsContact O-CB 3.31Å; V314-R318 WeakPolarHBondContact O-CB 3.4Å; V314-R318 WeakPolarHBondContact O-CD 3.41Å; V314-R318 WeakPolarHBondContact O-CG 3.37Å; V314-R318 PolarHBondContact O-N 3.41Å; V314-R318 VanDerWaalsContact O-N 3.13Å; S315-R318 WeakPolarHBondContact O-CB 3.49Å; S315-R318 PolarHBondContact O-N 2.97Å; Q316-R318 VanDerWaalsContact C-N 3.34Å; Q316-R318 PolarHBondContact O-N 3.06Å; R318-E320 PolarHBondContact O-N 2.98Å; R318-K321 WeakPolarHBondContact O-CA 3.15Å; R318-K321 PolarHBondContact O-N 2.89Å
319	D	81	Confident	78.9	Confident	133 Å²	133	80.2 Å²	80.2	71%	0.711	39%	0.388	S	S	*	.	H	α-helix	trans	-63.9	-33.4	175.3	-63.8	-25.4	0	0	0	111.3	S315 Q316 K321	S315-D319 PolarHBondContact O-N 3.22Å; Q316-D319 PolarHBondContact O-N 3.45Å; D319-K321 PolarHBondContact O-N 2.84Å
320	E	80.4	Confident	78.7	Confident	80 Å²	80	79.7 Å²	79.7	37%	0.374	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	3.8	169.2	-68.5	-175.4	174.6	0	0	114.8	Q316 R318 K322	Q316-E320 PolarHBondContact O-N 3.12Å; Q316-E320 VanDerWaalsContact O-N 3.16Å; R318-E320 PolarHBondContact O-N 2.98Å; E320-K322 VanDerWaalsContact C-N 3.28Å; E320-K322 HydrophobicContact CB-CD 4.36Å; E320-K322 PolarHBondContact O-N 3.01Å; E320-K322 WeakPolarHBondContact OE2-CE 3.23Å; E320-K322 IonicContact OE2-NZ 3.94Å; E320-K322 PolarHBondContact OE2-NZ 3.4Å
321	K	78.6	Confident	78.7	Confident	193 Å²	193	79.1 Å²	79.1	84%	0.839	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	27.8	177.1	-58.6	-175	178.9	-179.4	0	116	R318 D319	R318-K321 WeakPolarHBondContact O-CA 3.15Å; R318-K321 PolarHBondContact O-N 2.89Å; D319-K321 PolarHBondContact O-N 2.84Å
322	K	76.2	Confident	78.3	Confident	55 Å²	55	74.9 Å²	74.9	24%	0.239	37%	0.365	C	S	.	.			trans	-73.7	153.7	178.7	-74.6	164.4	173.4	166.7	0	112.5	L317 E320 V327 L330	L317-K322 HydrophobicContact CD2-CD 3.78Å; L317-K322 PolarHBondContact O-N 3.31Å; E320-K322 VanDerWaalsContact C-N 3.28Å; E320-K322 HydrophobicContact CB-CD 4.36Å; E320-K322 PolarHBondContact O-N 3.01Å; E320-K322 WeakPolarHBondContact OE2-CE 3.23Å; E320-K322 IonicContact OE2-NZ 3.94Å; E320-K322 PolarHBondContact OE2-NZ 3.4Å; K322-V327 HydrophobicContact CB-CG2 3.87Å; K322-L330 HydrophobicContact CD-CD1 3.84Å
323	S	79	Confident	77.7	Confident	60 Å²	60	70.8 Å²	70.8	42%	0.42	35%	0.353	S	S	.	.			trans	-66.8	145.5	179.5	70	0	0	0	0	111.7	S325 E326 V327	S323-S325 VanDerWaalsContact C-N 3.26Å; S323-S325 PolarHBondContact O-N 3.43Å; S323-E326 CarbonylContact O-C 3.59Å; S323-E326 WeakPolarHBondContact O-CA 3.05Å; S323-E326 WeakPolarHBondContact O-CB 3.49Å; S323-E326 PolarHBondContact O-N 3.49Å; S323-E326 WeakPolarHBondContact OG-CB 3.47Å; S323-V327 WeakPolarHBondContact O-CG2 3.22Å; S323-V327 PolarHBondContact O-N 3.05Å
324	V	74.7	Confident	77.6	Confident	104 Å²	104	73.1 Å²	73.1	63%	0.63	37%	0.365	S	S	*	.	H	α-helix	trans	-59.8	-34.7	-171.6	-179.5	0	0	0	0	113	K328	V324-K328 PolarHBondContact O-N 3.02Å
325	S	73.6	Confident	77.5	Confident	86 Å²	86	71.8 Å²	71.8	60%	0.601	36%	0.357	S	S	*	.	H	α-helix	trans	-67.6	-39	173.6	44	0	0	0	0	112.5	S323 K328 R329	S323-S325 VanDerWaalsContact C-N 3.26Å; S323-S325 PolarHBondContact O-N 3.43Å; S325-K328 PolarHBondContact O-N 3.22Å; S325-R329 PolarHBondContact O-N 3.02Å
326	E	75.8	Confident	77.2	Confident	50 Å²	50	72.2 Å²	72.2	23%	0.234	35%	0.354	C	S	.	.	H	α-helix	trans	-71.8	-37.9	175.7	-176.3	167.5	-147.7	0	0	112.4	S323 R329 L330 F1521	S323-E326 CarbonylContact O-C 3.59Å; S323-E326 WeakPolarHBondContact O-CA 3.05Å; S323-E326 WeakPolarHBondContact O-CB 3.49Å; S323-E326 PolarHBondContact O-N 3.49Å; S323-E326 WeakPolarHBondContact OG-CB 3.47Å; E326-R329 PolarHBondContact O-N 3.46Å; E326-L330 HydrophobicContact CG-CD1 4.06Å; E326-L330 HydrophobicContact CG-CG 4.36Å; E326-L330 WeakPolarHBondContact O-CB 3.39Å; E326-L330 WeakPolarHBondContact O-CG 3.47Å; E326-L330 PolarHBondContact O-N 2.88Å; E326-F1521 WeakPolarHBondContact OE1-CE2 3.48Å
327	V	74.1	Confident	76.9	Confident	10 Å²	10	73.1 Å²	73.1	6%	0.061	36%	0.356	C	S	.	.	H	α-helix	trans	-57.5	-49.8	169.5	177.1	0	0	0	0	109.8	V314 L317 K322 S323 R329 L330 V331	V314-V327 HydrophobicContact CG2-CG1 4.15Å; L317-V327 HydrophobicContact CB-CG1 4.07Å; L317-V327 HydrophobicContact CB-CG2 4.01Å; L317-V327 HydrophobicContact CD1-CG1 4.37Å; K322-V327 HydrophobicContact CB-CG2 3.87Å; S323-V327 WeakPolarHBondContact O-CG2 3.22Å; S323-V327 PolarHBondContact O-N 3.05Å; V327-R329 VanDerWaalsContact C-N 3.31Å; V327-R329 PolarHBondContact O-N 3.05Å; V327-L330 PolarHBondContact O-N 3.38Å; V327-V331 HydrophobicContact CG1-CG2 4.11Å; V327-V331 WeakPolarHBondContact O-CB 3.42Å; V327-V331 WeakPolarHBondContact O-CG2 3.46Å; V327-V331 PolarHBondContact O-N 2.79Å
328	K	74.1	Confident	76.7	Confident	77 Å²	77	75.6 Å²	75.6	34%	0.335	37%	0.367	S	S	.	.	H	α-helix	trans	-56.6	-42.5	174.9	-79.1	-164.8	173.3	-174.4	0	112.1	V324 S325 L332 L1480 D1481	V324-K328 PolarHBondContact O-N 3.02Å; S325-K328 PolarHBondContact O-N 3.22Å; K328-L332 WeakPolarHBondContact O-CB 3.5Å; K328-L332 PolarHBondContact O-N 2.88Å; K328-L332 VanDerWaalsContact O-N 3.1Å; K328-L1480 HydrophobicContact CG-CD1 4.34Å; K328-L1480 HydrophobicContact CG-CD2 4.35Å; K328-D1481 IonicContact NZ-OD1 3.52Å; K328-D1481 PolarHBondContact NZ-OD1 3.02Å
329	R	72.5	Confident	77	Confident	152 Å²	152	69.5 Å²	69.5	57%	0.574	35%	0.345	S	S	*	.	H	α-helix	trans	-65.3	-46.1	178.6	-168.7	-179.2	75.7	123.2	-3.5	112.8	S325 E326 V327 L332 L333	S325-R329 PolarHBondContact O-N 3.02Å; E326-R329 PolarHBondContact O-N 3.46Å; V327-R329 VanDerWaalsContact C-N 3.31Å; V327-R329 PolarHBondContact O-N 3.05Å; R329-L332 PolarHBondContact O-N 3.31Å; R329-L333 WeakPolarHBondContact O-CB 3.33Å; R329-L333 PolarHBondContact O-N 3.44Å
330	L	77.4	Confident	76.9	Confident	26 Å²	26	64.4 Å²	64.4	14%	0.136	32%	0.321	C	S	.	.	H	α-helix	trans	-68.3	-43.1	-178.8	-69.7	173.6	0	0	0	111.5	L317 K322 E326 V327 L332 L333 D334	L317-L330 HydrophobicContact CD1-CB 3.91Å; L317-L330 HydrophobicContact CD2-CD1 4.03Å; K322-L330 HydrophobicContact CD-CD1 3.84Å; E326-L330 HydrophobicContact CG-CD1 4.06Å; E326-L330 HydrophobicContact CG-CG 4.36Å; E326-L330 WeakPolarHBondContact O-CB 3.39Å; E326-L330 WeakPolarHBondContact O-CG 3.47Å; E326-L330 PolarHBondContact O-N 2.88Å; V327-L330 PolarHBondContact O-N 3.38Å; L330-L332 VanDerWaalsContact C-N 3.32Å; L330-L332 PolarHBondContact O-N 2.88Å; L330-L333 PolarHBondContact O-N 3.37Å; L330-D334 PolarHBondContact O-N 3.27Å
331	V	79.5	Confident	77.1	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.006	32%	0.324	C	S	.	.	H	α-helix	trans	-62.4	-38.1	176.4	175	0	0	0	0	111.8	K310 V314 L317 V327 G335	K310-V331 HydrophobicContact CB-CG1 4.41Å; K310-V331 HydrophobicContact CG-CG1 3.88Å; V314-V331 HydrophobicContact CG2-CG2 3.91Å; L317-V331 HydrophobicContact CD1-CG2 3.71Å; V327-V331 HydrophobicContact CG1-CG2 4.11Å; V327-V331 WeakPolarHBondContact O-CB 3.42Å; V327-V331 WeakPolarHBondContact O-CG2 3.46Å; V327-V331 PolarHBondContact O-N 2.79Å; V331-G335 WeakPolarHBondContact O-CA 3.16Å; V331-G335 PolarHBondContact O-N 2.92Å
332	L	75	Confident	77.3	Confident	23 Å²	23	60.1 Å²	60.1	12%	0.12	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-50.6	172.2	-168.5	89.4	0	0	0	111	K328 R329 L330 G335 M336 L1476	K328-L332 WeakPolarHBondContact O-CB 3.5Å; K328-L332 PolarHBondContact O-N 2.88Å; K328-L332 VanDerWaalsContact O-N 3.1Å; R329-L332 PolarHBondContact O-N 3.31Å; L330-L332 VanDerWaalsContact C-N 3.32Å; L330-L332 PolarHBondContact O-N 2.88Å; L332-G335 PolarHBondContact O-N 3.5Å; L332-M336 WeakPolarHBondContact O-CG 3.39Å; L332-M336 PolarHBondContact O-N 3.17Å; L332-L1476 HydrophobicContact CD1-CB 3.7Å; L332-L1476 HydrophobicContact CD1-CD2 3.76Å; L332-L1476 HydrophobicContact CD1-CG 4.38Å; L332-L1476 HydrophobicContact CG-CD2 4.42Å
333	L	74.1	Confident	77.7	Confident	68 Å²	68	58.6 Å²	58.6	36%	0.356	30%	0.296	S	S	.	.	H	α-helix	trans	-68.5	-43.5	-172.3	-162.6	158.2	0	0	0	111.9	R329 L330 M336 K337	R329-L333 WeakPolarHBondContact O-CB 3.33Å; R329-L333 PolarHBondContact O-N 3.44Å; L330-L333 PolarHBondContact O-N 3.37Å; L333-M336 PolarHBondContact O-N 3.29Å; L333-K337 HydrophobicContact CD2-CD 4.44Å; L333-K337 VanDerWaalsContact CD2-CE 3.41Å; L333-K337 VanDerWaalsContact CD2-NZ 3.33Å; L333-K337 PolarHBondContact O-N 3.46Å
334	D	77.3	Confident	78	Confident	60 Å²	60	57.1 Å²	57.1	32%	0.321	28%	0.282	S	S	.	.	H	α-helix	trans	-75.5	-28.4	175	-67.5	-32	0	0	0	112.2	F309 L330 K337 Q338	F309-D334 HydrophobicContact CZ-CB 4.26Å; L330-D334 PolarHBondContact O-N 3.27Å; D334-K337 PolarHBondContact O-N 3.25Å; D334-K337 WeakPolarHBondContact OD1-CD 3.44Å; D334-K337 IonicContact OD1-NZ 3.6Å; D334-K337 PolarHBondContact OD1-NZ 3.01Å; D334-Q338 WeakPolarHBondContact O-CG 3.43Å; D334-Q338 PolarHBondContact O-N 3.25Å
335	G	79.6	Confident	78.5	Confident	2 Å²	2	55.2 Å²	55.2	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-44.6	168.5	0	0	0	0	0	112.7	V331 L332 Q338 Y339	V331-G335 WeakPolarHBondContact O-CA 3.16Å; V331-G335 PolarHBondContact O-N 2.92Å; L332-G335 PolarHBondContact O-N 3.5Å; G335-Q338 PolarHBondContact O-N 2.69Å; G335-Y339 WeakPolarHBondContact O-CB 3.37Å; G335-Y339 PolarHBondContact O-N 2.95Å
336	M	76	Confident	79	Confident	65 Å²	65	52.1 Å²	52.1	32%	0.32	25%	0.248	S	C	.	.	H	α-helix	trans	-64.6	-38.1	174.3	-69.8	-169.6	-54.6	0	0	112.3	L332 L333 Y339 A340 V1473	L332-M336 WeakPolarHBondContact O-CG 3.39Å; L332-M336 PolarHBondContact O-N 3.17Å; L333-M336 PolarHBondContact O-N 3.29Å; M336-Y339 PolarHBondContact O-N 3.43Å; M336-A340 WeakPolarHBondContact O-CB 3.32Å; M336-A340 PolarHBondContact O-N 3.11Å; M336-V1473 HydrophobicContact SD-CG2 4.06Å
337	K	78.5	Confident	79.4	Confident	108 Å²	108	50.3 Å²	50.3	47%	0.47	24%	0.239	S	C	.	.	H	α-helix	trans	-60.7	-46.8	171.6	-69.2	173.2	-169.8	151.2	0	111.8	L333 D334 A340 I341	L333-K337 HydrophobicContact CD2-CD 4.44Å; L333-K337 VanDerWaalsContact CD2-CE 3.41Å; L333-K337 VanDerWaalsContact CD2-NZ 3.33Å; L333-K337 PolarHBondContact O-N 3.46Å; D334-K337 PolarHBondContact O-N 3.25Å; D334-K337 WeakPolarHBondContact OD1-CD 3.44Å; D334-K337 IonicContact OD1-NZ 3.6Å; D334-K337 PolarHBondContact OD1-NZ 3.01Å; K337-A340 PolarHBondContact O-N 2.88Å; K337-I341 VanDerWaalsContact O-CG1 3.28Å; K337-I341 WeakPolarHBondContact O-CG1 3.37Å; K337-I341 PolarHBondContact O-N 3.34Å
338	Q	78.5	Confident	79.9	Confident	70 Å²	70	55.7 Å²	55.7	33%	0.327	26%	0.259	S	S	.	.	H	α-helix	trans	-64.9	-38.3	178.9	-72.1	-66.6	-19.8	0	0	112.1	W305 F309 D334 G335 R342	W305-Q338 HydrophobicContact CH2-CB 3.79Å; W305-Q338 HydrophobicContact CZ3-CB 3.86Å; F309-Q338 HydrophobicContact CD2-CG 4.31Å; F309-Q338 HydrophobicContact CE2-CG 3.76Å; F309-Q338 HydrophobicContact CZ-CG 3.93Å; D334-Q338 WeakPolarHBondContact O-CG 3.43Å; D334-Q338 PolarHBondContact O-N 3.25Å; G335-Q338 PolarHBondContact O-N 2.69Å; Q338-R342 WeakPolarHBondContact O-CB 3.31Å; Q338-R342 WeakPolarHBondContact O-CD 3.23Å; Q338-R342 VanDerWaalsContact O-CG 3.23Å; Q338-R342 WeakPolarHBondContact O-CG 3.45Å; Q338-R342 PolarHBondContact O-N 3.05Å
339	Y	81.4	Confident	80.5	Confident	37 Å²	37	59.6 Å²	59.6	15%	0.145	28%	0.278	C	S	.	.	H	α-helix	trans	-62.1	-47.5	171.9	178.8	-100.2	0	0	0	111.6	V301 R302 W305 G335 M336 I341 R342 L343	V301-Y339 HydrophobicContact CB-CE2 4.31Å; V301-Y339 HydrophobicContact CG1-CD2 3.86Å; V301-Y339 HydrophobicContact CG1-CE2 3.73Å; R302-Y339 HydrophobicContact CG-CE2 4.44Å; W305-Y339 HydrophobicContact CZ2-CD2 4.31Å; G335-Y339 WeakPolarHBondContact O-CB 3.37Å; G335-Y339 PolarHBondContact O-N 2.95Å; M336-Y339 PolarHBondContact O-N 3.43Å; Y339-I341 PolarHBondContact O-N 3.38Å; Y339-R342 PolarHBondContact O-N 3.27Å; Y339-L343 HydrophobicContact CE1-CD2 4Å; Y339-L343 VanDerWaalsContact O-CB 3.31Å; Y339-L343 WeakPolarHBondContact O-CB 3.38Å; Y339-L343 PolarHBondContact O-N 3.36Å
340	A	79.2	Confident	80.9	Confident	26 Å²	26	53 Å²	53	22%	0.215	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-42.4	177.9	0	0	0	0	0	112.5	M336 K337 L343 F344	M336-A340 WeakPolarHBondContact O-CB 3.32Å; M336-A340 PolarHBondContact O-N 3.11Å; K337-A340 PolarHBondContact O-N 2.88Å; A340-L343 PolarHBondContact O-N 3.43Å; A340-F344 HydrophobicContact CB-CE2 4.23Å; A340-F344 HydrophobicContact CB-CZ 4.49Å; A340-F344 WeakPolarHBondContact O-CB 3.39Å; A340-F344 WeakPolarHBondContact O-CD2 3.38Å; A340-F344 WeakPolarHBondContact O-CG 3.22Å; A340-F344 PolarHBondContact O-N 3.24Å
341	I	84.2	Confident	81	Confident	83 Å²	83	58 Å²	58	43%	0.426	28%	0.278	S	S	.	.	H	α-helix	trans	-59.6	-53.3	174.3	-68.7	162.6	0	0	0	110.3	K337 Y339 L343 F344 D345	K337-I341 VanDerWaalsContact O-CG1 3.28Å; K337-I341 WeakPolarHBondContact O-CG1 3.37Å; K337-I341 PolarHBondContact O-N 3.34Å; Y339-I341 PolarHBondContact O-N 3.38Å; I341-L343 VanDerWaalsContact C-N 3.28Å; I341-L343 PolarHBondContact O-N 3.11Å; I341-F344 PolarHBondContact O-N 3.18Å; I341-D345 PolarHBondContact O-N 3.47Å
342	R	83.1	Confident	81.1	Confident	100 Å²	100	60.2 Å²	60.2	38%	0.377	30%	0.296	S	S	.	.	H	α-helix	trans	-59.7	-37.2	179.3	-70.3	167	-178.6	-113	3.6	112.5	V301 W305 Q338 Y339 A346	V301-R342 HydrophobicContact CG1-CB 3.78Å; W305-R342 VanDerWaalsContact CD2-NH1 3.34Å; Q338-R342 WeakPolarHBondContact O-CB 3.31Å; Q338-R342 WeakPolarHBondContact O-CD 3.23Å; Q338-R342 VanDerWaalsContact O-CG 3.23Å; Q338-R342 WeakPolarHBondContact O-CG 3.45Å; Q338-R342 PolarHBondContact O-N 3.05Å; Y339-R342 PolarHBondContact O-N 3.27Å; R342-A346 VanDerWaalsContact O-CB 3.3Å; R342-A346 WeakPolarHBondContact O-CB 3.27Å; R342-A346 PolarHBondContact O-N 2.87Å
343	L	83.5	Confident	81.3	Confident	22 Å²	22	59.1 Å²	59.1	12%	0.115	29%	0.29	C	S	.	.	H	α-helix	trans	-70.1	-42.5	176.5	-176.3	59.9	0	0	0	111.9	E298 V301 Y339 A340 I341 D345 A346 I347	E298-L343 HydrophobicContact CG-CD1 3.82Å; E298-L343 HydrophobicContact CG-CD2 4.11Å; V301-L343 HydrophobicContact CG2-CD1 4.41Å; Y339-L343 HydrophobicContact CE1-CD2 4Å; Y339-L343 VanDerWaalsContact O-CB 3.31Å; Y339-L343 WeakPolarHBondContact O-CB 3.38Å; Y339-L343 PolarHBondContact O-N 3.36Å; A340-L343 PolarHBondContact O-N 3.43Å; I341-L343 VanDerWaalsContact C-N 3.28Å; I341-L343 PolarHBondContact O-N 3.11Å; L343-D345 VanDerWaalsContact C-N 3.35Å; L343-A346 PolarHBondContact O-N 2.61Å; L343-I347 HydrophobicContact CD1-CD1 4.25Å; L343-I347 HydrophobicContact CD1-CG1 4.49Å; L343-I347 HydrophobicContact CG-CD1 4.02Å; L343-I347 WeakPolarHBondContact O-CB 3.47Å; L343-I347 VanDerWaalsContact O-CG1 3.22Å; L343-I347 WeakPolarHBondContact O-CG1 3.39Å; L343-I347 PolarHBondContact O-N 3.38Å
344	F	85	Confident	81.7	Confident	30 Å²	30	61.9 Å²	61.9	13%	0.132	30%	0.301	C	S	.	.	H	α-helix	trans	-64.7	-37.8	174.7	-63.1	-28.4	0	0	0	112.2	A340 I341 I347 R348 I365 A368 K369 L372	A340-F344 HydrophobicContact CB-CE2 4.23Å; A340-F344 HydrophobicContact CB-CZ 4.49Å; A340-F344 WeakPolarHBondContact O-CB 3.39Å; A340-F344 WeakPolarHBondContact O-CD2 3.38Å; A340-F344 WeakPolarHBondContact O-CG 3.22Å; A340-F344 PolarHBondContact O-N 3.24Å; I341-F344 PolarHBondContact O-N 3.18Å; F344-I347 PolarHBondContact O-N 3.01Å; F344-R348 WeakPolarHBondContact O-CG 3.4Å; F344-R348 PolarHBondContact O-N 2.79Å; F344-I365 HydrophobicContact CB-CD1 4.09Å; F344-I365 HydrophobicContact CB-CG1 4.16Å; F344-I365 HydrophobicContact CB-CG2 4.28Å; F344-I365 HydrophobicContact CD1-CB 4.41Å; F344-I365 HydrophobicContact CD1-CG1 3.86Å; F344-I365 HydrophobicContact CD1-CG2 4.11Å; F344-I365 HydrophobicContact CD2-CG2 4.34Å; F344-I365 HydrophobicContact CG-CG1 4.22Å; F344-I365 HydrophobicContact CG-CG2 3.99Å; F344-I365 WeakPolarHBondContact O-CD1 3.43Å; F344-A368 HydrophobicContact CE1-CB 3.79Å; F344-A368 HydrophobicContact CZ-CB 4.15Å; F344-K369 HydrophobicContact CE2-CG 4.03Å; F344-K369 HydrophobicContact CZ-CG 4.21Å; F344-L372 HydrophobicContact CZ-CD1 4.22Å
345	D	85.9	Confident	82	Confident	64 Å²	64	66.4 Å²	66.4	34%	0.342	32%	0.318	S	S	.	.	H	α-helix	trans	-70.8	-38.6	175.3	-71.4	-29.2	0	0	0	112.1	I341 L343 R348 Q349	I341-D345 PolarHBondContact O-N 3.47Å; L343-D345 VanDerWaalsContact C-N 3.35Å; D345-R348 PolarHBondContact O-N 3.19Å; D345-Q349 WeakPolarHBondContact O-CB 3.3Å; D345-Q349 VanDerWaalsContact O-CG 3.27Å; D345-Q349 WeakPolarHBondContact O-CG 3.47Å; D345-Q349 PolarHBondContact O-N 2.87Å
346	A	84.6	Confident	82	Confident	21 Å²	21	69.1 Å²	69.1	17%	0.174	33%	0.331	C	S	.	.	H	α-helix	trans	-62.4	-42.1	171.4	0	0	0	0	0	112.1	V301 R342 L343 R348 Q349 S350	V301-A346 HydrophobicContact CG2-CB 3.68Å; R342-A346 VanDerWaalsContact O-CB 3.3Å; R342-A346 WeakPolarHBondContact O-CB 3.27Å; R342-A346 PolarHBondContact O-N 2.87Å; L343-A346 PolarHBondContact O-N 2.61Å; A346-R348 VanDerWaalsContact C-N 3.35Å; A346-R348 PolarHBondContact O-N 3.03Å; A346-Q349 PolarHBondContact O-N 3.41Å; A346-S350 WeakPolarHBondContact O-CB 3.38Å; A346-S350 PolarHBondContact O-N 2.81Å
347	I	84	Confident	82	Confident	11 Å²	11	67 Å²	67	6%	0.056	32%	0.323	C	S	.	.	H	α-helix	trans	-60.5	-43.2	174	-74.1	166.8	0	0	0	110.7	L297 L343 F344 S350 L353 A361 I365	L297-I347 HydrophobicContact CD1-CG1 4.17Å; L343-I347 HydrophobicContact CD1-CD1 4.25Å; L343-I347 HydrophobicContact CD1-CG1 4.49Å; L343-I347 HydrophobicContact CG-CD1 4.02Å; L343-I347 WeakPolarHBondContact O-CB 3.47Å; L343-I347 VanDerWaalsContact O-CG1 3.22Å; L343-I347 WeakPolarHBondContact O-CG1 3.39Å; L343-I347 PolarHBondContact O-N 3.38Å; F344-I347 PolarHBondContact O-N 3.01Å; I347-S350 PolarHBondContact O-N 2.67Å; I347-S350 PolarHBondContact O-OG 3.11Å; I347-L353 HydrophobicContact CB-CD1 4.5Å; I347-L353 HydrophobicContact CG2-CD1 3.84Å; I347-A361 HydrophobicContact CG2-CB 3.92Å; I347-I365 HydrophobicContact CB-CD1 4.25Å; I347-I365 HydrophobicContact CB-CG1 4.48Å; I347-I365 HydrophobicContact CG2-CD1 3.8Å; I347-I365 HydrophobicContact CG2-CG1 3.91Å
348	R	85.2	Confident	82.1	Confident	124 Å²	124	65.8 Å²	65.8	47%	0.468	33%	0.326	S	S	.	.	H	α-helix	trans	-64.1	-38.2	175.1	-82	166.6	169.1	-175.5	-6.1	113.8	F344 D345 A346 S350 E362 I365	F344-R348 WeakPolarHBondContact O-CG 3.4Å; F344-R348 PolarHBondContact O-N 2.79Å; D345-R348 PolarHBondContact O-N 3.19Å; A346-R348 VanDerWaalsContact C-N 3.35Å; A346-R348 PolarHBondContact O-N 3.03Å; R348-S350 VanDerWaalsContact C-N 3.35Å; R348-E362 IonicContact CZ-OE1 2.65Å; R348-E362 IonicContact CZ-OE2 2.73Å; R348-E362 VanDerWaalsContact CZ-OE2 3.29Å; R348-E362 IonicContact NE-OE2 2.65Å; R348-E362 PolarHBondContact NE-OE2 2.92Å; R348-E362 VanDerWaalsContact NH2-CD 3.25Å; R348-E362 IonicContact NH2-OE1 3.24Å; R348-E362 PolarHBondContact NH2-OE1 3.45Å; R348-E362 IonicContact NH2-OE2 3.37Å; R348-E362 PolarHBondContact NH2-OE2 2.97Å; R348-I365 HydrophobicContact CG-CD1 3.57Å
349	Q	85.1	Confident	82.1	Confident	158 Å²	158	64.4 Å²	64.4	74%	0.738	33%	0.331	S	S	*	.	H	α-helix	trans	-82.1	-11.7	-179	-67.6	172.8	33.6	0	0	113.4	D345 A346 E351	D345-Q349 WeakPolarHBondContact O-CB 3.3Å; D345-Q349 VanDerWaalsContact O-CG 3.27Å; D345-Q349 WeakPolarHBondContact O-CG 3.47Å; D345-Q349 PolarHBondContact O-N 2.87Å; A346-Q349 PolarHBondContact O-N 3.41Å; Q349-E351 PolarHBondContact O-N 3.2Å; Q349-E351 VanDerWaalsContact O-N 3.17Å
350	S	82.7	Confident	82.2	Confident	14 Å²	14	62.7 Å²	62.7	10%	0.098	33%	0.325	C	S	.	.			trans	-72.5	107.5	-172.9	69.1	0	0	0	0	114.3	A346 I347 R348 A352 L353 H354	A346-S350 WeakPolarHBondContact O-CB 3.38Å; A346-S350 PolarHBondContact O-N 2.81Å; I347-S350 PolarHBondContact O-N 2.67Å; I347-S350 PolarHBondContact O-OG 3.11Å; R348-S350 VanDerWaalsContact C-N 3.35Å; S350-A352 PolarHBondContact O-N 3.27Å; S350-L353 PolarHBondContact O-N 3.16Å; S350-L353 WeakPolarHBondContact OG-CB 3.39Å; S350-L353 WeakPolarHBondContact OG-CD1 3.3Å; S350-L353 WeakPolarHBondContact OG-CG 3.44Å; S350-H354 PolarHBondContact O-N 3.38Å
351	E	79.6	Confident	82.3	Confident	132 Å²	132	62.3 Å²	62.3	62%	0.617	32%	0.321	S	S	*	.	H	α-helix	trans	-57	-31.4	172.2	-69.5	-167	179.1	0	0	112.8	Q349 H354 K355	Q349-E351 PolarHBondContact O-N 3.2Å; Q349-E351 VanDerWaalsContact O-N 3.17Å; E351-H354 PolarHBondContact O-N 3.46Å; E351-K355 HydrophobicContact CB-CD 4.5Å; E351-K355 WeakPolarHBondContact O-CB 3.47Å; E351-K355 WeakPolarHBondContact O-CD 3.37Å; E351-K355 VanDerWaalsContact O-CG 3.23Å; E351-K355 WeakPolarHBondContact O-CG 3.44Å; E351-K355 PolarHBondContact O-N 3.19Å; E351-K355 WeakPolarHBondContact OE2-CE 3.34Å; E351-K355 IonicContact OE2-NZ 3.63Å; E351-K355 PolarHBondContact OE2-NZ 3.19Å
352	A	80.8	Confident	82.3	Confident	46 Å²	46	61.3 Å²	61.3	38%	0.38	32%	0.315	S	S	.	.	H	α-helix	trans	-64.2	-43	-177.9	0	0	0	0	0	112.4	V293 S350 K355 I356	V293-A352 HydrophobicContact CG1-CB 3.62Å; V293-A352 HydrophobicContact CG2-CB 4.18Å; S350-A352 PolarHBondContact O-N 3.27Å; A352-K355 PolarHBondContact O-N 3.3Å; A352-I356 WeakPolarHBondContact O-CG1 3.49Å; A352-I356 PolarHBondContact O-N 3.48Å; A352-I356 VanDerWaalsContact O-N 3.11Å
353	L	79.6	Confident	82.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-67.8	-37.4	173.6	-66.8	-177.8	0	0	0	111.4	C290 V293 I294 L297 I347 S350 K355 I356 S357 I360 L364	C290-L353 HydrophobicContact CB-CD2 4.01Å; V293-L353 HydrophobicContact CB-CD2 3.81Å; V293-L353 HydrophobicContact CB-CG 4.43Å; V293-L353 HydrophobicContact CG1-CD2 3.8Å; V293-L353 HydrophobicContact CG1-CG 3.85Å; V293-L353 HydrophobicContact CG2-CD2 4.49Å; I294-L353 HydrophobicContact CG1-CD1 4.5Å; L297-L353 HydrophobicContact CD1-CD1 4.4Å; I347-L353 HydrophobicContact CB-CD1 4.5Å; I347-L353 HydrophobicContact CG2-CD1 3.84Å; S350-L353 PolarHBondContact O-N 3.16Å; S350-L353 WeakPolarHBondContact OG-CB 3.39Å; S350-L353 WeakPolarHBondContact OG-CD1 3.3Å; S350-L353 WeakPolarHBondContact OG-CG 3.44Å; L353-K355 VanDerWaalsContact C-N 3.32Å; L353-K355 PolarHBondContact O-N 3.02Å; L353-I356 HydrophobicContact CD2-CD1 4.43Å; L353-I356 PolarHBondContact O-N 2.93Å; L353-S357 PolarHBondContact O-N 3.34Å; L353-I360 HydrophobicContact CB-CG2 4.03Å; L353-I360 WeakPolarHBondContact O-CG2 3.32Å; L353-L364 HydrophobicContact CD1-CD1 4.09Å
354	H	82.8	Confident	82.1	Confident	127 Å²	127	57 Å²	57	59%	0.588	30%	0.3	S	S	*	.	H	α-helix	trans	-62.2	-38.9	175.5	-159.8	108	0	0	0	112.2	S350 E351 S357	S350-H354 PolarHBondContact O-N 3.38Å; E351-H354 PolarHBondContact O-N 3.46Å; H354-S357 CarbonylContact O-C 3.59Å
355	K	82.3	Confident	82	Confident	154 Å²	154	55.6 Å²	55.6	67%	0.67	29%	0.294	S	S	*	.	H	α-helix	trans	-69.6	-30.1	176	-72.3	163.2	-171.5	168.5	0	113	E351 A352 L353	E351-K355 HydrophobicContact CB-CD 4.5Å; E351-K355 WeakPolarHBondContact O-CB 3.47Å; E351-K355 WeakPolarHBondContact O-CD 3.37Å; E351-K355 VanDerWaalsContact O-CG 3.23Å; E351-K355 WeakPolarHBondContact O-CG 3.44Å; E351-K355 PolarHBondContact O-N 3.19Å; E351-K355 WeakPolarHBondContact OE2-CE 3.34Å; E351-K355 IonicContact OE2-NZ 3.63Å; E351-K355 PolarHBondContact OE2-NZ 3.19Å; A352-K355 PolarHBondContact O-N 3.3Å; L353-K355 VanDerWaalsContact C-N 3.32Å; L353-K355 PolarHBondContact O-N 3.02Å
356	I	79.8	Confident	81.8	Confident	59 Å²	59	54.9 Å²	54.9	30%	0.303	29%	0.288	S	S	.	.	H	α-helix	trans	-72.3	-49.4	173.9	-69.9	165	0	0	0	111	R289 V293 A352 L353	R289-I356 HydrophobicContact CB-CD1 4.24Å; R289-I356 HydrophobicContact CB-CG2 4.36Å; V293-I356 HydrophobicContact CG2-CD1 3.7Å; A352-I356 WeakPolarHBondContact O-CG1 3.49Å; A352-I356 PolarHBondContact O-N 3.48Å; A352-I356 VanDerWaalsContact O-N 3.11Å; L353-I356 HydrophobicContact CD2-CD1 4.43Å; L353-I356 PolarHBondContact O-N 2.93Å
357	S	77.1	Confident	81.6	Confident	21 Å²	21	55.9 Å²	55.9	15%	0.147	29%	0.289	C	S	.	.	S	Bend	trans	-159.8	123.3	174.4	-162.3	0	0	0	0	111	R280 L353 H354 G359 I360	R280-S357 PolarHBondContact NH1-OG 3.49Å; L353-S357 PolarHBondContact O-N 3.34Å; H354-S357 CarbonylContact O-C 3.59Å; S357-G359 PolarHBondContact O-N 3.5Å; S357-I360 WeakPolarHBondContact O-CB 3.37Å; S357-I360 VanDerWaalsContact O-CG2 3.3Å; S357-I360 WeakPolarHBondContact O-CG2 3.45Å; S357-I360 PolarHBondContact O-N 2.7Å; S357-I360 VanDerWaalsContact O-N 3.16Å
358	P	80.1	Confident	81.4	Confident	82 Å²	82	56.8 Å²	56.8	53%	0.532	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	131.3	-175.9	23	-33.1	0	0	0	111.1	R280 I360	R280-P358 PolarHBondContact NH1-O 2.9Å; P358-I360 PolarHBondContact O-N 2.96Å
359	G	78.2	Confident	81.2	Confident	42 Å²	42	53.6 Å²	53.6	43%	0.433	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	35	-177.8	0	0	0	0	0	114.6	R280 S357 P363	R280-G359 PolarHBondContact NH2-O 3.18Å; S357-G359 PolarHBondContact O-N 3.5Å; G359-P363 VanDerWaalsContact O-CD 3.24Å; G359-P363 WeakPolarHBondContact O-CD 3.42Å
360	I	82.6	Confident	81	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	26%	0.259	C	S	.	.			trans	-82.7	-24.3	169.2	-164.1	62.3	0	0	0	113.1	R280 L281 L286 L353 S357 P358 E362 P363 L364	R280-I360 HydrophobicContact CB-CD1 3.89Å; L281-I360 HydrophobicContact CD2-CD1 3.96Å; L281-I360 HydrophobicContact CD2-CG1 4.5Å; L286-I360 HydrophobicContact CD2-CD1 3.75Å; L286-I360 HydrophobicContact CD2-CG1 3.97Å; L353-I360 HydrophobicContact CB-CG2 4.03Å; L353-I360 WeakPolarHBondContact O-CG2 3.32Å; S357-I360 WeakPolarHBondContact O-CB 3.37Å; S357-I360 VanDerWaalsContact O-CG2 3.3Å; S357-I360 WeakPolarHBondContact O-CG2 3.45Å; S357-I360 PolarHBondContact O-N 2.7Å; S357-I360 VanDerWaalsContact O-N 3.16Å; P358-I360 PolarHBondContact O-N 2.96Å; I360-E362 PolarHBondContact O-N 3.07Å; I360-P363 WeakPolarHBondContact O-CD 3.41Å; I360-L364 HydrophobicContact CG1-CD1 4.13Å; I360-L364 HydrophobicContact CG1-CG 4.43Å; I360-L364 HydrophobicContact CG2-CD1 4.4Å; I360-L364 WeakPolarHBondContact O-CG 3.47Å; I360-L364 PolarHBondContact O-N 3.26Å; I360-L364 VanDerWaalsContact O-N 3.15Å
361	A	82.3	Confident	80.7	Confident	17 Å²	17	49.2 Å²	49.2	14%	0.14	27%	0.267	C	S	.	.	H	α-helix	trans	-58	-43.7	-179.8	0	0	0	0	0	113.2	I347 L364 I365	I347-A361 HydrophobicContact CG2-CB 3.92Å; A361-L364 PolarHBondContact O-N 3.23Å; A361-I365 WeakPolarHBondContact O-CD1 3.36Å; A361-I365 VanDerWaalsContact O-CG1 3.3Å; A361-I365 WeakPolarHBondContact O-CG1 3.23Å; A361-I365 PolarHBondContact O-N 2.94Å
362	E	84.6	Confident	80.6	Confident	63 Å²	63	47.2 Å²	47.2	29%	0.294	26%	0.26	S	S	.	.	H	α-helix	trans	-70.8	-45.2	-178.3	-162.7	65.3	-158.2	0	0	112.6	R348 I360 L364 I365 Q366	R348-E362 IonicContact CZ-OE1 2.65Å; R348-E362 IonicContact CZ-OE2 2.73Å; R348-E362 VanDerWaalsContact CZ-OE2 3.29Å; R348-E362 IonicContact NE-OE2 2.65Å; R348-E362 PolarHBondContact NE-OE2 2.92Å; R348-E362 VanDerWaalsContact NH2-CD 3.25Å; R348-E362 IonicContact NH2-OE1 3.24Å; R348-E362 PolarHBondContact NH2-OE1 3.45Å; R348-E362 IonicContact NH2-OE2 3.37Å; R348-E362 PolarHBondContact NH2-OE2 2.97Å; I360-E362 PolarHBondContact O-N 3.07Å; E362-L364 VanDerWaalsContact C-N 3.31Å; E362-L364 PolarHBondContact O-N 3.47Å; E362-I365 PolarHBondContact O-N 3.49Å; E362-I365 VanDerWaalsContact O-N 3.11Å; E362-Q366 HydrophobicContact CG-CG 4.34Å; E362-Q366 WeakPolarHBondContact O-CB 3.34Å; E362-Q366 VanDerWaalsContact O-CG 3.3Å; E362-Q366 WeakPolarHBondContact O-CG 3.36Å; E362-Q366 PolarHBondContact O-N 3.48Å
363	P	79.1	Confident	80.5	Confident	13 Å²	13	45.2 Å²	45.2	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-53	-41.7	168.4	-30	35.5	0	0	0	114.4	D278 L281 G359 I360 I365 Q366 E367	D278-P363 HydrophobicContact CB-CG 4.18Å; L281-P363 HydrophobicContact CD1-CB 4.45Å; G359-P363 VanDerWaalsContact O-CD 3.24Å; G359-P363 WeakPolarHBondContact O-CD 3.42Å; I360-P363 WeakPolarHBondContact O-CD 3.41Å; P363-I365 VanDerWaalsContact C-N 3.35Å; P363-I365 PolarHBondContact O-N 2.91Å; P363-Q366 PolarHBondContact O-N 3.1Å; P363-E367 WeakPolarHBondContact O-CB 3.25Å; P363-E367 PolarHBondContact O-N 2.85Å
364	L	82	Confident	80.3	Confident	18 Å²	18	45.7 Å²	45.7	9%	0.094	25%	0.246	C	C	.	.	H	α-helix	trans	-60.9	-42.7	175.5	-74.3	162.3	0	0	0	112	L281 L287 C290 I294 L353 I360 A361 E362 A368	L281-L364 HydrophobicContact CD2-CD2 3.54Å; L281-L364 HydrophobicContact CD2-CG 3.87Å; L287-L364 HydrophobicContact CD1-CD2 4.48Å; C290-L364 HydrophobicContact CB-CD1 4.19Å; I294-L364 HydrophobicContact CD1-CD1 4.21Å; I294-L364 HydrophobicContact CD1-CD2 4.17Å; L353-L364 HydrophobicContact CD1-CD1 4.09Å; I360-L364 HydrophobicContact CG1-CD1 4.13Å; I360-L364 HydrophobicContact CG1-CG 4.43Å; I360-L364 HydrophobicContact CG2-CD1 4.4Å; I360-L364 WeakPolarHBondContact O-CG 3.47Å; I360-L364 PolarHBondContact O-N 3.26Å; I360-L364 VanDerWaalsContact O-N 3.15Å; A361-L364 PolarHBondContact O-N 3.23Å; E362-L364 VanDerWaalsContact C-N 3.31Å; E362-L364 PolarHBondContact O-N 3.47Å; L364-A368 VanDerWaalsContact O-CB 3.32Å; L364-A368 WeakPolarHBondContact O-CB 3.32Å; L364-A368 PolarHBondContact O-N 2.7Å
365	I	83.3	Confident	79.9	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-71	-36.8	178	-68.6	164.5	0	0	0	111.4	F344 I347 R348 A361 E362 P363 K369	F344-I365 HydrophobicContact CB-CD1 4.09Å; F344-I365 HydrophobicContact CB-CG1 4.16Å; F344-I365 HydrophobicContact CB-CG2 4.28Å; F344-I365 HydrophobicContact CD1-CB 4.41Å; F344-I365 HydrophobicContact CD1-CG1 3.86Å; F344-I365 HydrophobicContact CD1-CG2 4.11Å; F344-I365 HydrophobicContact CD2-CG2 4.34Å; F344-I365 HydrophobicContact CG-CG1 4.22Å; F344-I365 HydrophobicContact CG-CG2 3.99Å; F344-I365 WeakPolarHBondContact O-CD1 3.43Å; I347-I365 HydrophobicContact CB-CD1 4.25Å; I347-I365 HydrophobicContact CB-CG1 4.48Å; I347-I365 HydrophobicContact CG2-CD1 3.8Å; I347-I365 HydrophobicContact CG2-CG1 3.91Å; R348-I365 HydrophobicContact CG-CD1 3.57Å; A361-I365 WeakPolarHBondContact O-CD1 3.36Å; A361-I365 VanDerWaalsContact O-CG1 3.3Å; A361-I365 WeakPolarHBondContact O-CG1 3.23Å; A361-I365 PolarHBondContact O-N 2.94Å; E362-I365 PolarHBondContact O-N 3.49Å; E362-I365 VanDerWaalsContact O-N 3.11Å; P363-I365 VanDerWaalsContact C-N 3.35Å; P363-I365 PolarHBondContact O-N 2.91Å; I365-K369 HydrophobicContact CG2-CD 3.95Å; I365-K369 HydrophobicContact CG2-CG 4.37Å; I365-K369 VanDerWaalsContact O-CB 3.32Å; I365-K369 WeakPolarHBondContact O-CB 3.22Å; I365-K369 WeakPolarHBondContact O-CG 3.47Å; I365-K369 PolarHBondContact O-N 2.74Å
366	Q	82.1	Confident	79.8	Confident	48 Å²	48	38.5 Å²	38.5	22%	0.224	22%	0.219	C	C	.	.	H	α-helix	trans	-66.7	-44.9	176.5	-71	-178.1	-9.3	0	0	111.3	E362 P363 K369 F370 L442 Y445	E362-Q366 HydrophobicContact CG-CG 4.34Å; E362-Q366 WeakPolarHBondContact O-CB 3.34Å; E362-Q366 VanDerWaalsContact O-CG 3.3Å; E362-Q366 WeakPolarHBondContact O-CG 3.36Å; E362-Q366 PolarHBondContact O-N 3.48Å; P363-Q366 PolarHBondContact O-N 3.1Å; Q366-K369 PolarHBondContact O-N 3.21Å; Q366-F370 VanDerWaalsContact O-CB 3.27Å; Q366-F370 WeakPolarHBondContact O-CB 3.23Å; Q366-F370 PolarHBondContact O-N 3.2Å; Q366-L442 HydrophobicContact CB-CD2 3.71Å; Q366-L442 HydrophobicContact CG-CD2 3.72Å; Q366-Y445 HydrophobicContact CB-CE2 3.99Å
367	E	80.6	Confident	79.7	Confident	43 Å²	43	35.9 Å²	35.9	20%	0.201	21%	0.206	C	C	.	.	H	α-helix	trans	-62.7	-43.5	174.1	-177.9	62.8	-161.2	0	0	111.6	L281 P363 F370 N371 Y445	L281-E367 HydrophobicContact CD1-CB 3.62Å; L281-E367 HydrophobicContact CD1-CG 3.92Å; P363-E367 WeakPolarHBondContact O-CB 3.25Å; P363-E367 PolarHBondContact O-N 2.85Å; E367-F370 PolarHBondContact O-N 2.85Å; E367-N371 VanDerWaalsContact CD-ND2 3.34Å; E367-N371 PolarHBondContact O-N 3.4Å; E367-N371 PolarHBondContact O-ND2 3.26Å; E367-N371 PolarHBondContact OE1-ND2 2.94Å; E367-Y445 WeakPolarHBondContact CA-OH 3.44Å; E367-Y445 WeakPolarHBondContact OE2-CE1 3.41Å; E367-Y445 PolarHBondContact OE2-OH 2.97Å
368	A	78.8	Confident	79.4	Confident	30 Å²	30	37.8 Å²	37.8	25%	0.248	21%	0.212	C	C	.	.	H	α-helix	trans	-63.1	-46.3	176.2	0	0	0	0	0	112.2	F344 L364 F370 N371 L372	F344-A368 HydrophobicContact CE1-CB 3.79Å; F344-A368 HydrophobicContact CZ-CB 4.15Å; L364-A368 VanDerWaalsContact O-CB 3.32Å; L364-A368 WeakPolarHBondContact O-CB 3.32Å; L364-A368 PolarHBondContact O-N 2.7Å; A368-F370 VanDerWaalsContact C-N 3.34Å; A368-F370 PolarHBondContact O-N 3.03Å; A368-N371 PolarHBondContact O-N 3.31Å; A368-L372 WeakPolarHBondContact O-CG 3.35Å; A368-L372 PolarHBondContact O-N 3.3Å
369	K	82.7	Confident	79.1	Confident	56 Å²	56	38.8 Å²	38.8	24%	0.243	21%	0.209	C	C	.	.	H	α-helix	trans	-61.4	-41.2	174.2	-75.4	171.1	177.9	175.7	0	112.1	F344 I365 Q366 L372 I373 L442	F344-K369 HydrophobicContact CE2-CG 4.03Å; F344-K369 HydrophobicContact CZ-CG 4.21Å; I365-K369 HydrophobicContact CG2-CD 3.95Å; I365-K369 HydrophobicContact CG2-CG 4.37Å; I365-K369 VanDerWaalsContact O-CB 3.32Å; I365-K369 WeakPolarHBondContact O-CB 3.22Å; I365-K369 WeakPolarHBondContact O-CG 3.47Å; I365-K369 PolarHBondContact O-N 2.74Å; Q366-K369 PolarHBondContact O-N 3.21Å; K369-L372 PolarHBondContact O-N 2.82Å; K369-I373 WeakPolarHBondContact O-CD1 3.37Å; K369-I373 VanDerWaalsContact O-CG1 3.27Å; K369-I373 WeakPolarHBondContact O-CG1 3.33Å; K369-I373 PolarHBondContact O-N 3.35Å; K369-L442 HydrophobicContact CB-CD1 4.16Å; K369-L442 HydrophobicContact CB-CD2 4.45Å
370	F	80.2	Confident	79.2	Confident	30 Å²	30	39.4 Å²	39.4	13%	0.132	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-48.4	178.4	176.2	-114	0	0	0	111.5	Q366 E367 A368 L372 I373 V374 V433 Y445 I449	Q366-F370 VanDerWaalsContact O-CB 3.27Å; Q366-F370 WeakPolarHBondContact O-CB 3.23Å; Q366-F370 PolarHBondContact O-N 3.2Å; E367-F370 PolarHBondContact O-N 2.85Å; A368-F370 VanDerWaalsContact C-N 3.34Å; A368-F370 PolarHBondContact O-N 3.03Å; F370-L372 VanDerWaalsContact C-N 3.3Å; F370-L372 PolarHBondContact O-N 3.04Å; F370-I373 WeakPolarHBondContact O-CB 3.49Å; F370-I373 PolarHBondContact O-N 2.81Å; F370-I373 VanDerWaalsContact O-N 3.13Å; F370-V374 HydrophobicContact CD1-CG2 4.48Å; F370-V374 HydrophobicContact CD2-CG2 4.23Å; F370-V374 HydrophobicContact CE1-CG2 3.95Å; F370-V374 HydrophobicContact CE2-CG2 3.64Å; F370-V374 HydrophobicContact CZ-CG2 3.48Å; F370-V374 VanDerWaalsContact CZ-CG2 3.48Å; F370-V374 WeakPolarHBondContact O-CG2 3.4Å; F370-V374 PolarHBondContact O-N 3.08Å; F370-V433 HydrophobicContact CE2-CG1 3.71Å; F370-Y445 HydrophobicContact CB-CD1 3.86Å; F370-Y445 HydrophobicContact CB-CE1 3.83Å; F370-Y445 HydrophobicContact CB-CG 4.23Å; F370-Y445 AromaticContact CD1-CD1 3.45Å; F370-Y445 HydrophobicContact CD1-CD1 3.45Å; F370-Y445 VanDerWaalsContact CD1-CD1 3.45Å; F370-Y445 AromaticContact CD1-CE1 3.44Å; F370-Y445 HydrophobicContact CD1-CE1 3.44Å; F370-Y445 VanDerWaalsContact CD1-CE1 3.44Å; F370-Y445 HydrophobicContact CD1-CG 4.5Å; F370-Y445 AromaticContact CD2-CD1 3.65Å; F370-Y445 HydrophobicContact CD2-CD1 3.65Å; F370-Y445 HydrophobicContact CD2-CE1 4.37Å; F370-Y445 HydrophobicContact CD2-CG 4.01Å; F370-Y445 AromaticContact CE1-CD1 3.89Å; F370-Y445 HydrophobicContact CE1-CD1 3.89Å; F370-Y445 HydrophobicContact CE1-CE1 4.13Å; F370-Y445 HydrophobicContact CE2-CD1 4.08Å; F370-Y445 AromaticContact CG-CD1 3.32Å; F370-Y445 HydrophobicContact CG-CD1 3.32Å; F370-Y445 AromaticContact CG-CE1 3.59Å; F370-Y445 HydrophobicContact CG-CE1 3.59Å; F370-Y445 AromaticContact CG-CG 3.96Å; F370-Y445 HydrophobicContact CG-CG 3.96Å; F370-Y445 HydrophobicContact CZ-CD1 4.19Å; F370-I449 HydrophobicContact CD2-CD1 4.45Å; F370-I449 HydrophobicContact CE2-CD1 3.36Å; F370-I449 HydrophobicContact CZ-CD1 3.7Å
371	N	76.3	Confident	79	Confident	51 Å²	51	41.2 Å²	41.2	27%	0.273	21%	0.21	S	C	.	.	H	α-helix	trans	-61.5	-37.6	176.3	-76.6	-80.3	0	0	0	112.1	E367 A368 V374 T375	E367-N371 VanDerWaalsContact CD-ND2 3.34Å; E367-N371 PolarHBondContact O-N 3.4Å; E367-N371 PolarHBondContact O-ND2 3.26Å; E367-N371 PolarHBondContact OE1-ND2 2.94Å; A368-N371 PolarHBondContact O-N 3.31Å; N371-V374 PolarHBondContact O-N 3.42Å; N371-T375 PolarHBondContact O-N 3.27Å; N371-T375 PolarHBondContact O-OG1 3.4Å
372	L	77	Confident	78.7	Confident	89 Å²	89	44.1 Å²	44.1	47%	0.466	22%	0.222	S	C	.	.	H	α-helix	trans	-64.1	-36.8	173.5	-74	169.2	0	0	0	113.3	F344 A368 K369 F370 V374 T375 E376	F344-L372 HydrophobicContact CZ-CD1 4.22Å; A368-L372 WeakPolarHBondContact O-CG 3.35Å; A368-L372 PolarHBondContact O-N 3.3Å; K369-L372 PolarHBondContact O-N 2.82Å; F370-L372 VanDerWaalsContact C-N 3.3Å; F370-L372 PolarHBondContact O-N 3.04Å; L372-V374 VanDerWaalsContact C-N 3.34Å; L372-T375 WeakPolarHBondContact CA-OG1 3.22Å; L372-T375 PolarHBondContact O-OG1 2.95Å; L372-T375 VanDerWaalsContact O-OG1 3.1Å; L372-E376 VanDerWaalsContact O-CB 3.29Å; L372-E376 WeakPolarHBondContact O-CB 3.5Å; L372-E376 PolarHBondContact O-N 2.95Å
373	I	80	Confident	78.5	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-66.6	-39.3	173	-67	161	0	0	0	110.5	K369 F370 E376 A377 V433 K436 N440 L442	K369-I373 WeakPolarHBondContact O-CD1 3.37Å; K369-I373 VanDerWaalsContact O-CG1 3.27Å; K369-I373 WeakPolarHBondContact O-CG1 3.33Å; K369-I373 PolarHBondContact O-N 3.35Å; F370-I373 WeakPolarHBondContact O-CB 3.49Å; F370-I373 PolarHBondContact O-N 2.81Å; F370-I373 VanDerWaalsContact O-N 3.13Å; I373-E376 PolarHBondContact O-N 3.48Å; I373-A377 VanDerWaalsContact O-CB 3.28Å; I373-A377 WeakPolarHBondContact O-CB 3.27Å; I373-A377 PolarHBondContact O-N 2.8Å; I373-V433 HydrophobicContact CG2-CB 4.3Å; I373-V433 HydrophobicContact CG2-CG1 4.05Å; I373-V433 HydrophobicContact CG2-CG2 4.23Å; I373-K436 HydrophobicContact CB-CB 4.44Å; I373-K436 HydrophobicContact CD1-CB 4.24Å; I373-K436 HydrophobicContact CG1-CB 4.13Å; I373-K436 HydrophobicContact CG2-CB 3.45Å; I373-K436 VanDerWaalsContact CG2-CB 3.45Å; I373-K436 HydrophobicContact CG2-CG 4.21Å; I373-N440 HydrophobicContact CD1-CB 4.47Å; I373-N440 WeakPolarHBondContact CD1-ND2 3.47Å; I373-L442 HydrophobicContact CD1-CD1 3.4Å
374	V	75	Confident	78.7	Confident	10 Å²	10	49.9 Å²	49.9	6%	0.061	25%	0.251	C	S	.	.	H	α-helix	trans	-69.6	-36.8	179	169.2	0	0	0	0	111.8	F370 N371 L372 K378 V433 F1408 I1412	F370-V374 HydrophobicContact CD1-CG2 4.48Å; F370-V374 HydrophobicContact CD2-CG2 4.23Å; F370-V374 HydrophobicContact CE1-CG2 3.95Å; F370-V374 HydrophobicContact CE2-CG2 3.64Å; F370-V374 HydrophobicContact CZ-CG2 3.48Å; F370-V374 VanDerWaalsContact CZ-CG2 3.48Å; F370-V374 WeakPolarHBondContact O-CG2 3.4Å; F370-V374 PolarHBondContact O-N 3.08Å; N371-V374 PolarHBondContact O-N 3.42Å; L372-V374 VanDerWaalsContact C-N 3.34Å; V374-K378 WeakPolarHBondContact O-CB 3.49Å; V374-K378 PolarHBondContact O-N 3.13Å; V374-V433 HydrophobicContact CG2-CG1 4.22Å; V374-V433 HydrophobicContact CG2-CG2 4.31Å; V374-F1408 HydrophobicContact CG1-CE1 3.98Å; V374-F1408 HydrophobicContact CG1-CZ 3.93Å; V374-I1412 HydrophobicContact CG1-CD1 3.53Å; V374-I1412 HydrophobicContact CG1-CG1 3.98Å
375	T	73.7	Confident	78.7	Confident	57 Å²	57	50.1 Å²	50.1	35%	0.35	25%	0.25	S	S	.	.	H	α-helix	trans	-71.5	-41.8	171.6	55.4	0	0	0	0	112	N371 L372 A377 K378 E379	N371-T375 PolarHBondContact O-N 3.27Å; N371-T375 PolarHBondContact O-OG1 3.4Å; L372-T375 WeakPolarHBondContact CA-OG1 3.22Å; L372-T375 PolarHBondContact O-OG1 2.95Å; L372-T375 VanDerWaalsContact O-OG1 3.1Å; T375-A377 VanDerWaalsContact C-N 3.33Å; T375-A377 PolarHBondContact O-N 3.44Å; T375-K378 WeakPolarHBondContact O-CB 3.4Å; T375-K378 PolarHBondContact O-N 3Å; T375-E379 WeakPolarHBondContact O-CB 3.26Å; T375-E379 WeakPolarHBondContact O-CG 3.2Å; T375-E379 PolarHBondContact O-N 3.47Å
376	E	79.8	Confident	78.7	Confident	74 Å²	74	54.2 Å²	54.2	35%	0.346	27%	0.272	S	S	.	.	H	α-helix	trans	-56.6	-45.9	172.7	-174.6	-173.9	-169.2	0	0	111.3	L372 I373 E379 L380 Y432 K436	L372-E376 VanDerWaalsContact O-CB 3.29Å; L372-E376 WeakPolarHBondContact O-CB 3.5Å; L372-E376 PolarHBondContact O-N 2.95Å; I373-E376 PolarHBondContact O-N 3.48Å; E376-E379 PolarHBondContact O-N 3.06Å; E376-L380 HydrophobicContact CG-CD1 3.99Å; E376-L380 WeakPolarHBondContact O-CB 3.03Å; E376-L380 VanDerWaalsContact O-CG 3.31Å; E376-L380 WeakPolarHBondContact O-CG 3.32Å; E376-L380 PolarHBondContact O-N 2.86Å; E376-Y432 VanDerWaalsContact CD-OH 3.26Å; E376-Y432 HydrophobicContact CG-CE1 4.44Å; E376-Y432 PolarHBondContact OE1-OH 2.85Å; E376-Y432 VanDerWaalsContact OE1-OH 3.08Å; E376-K436 IonicContact OE1-NZ 2.71Å; E376-K436 PolarHBondContact OE1-NZ 2.71Å; E376-K436 IonicContact OE2-NZ 2.75Å; E376-K436 PolarHBondContact OE2-NZ 3.4Å
377	A	78.3	Confident	78.9	Confident	3 Å²	3	54.6 Å²	54.6	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-61.9	-43.7	176.6	0	0	0	0	0	112.4	I373 T375 L380 F381 I429 Y432 V433	I373-A377 VanDerWaalsContact O-CB 3.28Å; I373-A377 WeakPolarHBondContact O-CB 3.27Å; I373-A377 PolarHBondContact O-N 2.8Å; T375-A377 VanDerWaalsContact C-N 3.33Å; T375-A377 PolarHBondContact O-N 3.44Å; A377-L380 PolarHBondContact O-N 3.31Å; A377-F381 WeakPolarHBondContact O-CB 3.49Å; A377-F381 PolarHBondContact O-N 3Å; A377-I429 HydrophobicContact CB-CG2 4.07Å; A377-Y432 HydrophobicContact CB-CD1 3.58Å; A377-Y432 HydrophobicContact CB-CE1 4.08Å; A377-Y432 HydrophobicContact CB-CG 4.49Å; A377-V433 HydrophobicContact CB-CG2 3.54Å
378	K	70.7	Confident	79.3	Confident	62 Å²	62	55.7 Å²	55.7	27%	0.27	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-42.8	176.3	-174.1	-175.7	179.1	-178.8	0	111.8	V374 T375 M382 F1408	V374-K378 WeakPolarHBondContact O-CB 3.49Å; V374-K378 PolarHBondContact O-N 3.13Å; T375-K378 WeakPolarHBondContact O-CB 3.4Å; T375-K378 PolarHBondContact O-N 3Å; K378-M382 VanDerWaalsContact O-CB 3.23Å; K378-M382 WeakPolarHBondContact O-CB 3.4Å; K378-M382 PolarHBondContact O-N 3.2Å; K378-F1408 HydrophobicContact CB-CD1 4.27Å; K378-F1408 HydrophobicContact CB-CE1 3.85Å; K378-F1408 HydrophobicContact CD-CD1 4.03Å; K378-F1408 HydrophobicContact CD-CE1 4.23Å; K378-F1408 HydrophobicContact CG-CD1 4.01Å; K378-F1408 HydrophobicContact CG-CE1 4.11Å
379	E	74.9	Confident	79.5	Confident	102 Å²	102	55.2 Å²	55.2	48%	0.477	28%	0.277	S	S	.	.	H	α-helix	trans	-67.7	-42.9	178.2	-77.9	-176.6	-156.5	0	0	112	T375 E376 M382 Q383	T375-E379 WeakPolarHBondContact O-CB 3.26Å; T375-E379 WeakPolarHBondContact O-CG 3.2Å; T375-E379 PolarHBondContact O-N 3.47Å; E376-E379 PolarHBondContact O-N 3.06Å; E379-M382 PolarHBondContact O-N 3.46Å; E379-Q383 WeakPolarHBondContact O-CB 3Å; E379-Q383 WeakPolarHBondContact O-CG 3.33Å; E379-Q383 PolarHBondContact O-N 2.99Å
380	L	79.9	Confident	79.6	Confident	56 Å²	56	57.2 Å²	57.2	29%	0.293	29%	0.287	S	S	.	.	H	α-helix	trans	-65.4	-44	175.8	-72.5	169.9	0	0	0	111.7	E376 A377 M382 Q383 N384 Y432	E376-L380 HydrophobicContact CG-CD1 3.99Å; E376-L380 WeakPolarHBondContact O-CB 3.03Å; E376-L380 VanDerWaalsContact O-CG 3.31Å; E376-L380 WeakPolarHBondContact O-CG 3.32Å; E376-L380 PolarHBondContact O-N 2.86Å; A377-L380 PolarHBondContact O-N 3.31Å; L380-M382 VanDerWaalsContact C-N 3.32Å; L380-M382 PolarHBondContact O-N 3.32Å; L380-Q383 PolarHBondContact O-N 2.96Å; L380-N384 WeakPolarHBondContact O-CB 3.49Å; L380-N384 PolarHBondContact O-N 3.2Å; L380-N384 PolarHBondContact O-OD1 3.19Å; L380-Y432 HydrophobicContact CD1-CE1 4.09Å; L380-Y432 HydrophobicContact CD1-CE2 3.68Å; L380-Y432 WeakPolarHBondContact CD1-OH 3.49Å
381	F	78.2	Confident	80.1	Confident	39 Å²	39	58.6 Å²	58.6	17%	0.171	30%	0.3	C	S	.	.	H	α-helix	trans	-60.2	-42.4	173.4	-178.2	-92.6	0	0	0	111.7	A377 N384 W385 Y421 L422 H425 I429	A377-F381 WeakPolarHBondContact O-CB 3.49Å; A377-F381 PolarHBondContact O-N 3Å; F381-N384 PolarHBondContact O-N 3.44Å; F381-W385 VanDerWaalsContact O-CB 3.26Å; F381-W385 WeakPolarHBondContact O-CB 3.43Å; F381-W385 PolarHBondContact O-N 2.69Å; F381-Y421 AromaticContact CE2-CE1 3.98Å; F381-Y421 HydrophobicContact CE2-CE1 3.98Å; F381-Y421 AromaticContact CZ-CE1 3.9Å; F381-Y421 HydrophobicContact CZ-CE1 3.9Å; F381-L422 HydrophobicContact CZ-CD2 4.18Å; F381-H425 HydrophobicContact CE2-CB 4.01Å; F381-I429 HydrophobicContact CB-CD1 4.22Å; F381-I429 HydrophobicContact CB-CG1 4.26Å; F381-I429 HydrophobicContact CD1-CD1 4.09Å; F381-I429 HydrophobicContact CD2-CD1 3.79Å; F381-I429 HydrophobicContact CD2-CG1 3.75Å; F381-I429 HydrophobicContact CE1-CD1 4.43Å; F381-I429 HydrophobicContact CE2-CD1 4.14Å; F381-I429 HydrophobicContact CE2-CG1 4.31Å; F381-I429 HydrophobicContact CG-CD1 3.76Å; F381-I429 HydrophobicContact CG-CG1 4.05Å; F381-I429 HydrophobicContact CZ-CD1 4.45Å
382	M	75.1	Confident	80.7	Confident	78 Å²	78	58.6 Å²	58.6	38%	0.384	30%	0.297	S	S	.	.	H	α-helix	trans	-67.6	-38.7	177.2	-174.7	173	65.5	0	0	112.5	K378 E379 L380 L386	K378-M382 VanDerWaalsContact O-CB 3.23Å; K378-M382 WeakPolarHBondContact O-CB 3.4Å; K378-M382 PolarHBondContact O-N 3.2Å; E379-M382 PolarHBondContact O-N 3.46Å; L380-M382 VanDerWaalsContact C-N 3.32Å; L380-M382 PolarHBondContact O-N 3.32Å; M382-L386 HydrophobicContact CG-CD1 4.03Å; M382-L386 HydrophobicContact CG-CG 4.48Å; M382-L386 VanDerWaalsContact O-CB 3.31Å; M382-L386 WeakPolarHBondContact O-CB 3.09Å; M382-L386 WeakPolarHBondContact O-CG 3.22Å; M382-L386 PolarHBondContact O-N 3.4Å
383	Q	81	Confident	81.2	Confident	106 Å²	106	56.7 Å²	56.7	50%	0.495	29%	0.286	S	S	.	.	H	α-helix	trans	-65.8	-44.8	174.6	-74.9	170.8	50.7	0	0	111.2	E379 L380 L386 S387	E379-Q383 WeakPolarHBondContact O-CB 3Å; E379-Q383 WeakPolarHBondContact O-CG 3.33Å; E379-Q383 PolarHBondContact O-N 2.99Å; L380-Q383 PolarHBondContact O-N 2.96Å; Q383-L386 PolarHBondContact O-N 3Å; Q383-S387 WeakPolarHBondContact O-CB 3.41Å; Q383-S387 PolarHBondContact O-N 2.75Å
384	N	84.2	Confident	81.5	Confident	91 Å²	91	63.1 Å²	63.1	49%	0.487	31%	0.31	S	S	.	.	H	α-helix	trans	-59.5	-51.5	174.5	-71.3	-5.8	0	0	0	110.6	L380 F381 L386 S387 Y388	L380-N384 WeakPolarHBondContact O-CB 3.49Å; L380-N384 PolarHBondContact O-N 3.2Å; L380-N384 PolarHBondContact O-OD1 3.19Å; F381-N384 PolarHBondContact O-N 3.44Å; N384-L386 PolarHBondContact O-N 3.08Å; N384-S387 PolarHBondContact O-N 2.73Å; N384-S387 VanDerWaalsContact O-N 3.12Å; N384-S387 PolarHBondContact O-OG 2.88Å; N384-Y388 WeakPolarHBondContact O-CB 3.48Å; N384-Y388 PolarHBondContact O-N 2.84Å
385	W	80.5	Confident	82.3	Confident	22 Å²	22	66.7 Å²	66.7	8%	0.083	33%	0.329	C	S	.	.	H	α-helix	trans	-58.2	-42.8	176.7	172.6	-111	0	0	0	112.8	F381 Y388 C389 K418 Y421	F381-W385 VanDerWaalsContact O-CB 3.26Å; F381-W385 WeakPolarHBondContact O-CB 3.43Å; F381-W385 PolarHBondContact O-N 2.69Å; W385-Y388 AromaticContact CE3-CD1 3.91Å; W385-Y388 HydrophobicContact CE3-CD1 3.91Å; W385-Y388 AromaticContact CZ3-CD1 3.68Å; W385-Y388 HydrophobicContact CZ3-CD1 3.68Å; W385-Y388 AromaticContact CZ3-CE1 3.86Å; W385-Y388 HydrophobicContact CZ3-CE1 3.86Å; W385-Y388 PolarHBondContact O-N 2.93Å; W385-C389 WeakPolarHBondContact CZ2-SG 3.41Å; W385-C389 WeakPolarHBondContact O-CB 3.39Å; W385-C389 PolarHBondContact O-N 2.97Å; W385-C389 PolarHBondContact O-SG 2.87Å; W385-K418 HydrophobicContact CH2-CB 3.78Å; W385-K418 HydrophobicContact CH2-CD 4.07Å; W385-K418 HydrophobicContact CH2-CG 3.79Å; W385-K418 HydrophobicContact CZ2-CB 4.48Å; W385-K418 HydrophobicContact CZ2-CD 3.96Å; W385-K418 HydrophobicContact CZ2-CG 4.21Å; W385-Y421 HydrophobicContact CB-CE1 4.35Å; W385-Y421 HydrophobicContact CD2-CD1 4.5Å; W385-Y421 HydrophobicContact CD2-CE1 4.4Å; W385-Y421 AromaticContact CE3-CD1 3.4Å; W385-Y421 HydrophobicContact CE3-CD1 3.4Å; W385-Y421 HydrophobicContact CE3-CD2 4.13Å; W385-Y421 AromaticContact CE3-CE1 3.57Å; W385-Y421 HydrophobicContact CE3-CE1 3.57Å; W385-Y421 HydrophobicContact CE3-CE2 4.25Å; W385-Y421 AromaticContact CE3-CG 3.72Å; W385-Y421 HydrophobicContact CE3-CG 3.72Å; W385-Y421 AromaticContact CZ3-CD1 3.68Å; W385-Y421 HydrophobicContact CZ3-CD1 3.68Å; W385-Y421 HydrophobicContact CZ3-CD2 4.26Å; W385-Y421 HydrophobicContact CZ3-CE1 4.32Å; W385-Y421 AromaticContact CZ3-CG 3.66Å; W385-Y421 HydrophobicContact CZ3-CG 3.66Å; W385-Y421 PolarHBondContact N-OH 3.45Å
386	L	84.1	Confident	82.9	Confident	87 Å²	87	64.7 Å²	64.7	46%	0.455	32%	0.316	S	S	.	.	H	α-helix	trans	-66.8	-37.7	175.6	-74.4	169.3	0	0	0	112.1	M382 Q383 N384 C389 Q390	M382-L386 HydrophobicContact CG-CD1 4.03Å; M382-L386 HydrophobicContact CG-CG 4.48Å; M382-L386 VanDerWaalsContact O-CB 3.31Å; M382-L386 WeakPolarHBondContact O-CB 3.09Å; M382-L386 WeakPolarHBondContact O-CG 3.22Å; M382-L386 PolarHBondContact O-N 3.4Å; Q383-L386 PolarHBondContact O-N 3Å; N384-L386 PolarHBondContact O-N 3.08Å; L386-C389 PolarHBondContact O-N 3.34Å; L386-Q390 WeakPolarHBondContact O-CG 3.26Å; L386-Q390 PolarHBondContact O-N 3.18Å
387	S	86.6	Confident	83.4	Confident	56 Å²	56	67 Å²	67	39%	0.392	33%	0.325	S	S	.	.	H	α-helix	trans	-67.6	-39	175.9	80.2	0	0	0	0	112.1	Q383 N384 S391	Q383-S387 WeakPolarHBondContact O-CB 3.41Å; Q383-S387 PolarHBondContact O-N 2.75Å; N384-S387 PolarHBondContact O-N 2.73Å; N384-S387 VanDerWaalsContact O-N 3.12Å; N384-S387 PolarHBondContact O-OG 2.88Å; S387-S391 VanDerWaalsContact O-CB 3.31Å; S387-S391 WeakPolarHBondContact O-CB 3.25Å; S387-S391 PolarHBondContact O-N 3.24Å; S387-S391 PolarHBondContact O-OG 2.73Å
388	Y	87.6	Confident	84	Confident	67 Å²	67	73.2 Å²	73.2	26%	0.263	36%	0.356	S	S	.	.	H	α-helix	trans	-62.6	-50.7	171.7	175.1	-96.6	0	0	0	110.3	N384 W385 Q390 S391 Y392 A417 Y421	N384-Y388 WeakPolarHBondContact O-CB 3.48Å; N384-Y388 PolarHBondContact O-N 2.84Å; W385-Y388 AromaticContact CE3-CD1 3.91Å; W385-Y388 HydrophobicContact CE3-CD1 3.91Å; W385-Y388 AromaticContact CZ3-CD1 3.68Å; W385-Y388 HydrophobicContact CZ3-CD1 3.68Å; W385-Y388 AromaticContact CZ3-CE1 3.86Å; W385-Y388 HydrophobicContact CZ3-CE1 3.86Å; W385-Y388 PolarHBondContact O-N 2.93Å; Y388-Q390 PolarHBondContact O-N 3.42Å; Y388-S391 PolarHBondContact O-N 2.86Å; Y388-S391 VanDerWaalsContact O-N 3.16Å; Y388-Y392 VanDerWaalsContact O-CB 3.24Å; Y388-Y392 WeakPolarHBondContact O-CB 3.37Å; Y388-Y392 PolarHBondContact O-N 2.84Å; Y388-A417 HydrophobicContact CE1-CB 4.44Å; Y388-Y421 AromaticContact CD1-CD2 3.71Å; Y388-Y421 HydrophobicContact CD1-CD2 3.71Å; Y388-Y421 HydrophobicContact CD1-CE2 4.14Å; Y388-Y421 HydrophobicContact CD1-CG 4.32Å; Y388-Y421 AromaticContact CD2-CD2 3.86Å; Y388-Y421 HydrophobicContact CD2-CD2 3.86Å; Y388-Y421 HydrophobicContact CD2-CE2 4.09Å; Y388-Y421 AromaticContact CE1-CD2 3.88Å; Y388-Y421 HydrophobicContact CE1-CD2 3.88Å; Y388-Y421 HydrophobicContact CE1-CG 4.27Å; Y388-Y421 HydrophobicContact CE2-CD2 4Å; Y388-Y421 AromaticContact CG-CD2 3.71Å; Y388-Y421 HydrophobicContact CG-CD2 3.71Å; Y388-Y421 AromaticContact CG-CE2 3.8Å; Y388-Y421 HydrophobicContact CG-CE2 3.8Å
389	C	83.3	Confident	84.9	Confident	19 Å²	19	76 Å²	76	13%	0.128	37%	0.374	C	S	.	.	H	α-helix	trans	-54.1	-51.6	176.5	-73.4	0	0	0	0	112.4	W385 L386 S391 Y392 E393 W414	W385-C389 WeakPolarHBondContact CZ2-SG 3.41Å; W385-C389 WeakPolarHBondContact O-CB 3.39Å; W385-C389 PolarHBondContact O-N 2.97Å; W385-C389 PolarHBondContact O-SG 2.87Å; L386-C389 PolarHBondContact O-N 3.34Å; C389-S391 VanDerWaalsContact C-N 3.31Å; C389-S391 PolarHBondContact O-N 3.15Å; C389-Y392 PolarHBondContact O-N 3.13Å; C389-E393 WeakPolarHBondContact O-CB 3.4Å; C389-E393 PolarHBondContact O-N 3.49Å; C389-W414 HydrophobicContact CB-CH2 3.81Å; C389-W414 HydrophobicContact CB-CZ3 3.98Å; C389-W414 WeakPolarHBondContact O-CH2 3.49Å
390	Q	86	Confident	85.5	Confident	99 Å²	99	74 Å²	74	46%	0.463	37%	0.367	S	S	.	.	H	α-helix	trans	-64.5	-35.8	179.9	-70.3	-174.5	25.6	0	0	112.7	L386 Y388 R394	L386-Q390 WeakPolarHBondContact O-CG 3.26Å; L386-Q390 PolarHBondContact O-N 3.18Å; Y388-Q390 PolarHBondContact O-N 3.42Å; Q390-R394 WeakPolarHBondContact O-CB 3.03Å; Q390-R394 WeakPolarHBondContact O-CG 3.35Å; Q390-R394 PolarHBondContact O-N 2.77Å; Q390-R394 VanDerWaalsContact O-N 3.08Å
391	S	89.6	Confident	85.8	Confident	58 Å²	58	75.1 Å²	75.1	41%	0.406	38%	0.377	S	S	.	.	H	α-helix	trans	-72.4	-43.1	179	-55.7	0	0	0	0	111.1	S387 Y388 C389 R394 N395	S387-S391 VanDerWaalsContact O-CB 3.31Å; S387-S391 WeakPolarHBondContact O-CB 3.25Å; S387-S391 PolarHBondContact O-N 3.24Å; S387-S391 PolarHBondContact O-OG 2.73Å; Y388-S391 PolarHBondContact O-N 2.86Å; Y388-S391 VanDerWaalsContact O-N 3.16Å; C389-S391 VanDerWaalsContact C-N 3.31Å; C389-S391 PolarHBondContact O-N 3.15Å; S391-R394 PolarHBondContact O-N 3.38Å; S391-N395 WeakPolarHBondContact O-CB 3.49Å; S391-N395 PolarHBondContact O-N 2.83Å; S391-N395 PolarHBondContact O-ND2 3.01Å; S391-N395 PolarHBondContact O-OD1 3.45Å
392	Y	88.8	Confident	86	Confident	51 Å²	51	78.1 Å²	78.1	20%	0.2	40%	0.399	C	S	.	.	H	α-helix	trans	-61.9	-44.6	174.3	-172.9	-109	0	0	0	111.6	Y388 C389 N395 L396 Q413 W414 A417	Y388-Y392 VanDerWaalsContact O-CB 3.24Å; Y388-Y392 WeakPolarHBondContact O-CB 3.37Å; Y388-Y392 PolarHBondContact O-N 2.84Å; C389-Y392 PolarHBondContact O-N 3.13Å; Y392-N395 PolarHBondContact O-N 2.94Å; Y392-L396 HydrophobicContact CD1-CD1 4.31Å; Y392-L396 HydrophobicContact CE1-CD1 3.74Å; Y392-L396 HydrophobicContact CE2-CD1 3.99Å; Y392-L396 WeakPolarHBondContact O-CB 3.46Å; Y392-L396 PolarHBondContact O-N 3.03Å; Y392-Q413 PolarHBondContact OH-O 3.4Å; Y392-Q413 VanDerWaalsContact OH-O 3.1Å; Y392-W414 HydrophobicContact CD1-CD2 4.45Å; Y392-W414 AromaticContact CD1-CE3 3.95Å; Y392-W414 HydrophobicContact CD1-CE3 3.95Å; Y392-W414 HydrophobicContact CD1-CH2 4.28Å; Y392-W414 AromaticContact CD1-CZ3 3.85Å; Y392-W414 HydrophobicContact CD1-CZ3 3.85Å; Y392-W414 HydrophobicContact CE1-CE3 4.25Å; Y392-A417 HydrophobicContact CD1-CB 4.14Å; Y392-A417 HydrophobicContact CD2-CB 4.38Å; Y392-A417 HydrophobicContact CE1-CB 3.54Å; Y392-A417 HydrophobicContact CE2-CB 3.85Å
393	E	87.4	Confident	86.4	Confident	50 Å²	50	76.6 Å²	76.6	23%	0.234	39%	0.392	C	S	.	.	H	α-helix	trans	-66.1	-40.8	177.4	-165	174.4	-161.2	0	0	112.5	C389 L396 K397 F404 W414	C389-E393 WeakPolarHBondContact O-CB 3.4Å; C389-E393 PolarHBondContact O-N 3.49Å; E393-L396 PolarHBondContact O-N 3.16Å; E393-K397 WeakPolarHBondContact O-CB 3.2Å; E393-K397 PolarHBondContact O-N 3.44Å; E393-F404 HydrophobicContact CG-CE2 3.86Å; E393-F404 HydrophobicContact CG-CZ 4.12Å; E393-F404 WeakPolarHBondContact OE1-CZ 3.31Å; E393-W414 HydrophobicContact CB-CH2 4.14Å; E393-W414 HydrophobicContact CB-CZ2 3.8Å; E393-W414 HydrophobicContact CG-CZ2 4.05Å
394	R	87.4	Confident	86.7	Confident	138 Å²	138	72.6 Å²	72.6	52%	0.521	37%	0.373	S	S	.	.	H	α-helix	trans	-59.4	-48.3	172.5	-75.4	173.2	-169	118.5	8.3	110.8	Q390 S391 L396 K397 L398	Q390-R394 WeakPolarHBondContact O-CB 3.03Å; Q390-R394 WeakPolarHBondContact O-CG 3.35Å; Q390-R394 PolarHBondContact O-N 2.77Å; Q390-R394 VanDerWaalsContact O-N 3.08Å; S391-R394 PolarHBondContact O-N 3.38Å; R394-L396 PolarHBondContact O-N 2.69Å; R394-K397 PolarHBondContact O-N 3.12Å; R394-L398 WeakPolarHBondContact O-CB 3.48Å; R394-L398 VanDerWaalsContact O-CG 3.27Å; R394-L398 WeakPolarHBondContact O-CG 3.23Å; R394-L398 PolarHBondContact O-N 2.97Å
395	N	90.8	Very high	86.7	Confident	86 Å²	86	71.9 Å²	71.9	46%	0.46	37%	0.369	S	S	.	.	H	α-helix	trans	-62.7	-40.7	177.7	-68.6	-9.8	0	0	0	111.8	S391 Y392 K397 L398 N399	S391-N395 WeakPolarHBondContact O-CB 3.49Å; S391-N395 PolarHBondContact O-N 2.83Å; S391-N395 PolarHBondContact O-ND2 3.01Å; S391-N395 PolarHBondContact O-OD1 3.45Å; Y392-N395 PolarHBondContact O-N 2.94Å; N395-K397 PolarHBondContact O-N 3.49Å; N395-L398 PolarHBondContact O-N 3.36Å; N395-N399 VanDerWaalsContact O-CB 3.24Å; N395-N399 WeakPolarHBondContact O-CB 3.49Å; N395-N399 PolarHBondContact O-N 3.28Å; N395-N399 PolarHBondContact O-OD1 3.43Å
396	L	87.8	Confident	87	Confident	15 Å²	15	71 Å²	71	8%	0.079	37%	0.366	C	S	.	.	H	α-helix	trans	-61.3	-45.2	175.6	-128.2	82.7	0	0	0	111.8	Y392 E393 R394 N400 F404 W409 R410 Q413	Y392-L396 HydrophobicContact CD1-CD1 4.31Å; Y392-L396 HydrophobicContact CE1-CD1 3.74Å; Y392-L396 HydrophobicContact CE2-CD1 3.99Å; Y392-L396 WeakPolarHBondContact O-CB 3.46Å; Y392-L396 PolarHBondContact O-N 3.03Å; E393-L396 PolarHBondContact O-N 3.16Å; R394-L396 PolarHBondContact O-N 2.69Å; L396-N400 WeakPolarHBondContact O-CB 3.47Å; L396-N400 PolarHBondContact O-N 2.72Å; L396-F404 HydrophobicContact CB-CD2 4.45Å; L396-F404 HydrophobicContact CD2-CD2 4.45Å; L396-W409 HydrophobicContact CD2-CH2 4.08Å; L396-W409 HydrophobicContact CD2-CZ3 3.79Å; L396-W409 HydrophobicContact CG-CH2 4.05Å; L396-W409 HydrophobicContact CG-CZ3 4.19Å; L396-R410 HydrophobicContact CD2-CG 4.34Å; L396-Q413 HydrophobicContact CD1-CB 4.41Å; L396-Q413 HydrophobicContact CD2-CB 4.01Å; L396-Q413 HydrophobicContact CD2-CG 4.39Å
397	K	88.7	Confident	86.9	Confident	123 Å²	123	70.6 Å²	70.6	54%	0.535	37%	0.369	S	S	.	.	H	α-helix	trans	-70	-38.1	-178.9	-171.8	-172.8	174.9	-166.1	0	112.1	E393 R394 N395 P401 F404	E393-K397 WeakPolarHBondContact O-CB 3.2Å; E393-K397 PolarHBondContact O-N 3.44Å; R394-K397 PolarHBondContact O-N 3.12Å; N395-K397 PolarHBondContact O-N 3.49Å; K397-P401 WeakPolarHBondContact O-CA 3.4Å; K397-F404 HydrophobicContact CB-CD2 4.29Å; K397-F404 HydrophobicContact CB-CE2 4.42Å; K397-F404 HydrophobicContact CB-CG 4.47Å; K397-F404 HydrophobicContact CG-CD1 4.45Å
398	L	90.9	Very high	86.6	Confident	132 Å²	132	72.5 Å²	72.5	69%	0.691	37%	0.37	S	S	*	.	H	α-helix	trans	-67.9	-48.6	175.8	-73.8	168.1	0	0	0	111.4	R394 N395	R394-L398 WeakPolarHBondContact O-CB 3.48Å; R394-L398 VanDerWaalsContact O-CG 3.27Å; R394-L398 WeakPolarHBondContact O-CG 3.23Å; R394-L398 PolarHBondContact O-N 2.97Å; N395-L398 PolarHBondContact O-N 3.36Å
399	N	89.9	Confident	86.6	Confident	121 Å²	121	70.5 Å²	70.5	65%	0.647	36%	0.362	S	S	*	.	H	α-helix	trans	-75.6	-29.2	-175.1	-63.9	-3.4	0	0	0	112.7	N395	N395-N399 VanDerWaalsContact O-CB 3.24Å; N395-N399 WeakPolarHBondContact O-CB 3.49Å; N395-N399 PolarHBondContact O-N 3.28Å; N395-N399 PolarHBondContact O-OD1 3.43Å
400	N	87.8	Confident	86.7	Confident	60 Å²	60	72.1 Å²	72.1	32%	0.321	37%	0.365	S	S	.	.			trans	-140.9	59	-170.5	-69.8	-81	0	0	0	113.7	L396 V402 L403 F404 W409	L396-N400 WeakPolarHBondContact O-CB 3.47Å; L396-N400 PolarHBondContact O-N 2.72Å; N400-V402 VanDerWaalsContact C-N 3.33Å; N400-V402 PolarHBondContact O-N 3.13Å; N400-L403 HydrophobicContact CB-CB 4.21Å; N400-L403 HydrophobicContact CB-CD1 4.39Å; N400-L403 HydrophobicContact CB-CG 4.47Å; N400-L403 PolarHBondContact O-N 2.74Å; N400-F404 WeakPolarHBondContact O-CB 3.2Å; N400-F404 PolarHBondContact O-N 3.18Å; N400-W409 HydrophobicContact CB-CH2 3.6Å; N400-W409 HydrophobicContact CB-CZ2 4.33Å; N400-W409 HydrophobicContact CB-CZ3 4.19Å
401	P	85.5	Confident	86.6	Confident	79 Å²	79	70.8 Å²	70.8	51%	0.513	37%	0.367	S	S	.	.	H	α-helix	trans	-60.4	-35.8	-171.8	22.7	-34.2	0	0	0	114.3	K397	K397-P401 WeakPolarHBondContact O-CA 3.4Å
402	V	82.9	Confident	86.2	Confident	102 Å²	102	69.9 Å²	69.9	62%	0.618	36%	0.356	S	S	*	.	H	α-helix	trans	-74.2	-45.9	178.7	-178.2	0	0	0	0	111.4	N400 F404 N405	N400-V402 VanDerWaalsContact C-N 3.33Å; N400-V402 PolarHBondContact O-N 3.13Å; V402-F404 VanDerWaalsContact C-N 3.29Å; V402-F404 PolarHBondContact O-N 2.75Å; V402-N405 PolarHBondContact O-N 3.17Å
403	L	84.1	Confident	86.1	Confident	47 Å²	47	70 Å²	70	25%	0.246	36%	0.358	C	S	.	.	H	α-helix	trans	-68.3	-30.8	-179.3	-52.6	-176.2	0	0	0	111.9	V169 N400 N405 I406 W409	V169-L403 HydrophobicContact CG1-CD2 4.15Å; V169-L403 HydrophobicContact CG2-CD2 3.88Å; N400-L403 HydrophobicContact CB-CB 4.21Å; N400-L403 HydrophobicContact CB-CD1 4.39Å; N400-L403 HydrophobicContact CB-CG 4.47Å; N400-L403 PolarHBondContact O-N 2.74Å; L403-N405 PolarHBondContact O-N 2.7Å; L403-I406 HydrophobicContact CD2-CD1 4.14Å; L403-I406 WeakPolarHBondContact O-CB 3.5Å; L403-I406 PolarHBondContact O-N 3.07Å; L403-W409 HydrophobicContact CB-CD2 3.8Å; L403-W409 HydrophobicContact CB-CE3 3.65Å; L403-W409 HydrophobicContact CB-CG 4.49Å; L403-W409 HydrophobicContact CB-CH2 4.05Å; L403-W409 HydrophobicContact CB-CZ2 4.17Å; L403-W409 HydrophobicContact CB-CZ3 3.79Å; L403-W409 HydrophobicContact CD1-CH2 4.47Å; L403-W409 HydrophobicContact CD1-CZ2 3.95Å
404	F	85.9	Confident	85.9	Confident	22 Å²	22	70.7 Å²	70.7	10%	0.096	36%	0.359	C	S	.	.	H	α-helix	trans	-55.7	-32.1	176.6	-175.3	-94.6	0	0	0	112.9	E393 L396 K397 N400 V402 I406 R410	E393-F404 HydrophobicContact CG-CE2 3.86Å; E393-F404 HydrophobicContact CG-CZ 4.12Å; E393-F404 WeakPolarHBondContact OE1-CZ 3.31Å; L396-F404 HydrophobicContact CB-CD2 4.45Å; L396-F404 HydrophobicContact CD2-CD2 4.45Å; K397-F404 HydrophobicContact CB-CD2 4.29Å; K397-F404 HydrophobicContact CB-CE2 4.42Å; K397-F404 HydrophobicContact CB-CG 4.47Å; K397-F404 HydrophobicContact CG-CD1 4.45Å; N400-F404 WeakPolarHBondContact O-CB 3.2Å; N400-F404 PolarHBondContact O-N 3.18Å; V402-F404 VanDerWaalsContact C-N 3.29Å; V402-F404 PolarHBondContact O-N 2.75Å; F404-I406 PolarHBondContact O-N 2.98Å; F404-R410 HydrophobicContact CD2-CG 4.14Å; F404-R410 VanDerWaalsContact CE1-CZ 3.45Å; F404-R410 HydrophobicContact CE2-CG 4.05Å; F404-R410 VanDerWaalsContact O-CZ 3.25Å; F404-R410 PolarHBondContact O-NE 3.31Å; F404-R410 PolarHBondContact O-NH2 2.98Å
405	N	85.5	Confident	85.6	Confident	75 Å²	75	70.3 Å²	70.3	40%	0.401	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-10.5	176.5	-74.2	-16.2	0	0	0	113.9	Y162 V402 L403 P407	Y162-N405 HydrophobicContact CD1-CB 4.28Å; Y162-N405 HydrophobicContact CE1-CB 3.76Å; V402-N405 PolarHBondContact O-N 3.17Å; L403-N405 PolarHBondContact O-N 2.7Å; N405-P407 VanDerWaalsContact O-CD 3.27Å; N405-P407 WeakPolarHBondContact O-CD 3.46Å
406	I	86.3	Confident	85.2	Confident	3 Å²	3	71.2 Å²	71.2	2%	0.015	36%	0.356	C	S	.	.			trans	-87.5	105.7	175.8	-52.3	172.8	0	0	0	108.8	F165 V169 L403 F404 K408 W409 R410	F165-I406 HydrophobicContact CB-CD1 3.8Å; F165-I406 HydrophobicContact CB-CG1 4.39Å; V169-I406 HydrophobicContact CB-CD1 4.34Å; V169-I406 HydrophobicContact CG2-CD1 4.08Å; L403-I406 HydrophobicContact CD2-CD1 4.14Å; L403-I406 WeakPolarHBondContact O-CB 3.5Å; L403-I406 PolarHBondContact O-N 3.07Å; F404-I406 PolarHBondContact O-N 2.98Å; I406-K408 VanDerWaalsContact C-N 3.3Å; I406-K408 PolarHBondContact O-N 2.93Å; I406-W409 HydrophobicContact CB-CB 4.13Å; I406-W409 HydrophobicContact CG2-CB 4.18Å; I406-W409 PolarHBondContact O-N 3.21Å; I406-W409 VanDerWaalsContact O-N 3.09Å; I406-R410 PolarHBondContact O-N 2.9Å; I406-R410 VanDerWaalsContact O-N 3.12Å
407	P	81.5	Confident	85	Confident	79 Å²	79	70.5 Å²	70.5	51%	0.513	35%	0.352	S	S	.	.	H	α-helix	trans	-62.7	-35.6	-170.9	23.7	-33.9	0	0	0	113.1	N405 W409 R410 S411	N405-P407 VanDerWaalsContact O-CD 3.27Å; N405-P407 WeakPolarHBondContact O-CD 3.46Å; P407-W409 VanDerWaalsContact C-N 3.35Å; P407-W409 PolarHBondContact O-N 3.48Å; P407-R410 PolarHBondContact O-N 3.15Å; P407-S411 PolarHBondContact O-N 2.83Å; P407-S411 PolarHBondContact O-OG 3.48Å
408	K	81.5	Confident	84.5	Confident	97 Å²	97	66.3 Å²	66.3	42%	0.422	33%	0.334	S	S	.	.	H	α-helix	trans	-67.1	-30.3	177.6	-62.1	-178.1	-169	161.7	0	113.8	S166 V170 I406 S411 K412	S166-K408 PolarHBondContact OG-NZ 3.43Å; V170-K408 HydrophobicContact CG1-CB 4.45Å; V170-K408 HydrophobicContact CG2-CB 4.17Å; I406-K408 VanDerWaalsContact C-N 3.3Å; I406-K408 PolarHBondContact O-N 2.93Å; K408-S411 PolarHBondContact O-OG 3.18Å; K408-K412 PolarHBondContact O-N 3.29Å
409	W	87	Confident	83.7	Confident	25 Å²	25	60.8 Å²	60.8	10%	0.095	31%	0.308	C	S	.	.	H	α-helix	trans	-77.6	-47.5	176.3	177.6	82.5	0	0	0	109.6	V169 V170 L396 N400 L403 I406 P407 S411 K412 Q413	V169-W409 HydrophobicContact CG1-CB 4.35Å; V169-W409 VanDerWaalsContact CG1-CD1 3.45Å; V169-W409 HydrophobicContact CG1-CG 4Å; V170-W409 HydrophobicContact CG2-CB 3.73Å; L396-W409 HydrophobicContact CD2-CH2 4.08Å; L396-W409 HydrophobicContact CD2-CZ3 3.79Å; L396-W409 HydrophobicContact CG-CH2 4.05Å; L396-W409 HydrophobicContact CG-CZ3 4.19Å; N400-W409 HydrophobicContact CB-CH2 3.6Å; N400-W409 HydrophobicContact CB-CZ2 4.33Å; N400-W409 HydrophobicContact CB-CZ3 4.19Å; L403-W409 HydrophobicContact CB-CD2 3.8Å; L403-W409 HydrophobicContact CB-CE3 3.65Å; L403-W409 HydrophobicContact CB-CG 4.49Å; L403-W409 HydrophobicContact CB-CH2 4.05Å; L403-W409 HydrophobicContact CB-CZ2 4.17Å; L403-W409 HydrophobicContact CB-CZ3 3.79Å; L403-W409 HydrophobicContact CD1-CH2 4.47Å; L403-W409 HydrophobicContact CD1-CZ2 3.95Å; I406-W409 HydrophobicContact CB-CB 4.13Å; I406-W409 HydrophobicContact CG2-CB 4.18Å; I406-W409 PolarHBondContact O-N 3.21Å; I406-W409 VanDerWaalsContact O-N 3.09Å; P407-W409 VanDerWaalsContact C-N 3.35Å; P407-W409 PolarHBondContact O-N 3.48Å; W409-S411 VanDerWaalsContact C-N 3.3Å; W409-S411 PolarHBondContact O-N 3.07Å; W409-K412 PolarHBondContact O-N 2.93Å; W409-K412 VanDerWaalsContact O-N 3.1Å; W409-Q413 HydrophobicContact CD2-CG 4.04Å; W409-Q413 HydrophobicContact CE3-CG 4.35Å; W409-Q413 HydrophobicContact CH2-CG 4.11Å; W409-Q413 HydrophobicContact CZ2-CG 3.78Å; W409-Q413 HydrophobicContact CZ3-CG 4.39Å; W409-Q413 WeakPolarHBondContact O-CG 3.43Å; W409-Q413 PolarHBondContact O-N 3.27Å
410	R	86	Confident	83.4	Confident	52 Å²	52	60.4 Å²	60.4	20%	0.196	30%	0.302	C	S	.	.	H	α-helix	trans	-54.4	-45	177.1	-158	-163.6	-57.5	172.8	2.5	111.6	L396 F404 I406 P407 Q413 W414	L396-R410 HydrophobicContact CD2-CG 4.34Å; F404-R410 HydrophobicContact CD2-CG 4.14Å; F404-R410 VanDerWaalsContact CE1-CZ 3.45Å; F404-R410 HydrophobicContact CE2-CG 4.05Å; F404-R410 VanDerWaalsContact O-CZ 3.25Å; F404-R410 PolarHBondContact O-NE 3.31Å; F404-R410 PolarHBondContact O-NH2 2.98Å; I406-R410 PolarHBondContact O-N 2.9Å; I406-R410 VanDerWaalsContact O-N 3.12Å; P407-R410 PolarHBondContact O-N 3.15Å; R410-Q413 PolarHBondContact O-N 2.96Å; R410-W414 PolarHBondContact O-N 3.23Å
411	S	82.4	Confident	83	Confident	71 Å²	71	58 Å²	58	50%	0.497	29%	0.289	S	S	.	.	H	α-helix	trans	-68.8	-33.1	178.4	63.2	0	0	0	0	114	P407 K408 W409 Y415	P407-S411 PolarHBondContact O-N 2.83Å; P407-S411 PolarHBondContact O-OG 3.48Å; K408-S411 PolarHBondContact O-OG 3.18Å; W409-S411 VanDerWaalsContact C-N 3.3Å; W409-S411 PolarHBondContact O-N 3.07Å; S411-Y415 PolarHBondContact O-N 2.89Å
412	K	81.3	Confident	82.5	Confident	40 Å²	40	56 Å²	56	17%	0.174	27%	0.273	C	S	.	.	H	α-helix	trans	-65.8	-42.2	173.3	-166.3	179	-179.6	-172.9	0	111.1	N174 E177 K408 W409 Y415 Y416	N174-K412 PolarHBondContact OD1-NZ 3.47Å; E177-K412 IonicContact OE2-NZ 2.74Å; K408-K412 PolarHBondContact O-N 3.29Å; W409-K412 PolarHBondContact O-N 2.93Å; W409-K412 VanDerWaalsContact O-N 3.1Å; K412-Y415 WeakPolarHBondContact O-CB 3.27Å; K412-Y415 PolarHBondContact O-N 3.32Å; K412-Y416 HydrophobicContact CD-CE2 4.16Å; K412-Y416 WeakPolarHBondContact CE-OH 3.45Å; K412-Y416 HydrophobicContact CG-CD2 4.33Å; K412-Y416 HydrophobicContact CG-CE2 3.69Å; K412-Y416 VanDerWaalsContact O-CD2 3.32Å; K412-Y416 WeakPolarHBondContact O-CD2 3.26Å; K412-Y416 PolarHBondContact O-N 2.92Å
413	Q	87.2	Confident	82.1	Confident	54 Å²	54	57.9 Å²	57.9	25%	0.252	28%	0.275	S	S	.	.	H	α-helix	trans	-65.7	-39.8	175.9	-62.8	-57.6	-19.7	0	0	113	Y392 L396 W409 R410 Y415 A417	Y392-Q413 PolarHBondContact OH-O 3.4Å; Y392-Q413 VanDerWaalsContact OH-O 3.1Å; L396-Q413 HydrophobicContact CD1-CB 4.41Å; L396-Q413 HydrophobicContact CD2-CB 4.01Å; L396-Q413 HydrophobicContact CD2-CG 4.39Å; W409-Q413 HydrophobicContact CD2-CG 4.04Å; W409-Q413 HydrophobicContact CE3-CG 4.35Å; W409-Q413 HydrophobicContact CH2-CG 4.11Å; W409-Q413 HydrophobicContact CZ2-CG 3.78Å; W409-Q413 HydrophobicContact CZ3-CG 4.39Å; W409-Q413 WeakPolarHBondContact O-CG 3.43Å; W409-Q413 PolarHBondContact O-N 3.27Å; R410-Q413 PolarHBondContact O-N 2.96Å; Q413-Y415 VanDerWaalsContact C-N 3.3Å; Q413-Y415 PolarHBondContact O-N 2.99Å; Q413-A417 PolarHBondContact O-N 3.28Å
414	W	83.6	Confident	81.8	Confident	63 Å²	63	62.3 Å²	62.3	24%	0.239	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-33	173.1	-83.8	121.4	0	0	0	113.3	C389 Y392 E393 R410 K418	C389-W414 HydrophobicContact CB-CH2 3.81Å; C389-W414 HydrophobicContact CB-CZ3 3.98Å; C389-W414 WeakPolarHBondContact O-CH2 3.49Å; Y392-W414 HydrophobicContact CD1-CD2 4.45Å; Y392-W414 AromaticContact CD1-CE3 3.95Å; Y392-W414 HydrophobicContact CD1-CE3 3.95Å; Y392-W414 HydrophobicContact CD1-CH2 4.28Å; Y392-W414 AromaticContact CD1-CZ3 3.85Å; Y392-W414 HydrophobicContact CD1-CZ3 3.85Å; Y392-W414 HydrophobicContact CE1-CE3 4.25Å; E393-W414 HydrophobicContact CB-CH2 4.14Å; E393-W414 HydrophobicContact CB-CZ2 3.8Å; E393-W414 HydrophobicContact CG-CZ2 4.05Å; R410-W414 PolarHBondContact O-N 3.23Å; W414-K418 VanDerWaalsContact O-CB 3.25Å; W414-K418 WeakPolarHBondContact O-CB 3.15Å; W414-K418 PolarHBondContact O-N 3.07Å; W414-K418 VanDerWaalsContact O-N 3.13Å
415	Y	80.8	Confident	81.4	Confident	131 Å²	131	64 Å²	64	51%	0.514	30%	0.302	S	S	.	.	H	α-helix	trans	-67.1	-47	178.6	179.7	-97.1	0	0	0	111.9	S411 K412 Q413 K418 A419 L1728	S411-Y415 PolarHBondContact O-N 2.89Å; K412-Y415 WeakPolarHBondContact O-CB 3.27Å; K412-Y415 PolarHBondContact O-N 3.32Å; Q413-Y415 VanDerWaalsContact C-N 3.3Å; Q413-Y415 PolarHBondContact O-N 2.99Å; Y415-K418 PolarHBondContact O-N 3.45Å; Y415-A419 WeakPolarHBondContact O-CB 3.32Å; Y415-A419 PolarHBondContact O-N 2.95Å; Y415-L1728 HydrophobicContact CE1-CD1 4.32Å; Y415-L1728 HydrophobicContact CE2-CD1 4.45Å; Y415-L1728 WeakPolarHBondContact OH-CD1 3.44Å
416	Y	82.4	Confident	80.7	Confident	104 Å²	104	63.8 Å²	63.8	41%	0.408	30%	0.298	S	S	.	.	H	α-helix	trans	-65.6	-51.1	179.3	-65.2	-53.8	0	0	0	112.4	K412 K418 A419 E420	K412-Y416 HydrophobicContact CD-CE2 4.16Å; K412-Y416 WeakPolarHBondContact CE-OH 3.45Å; K412-Y416 HydrophobicContact CG-CD2 4.33Å; K412-Y416 HydrophobicContact CG-CE2 3.69Å; K412-Y416 VanDerWaalsContact O-CD2 3.32Å; K412-Y416 WeakPolarHBondContact O-CD2 3.26Å; K412-Y416 PolarHBondContact O-N 2.92Å; Y416-K418 PolarHBondContact O-N 3.43Å; Y416-A419 WeakPolarHBondContact O-CA 3.47Å; Y416-A419 WeakPolarHBondContact O-CB 3.18Å; Y416-A419 PolarHBondContact O-N 3.36Å; Y416-E420 WeakPolarHBondContact O-CB 3.32Å; Y416-E420 PolarHBondContact O-N 3.27Å
417	A	84.6	Confident	80.3	Confident	1 Å²	1	65 Å²	65	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-30.6	178.1	0	0	0	0	0	113.1	Y388 Y392 Q413 Y421	Y388-A417 HydrophobicContact CE1-CB 4.44Å; Y392-A417 HydrophobicContact CD1-CB 4.14Å; Y392-A417 HydrophobicContact CD2-CB 4.38Å; Y392-A417 HydrophobicContact CE1-CB 3.54Å; Y392-A417 HydrophobicContact CE2-CB 3.85Å; Q413-A417 PolarHBondContact O-N 3.28Å; A417-Y421 VanDerWaalsContact O-CB 3.23Å; A417-Y421 WeakPolarHBondContact O-CB 3.33Å; A417-Y421 PolarHBondContact O-N 3.4Å; A417-Y421 VanDerWaalsContact O-N 3.12Å
418	K	77.5	Confident	80.1	Confident	35 Å²	35	64.6 Å²	64.6	15%	0.152	30%	0.298	C	S	.	.	H	α-helix	trans	-72.5	-38.1	171.4	-178.3	160	-175.6	152.9	0	112.9	W385 W414 Y415 Y416 L422 N1400 S1404	W385-K418 HydrophobicContact CH2-CB 3.78Å; W385-K418 HydrophobicContact CH2-CD 4.07Å; W385-K418 HydrophobicContact CH2-CG 3.79Å; W385-K418 HydrophobicContact CZ2-CB 4.48Å; W385-K418 HydrophobicContact CZ2-CD 3.96Å; W385-K418 HydrophobicContact CZ2-CG 4.21Å; W414-K418 VanDerWaalsContact O-CB 3.25Å; W414-K418 WeakPolarHBondContact O-CB 3.15Å; W414-K418 PolarHBondContact O-N 3.07Å; W414-K418 VanDerWaalsContact O-N 3.13Å; Y415-K418 PolarHBondContact O-N 3.45Å; Y416-K418 PolarHBondContact O-N 3.43Å; K418-L422 HydrophobicContact CD-CD1 4.4Å; K418-L422 VanDerWaalsContact CE-CD1 3.49Å; K418-L422 HydrophobicContact CG-CD1 3.89Å; K418-L422 HydrophobicContact CG-CG 4.31Å; K418-L422 WeakPolarHBondContact O-CB 3.48Å; K418-L422 VanDerWaalsContact O-CG 3.27Å; K418-L422 WeakPolarHBondContact O-CG 3.47Å; K418-L422 PolarHBondContact O-N 3.33Å; K418-L422 VanDerWaalsContact O-N 3.15Å; K418-N1400 PolarHBondContact NZ-O 2.87Å; K418-S1404 PolarHBondContact NZ-OG 2.79Å
419	A	74.4	Confident	79.8	Confident	16 Å²	16	61.2 Å²	61.2	13%	0.132	28%	0.284	C	S	.	.	H	α-helix	trans	-64.4	-48.2	178	0	0	0	0	0	111.1	Y415 Y416 L422 Q423 L1728	Y415-A419 WeakPolarHBondContact O-CB 3.32Å; Y415-A419 PolarHBondContact O-N 2.95Å; Y416-A419 WeakPolarHBondContact O-CA 3.47Å; Y416-A419 WeakPolarHBondContact O-CB 3.18Å; Y416-A419 PolarHBondContact O-N 3.36Å; A419-L422 PolarHBondContact O-N 3.35Å; A419-Q423 WeakPolarHBondContact O-CB 3.3Å; A419-Q423 PolarHBondContact O-N 3.16Å; A419-L1728 HydrophobicContact CB-CD1 3.5Å; A419-L1728 VanDerWaalsContact CB-CD1 3.5Å; A419-L1728 HydrophobicContact CB-CD2 3.89Å; A419-L1728 HydrophobicContact CB-CG 4.35Å
420	E	82.3	Confident	79.4	Confident	113 Å²	113	61.1 Å²	61.1	53%	0.528	29%	0.285	S	S	.	.	H	α-helix	trans	-58.5	-58.4	177.3	-171.8	170.5	-139.7	0	0	111.3	Y416 L422 Q423 E424	Y416-E420 WeakPolarHBondContact O-CB 3.32Å; Y416-E420 PolarHBondContact O-N 3.27Å; E420-L422 VanDerWaalsContact C-N 3.3Å; E420-L422 PolarHBondContact O-N 2.93Å; E420-Q423 PolarHBondContact O-N 3.01Å; E420-E424 PolarHBondContact O-N 3.36Å
421	Y	81	Confident	79.3	Confident	10 Å²	10	62.5 Å²	62.5	4%	0.039	29%	0.293	C	S	.	.	H	α-helix	trans	-56.2	-40.2	179	-176	-79.7	0	0	0	113.2	F381 W385 Y388 A417 H425	F381-Y421 AromaticContact CE2-CE1 3.98Å; F381-Y421 HydrophobicContact CE2-CE1 3.98Å; F381-Y421 AromaticContact CZ-CE1 3.9Å; F381-Y421 HydrophobicContact CZ-CE1 3.9Å; W385-Y421 HydrophobicContact CB-CE1 4.35Å; W385-Y421 HydrophobicContact CD2-CD1 4.5Å; W385-Y421 HydrophobicContact CD2-CE1 4.4Å; W385-Y421 AromaticContact CE3-CD1 3.4Å; W385-Y421 HydrophobicContact CE3-CD1 3.4Å; W385-Y421 HydrophobicContact CE3-CD2 4.13Å; W385-Y421 AromaticContact CE3-CE1 3.57Å; W385-Y421 HydrophobicContact CE3-CE1 3.57Å; W385-Y421 HydrophobicContact CE3-CE2 4.25Å; W385-Y421 AromaticContact CE3-CG 3.72Å; W385-Y421 HydrophobicContact CE3-CG 3.72Å; W385-Y421 AromaticContact CZ3-CD1 3.68Å; W385-Y421 HydrophobicContact CZ3-CD1 3.68Å; W385-Y421 HydrophobicContact CZ3-CD2 4.26Å; W385-Y421 HydrophobicContact CZ3-CE1 4.32Å; W385-Y421 AromaticContact CZ3-CG 3.66Å; W385-Y421 HydrophobicContact CZ3-CG 3.66Å; W385-Y421 PolarHBondContact N-OH 3.45Å; Y388-Y421 AromaticContact CD1-CD2 3.71Å; Y388-Y421 HydrophobicContact CD1-CD2 3.71Å; Y388-Y421 HydrophobicContact CD1-CE2 4.14Å; Y388-Y421 HydrophobicContact CD1-CG 4.32Å; Y388-Y421 AromaticContact CD2-CD2 3.86Å; Y388-Y421 HydrophobicContact CD2-CD2 3.86Å; Y388-Y421 HydrophobicContact CD2-CE2 4.09Å; Y388-Y421 AromaticContact CE1-CD2 3.88Å; Y388-Y421 HydrophobicContact CE1-CD2 3.88Å; Y388-Y421 HydrophobicContact CE1-CG 4.27Å; Y388-Y421 HydrophobicContact CE2-CD2 4Å; Y388-Y421 AromaticContact CG-CD2 3.71Å; Y388-Y421 HydrophobicContact CG-CD2 3.71Å; Y388-Y421 AromaticContact CG-CE2 3.8Å; Y388-Y421 HydrophobicContact CG-CE2 3.8Å; A417-Y421 VanDerWaalsContact O-CB 3.23Å; A417-Y421 WeakPolarHBondContact O-CB 3.33Å; A417-Y421 PolarHBondContact O-N 3.4Å; A417-Y421 VanDerWaalsContact O-N 3.12Å; Y421-H425 AromaticContact CD1-CD2 3.77Å; Y421-H425 AromaticContact CD2-CD2 3.57Å; Y421-H425 AromaticContact CD2-NE2 3.85Å; Y421-H425 HydrophobicContact CE1-CB 4.32Å; Y421-H425 AromaticContact CE1-CD2 3.6Å; Y421-H425 AromaticContact CE2-CD2 3.42Å; Y421-H425 VanDerWaalsContact CE2-CD2 3.42Å; Y421-H425 WeakPolarHBondContact CE2-CD2 3.42Å; Y421-H425 AromaticContact CE2-NE2 3.51Å; Y421-H425 AromaticContact CG-CD2 3.75Å; Y421-H425 AromaticContact CZ-CD2 3.42Å; Y421-H425 VanDerWaalsContact CZ-CD2 3.42Å; Y421-H425 AromaticContact CZ-NE2 3.83Å; Y421-H425 WeakPolarHBondContact O-CB 3.22Å; Y421-H425 PolarHBondContact O-CD2 3.23Å; Y421-H425 VanDerWaalsContact O-CD2 3.27Å; Y421-H425 PolarHBondContact O-N 2.84Å
422	L	74.4	Confident	79.4	Confident	36 Å²	36	62.2 Å²	62.2	19%	0.188	28%	0.282	C	S	.	.	H	α-helix	trans	-73	-28.5	178.3	-72.9	177.3	0	0	0	112.9	F381 K418 A419 E420 K426 L1730	F381-L422 HydrophobicContact CZ-CD2 4.18Å; K418-L422 HydrophobicContact CD-CD1 4.4Å; K418-L422 VanDerWaalsContact CE-CD1 3.49Å; K418-L422 HydrophobicContact CG-CD1 3.89Å; K418-L422 HydrophobicContact CG-CG 4.31Å; K418-L422 WeakPolarHBondContact O-CB 3.48Å; K418-L422 VanDerWaalsContact O-CG 3.27Å; K418-L422 WeakPolarHBondContact O-CG 3.47Å; K418-L422 PolarHBondContact O-N 3.33Å; K418-L422 VanDerWaalsContact O-N 3.15Å; A419-L422 PolarHBondContact O-N 3.35Å; E420-L422 VanDerWaalsContact C-N 3.3Å; E420-L422 PolarHBondContact O-N 2.93Å; L422-K426 PolarHBondContact O-N 3.5Å; L422-L1730 HydrophobicContact CB-CD1 3.67Å; L422-L1730 HydrophobicContact CB-CD2 4.4Å; L422-L1730 HydrophobicContact CD1-CD1 3.99Å; L422-L1730 HydrophobicContact CG-CD1 4.44Å; L422-L1730 WeakPolarHBondContact O-CD2 3.4Å
423	Q	73.9	Confident	79.4	Confident	142 Å²	142	60.7 Å²	60.7	66%	0.664	28%	0.276	S	S	*	.	H	α-helix	trans	-74.3	-42.7	176.6	-179.2	169.7	-19.1	0	0	111.3	A419 E420	A419-Q423 WeakPolarHBondContact O-CB 3.3Å; A419-Q423 PolarHBondContact O-N 3.16Å; E420-Q423 PolarHBondContact O-N 3.01Å
424	E	79.1	Confident	79.4	Confident	139 Å²	139	59.7 Å²	59.7	65%	0.65	27%	0.272	S	S	*	.	H	α-helix	trans	-62.8	-55.2	173	-66.1	-173.5	136.3	0	0	110.7	E420 K426	E420-E424 PolarHBondContact O-N 3.36Å; E424-K426 VanDerWaalsContact C-N 3.26Å; E424-K426 PolarHBondContact O-N 2.99Å; E424-K426 VanDerWaalsContact O-N 3.12Å
425	H	77.2	Confident	79.7	Confident	57 Å²	57	59.8 Å²	59.8	26%	0.264	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	28.6	-174.2	-59.7	-70.8	0	0	0	114.7	F381 Y421 L427 D428	F381-H425 HydrophobicContact CE2-CB 4.01Å; Y421-H425 AromaticContact CD1-CD2 3.77Å; Y421-H425 AromaticContact CD2-CD2 3.57Å; Y421-H425 AromaticContact CD2-NE2 3.85Å; Y421-H425 HydrophobicContact CE1-CB 4.32Å; Y421-H425 AromaticContact CE1-CD2 3.6Å; Y421-H425 AromaticContact CE2-CD2 3.42Å; Y421-H425 VanDerWaalsContact CE2-CD2 3.42Å; Y421-H425 WeakPolarHBondContact CE2-CD2 3.42Å; Y421-H425 AromaticContact CE2-NE2 3.51Å; Y421-H425 AromaticContact CG-CD2 3.75Å; Y421-H425 AromaticContact CZ-CD2 3.42Å; Y421-H425 VanDerWaalsContact CZ-CD2 3.42Å; Y421-H425 AromaticContact CZ-NE2 3.83Å; Y421-H425 WeakPolarHBondContact O-CB 3.22Å; Y421-H425 PolarHBondContact O-CD2 3.23Å; Y421-H425 VanDerWaalsContact O-CD2 3.27Å; Y421-H425 PolarHBondContact O-N 2.84Å; H425-L427 VanDerWaalsContact C-N 3.3Å; H425-L427 PolarHBondContact O-N 3.27Å; H425-D428 VanDerWaalsContact CA-OD1 3.31Å; H425-D428 WeakPolarHBondContact CA-OD1 3.43Å; H425-D428 HydrophobicContact CB-CB 4.5Å; H425-D428 IonicContact CE1-OD2 3.9Å; H425-D428 IonicContact CG-OD2 2.73Å; H425-D428 IonicContact ND1-OD1 2.69Å; H425-D428 IonicContact ND1-OD2 3.87Å; H425-D428 PolarHBondContact ND1-OD2 3.39Å
426	K	70.1	Confident	80	Confident	72 Å²	72	55.9 Å²	55.9	31%	0.313	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-36.7	179.6	177.4	-173.7	170.8	-170.2	0	112.2	L422 E424 E460 L1730	L422-K426 PolarHBondContact O-N 3.5Å; E424-K426 VanDerWaalsContact C-N 3.26Å; E424-K426 PolarHBondContact O-N 2.99Å; E424-K426 VanDerWaalsContact O-N 3.12Å; K426-E460 IonicContact NZ-OE2 2.61Å; K426-E460 PolarHBondContact NZ-OE2 2.89Å; K426-L1730 HydrophobicContact CB-CD2 4.32Å; K426-L1730 HydrophobicContact CG-CD2 4.22Å
427	L	78.3	Confident	80.2	Confident	29 Å²	29	50.9 Å²	50.9	15%	0.152	25%	0.249	C	C	.	.	S	Bend	trans	-106.6	-19.4	-169.6	-61.9	-179.5	0	0	0	114.2	H425 I429 H430 E431 L456 R457	H425-L427 VanDerWaalsContact C-N 3.3Å; H425-L427 PolarHBondContact O-N 3.27Å; L427-I429 PolarHBondContact O-N 3.48Å; L427-H430 WeakPolarHBondContact O-CA 3.46Å; L427-H430 WeakPolarHBondContact O-CB 3.27Å; L427-H430 PolarHBondContact O-N 3.04Å; L427-E431 PolarHBondContact O-N 3.25Å; L427-L456 HydrophobicContact CD2-CB 4.05Å; L427-L456 HydrophobicContact CD2-CD1 4.39Å; L427-R457 HydrophobicContact CD1-CB 4.32Å; L427-R457 HydrophobicContact CD1-CG 4.44Å
428	D	77.5	Confident	80.3	Confident	70 Å²	70	56.1 Å²	56.1	37%	0.374	28%	0.275	S	S	.	.	H	α-helix	trans	-48.5	-38.9	-175.4	-66.5	44.3	0	0	0	114.2	H425 E431 Y432	H425-D428 VanDerWaalsContact CA-OD1 3.31Å; H425-D428 WeakPolarHBondContact CA-OD1 3.43Å; H425-D428 HydrophobicContact CB-CB 4.5Å; H425-D428 IonicContact CE1-OD2 3.9Å; H425-D428 IonicContact CG-OD2 2.73Å; H425-D428 IonicContact ND1-OD1 2.69Å; H425-D428 IonicContact ND1-OD2 3.87Å; H425-D428 PolarHBondContact ND1-OD2 3.39Å; D428-E431 PolarHBondContact O-N 3.43Å; D428-Y432 VanDerWaalsContact O-CB 3.24Å; D428-Y432 WeakPolarHBondContact O-CB 3.41Å; D428-Y432 PolarHBondContact O-N 3.01Å
429	I	75.1	Confident	80.9	Confident	25 Å²	25	58.2 Å²	58.2	13%	0.128	30%	0.295	C	S	.	.	H	α-helix	trans	-68.9	-39.9	-179.9	-48.7	178.5	0	0	0	110.5	A377 F381 L427 V433 F1408	A377-I429 HydrophobicContact CB-CG2 4.07Å; F381-I429 HydrophobicContact CB-CD1 4.22Å; F381-I429 HydrophobicContact CB-CG1 4.26Å; F381-I429 HydrophobicContact CD1-CD1 4.09Å; F381-I429 HydrophobicContact CD2-CD1 3.79Å; F381-I429 HydrophobicContact CD2-CG1 3.75Å; F381-I429 HydrophobicContact CE1-CD1 4.43Å; F381-I429 HydrophobicContact CE2-CD1 4.14Å; F381-I429 HydrophobicContact CE2-CG1 4.31Å; F381-I429 HydrophobicContact CG-CD1 3.76Å; F381-I429 HydrophobicContact CG-CG1 4.05Å; F381-I429 HydrophobicContact CZ-CD1 4.45Å; L427-I429 PolarHBondContact O-N 3.48Å; I429-V433 HydrophobicContact CG2-CG2 4.49Å; I429-V433 WeakPolarHBondContact O-CB 3.07Å; I429-V433 WeakPolarHBondContact O-CG2 3.42Å; I429-V433 PolarHBondContact O-N 2.77Å; I429-F1408 HydrophobicContact CB-CE2 4.45Å; I429-F1408 HydrophobicContact CD1-CD2 4.27Å; I429-F1408 HydrophobicContact CD1-CE2 4.36Å; I429-F1408 HydrophobicContact CG2-CD2 4.44Å; I429-F1408 HydrophobicContact CG2-CE2 3.54Å; I429-F1408 HydrophobicContact CG2-CZ 3.68Å
430	H	77.8	Confident	81.3	Confident	24 Å²	24	61.2 Å²	61.2	11%	0.111	31%	0.308	C	S	.	.	H	α-helix	trans	-68.2	-40	174.8	-70.1	-106.1	0	0	0	111.1	L427 L434 D452 L453	L427-H430 WeakPolarHBondContact O-CA 3.46Å; L427-H430 WeakPolarHBondContact O-CB 3.27Å; L427-H430 PolarHBondContact O-N 3.04Å; H430-L434 WeakPolarHBondContact O-CB 3.12Å; H430-L434 PolarHBondContact O-N 2.76Å; H430-D452 IonicContact CE1-OD2 2.86Å; H430-D452 PolarHBondContact CE1-OD2 2.88Å; H430-D452 VanDerWaalsContact CE1-OD2 3.31Å; H430-D452 IonicContact ND1-OD2 3.91Å; H430-L453 HydrophobicContact CB-CD1 4.03Å
431	E	84.3	Confident	81.4	Confident	80 Å²	80	57.8 Å²	57.8	37%	0.374	30%	0.304	S	S	.	.	H	α-helix	trans	-65.9	-44.9	177.5	-69	-174.7	-148.8	0	0	112.1	L427 D428 L434 S435 L453 R457	L427-E431 PolarHBondContact O-N 3.25Å; D428-E431 PolarHBondContact O-N 3.43Å; E431-L434 PolarHBondContact O-N 3.34Å; E431-S435 PolarHBondContact O-N 3.18Å; E431-L453 HydrophobicContact CB-CD1 4.43Å; E431-L453 HydrophobicContact CG-CD1 3.36Å; E431-R457 VanDerWaalsContact CD-NH2 3.26Å; E431-R457 IonicContact OE1-CZ 3.53Å; E431-R457 IonicContact OE1-NH2 3.52Å; E431-R457 PolarHBondContact OE1-NH2 3Å; E431-R457 IonicContact OE2-NH2 3.83Å
432	Y	84.1	Confident	81.5	Confident	65 Å²	65	57.4 Å²	57.4	26%	0.255	30%	0.302	S	S	.	.	H	α-helix	trans	-61.3	-51.7	175.7	-175.7	-85	0	0	0	111.4	E376 A377 L380 D428 L434 S435 K436	E376-Y432 VanDerWaalsContact CD-OH 3.26Å; E376-Y432 HydrophobicContact CG-CE1 4.44Å; E376-Y432 PolarHBondContact OE1-OH 2.85Å; E376-Y432 VanDerWaalsContact OE1-OH 3.08Å; A377-Y432 HydrophobicContact CB-CD1 3.58Å; A377-Y432 HydrophobicContact CB-CE1 4.08Å; A377-Y432 HydrophobicContact CB-CG 4.49Å; L380-Y432 HydrophobicContact CD1-CE1 4.09Å; L380-Y432 HydrophobicContact CD1-CE2 3.68Å; L380-Y432 WeakPolarHBondContact CD1-OH 3.49Å; D428-Y432 VanDerWaalsContact O-CB 3.24Å; D428-Y432 WeakPolarHBondContact O-CB 3.41Å; D428-Y432 PolarHBondContact O-N 3.01Å; Y432-L434 VanDerWaalsContact C-N 3.33Å; Y432-L434 PolarHBondContact O-N 3.04Å; Y432-S435 PolarHBondContact O-N 3.33Å; Y432-S435 PolarHBondContact O-OG 3.03Å; Y432-K436 HydrophobicContact CD1-CG 4.18Å; Y432-K436 HydrophobicContact CE1-CG 3.62Å; Y432-K436 PolarHBondContact O-N 3.39Å; Y432-K436 WeakPolarHBondContact OH-CE 3.21Å; Y432-K436 PolarHBondContact OH-NZ 3.39Å
433	V	81.9	Confident	81.9	Confident	8 Å²	8	60.3 Å²	60.3	5%	0.048	32%	0.318	C	S	.	.	H	α-helix	trans	-60.8	-42.6	179.5	172.5	0	0	0	0	110.8	F370 I373 V374 A377 I429 S435 K436 C437 I449	F370-V433 HydrophobicContact CE2-CG1 3.71Å; I373-V433 HydrophobicContact CG2-CB 4.3Å; I373-V433 HydrophobicContact CG2-CG1 4.05Å; I373-V433 HydrophobicContact CG2-CG2 4.23Å; V374-V433 HydrophobicContact CG2-CG1 4.22Å; V374-V433 HydrophobicContact CG2-CG2 4.31Å; A377-V433 HydrophobicContact CB-CG2 3.54Å; I429-V433 HydrophobicContact CG2-CG2 4.49Å; I429-V433 WeakPolarHBondContact O-CB 3.07Å; I429-V433 WeakPolarHBondContact O-CG2 3.42Å; I429-V433 PolarHBondContact O-N 2.77Å; V433-S435 PolarHBondContact O-N 2.96Å; V433-K436 PolarHBondContact O-N 3.44Å; V433-C437 WeakPolarHBondContact O-CB 3.35Å; V433-C437 PolarHBondContact O-N 2.86Å; V433-C437 PolarHBondContact O-SG 2.87Å; V433-I449 HydrophobicContact CG1-CD1 3.66Å
434	L	86.3	Confident	82	Confident	33 Å²	33	54 Å²	54	17%	0.173	29%	0.289	C	S	.	.	H	α-helix	trans	-58.5	-48.3	175.4	179.7	58.2	0	0	0	111.8	H430 E431 Y432 K436 C437 I438 A446 I449	H430-L434 WeakPolarHBondContact O-CB 3.12Å; H430-L434 PolarHBondContact O-N 2.76Å; E431-L434 PolarHBondContact O-N 3.34Å; Y432-L434 VanDerWaalsContact C-N 3.33Å; Y432-L434 PolarHBondContact O-N 3.04Å; L434-K436 VanDerWaalsContact C-N 3.32Å; L434-K436 PolarHBondContact O-N 3.47Å; L434-C437 PolarHBondContact O-N 3.04Å; L434-I438 HydrophobicContact CD1-CD1 4.03Å; L434-I438 HydrophobicContact CD1-CG1 4.41Å; L434-I438 HydrophobicContact CG-CD1 4.09Å; L434-I438 WeakPolarHBondContact O-CG1 3.44Å; L434-I438 PolarHBondContact O-N 3.21Å; L434-A446 HydrophobicContact CD1-CB 4.22Å; L434-A446 VanDerWaalsContact CD1-O 3.27Å; L434-A446 WeakPolarHBondContact CD1-O 3.4Å; L434-I449 HydrophobicContact CB-CG2 4.17Å
435	S	90.3	Very high	82	Confident	65 Å²	65	49.3 Å²	49.3	46%	0.455	27%	0.266	S	S	.	.	H	α-helix	trans	-60.1	-40.6	179	77.2	0	0	0	0	112.6	E431 Y432 V433 I438 S439	E431-S435 PolarHBondContact O-N 3.18Å; Y432-S435 PolarHBondContact O-N 3.33Å; Y432-S435 PolarHBondContact O-OG 3.03Å; V433-S435 PolarHBondContact O-N 2.96Å; S435-I438 PolarHBondContact O-N 3.43Å; S435-S439 PolarHBondContact O-N 3.4Å
436	K	86.9	Confident	82.3	Confident	49 Å²	49	47.1 Å²	47.1	21%	0.213	26%	0.258	C	S	.	.	H	α-helix	trans	-73.8	-32.4	176.7	-75.7	-57.3	-163.3	84	0	113.3	I373 E376 Y432 V433 L434 S439 N440	I373-K436 HydrophobicContact CB-CB 4.44Å; I373-K436 HydrophobicContact CD1-CB 4.24Å; I373-K436 HydrophobicContact CG1-CB 4.13Å; I373-K436 HydrophobicContact CG2-CB 3.45Å; I373-K436 VanDerWaalsContact CG2-CB 3.45Å; I373-K436 HydrophobicContact CG2-CG 4.21Å; E376-K436 IonicContact OE1-NZ 2.71Å; E376-K436 PolarHBondContact OE1-NZ 2.71Å; E376-K436 IonicContact OE2-NZ 2.75Å; E376-K436 PolarHBondContact OE2-NZ 3.4Å; Y432-K436 HydrophobicContact CD1-CG 4.18Å; Y432-K436 HydrophobicContact CE1-CG 3.62Å; Y432-K436 PolarHBondContact O-N 3.39Å; Y432-K436 WeakPolarHBondContact OH-CE 3.21Å; Y432-K436 PolarHBondContact OH-NZ 3.39Å; V433-K436 PolarHBondContact O-N 3.44Å; L434-K436 VanDerWaalsContact C-N 3.32Å; L434-K436 PolarHBondContact O-N 3.47Å; K436-S439 WeakPolarHBondContact CA-OG 3.49Å; K436-S439 PolarHBondContact O-OG 2.68Å; K436-N440 VanDerWaalsContact O-CB 3.26Å; K436-N440 WeakPolarHBondContact O-CB 3.43Å; K436-N440 VanDerWaalsContact O-CG 3.25Å; K436-N440 PolarHBondContact O-N 2.77Å; K436-N440 VanDerWaalsContact O-N 3.12Å; K436-N440 PolarHBondContact O-ND2 2.91Å; K436-N440 VanDerWaalsContact O-ND2 3.14Å
437	C	86.3	Confident	82.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.4	-42.7	172.1	-75.7	0	0	0	0	110.9	V433 L434 N440 G441 L442 A446	V433-C437 WeakPolarHBondContact O-CB 3.35Å; V433-C437 PolarHBondContact O-N 2.86Å; V433-C437 PolarHBondContact O-SG 2.87Å; L434-C437 PolarHBondContact O-N 3.04Å; C437-N440 PolarHBondContact O-N 2.79Å; C437-G441 PolarHBondContact O-N 3.31Å; C437-L442 HydrophobicContact CB-CB 4.1Å; C437-L442 PolarHBondContact O-N 3.37Å; C437-A446 HydrophobicContact CB-CB 3.94Å
438	I	88.5	Confident	82.8	Confident	110 Å²	110	44.9 Å²	44.9	56%	0.564	25%	0.247	S	C	*	.	H	α-helix	trans	-63.8	-47.8	175	-65.1	165.1	0	0	0	110.7	L434 S435 N440 G441 A446	L434-I438 HydrophobicContact CD1-CD1 4.03Å; L434-I438 HydrophobicContact CD1-CG1 4.41Å; L434-I438 HydrophobicContact CG-CD1 4.09Å; L434-I438 WeakPolarHBondContact O-CG1 3.44Å; L434-I438 PolarHBondContact O-N 3.21Å; S435-I438 PolarHBondContact O-N 3.43Å; I438-N440 PolarHBondContact O-N 2.97Å; I438-G441 PolarHBondContact O-N 3.22Å; I438-A446 HydrophobicContact CG1-CB 4Å
439	S	88.5	Confident	83	Confident	80 Å²	80	41.8 Å²	41.8	56%	0.559	23%	0.231	S	C	*	.	H	α-helix	trans	-63.9	-23.7	-179.5	75.3	0	0	0	0	114.1	S435 K436	S435-S439 PolarHBondContact O-N 3.4Å; K436-S439 WeakPolarHBondContact CA-OG 3.49Å; K436-S439 PolarHBondContact O-OG 2.68Å
440	N	83.8	Confident	83.4	Confident	78 Å²	78	41.7 Å²	41.7	42%	0.417	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	4.3	-177.1	-67.7	-26	0	0	0	114	I373 K436 C437 I438 L442	I373-N440 HydrophobicContact CD1-CB 4.47Å; I373-N440 WeakPolarHBondContact CD1-ND2 3.47Å; K436-N440 VanDerWaalsContact O-CB 3.26Å; K436-N440 WeakPolarHBondContact O-CB 3.43Å; K436-N440 VanDerWaalsContact O-CG 3.25Å; K436-N440 PolarHBondContact O-N 2.77Å; K436-N440 VanDerWaalsContact O-N 3.12Å; K436-N440 PolarHBondContact O-ND2 2.91Å; K436-N440 VanDerWaalsContact O-ND2 3.14Å; C437-N440 PolarHBondContact O-N 2.79Å; I438-N440 PolarHBondContact O-N 2.97Å; N440-L442 HydrophobicContact CB-CD1 4.25Å; N440-L442 HydrophobicContact CB-CG 4.35Å
441	G	83.5	Confident	83.5	Confident	42 Å²	42	41.9 Å²	41.9	43%	0.433	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	34	179.7	0	0	0	0	0	114.2	C437 I438 D443	C437-G441 PolarHBondContact O-N 3.31Å; I438-G441 PolarHBondContact O-N 3.22Å; G441-D443 VanDerWaalsContact C-N 3.33Å; G441-D443 PolarHBondContact O-N 2.59Å
442	L	84	Confident	83.2	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	22%	0.219	C	C	.	.			trans	-94.6	54.5	179.6	-67	169.6	0	0	0	111.1	Q366 K369 I373 C437 N440 S444 Y445 A446	Q366-L442 HydrophobicContact CB-CD2 3.71Å; Q366-L442 HydrophobicContact CG-CD2 3.72Å; K369-L442 HydrophobicContact CB-CD1 4.16Å; K369-L442 HydrophobicContact CB-CD2 4.45Å; I373-L442 HydrophobicContact CD1-CD1 3.4Å; C437-L442 HydrophobicContact CB-CB 4.1Å; C437-L442 PolarHBondContact O-N 3.37Å; N440-L442 HydrophobicContact CB-CD1 4.25Å; N440-L442 HydrophobicContact CB-CG 4.35Å; L442-S444 PolarHBondContact O-N 3.31Å; L442-Y445 HydrophobicContact CB-CD2 4.37Å; L442-Y445 HydrophobicContact CD2-CD2 4.43Å; L442-Y445 PolarHBondContact O-N 3Å; L442-A446 WeakPolarHBondContact O-CB 3.26Å; L442-A446 PolarHBondContact O-N 3.11Å
443	D	81.8	Confident	83	Confident	96 Å²	96	35.9 Å²	35.9	51%	0.513	21%	0.211	S	C	.	.	H	α-helix	trans	-51.7	-35.4	-170	-55.8	-17.4	0	0	0	114.2	V275 G441 F447	V275-D443 HydrophobicContact CG1-CB 4.06Å; V275-D443 HydrophobicContact CG2-CB 4.48Å; G441-D443 VanDerWaalsContact C-N 3.33Å; G441-D443 PolarHBondContact O-N 2.59Å; D443-F447 WeakPolarHBondContact O-CB 3.31Å; D443-F447 PolarHBondContact O-N 3.28Å
444	S	76.8	Confident	83.2	Confident	10 Å²	10	37 Å²	37	7%	0.07	22%	0.221	C	C	.	.	H	α-helix	trans	-65.3	-47.8	176.8	45.6	0	0	0	0	112.7	L442 L448	L442-S444 PolarHBondContact O-N 3.31Å; S444-L448 WeakPolarHBondContact O-CG 3.35Å; S444-L448 PolarHBondContact O-N 3.42Å
445	Y	78.3	Confident	83	Confident	41 Å²	41	35.5 Å²	35.5	16%	0.161	21%	0.213	C	C	.	.	H	α-helix	trans	-74.2	-38.6	178.3	-63.3	-98.4	0	0	0	110.9	Q366 E367 F370 L442 F447 L448 I449	Q366-Y445 HydrophobicContact CB-CE2 3.99Å; E367-Y445 WeakPolarHBondContact CA-OH 3.44Å; E367-Y445 WeakPolarHBondContact OE2-CE1 3.41Å; E367-Y445 PolarHBondContact OE2-OH 2.97Å; F370-Y445 HydrophobicContact CB-CD1 3.86Å; F370-Y445 HydrophobicContact CB-CE1 3.83Å; F370-Y445 HydrophobicContact CB-CG 4.23Å; F370-Y445 AromaticContact CD1-CD1 3.45Å; F370-Y445 HydrophobicContact CD1-CD1 3.45Å; F370-Y445 VanDerWaalsContact CD1-CD1 3.45Å; F370-Y445 AromaticContact CD1-CE1 3.44Å; F370-Y445 HydrophobicContact CD1-CE1 3.44Å; F370-Y445 VanDerWaalsContact CD1-CE1 3.44Å; F370-Y445 HydrophobicContact CD1-CG 4.5Å; F370-Y445 AromaticContact CD2-CD1 3.65Å; F370-Y445 HydrophobicContact CD2-CD1 3.65Å; F370-Y445 HydrophobicContact CD2-CE1 4.37Å; F370-Y445 HydrophobicContact CD2-CG 4.01Å; F370-Y445 AromaticContact CE1-CD1 3.89Å; F370-Y445 HydrophobicContact CE1-CD1 3.89Å; F370-Y445 HydrophobicContact CE1-CE1 4.13Å; F370-Y445 HydrophobicContact CE2-CD1 4.08Å; F370-Y445 AromaticContact CG-CD1 3.32Å; F370-Y445 HydrophobicContact CG-CD1 3.32Å; F370-Y445 AromaticContact CG-CE1 3.59Å; F370-Y445 HydrophobicContact CG-CE1 3.59Å; F370-Y445 AromaticContact CG-CG 3.96Å; F370-Y445 HydrophobicContact CG-CG 3.96Å; F370-Y445 HydrophobicContact CZ-CD1 4.19Å; L442-Y445 HydrophobicContact CB-CD2 4.37Å; L442-Y445 HydrophobicContact CD2-CD2 4.43Å; L442-Y445 PolarHBondContact O-N 3Å; Y445-F447 PolarHBondContact O-N 3.33Å; Y445-L448 PolarHBondContact O-N 3.23Å; Y445-I449 WeakPolarHBondContact O-CB 3.48Å; Y445-I449 VanDerWaalsContact O-CG1 3.3Å; Y445-I449 WeakPolarHBondContact O-CG1 3.42Å; Y445-I449 PolarHBondContact O-N 2.87Å
446	A	83.3	Confident	82.4	Confident	11 Å²	11	33.1 Å²	33.1	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-59.4	-43.1	174.8	0	0	0	0	0	111.9	L434 C437 I438 L442 G450	L434-A446 HydrophobicContact CD1-CB 4.22Å; L434-A446 VanDerWaalsContact CD1-O 3.27Å; L434-A446 WeakPolarHBondContact CD1-O 3.4Å; C437-A446 HydrophobicContact CB-CB 3.94Å; I438-A446 HydrophobicContact CG1-CB 4Å; L442-A446 WeakPolarHBondContact O-CB 3.26Å; L442-A446 PolarHBondContact O-N 3.11Å; A446-G450 PolarHBondContact O-N 2.8Å
447	F	82.8	Confident	82.2	Confident	40 Å²	40	36.9 Å²	36.9	18%	0.175	21%	0.208	C	C	.	.	H	α-helix	trans	-60.7	-50.3	174.9	176.2	-96.8	0	0	0	112.1	T271 D443 Y445 I449 G450 R451	T271-F447 HydrophobicContact CG2-CD1 3.48Å; T271-F447 VanDerWaalsContact CG2-CD1 3.48Å; T271-F447 HydrophobicContact CG2-CD2 4.43Å; T271-F447 HydrophobicContact CG2-CE1 3.61Å; T271-F447 HydrophobicContact CG2-CG 3.92Å; T271-F447 HydrophobicContact CG2-CZ 4.16Å; D443-F447 WeakPolarHBondContact O-CB 3.31Å; D443-F447 PolarHBondContact O-N 3.28Å; Y445-F447 PolarHBondContact O-N 3.33Å; F447-I449 PolarHBondContact O-N 2.77Å; F447-G450 PolarHBondContact O-N 3.23Å; F447-R451 HydrophobicContact CE1-CG 4.44Å; F447-R451 HydrophobicContact CZ-CG 4.37Å; F447-R451 WeakPolarHBondContact O-CG 3.4Å; F447-R451 PolarHBondContact O-N 3.1Å
448	L	77.6	Confident	81.9	Confident	13 Å²	13	41.6 Å²	41.6	7%	0.068	23%	0.233	C	C	.	.	H	α-helix	trans	-64.6	-41.9	-177.2	-67.5	171.8	0	0	0	112.2	S444 Y445 R451 D452 Y1419	S444-L448 WeakPolarHBondContact O-CG 3.35Å; S444-L448 PolarHBondContact O-N 3.42Å; Y445-L448 PolarHBondContact O-N 3.23Å; L448-R451 PolarHBondContact O-N 3.42Å; L448-D452 PolarHBondContact O-N 3.47Å; L448-Y1419 HydrophobicContact CB-CE1 4.18Å; L448-Y1419 HydrophobicContact CD1-CD1 4.08Å; L448-Y1419 HydrophobicContact CD1-CE1 3.96Å; L448-Y1419 HydrophobicContact CD1-CG 4.47Å; L448-Y1419 HydrophobicContact CD2-CD1 4.42Å; L448-Y1419 HydrophobicContact CD2-CE1 3.94Å; L448-Y1419 HydrophobicContact CG-CE1 4.25Å
449	I	80.6	Confident	81.4	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-75.2	-34.1	-179.7	-63.5	171.9	0	0	0	111.4	F370 V433 L434 Y445 F447 R451 D452 L453 M1415	F370-I449 HydrophobicContact CD2-CD1 4.45Å; F370-I449 HydrophobicContact CE2-CD1 3.36Å; F370-I449 HydrophobicContact CZ-CD1 3.7Å; V433-I449 HydrophobicContact CG1-CD1 3.66Å; L434-I449 HydrophobicContact CB-CG2 4.17Å; Y445-I449 WeakPolarHBondContact O-CB 3.48Å; Y445-I449 VanDerWaalsContact O-CG1 3.3Å; Y445-I449 WeakPolarHBondContact O-CG1 3.42Å; Y445-I449 PolarHBondContact O-N 2.87Å; F447-I449 PolarHBondContact O-N 2.77Å; I449-R451 VanDerWaalsContact C-N 3.34Å; I449-R451 PolarHBondContact O-N 2.88Å; I449-D452 PolarHBondContact O-N 3.09Å; I449-L453 WeakPolarHBondContact O-CB 3.32Å; I449-L453 PolarHBondContact O-N 2.94Å; I449-M1415 HydrophobicContact CG1-CE 4.08Å
450	G	84.2	Confident	81	Confident	23 Å²	23	39.5 Å²	39.5	24%	0.237	21%	0.206	C	C	.	.	H	α-helix	trans	-60.3	-41.6	170.4	0	0	0	0	0	112.3	A446 F447 A454	A446-G450 PolarHBondContact O-N 2.8Å; F447-G450 PolarHBondContact O-N 3.23Å; G450-A454 WeakPolarHBondContact O-CB 3.49Å; G450-A454 PolarHBondContact O-N 3.17Å
451	R	80.7	Confident	80.7	Confident	29 Å²	29	39.7 Å²	39.7	11%	0.109	21%	0.213	C	C	.	.	H	α-helix	trans	-66.1	-43.8	172.6	-70.1	-169.9	75.9	81.6	-8.8	112.9	F223 L224 E227 F447 L448 I449 L453 A454 F455	F223-R451 HydrophobicContact CE1-CB 4.38Å; F223-R451 PolarHBondContact O-NE 2.84Å; F223-R451 VanDerWaalsContact O-NE 3.14Å; F223-R451 PolarHBondContact O-NH2 3.4Å; L224-R451 HydrophobicContact CD2-CB 3.92Å; E227-R451 VanDerWaalsContact CD-CZ 3.49Å; E227-R451 IonicContact OE1-CZ 3.58Å; E227-R451 IonicContact OE1-NH1 2.83Å; E227-R451 PolarHBondContact OE1-NH1 3.36Å; E227-R451 IonicContact OE1-NH2 3.9Å; E227-R451 PolarHBondContact OE1-NH2 3.04Å; E227-R451 IonicContact OE2-CZ 2.67Å; E227-R451 IonicContact OE2-NH1 2.73Å; E227-R451 PolarHBondContact OE2-NH1 3.34Å; E227-R451 IonicContact OE2-NH2 3.13Å; F447-R451 HydrophobicContact CE1-CG 4.44Å; F447-R451 HydrophobicContact CZ-CG 4.37Å; F447-R451 WeakPolarHBondContact O-CG 3.4Å; F447-R451 PolarHBondContact O-N 3.1Å; L448-R451 PolarHBondContact O-N 3.42Å; I449-R451 VanDerWaalsContact C-N 3.34Å; I449-R451 PolarHBondContact O-N 2.88Å; R451-L453 VanDerWaalsContact C-N 3.32Å; R451-L453 PolarHBondContact O-N 2.91Å; R451-A454 PolarHBondContact O-N 3.43Å; R451-F455 PolarHBondContact O-N 3.4Å
452	D	77.1	Confident	80.6	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.011	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-41.2	179.9	-164.8	47.6	0	0	0	111.4	R220 L224 H430 L448 I449 F455 L456	R220-D452 IonicContact CZ-OD1 2.64Å; R220-D452 IonicContact CZ-OD2 3.29Å; R220-D452 IonicContact NE-OD1 2.87Å; R220-D452 PolarHBondContact NE-OD1 3.25Å; R220-D452 IonicContact NH2-OD1 3.72Å; R220-D452 PolarHBondContact NH2-OD1 3.45Å; R220-D452 IonicContact NH2-OD2 2.86Å; R220-D452 PolarHBondContact NH2-OD2 3.48Å; L224-D452 HydrophobicContact CD2-CB 3.86Å; H430-D452 IonicContact CE1-OD2 2.86Å; H430-D452 PolarHBondContact CE1-OD2 2.88Å; H430-D452 VanDerWaalsContact CE1-OD2 3.31Å; H430-D452 IonicContact ND1-OD2 3.91Å; L448-D452 PolarHBondContact O-N 3.47Å; I449-D452 PolarHBondContact O-N 3.09Å; D452-F455 PolarHBondContact O-N 2.92Å; D452-L456 WeakPolarHBondContact O-CB 3.31Å; D452-L456 VanDerWaalsContact O-CG 3.28Å; D452-L456 WeakPolarHBondContact O-CG 3.24Å; D452-L456 PolarHBondContact O-N 2.66Å
453	L	80.6	Confident	80.4	Confident	17 Å²	17	44 Å²	44	9%	0.089	23%	0.225	C	C	.	.	H	α-helix	trans	-65.8	-45	173.7	-177.8	144.7	0	0	0	112.3	H430 E431 I449 R451 F455 L456 R457	H430-L453 HydrophobicContact CB-CD1 4.03Å; E431-L453 HydrophobicContact CB-CD1 4.43Å; E431-L453 HydrophobicContact CG-CD1 3.36Å; I449-L453 WeakPolarHBondContact O-CB 3.32Å; I449-L453 PolarHBondContact O-N 2.94Å; R451-L453 VanDerWaalsContact C-N 3.32Å; R451-L453 PolarHBondContact O-N 2.91Å; L453-F455 VanDerWaalsContact C-N 3.28Å; L453-F455 PolarHBondContact O-N 3.28Å; L453-L456 PolarHBondContact O-N 3.1Å; L453-R457 VanDerWaalsContact O-CB 3.32Å; L453-R457 WeakPolarHBondContact O-CB 3.2Å; L453-R457 PolarHBondContact O-N 3.41Å
454	A	84.3	Confident	80.3	Confident	31 Å²	31	42.5 Å²	42.5	26%	0.256	21%	0.212	S	C	.	.	H	α-helix	trans	-61.9	-36.7	176.3	0	0	0	0	0	111.9	G450 R451 D458	G450-A454 WeakPolarHBondContact O-CB 3.49Å; G450-A454 PolarHBondContact O-N 3.17Å; R451-A454 PolarHBondContact O-N 3.43Å; A454-D458 WeakPolarHBondContact O-CB 3.49Å; A454-D458 PolarHBondContact O-N 3.29Å
455	F	82.5	Confident	80.4	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.009	23%	0.228	C	C	.	.	I	π-helix	trans	-63.1	-51.7	171.4	-174.2	-83.8	0	0	0	111.4	L216 R220 F223 R451 D452 L453 R457 R459 E460 L463	L216-F455 HydrophobicContact CD1-CE1 4.33Å; L216-F455 HydrophobicContact CD1-CZ 4.07Å; R220-F455 HydrophobicContact CB-CD1 4.04Å; R220-F455 HydrophobicContact CB-CE1 3.57Å; R220-F455 HydrophobicContact CB-CE2 4.09Å; R220-F455 HydrophobicContact CB-CG 4.5Å; R220-F455 HydrophobicContact CB-CZ 3.59Å; R220-F455 HydrophobicContact CG-CD1 3.72Å; R220-F455 HydrophobicContact CG-CE1 3.78Å; R220-F455 HydrophobicContact CG-CG 4.14Å; R220-F455 HydrophobicContact CG-CZ 4.21Å; F223-F455 HydrophobicContact CB-CD2 3.83Å; F223-F455 HydrophobicContact CB-CE2 4.12Å; F223-F455 HydrophobicContact CD1-CB 3.81Å; F223-F455 AromaticContact CD1-CD2 3.6Å; F223-F455 HydrophobicContact CD1-CD2 3.6Å; F223-F455 HydrophobicContact CD1-CG 4.16Å; F223-F455 HydrophobicContact CE1-CB 4.01Å; F223-F455 HydrophobicContact CE1-CD2 4.39Å; F223-F455 AromaticContact CG-CD2 3.84Å; F223-F455 HydrophobicContact CG-CD2 3.84Å; R451-F455 PolarHBondContact O-N 3.4Å; D452-F455 PolarHBondContact O-N 2.92Å; L453-F455 VanDerWaalsContact C-N 3.28Å; L453-F455 PolarHBondContact O-N 3.28Å; F455-R457 VanDerWaalsContact C-N 3.29Å; F455-R457 PolarHBondContact O-N 3.3Å; F455-R459 HydrophobicContact CD2-CB 4.03Å; F455-R459 HydrophobicContact CE2-CB 4.34Å; F455-R459 HydrophobicContact CG-CB 4.4Å; F455-R459 CarbonylContact O-C 3.59Å; F455-R459 WeakPolarHBondContact O-CA 3.47Å; F455-R459 PolarHBondContact O-N 3.03Å; F455-E460 HydrophobicContact CE1-CB 4.39Å; F455-E460 HydrophobicContact CE1-CG 4.43Å; F455-E460 PolarHBondContact O-N 3.48Å; F455-L463 HydrophobicContact CD2-CD1 4.38Å; F455-L463 HydrophobicContact CE2-CD1 3.4Å; F455-L463 VanDerWaalsContact CE2-CD1 3.4Å; F455-L463 HydrophobicContact CZ-CD1 3.7Å
456	L	78.5	Confident	80.4	Confident	14 Å²	14	49.2 Å²	49.2	7%	0.073	25%	0.246	C	C	.	.	I	π-helix	trans	-64.7	-28.5	-177.4	-74.1	172	0	0	0	114.2	L427 D452 L453	L427-L456 HydrophobicContact CD2-CB 4.05Å; L427-L456 HydrophobicContact CD2-CD1 4.39Å; D452-L456 WeakPolarHBondContact O-CB 3.31Å; D452-L456 VanDerWaalsContact O-CG 3.28Å; D452-L456 WeakPolarHBondContact O-CG 3.24Å; D452-L456 PolarHBondContact O-N 2.66Å; L453-L456 PolarHBondContact O-N 3.1Å
457	R	81.7	Confident	79.8	Confident	129 Å²	129	49.3 Å²	49.3	49%	0.487	25%	0.245	S	C	.	.	I	π-helix	trans	-89	-49.9	179.6	-169.8	-174.6	-78.4	-177.8	-6.6	112.2	L427 E431 L453 F455	L427-R457 HydrophobicContact CD1-CB 4.32Å; L427-R457 HydrophobicContact CD1-CG 4.44Å; E431-R457 VanDerWaalsContact CD-NH2 3.26Å; E431-R457 IonicContact OE1-CZ 3.53Å; E431-R457 IonicContact OE1-NH2 3.52Å; E431-R457 PolarHBondContact OE1-NH2 3Å; E431-R457 IonicContact OE2-NH2 3.83Å; L453-R457 VanDerWaalsContact O-CB 3.32Å; L453-R457 WeakPolarHBondContact O-CB 3.2Å; L453-R457 PolarHBondContact O-N 3.41Å; F455-R457 VanDerWaalsContact C-N 3.29Å; F455-R457 PolarHBondContact O-N 3.3Å
458	D	81.4	Confident	79.1	Confident	99 Å²	99	52.4 Å²	52.4	53%	0.529	26%	0.259	S	S	.	.	I	π-helix	trans	-106.1	-26.8	-164.6	-47.9	-34.8	0	0	0	113.3	A454	A454-D458 WeakPolarHBondContact O-CB 3.49Å; A454-D458 PolarHBondContact O-N 3.29Å
459	R	77.9	Confident	78.9	Confident	125 Å²	125	57.4 Å²	57.4	47%	0.472	28%	0.28	S	S	.	.	I	π-helix	trans	-108.4	-29.1	-175.2	-66.4	-170.1	171.2	-143.7	-2.2	115.2	F223 F455 C461 L462 L463	F223-R459 VanDerWaalsContact CE2-CZ 3.43Å; F455-R459 HydrophobicContact CD2-CB 4.03Å; F455-R459 HydrophobicContact CE2-CB 4.34Å; F455-R459 HydrophobicContact CG-CB 4.4Å; F455-R459 CarbonylContact O-C 3.59Å; F455-R459 WeakPolarHBondContact O-CA 3.47Å; F455-R459 PolarHBondContact O-N 3.03Å; R459-C461 VanDerWaalsContact C-N 3.28Å; R459-C461 PolarHBondContact O-N 3.41Å; R459-L462 PolarHBondContact O-N 2.92Å; R459-L463 HydrophobicContact CB-CD1 4Å; R459-L463 WeakPolarHBondContact O-CB 3.34Å; R459-L463 PolarHBondContact O-N 2.86Å
460	E	78.9	Confident	78.2	Confident	21 Å²	21	61.4 Å²	61.4	10%	0.098	31%	0.308	C	S	.	.	H	α-helix	trans	-55.9	-42.7	-173.6	-161.5	-158.5	145.5	0	0	111.7	L216 K426 F455 R464	L216-E460 HydrophobicContact CD1-CG 4.36Å; L216-E460 HydrophobicContact CD2-CG 3.87Å; L216-E460 HydrophobicContact CG-CG 4.44Å; K426-E460 IonicContact NZ-OE2 2.61Å; K426-E460 PolarHBondContact NZ-OE2 2.89Å; F455-E460 HydrophobicContact CE1-CB 4.39Å; F455-E460 HydrophobicContact CE1-CG 4.43Å; F455-E460 PolarHBondContact O-N 3.48Å; E460-R464 WeakPolarHBondContact O-CB 3.28Å; E460-R464 PolarHBondContact O-N 3.18Å; E460-R464 VanDerWaalsContact O-N 3.08Å; E460-R464 IonicContact OE1-CZ 3.66Å; E460-R464 IonicContact OE1-NE 2.63Å; E460-R464 IonicContact OE1-NH2 2.75Å; E460-R464 PolarHBondContact OE1-NH2 3.42Å
461	C	77.8	Confident	77.2	Confident	81 Å²	81	60.3 Å²	60.3	55%	0.547	30%	0.297	S	S	.	.	H	α-helix	trans	-67.5	-54.8	179	-159.5	0	0	0	0	112	R459 L463 R464 D465	R459-C461 VanDerWaalsContact C-N 3.28Å; R459-C461 PolarHBondContact O-N 3.41Å; C461-L463 VanDerWaalsContact C-N 3.34Å; C461-L463 PolarHBondContact O-N 3.1Å; C461-R464 WeakPolarHBondContact O-CB 3.32Å; C461-R464 PolarHBondContact O-N 3.45Å; C461-R464 VanDerWaalsContact O-N 3.14Å; C461-D465 PolarHBondContact O-N 2.88Å
462	L	82.8	Confident	76.3	Confident	108 Å²	108	65.8 Å²	65.8	57%	0.565	32%	0.318	S	S	*	.	H	α-helix	trans	-60.9	-41.2	-176.8	-62.2	176	0	0	0	112.3	R459 D465 Q466	R459-L462 PolarHBondContact O-N 2.92Å; L462-D465 PolarHBondContact O-N 3.42Å; L462-Q466 WeakPolarHBondContact O-CB 3.31Å; L462-Q466 VanDerWaalsContact O-CG 3.27Å; L462-Q466 WeakPolarHBondContact O-CG 3.38Å; L462-Q466 PolarHBondContact O-N 3.02Å
463	L	78.9	Confident	75.6	Confident	26 Å²	26	71.2 Å²	71.2	14%	0.136	34%	0.341	C	S	.	.	H	α-helix	trans	-70.2	-37.6	176.7	-72.2	171.7	0	0	0	111.9	L216 E219 F455 R459 C461 D465 Q466 I467	L216-L463 HydrophobicContact CD1-CB 3.87Å; E219-L463 HydrophobicContact CB-CD1 4.33Å; F455-L463 HydrophobicContact CD2-CD1 4.38Å; F455-L463 HydrophobicContact CE2-CD1 3.4Å; F455-L463 VanDerWaalsContact CE2-CD1 3.4Å; F455-L463 HydrophobicContact CZ-CD1 3.7Å; R459-L463 HydrophobicContact CB-CD1 4Å; R459-L463 WeakPolarHBondContact O-CB 3.34Å; R459-L463 PolarHBondContact O-N 2.86Å; C461-L463 VanDerWaalsContact C-N 3.34Å; C461-L463 PolarHBondContact O-N 3.1Å; L463-D465 VanDerWaalsContact C-N 3.3Å; L463-D465 PolarHBondContact O-N 3.07Å; L463-Q466 PolarHBondContact O-N 2.87Å; L463-I467 WeakPolarHBondContact O-CB 3.43Å; L463-I467 WeakPolarHBondContact O-CD1 3.37Å; L463-I467 WeakPolarHBondContact O-CG1 3.48Å; L463-I467 PolarHBondContact O-N 2.8Å
464	R	79.7	Confident	74.8	Confident	66 Å²	66	72.4 Å²	72.4	25%	0.249	35%	0.35	C	S	.	.	H	α-helix	trans	-58.8	-44	174.5	-176.9	178.5	-65.3	-80.1	7.8	110.9	V212 D213 L216 E460 C461 F468	V212-R464 HydrophobicContact CG1-CG 4.22Å; D213-R464 IonicContact OD1-CZ 3.65Å; D213-R464 IonicContact OD1-NH1 3.73Å; D213-R464 PolarHBondContact OD1-NH1 3.2Å; D213-R464 IonicContact OD1-NH2 3.75Å; L216-R464 HydrophobicContact CD2-CB 4.41Å; L216-R464 VanDerWaalsContact CD2-CZ 3.41Å; E460-R464 WeakPolarHBondContact O-CB 3.28Å; E460-R464 PolarHBondContact O-N 3.18Å; E460-R464 VanDerWaalsContact O-N 3.08Å; E460-R464 IonicContact OE1-CZ 3.66Å; E460-R464 IonicContact OE1-NE 2.63Å; E460-R464 IonicContact OE1-NH2 2.75Å; E460-R464 PolarHBondContact OE1-NH2 3.42Å; C461-R464 WeakPolarHBondContact O-CB 3.32Å; C461-R464 PolarHBondContact O-N 3.45Å; C461-R464 VanDerWaalsContact O-N 3.14Å; R464-F468 VanDerWaalsContact O-CB 3.26Å; R464-F468 WeakPolarHBondContact O-CB 3.18Å; R464-F468 PolarHBondContact O-N 3.33Å
465	D	78.4	Confident	73.8	Confident	74 Å²	74	73.5 Å²	73.5	40%	0.396	35%	0.352	S	S	.	.	H	α-helix	trans	-68.7	-39.7	178.3	-59.8	-22	0	0	0	112.4	C461 L462 L463 F468 K469	C461-D465 PolarHBondContact O-N 2.88Å; L462-D465 PolarHBondContact O-N 3.42Å; L463-D465 VanDerWaalsContact C-N 3.3Å; L463-D465 PolarHBondContact O-N 3.07Å; D465-F468 PolarHBondContact O-N 2.91Å; D465-K469 WeakPolarHBondContact O-CD 3.27Å; D465-K469 WeakPolarHBondContact O-CG 3.3Å; D465-K469 PolarHBondContact O-N 3.4Å; D465-K469 VanDerWaalsContact O-N 3.1Å
466	Q	78.5	Confident	73	Confident	118 Å²	118	75.2 Å²	75.2	55%	0.551	36%	0.36	S	S	*	.	H	α-helix	trans	-66.6	-44.1	175.8	-74.6	174.8	-3.9	0	0	112.1	L462 L463 F468 K469 S470	L462-Q466 WeakPolarHBondContact O-CB 3.31Å; L462-Q466 VanDerWaalsContact O-CG 3.27Å; L462-Q466 WeakPolarHBondContact O-CG 3.38Å; L462-Q466 PolarHBondContact O-N 3.02Å; L463-Q466 PolarHBondContact O-N 2.87Å; Q466-F468 VanDerWaalsContact C-N 3.33Å; Q466-F468 PolarHBondContact O-N 2.91Å; Q466-K469 PolarHBondContact O-N 2.79Å; Q466-K469 VanDerWaalsContact O-N 3.14Å; Q466-S470 PolarHBondContact O-N 3.23Å; Q466-S470 PolarHBondContact O-OG 3.31Å
467	I	71.8	Confident	72.7	Confident	12 Å²	12	79.5 Å²	79.5	6%	0.062	38%	0.38	C	S	.	.	H	α-helix	trans	-64	-39.6	175.2	-65.5	163.7	0	0	0	110.3	V212 K215 L216 E219 L463 K469 S470 A471	V212-I467 HydrophobicContact CB-CG2 4.37Å; V212-I467 HydrophobicContact CG1-CB 4.31Å; V212-I467 HydrophobicContact CG1-CG2 3.9Å; V212-I467 HydrophobicContact CG2-CG2 4.33Å; K215-I467 HydrophobicContact CB-CD1 4.25Å; K215-I467 HydrophobicContact CB-CG2 4.05Å; K215-I467 HydrophobicContact CD-CG2 3.95Å; L216-I467 HydrophobicContact CB-CD1 4.11Å; L216-I467 HydrophobicContact CD1-CD1 4.28Å; E219-I467 HydrophobicContact CG-CD1 4.19Å; L463-I467 WeakPolarHBondContact O-CB 3.43Å; L463-I467 WeakPolarHBondContact O-CD1 3.37Å; L463-I467 WeakPolarHBondContact O-CG1 3.48Å; L463-I467 PolarHBondContact O-N 2.8Å; I467-K469 PolarHBondContact O-N 3.42Å; I467-S470 PolarHBondContact O-N 3.02Å; I467-A471 HydrophobicContact CG2-CB 4.1Å; I467-A471 WeakPolarHBondContact O-CB 3.41Å; I467-A471 PolarHBondContact O-N 3.27Å
468	F	67.8	Low	72.3	Confident	106 Å²	106	74.1 Å²	74.1	47%	0.465	36%	0.36	S	S	.	.	H	α-helix	trans	-65.7	-22.7	175.5	-165.2	-89.8	0	0	0	113.3	N209 R464 D465 Q466	N209-F468 HydrophobicContact CB-CD2 4.44Å; N209-F468 HydrophobicContact CB-CE2 4.49Å; N209-F468 WeakPolarHBondContact ND2-CD1 3.11Å; N209-F468 WeakPolarHBondContact ND2-CD2 3.26Å; N209-F468 WeakPolarHBondContact ND2-CE1 3.31Å; N209-F468 WeakPolarHBondContact ND2-CE2 3.34Å; N209-F468 WeakPolarHBondContact ND2-CG 3.22Å; N209-F468 WeakPolarHBondContact ND2-CZ 3.48Å; N209-F468 PolarHBondContact ND2-O 3.45Å; N209-F468 PolarHBondContact OD1-O 3.05Å; R464-F468 VanDerWaalsContact O-CB 3.26Å; R464-F468 WeakPolarHBondContact O-CB 3.18Å; R464-F468 PolarHBondContact O-N 3.33Å; D465-F468 PolarHBondContact O-N 2.91Å; Q466-F468 VanDerWaalsContact C-N 3.33Å; Q466-F468 PolarHBondContact O-N 2.91Å
469	K	72.4	Confident	72	Confident	118 Å²	118	73.6 Å²	73.6	51%	0.513	36%	0.356	S	S	.	.	H	α-helix	trans	-88	-33.1	173.8	-72.7	164.5	-176.5	169.3	0	112.5	D465 Q466 I467 R472	D465-K469 WeakPolarHBondContact O-CD 3.27Å; D465-K469 WeakPolarHBondContact O-CG 3.3Å; D465-K469 PolarHBondContact O-N 3.4Å; D465-K469 VanDerWaalsContact O-N 3.1Å; Q466-K469 PolarHBondContact O-N 2.79Å; Q466-K469 VanDerWaalsContact O-N 3.14Å; I467-K469 PolarHBondContact O-N 3.42Å; K469-R472 VanDerWaalsContact O-CD 3.28Å; K469-R472 WeakPolarHBondContact O-CD 3.41Å
470	S	66.6	Low	71.8	Confident	88 Å²	88	69.3 Å²	69.3	62%	0.615	34%	0.341	S	S	*	.	H	α-helix	trans	-94.5	-30.6	-176.4	69.7	0	0	0	0	115.6	Q466 I467 R472	Q466-S470 PolarHBondContact O-N 3.23Å; Q466-S470 PolarHBondContact O-OG 3.31Å; I467-S470 PolarHBondContact O-N 3.02Å; S470-R472 PolarHBondContact O-N 3.41Å
471	A	62.5	Low	71.4	Confident	1 Å²	1	73.1 Å²	73.1	1%	0.008	36%	0.359	C	S	.	.			trans	-78.8	33.1	-174.8	0	0	0	0	0	114.4	N209 K215 I467 F473	N209-A471 WeakPolarHBondContact CA-O 3.17Å; K215-A471 HydrophobicContact CD-CB 4.32Å; I467-A471 HydrophobicContact CG2-CB 4.1Å; I467-A471 WeakPolarHBondContact O-CB 3.41Å; I467-A471 PolarHBondContact O-N 3.27Å; A471-F473 WeakPolarHBondContact O-CD2 3.31Å; A471-F473 WeakPolarHBondContact O-CE2 3.14Å; A471-F473 PolarHBondContact O-N 3.39Å
472	R	62.2	Low	71	Confident	144 Å²	144	69.4 Å²	69.4	54%	0.543	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	93.6	-167.8	-80.8	-173.1	177.1	-170.8	-1.9	112.8	V207 N209 K469 S470	V207-R472 HydrophobicContact CG1-CB 3.4Å; V207-R472 VanDerWaalsContact CG1-CB 3.4Å; V207-R472 HydrophobicContact CG1-CG 3.63Å; N209-R472 WeakPolarHBondContact OD1-CG 3.25Å; K469-R472 VanDerWaalsContact O-CD 3.28Å; K469-R472 WeakPolarHBondContact O-CD 3.41Å; S470-R472 PolarHBondContact O-N 3.41Å
473	F	63.2	Low	70.1	Confident	115 Å²	115	65.9 Å²	65.9	50%	0.504	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	148.6	176.7	-57.5	-80.4	0	0	0	111.7	V207 N208 A471	V207-F473 CarbonylContact C-O 3.35Å; V207-F473 WeakPolarHBondContact CA-O 3.37Å; V207-F473 WeakPolarHBondContact CG1-O 3.32Å; N208-F473 PolarHBondContact N-O 3.27Å; N208-F473 PolarHBondContact O-N 3.14Å; N208-F473 VanDerWaalsContact O-N 3.12Å; A471-F473 WeakPolarHBondContact O-CD2 3.31Å; A471-F473 WeakPolarHBondContact O-CE2 3.14Å; A471-F473 PolarHBondContact O-N 3.39Å
474	P	64	Low	69.3	Low	43 Å²	43	68 Å²	68	28%	0.279	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	138.5	172.4	26.7	-32.9	0	0	0	112	E476 S628 T629 R630	P474-E476 VanDerWaalsContact C-N 3.34Å; P474-E476 PolarHBondContact O-N 3.28Å; P474-S628 WeakPolarHBondContact CB-OG 3.41Å; P474-S628 WeakPolarHBondContact CG-OG 3.44Å; P474-T629 WeakPolarHBondContact CB-OG1 3.35Å; P474-R630 HydrophobicContact CB-CB 4.21Å
475	D	62	Low	68.3	Low	54 Å²	54	70.8 Å²	70.8	29%	0.289	33%	0.334	S	S	.	.	S	Bend	trans	-54.7	-44	173.8	-78.7	26.1	0	0	0	113.1	R206 V207 N208 T629 P798	R206-D475 HydrophobicContact CB-CB 4.18Å; R206-D475 PolarHBondContact O-N 3.29Å; V207-D475 PolarHBondContact N-OD1 3.48Å; N208-D475 PolarHBondContact N-OD1 2.79Å; D475-T629 PolarHBondContact N-OG1 3.11Å; D475-T629 VanDerWaalsContact N-OG1 3.08Å; D475-P798 HydrophobicContact CB-CB 4.3Å
476	E	66.6	Low	67	Low	37 Å²	37	70.1 Å²	70.1	17%	0.173	34%	0.335	C	S	.	.			trans	-142.9	148.8	178.8	-79.4	-168.5	150.8	0	0	113.8	P474 F478 S628 T629 P798	P474-E476 VanDerWaalsContact C-N 3.34Å; P474-E476 PolarHBondContact O-N 3.28Å; E476-F478 HydrophobicContact CB-CE2 4.38Å; E476-F478 HydrophobicContact CB-CZ 4.18Å; E476-F478 WeakPolarHBondContact OE2-CE1 3.37Å; E476-F478 WeakPolarHBondContact OE2-CZ 3.48Å; E476-S628 WeakPolarHBondContact O-CA 3.41Å; E476-T629 HydrophobicContact CB-CG2 4.21Å; E476-T629 PolarHBondContact N-OG1 3.39Å; E476-T629 PolarHBondContact O-N 3.04Å; E476-P798 HydrophobicContact CG-CB 4.07Å
477	E	70.9	Confident	65.5	Low	105 Å²	105	69.4 Å²	69.4	49%	0.491	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	121.9	159.6	-72.1	-163.5	175.2	0	0	110.3	K626 A627	E477-K626 IonicContact OE2-NZ 3.34Å; E477-K626 PolarHBondContact OE2-NZ 3.34Å; E477-A627 CarbonylContact C-O 3.57Å; E477-A627 VanDerWaalsContact CA-O 3.27Å; E477-A627 WeakPolarHBondContact CA-O 3.24Å
478	F	73.1	Confident	64.3	Low	16 Å²	16	78.9 Å²	78.9	7%	0.07	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	116	174.9	-59.6	-78	0	0	0	110	E476 F480 K626 A627 T629 W634 V638 Y796	E476-F478 HydrophobicContact CB-CE2 4.38Å; E476-F478 HydrophobicContact CB-CZ 4.18Å; E476-F478 WeakPolarHBondContact OE2-CE1 3.37Å; E476-F478 WeakPolarHBondContact OE2-CZ 3.48Å; F478-F480 HydrophobicContact CB-CE2 4.25Å; F478-K626 CarbonylContact O-C 3.51Å; F478-K626 WeakPolarHBondContact O-CA 3.19Å; F478-A627 HydrophobicContact CB-CB 4.34Å; F478-A627 PolarHBondContact N-O 2.78Å; F478-A627 PolarHBondContact O-N 3.05Å; F478-T629 HydrophobicContact CE2-CG2 3.9Å; F478-T629 HydrophobicContact CZ-CG2 4.46Å; F478-W634 AromaticContact CE2-CE3 3.78Å; F478-W634 HydrophobicContact CE2-CE3 3.78Å; F478-W634 HydrophobicContact CE2-CH2 4.4Å; F478-W634 AromaticContact CE2-CZ3 3.52Å; F478-W634 HydrophobicContact CE2-CZ3 3.52Å; F478-W634 HydrophobicContact CZ-CE3 4.46Å; F478-W634 HydrophobicContact CZ-CH2 4.35Å; F478-W634 AromaticContact CZ-CZ3 3.74Å; F478-W634 HydrophobicContact CZ-CZ3 3.74Å; F478-V638 HydrophobicContact CB-CG1 4.47Å; F478-V638 HydrophobicContact CB-CG2 4.27Å; F478-V638 HydrophobicContact CD2-CG1 4.36Å; F478-V638 HydrophobicContact CD2-CG2 3.48Å; F478-V638 VanDerWaalsContact CD2-CG2 3.48Å; F478-V638 HydrophobicContact CE2-CG2 4.09Å; F478-V638 HydrophobicContact CG-CG1 4.2Å; F478-V638 HydrophobicContact CG-CG2 4.01Å; F478-Y796 HydrophobicContact CD1-CD1 4.5Å; F478-Y796 HydrophobicContact CE1-CD1 4.13Å; F478-Y796 HydrophobicContact CZ-CD1 4.48Å
479	I	75.9	Confident	63.6	Low	87 Å²	87	78.3 Å²	78.3	45%	0.446	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	107.6	-178.5	-51.8	-175.6	0	0	0	110	Q481 V624 L625 K626	I479-Q481 HydrophobicContact CG2-CG 4.44Å; I479-V624 HydrophobicContact CG2-CG1 3.51Å; I479-L625 CarbonylContact C-O 3.1Å; I479-L625 WeakPolarHBondContact CA-O 3.23Å; I479-K626 HydrophobicContact CG1-CG 4.32Å
480	F	73.2	Confident	62.9	Low	36 Å²	36	75.9 Å²	75.9	16%	0.158	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124.8	177.3	-63.8	-87	0	0	0	110.5	F478 V624 L625 V638 L641 C642	F478-F480 HydrophobicContact CB-CE2 4.25Å; F480-V624 WeakPolarHBondContact O-CA 3.45Å; F480-L625 HydrophobicContact CB-CB 4.3Å; F480-L625 PolarHBondContact N-O 2.75Å; F480-L625 PolarHBondContact O-N 3.06Å; F480-V638 HydrophobicContact CE2-CG1 4.11Å; F480-V638 HydrophobicContact CZ-CG1 3.77Å; F480-L641 HydrophobicContact CD2-CB 3.89Å; F480-L641 HydrophobicContact CD2-CD1 4.45Å; F480-L641 HydrophobicContact CE2-CB 3.81Å; F480-L641 HydrophobicContact CE2-CD1 4.45Å; F480-C642 HydrophobicContact CE1-CB 3.73Å; F480-C642 HydrophobicContact CZ-CB 3.88Å
481	Q	71.6	Confident	62.7	Low	101 Å²	101	75.1 Å²	75.1	47%	0.472	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.6	176	-61.6	-170.1	-5.9	0	0	111.1	I479 T622 L623 V624 R649	I479-Q481 HydrophobicContact CG2-CG 4.44Å; Q481-T622 HydrophobicContact CB-CG2 4.43Å; Q481-L623 CarbonylContact C-O 3.59Å; Q481-L623 WeakPolarHBondContact CA-O 3.34Å; Q481-V624 HydrophobicContact CG-CG2 4.35Å; Q481-R649 PolarHBondContact O-NH1 3.44Å; Q481-R649 VanDerWaalsContact O-NH1 3.08Å
482	V	68.3	Low	62.7	Low	3 Å²	3	75.5 Å²	75.5	2%	0.018	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	117.8	-176.8	177.6	0	0	0	0	109.4	T622 L623 I648 R649	V482-T622 CarbonylContact O-C 3.59Å; V482-T622 VanDerWaalsContact O-CA 3.31Å; V482-T622 WeakPolarHBondContact O-CA 3.27Å; V482-L623 HydrophobicContact CB-CB 4.46Å; V482-L623 HydrophobicContact CB-CD2 4.47Å; V482-L623 PolarHBondContact N-O 2.98Å; V482-L623 PolarHBondContact O-N 3.28Å; V482-I648 HydrophobicContact CG1-CB 3.97Å; V482-I648 HydrophobicContact CG1-CG2 3.52Å; V482-R649 HydrophobicContact CG1-CG 4.22Å
483	S	64.6	Low	63	Low	34 Å²	34	71.7 Å²	71.7	24%	0.238	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	145.1	179.9	-166.1	0	0	0	0	111.8	S621 Q652	S483-S621 CarbonylContact C-O 3.58Å; S483-S621 WeakPolarHBondContact CA-O 3.4Å; S483-S621 PolarHBondContact OG-O 3.17Å; S483-Q652 PolarHBondContact O-NE2 2.84Å; S483-Q652 PolarHBondContact O-OE1 2.79Å
484	R	62.2	Low	63	Low	70 Å²	70	70.5 Å²	70.5	26%	0.264	33%	0.331	S	S	.	.			trans	-99.2	29.2	-175.6	-65.3	-170.4	175.8	-157.9	-1.5	113.3	C486 L487 S621 L623	R484-C486 PolarHBondContact O-N 2.59Å; R484-L487 HydrophobicContact CB-CB 4.34Å; R484-L487 HydrophobicContact CB-CD1 4.3Å; R484-L487 HydrophobicContact CG-CD1 4.13Å; R484-L487 PolarHBondContact O-N 3.04Å; R484-S621 PolarHBondContact N-O 2.91Å; R484-L623 HydrophobicContact CG-CB 4.48Å
485	R	58.7	Low	63.1	Low	124 Å²	124	71.5 Å²	71.5	47%	0.468	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-25.4	-171	-64.3	-172.3	-177	-179.9	1.5	115	Q652	R485-Q652 VanDerWaalsContact N-OE1 3.17Å
486	C	50.7	Low	62.9	Low	60 Å²	60	70.8 Å²	70.8	41%	0.405	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-6.8	178.8	-60.2	0	0	0	0	114.5	R484 Q652 V656	R484-C486 PolarHBondContact O-N 2.59Å; C486-Q652 HydrophobicContact CB-CG 3.98Å; C486-Q652 VanDerWaalsContact SG-CG 3.57Å; C486-V656 VanDerWaalsContact SG-CG2 3.55Å
487	L	47.8	Very low	62.1	Low	104 Å²	104	78.9 Å²	78.9	55%	0.545	36%	0.363	S	S	.	.	S	Bend	trans	-85.5	126	171.7	-68.5	173.8	0	0	0	108.5	R484 N489	R484-L487 HydrophobicContact CB-CB 4.34Å; R484-L487 HydrophobicContact CB-CD1 4.3Å; R484-L487 HydrophobicContact CG-CD1 4.13Å; R484-L487 PolarHBondContact O-N 3.04Å; L487-N489 PolarHBondContact O-N 3Å
488	R	46	Very low	61.2	Low	210 Å²	210	78.8 Å²	78.8	79%	0.792	37%	0.374	S	S	*	.	S	Bend	trans	-64.2	-6.7	-172.7	-160.4	173.9	-177.1	157.9	0.3	114.6	H529	R488-H529 PolarHBondContact NH2-O 3.26Å
489	N	52.8	Low	60.3	Low	94 Å²	94	83.1 Å²	83.1	50%	0.503	40%	0.398	S	S	.	.			trans	-115.4	105.9	-174.2	-58.1	3.8	0	0	0	109.2	L487 Y491	L487-N489 PolarHBondContact O-N 3Å; N489-Y491 HydrophobicContact CB-CE2 3.81Å; N489-Y491 WeakPolarHBondContact O-CD2 3.41Å; N489-Y491 WeakPolarHBondContact O-CE2 3.25Å
490	V	57.3	Low	58.9	Low	68 Å²	68	82.8 Å²	82.8	41%	0.412	40%	0.403	S	S	.	.			trans	-84.3	132	164.4	169.6	0	0	0	0	107.9	V492 M619	V490-V492 HydrophobicContact CG1-CG2 4.27Å; V490-M619 HydrophobicContact CG1-CE 3.65Å; V490-M619 HydrophobicContact CG1-CG 3.57Å; V490-M619 HydrophobicContact CG1-SD 3.7Å; V490-M619 HydrophobicContact CG2-CE 4.05Å
491	Y	63.4	Low	57.9	Low	71 Å²	71	85.6 Å²	85.6	28%	0.278	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117.2	179.4	-66.7	-98.5	0	0	0	108.6	N489 L505 Q620	N489-Y491 HydrophobicContact CB-CE2 3.81Å; N489-Y491 WeakPolarHBondContact O-CD2 3.41Å; N489-Y491 WeakPolarHBondContact O-CE2 3.25Å; Y491-L505 HydrophobicContact CD1-CD1 3.68Å; Y491-L505 HydrophobicContact CD1-CD2 3.82Å; Y491-L505 HydrophobicContact CD1-CG 4.41Å; Y491-L505 HydrophobicContact CE1-CD2 4.18Å; Y491-L505 HydrophobicContact CG-CD1 4.29Å; Y491-Q620 PolarHBondContact O-N 3.3Å; Y491-Q620 VanDerWaalsContact O-N 3.09Å
492	V	62.2	Low	56.8	Low	10 Å²	10	86.5 Å²	86.5	6%	0.061	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	122.9	176.2	-177.6	0	0	0	0	108	V490 V506 F617	V490-V492 HydrophobicContact CG1-CG2 4.27Å; V492-V506 PolarHBondContact O-N 3.26Å; V492-F617 HydrophobicContact CG1-CB 4.03Å; V492-F617 HydrophobicContact CG1-CD1 4.05Å; V492-F617 HydrophobicContact CG1-CG 4.45Å
493	Y	68	Low	56.3	Low	63 Å²	63	91.5 Å²	91.5	25%	0.247	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	142	178	-66.7	-91.9	0	0	0	110.2	Q504 L505 F617 V618 Q620	Y493-Q504 CarbonylContact C-O 3.54Å; Y493-Q504 VanDerWaalsContact CA-O 3.3Å; Y493-Q504 WeakPolarHBondContact CA-O 3.29Å; Y493-L505 HydrophobicContact CD1-CB 4.32Å; Y493-L505 HydrophobicContact CD1-CD1 4.39Å; Y493-L505 HydrophobicContact CE1-CB 4.12Å; Y493-L505 HydrophobicContact CE1-CD1 4.09Å; Y493-L505 HydrophobicContact CE2-CD1 4.35Å; Y493-F617 CarbonylContact O-C 2.9Å; Y493-F617 WeakPolarHBondContact O-CA 2.88Å; Y493-V618 PolarHBondContact N-O 3.06Å; Y493-V618 PolarHBondContact O-N 3.36Å; Y493-Q620 HydrophobicContact CD2-CB 4.01Å; Y493-Q620 HydrophobicContact CE2-CB 3.78Å
494	R	64.5	Low	56.3	Low	91 Å²	91	94.6 Å²	94.6	34%	0.343	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	136.8	165.6	167.9	176.4	-77	160.6	-6.7	108.4	Y503 Q504 V506 S615 F617	R494-Y503 CarbonylContact O-C 3.46Å; R494-Y503 WeakPolarHBondContact O-CA 3.39Å; R494-Q504 PolarHBondContact N-O 2.97Å; R494-Q504 PolarHBondContact O-N 3.04Å; R494-V506 HydrophobicContact CB-CG2 4.03Å; R494-S615 PolarHBondContact NE-OG 3.32Å; R494-S615 VanDerWaalsContact NE-OG 3.07Å; R494-S615 PolarHBondContact NH2-OG 2.84Å; R494-F617 HydrophobicContact CB-CE1 4.45Å
495	E	65.5	Low	56.4	Low	64 Å²	64	94.7 Å²	94.7	30%	0.299	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	129.1	171.3	-174	170.4	-134.7	0	0	110.8	Y503 N616	E495-Y503 HydrophobicContact CB-CD1 4.21Å; E495-Y503 HydrophobicContact CB-CE1 4Å; E495-Y503 HydrophobicContact CG-CE1 3.97Å; E495-N616 HydrophobicContact CB-CB 4.23Å; E495-N616 PolarHBondContact N-O 3.25Å; E495-N616 WeakPolarHBondContact OE2-CB 3.39Å; E495-N616 PolarHBondContact OE2-ND2 3Å
496	D	57.2	Low	56.5	Low	39 Å²	39	90.7 Å²	90.7	21%	0.209	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-88.3	116.1	179.6	-78	-36.3	0	0	0	111.2	S498 L499 H502	D496-S498 PolarHBondContact O-N 3.48Å; D496-L499 CarbonylContact O-C 3.48Å; D496-L499 PolarHBondContact O-N 3.2Å; D496-L499 VanDerWaalsContact O-O 3.11Å; D496-H502 HydrophobicContact CB-CB 4.35Å; D496-H502 PolarHBondContact N-O 3.08Å; D496-H502 VanDerWaalsContact N-O 3.17Å; D496-H502 IonicContact OD2-CD2 3.61Å
497	F	49.2	Very low	56.4	Low	206 Å²	206	95 Å²	95	90%	0.904	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-17.3	-171.3	-170.9	-98.1	0	0	0	115.3
498	S	52	Low	56.4	Low	104 Å²	104	95.4 Å²	95.4	73%	0.727	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-24.9	-178.3	51.8	0	0	0	0	114.3	D496	D496-S498 PolarHBondContact O-N 3.48Å
499	L	54.8	Low	56.4	Low	107 Å²	107	89.4 Å²	89.4	56%	0.56	46%	0.457	S	S	*	.			trans	-143.3	113.9	175.1	-75.1	93.6	0	0	0	108.9	D496 N501 H502	D496-L499 CarbonylContact O-C 3.48Å; D496-L499 PolarHBondContact O-N 3.2Å; D496-L499 VanDerWaalsContact O-O 3.11Å; L499-N501 PolarHBondContact O-N 3.44Å; L499-H502 HydrophobicContact CB-CB 4.27Å; L499-H502 PolarHBondContact O-N 3.37Å
500	S	46.7	Very low	55.7	Low	79 Å²	79	91.1 Å²	91.1	55%	0.552	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	1.6	178.6	60.8	0	0	0	0	115.7
501	N	52.1	Low	54.7	Low	96 Å²	96	94.1 Å²	94.1	51%	0.513	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	13	-175.4	-62.2	4.1	0	0	0	111.1	L499 T1666	L499-N501 PolarHBondContact O-N 3.44Å; N501-T1666 HydrophobicContact CB-CG2 3.74Å
502	H	49.6	Very low	53.4	Low	119 Å²	119	95.2 Å²	95.2	55%	0.551	50%	0.501	S	S	*	.			trans	-129.2	138.9	-175.9	-134.2	58.9	0	0	0	112.6	D496 L499	D496-H502 HydrophobicContact CB-CB 4.35Å; D496-H502 PolarHBondContact N-O 3.08Å; D496-H502 VanDerWaalsContact N-O 3.17Å; D496-H502 IonicContact OD2-CD2 3.61Å; L499-H502 HydrophobicContact CB-CB 4.27Å; L499-H502 PolarHBondContact O-N 3.37Å
503	Y	56.1	Low	51.9	Low	108 Å²	108	105.7 Å²	105.7	42%	0.424	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	121.4	-172.7	-67.2	-71.8	0	0	0	110.9	R494 E495	R494-Y503 CarbonylContact O-C 3.46Å; R494-Y503 WeakPolarHBondContact O-CA 3.39Å; E495-Y503 HydrophobicContact CB-CD1 4.21Å; E495-Y503 HydrophobicContact CB-CE1 4Å; E495-Y503 HydrophobicContact CG-CE1 3.97Å
504	Q	66	Low	50.4	Low	100 Å²	100	107.3 Å²	107.3	47%	0.467	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.1	137	178.2	-175.2	176.9	80.3	0	0	111	Y493 R494	Y493-Q504 CarbonylContact C-O 3.54Å; Y493-Q504 VanDerWaalsContact CA-O 3.3Å; Y493-Q504 WeakPolarHBondContact CA-O 3.29Å; R494-Q504 PolarHBondContact N-O 2.97Å; R494-Q504 PolarHBondContact O-N 3.04Å
505	L	63.3	Low	48.7	Very low	71 Å²	71	106.5 Å²	106.5	37%	0.372	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.7	142.5	177.5	-179.5	63.4	0	0	0	112.2	Y491 Y493	Y491-L505 HydrophobicContact CD1-CD1 3.68Å; Y491-L505 HydrophobicContact CD1-CD2 3.82Å; Y491-L505 HydrophobicContact CD1-CG 4.41Å; Y491-L505 HydrophobicContact CE1-CD2 4.18Å; Y491-L505 HydrophobicContact CG-CD1 4.29Å; Y493-L505 HydrophobicContact CD1-CB 4.32Å; Y493-L505 HydrophobicContact CD1-CD1 4.39Å; Y493-L505 HydrophobicContact CE1-CB 4.12Å; Y493-L505 HydrophobicContact CE1-CD1 4.09Å; Y493-L505 HydrophobicContact CE2-CD1 4.35Å
506	V	60.2	Low	47.1	Very low	40 Å²	40	106.7 Å²	106.7	24%	0.242	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.8	118.6	179.1	-174.7	0	0	0	0	111.4	V492 R494 F617	V492-V506 PolarHBondContact O-N 3.26Å; R494-V506 HydrophobicContact CB-CG2 4.03Å; V506-F617 HydrophobicContact CG2-CE1 4.45Å
507	D	49.5	Very low	45.7	Very low	150 Å²	150	114.3 Å²	114.3	80%	0.802	60%	0.597	S	S	*	*			trans	-88.2	-6	-170.9	-77.2	-28.7	0	0	0	115.9
508	T	48.2	Very low	44.8	Very low	114 Å²	114	107.7 Å²	107.7	70%	0.699	59%	0.587	S	S	*	*			trans	-127.9	120.7	-172	56.9	0	0	0	0	113.9
509	I	46.5	Very low	43.9	Very low	83 Å²	83	106.4 Å²	106.4	43%	0.426	58%	0.578	S	S	.	*			trans	-107.5	126.1	172.5	-54.4	174.7	0	0	0	109.2	V511	I509-V511 HydrophobicContact CG2-CG2 4.38Å
510	L	37.6	Very low	43.1	Very low	131 Å²	131	106.3 Å²	106.3	69%	0.686	58%	0.583	S	S	*	*			trans	-93.7	146.2	174.4	-70.5	168.1	0	0	0	110.9
511	V	37	Very low	42.7	Very low	130 Å²	130	107 Å²	107	79%	0.788	58%	0.581	S	S	*	*			trans	-143.2	114.7	-175.8	-176.8	0	0	0	0	111.8	I509	I509-V511 HydrophobicContact CG2-CG2 4.38Å
512	S	35.4	Very low	41.9	Very low	94 Å²	94	107.9 Å²	107.9	66%	0.657	58%	0.582	S	S	*	*			trans	-172.5	148.8	176.8	49.7	0	0	0	0	109
513	Y	30.9	Very low	41.3	Very low	230 Å²	230	105.8 Å²	105.8	90%	0.902	58%	0.575	S	S	*	*			cis	-150.9	171.7	-14.8	-175	-97.6	0	0	0	107.4
514	D	35.3	Very low	40.4	Very low	98 Å²	98	104.6 Å²	104.6	52%	0.524	58%	0.58	S	S	.	*			trans	-86.8	139.5	-175	-175.8	24.1	0	0	0	113.3
515	S	29.2	Very low	39	Very low	74 Å²	74	105 Å²	105	52%	0.517	59%	0.589	S	S	.	*			trans	-162.6	85.4	164.7	-169.2	0	0	0	0	111.7	N949	S515-N949 PolarHBondContact O-ND2 3.47Å; S515-N949 VanDerWaalsContact O-ND2 3.12Å; S515-N949 PolarHBondContact OG-ND2 2.96Å
516	D	32	Very low	37.8	Very low	67 Å²	67	107.6 Å²	107.6	36%	0.358	60%	0.602	S	S	.	*				-166.6	149.5	115.3	-115.2	-50.5	0	0	0	115.7	N949	D516-N949 WeakPolarHBondContact OD2-CB 3.11Å; D516-N949 PolarHBondContact OD2-ND2 3.12Å
517	K	28.6	Very low	36.2	Very low	200 Å²	200	114.4 Å²	114.4	87%	0.87	63%	0.629	S	S	*	*			trans	-107.7	55.7	179.2	-70.6	179.9	179.9	171	0	111.9
518	G	29.9	Very low	35.4	Very low	66 Å²	66	117 Å²	117	68%	0.68	63%	0.627	S	S	*	*			trans	-119.9	-13.3	-172.9	0	0	0	0	0	117.8
519	S	34.1	Very low	34.5	Very low	78 Å²	78	118 Å²	118	55%	0.545	62%	0.623	S	S	.	*			trans	-133.5	150.3	-174.8	82.4	0	0	0	0	113.7	D521	S519-D521 PolarHBondContact O-N 3.02Å
520	P	37.5	Very low	33.7	Very low	104 Å²	104	121.4 Å²	121.4	68%	0.675	64%	0.641	S	S	*	*	S	Bend	trans	-77.3	2.8	-178.1	33.1	-37.1	0	0	0	114.3
521	D	37.4	Very low	33.2	Very low	93 Å²	93	124 Å²	124	50%	0.497	65%	0.647	S	S	.	*			trans	-114	50.6	-174	-70.4	-56.6	0	0	0	112.5	S519 L523 T673	S519-D521 PolarHBondContact O-N 3.02Å; D521-L523 PolarHBondContact O-N 3.35Å; D521-T673 HydrophobicContact CB-CG2 4.28Å
522	Q	35.6	Very low	32.8	Very low	115 Å²	115	129.1 Å²	129.1	54%	0.537	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-62.2	134.5	176.3	-75.2	-170.5	-43.8	0	0	112.6
523	L	36.5	Very low	32.3	Very low	76 Å²	76	132.2 Å²	132.2	40%	0.398	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-85	142.1	171.2	-95.6	73.3	0	0	0	110.9	D521 T525 Y676 Y690	D521-L523 PolarHBondContact O-N 3.35Å; L523-T525 PolarHBondContact O-N 3.41Å; L523-Y676 HydrophobicContact CD1-CE2 3.81Å; L523-Y676 HydrophobicContact CD2-CD2 4.19Å; L523-Y676 HydrophobicContact CD2-CE2 4.22Å; L523-Y676 HydrophobicContact CG-CD2 4.41Å; L523-Y676 HydrophobicContact CG-CE2 4.16Å; L523-Y690 HydrophobicContact CD2-CD2 3.6Å; L523-Y690 HydrophobicContact CD2-CE2 4.09Å; L523-Y690 HydrophobicContact CD2-CG 4.18Å
524	P	38.8	Very low	32.1	Very low	82 Å²	82	130.3 Å²	130.3	53%	0.532	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-75.4	116.5	169	30.5	-32.2	0	0	0	110.9
525	T	35.3	Very low	31.8	Very low	108 Å²	108	132.1 Å²	132.1	66%	0.663	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-72.9	139.4	168.8	33	0	0	0	0	111.3	L523 K527	L523-T525 PolarHBondContact O-N 3.41Å; T525-K527 PolarHBondContact O-N 3.17Å
526	I	38.6	Very low	31.7	Very low	126 Å²	126	137.7 Å²	137.7	65%	0.646	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-71.9	117.1	-175.1	-62.2	175.2	0	0	0	110.2
527	K	27.2	Very low	31.5	Very low	184 Å²	184	142.3 Å²	142.3	80%	0.8	72%	0.715	S	S	*	*			trans	-94.6	112.6	176.9	-88.6	-179	177	173	0	112.8	T525	T525-K527 PolarHBondContact O-N 3.17Å
528	R	31.7	Very low	31.3	Very low	205 Å²	205	139 Å²	139	77%	0.774	72%	0.716	S	S	*	*			trans	90.6	155	144.6	-61.3	176.9	163.5	-178	-3.6	121.6
529	H	28.6	Very low	31.1	Very low	133 Å²	133	142 Å²	142	62%	0.616	72%	0.72	S	S	*	*			trans	72.9	83.2	157.3	-61.9	-54.5	0	0	0	118.8	R488	R488-H529 PolarHBondContact NH2-O 3.26Å
530	I	30.2	Very low	30.7	Very low	155 Å²	155	143.9 Å²	143.9	80%	0.795	73%	0.729	S	S	*	*			trans	-73.3	134.3	132.8	-62.8	172.1	0	0	0	107.6
531	K	28.3	Very low	30.1	Very low	187 Å²	187	147.8 Å²	147.8	81%	0.813	74%	0.738	S	S	*	*			trans	-85.1	115.4	170.6	-131.6	-175.3	-177.4	-172.5	0	107.5	N533	K531-N533 PolarHBondContact O-N 3.42Å
532	R	27	Very low	29.4	Very low	237 Å²	237	149.3 Å²	149.3	89%	0.894	75%	0.751	S	S	*	*			trans	-67.8	112.8	165.8	-102.5	180	167.1	147.7	-4.8	107.6	K534	R532-K534 VanDerWaalsContact C-N 3.28Å; R532-K534 PolarHBondContact O-N 3.5Å
533	N	26	Very low	28.9	Very low	158 Å²	158	152 Å²	152	85%	0.845	77%	0.767	S	S	*	*			trans	-70.3	92.3	160.6	-85.4	6.6	0	0	0	107.7	K531	K531-N533 PolarHBondContact O-N 3.42Å
534	K	26.8	Very low	28.4	Very low	191 Å²	191	153.3 Å²	153.3	83%	0.83	78%	0.78	S	S	*	*			trans	-75.4	133.6	159.8	-124.7	-172.5	178.3	-169.3	0	107.1	R532 Q536	R532-K534 VanDerWaalsContact C-N 3.28Å; R532-K534 PolarHBondContact O-N 3.5Å; K534-Q536 PolarHBondContact O-N 2.8Å
535	T	29.2	Very low	27.9	Very low	135 Å²	135	158 Å²	158	83%	0.828	80%	0.8	S	S	*	*			trans	-64.4	121.5	177.4	34.4	0	0	0	0	111
536	Q	27.4	Very low	27.3	Very low	191 Å²	191	160.9 Å²	160.9	89%	0.893	81%	0.808	S	S	*	*			trans	-156.9	145	160.1	-118.8	168.2	-8.4	0	0	109.7	K534	K534-Q536 PolarHBondContact O-N 2.8Å
537	N	26.3	Very low	26.7	Very low	165 Å²	165	165.6 Å²	165.6	88%	0.882	82%	0.819	S	S	*	*			trans	-81.1	130.8	-162.2	-55.9	-17.1	0	0	0	112.3
538	C	25.5	Very low	26.5	Very low	131 Å²	131	168.3 Å²	168.3	89%	0.885	82%	0.824	S	S	*	*			trans	-155.2	147.9	141.3	-138	0	0	0	0	110.6
539	T	24.8	Very low	26.3	Very low	127 Å²	127	167.5 Å²	167.5	78%	0.779	83%	0.827	S	S	*	*			trans	-86	144.3	179.2	45	0	0	0	0	111.5
540	T	25.3	Very low	26.3	Very low	119 Å²	119	166.5 Å²	166.5	73%	0.73	83%	0.832	S	S	*	*				175.8	123	128.8	-69.2	0	0	0	0	109.2
541	E	24.6	Very low	26	Very low	185 Å²	185	171 Å²	171	86%	0.864	84%	0.839	S	S	*	*			trans	49.3	144.8	159.4	-68.1	167	-163.4	0	0	122
542	V	23.8	Very low	25.9	Very low	125 Å²	125	167 Å²	167	76%	0.758	83%	0.834	S	S	*	*			trans	-132	123.9	-177.1	174.5	0	0	0	0	109.1
543	I	24.8	Very low	25.8	Very low	171 Å²	171	160.2 Å²	160.2	88%	0.877	82%	0.823	S	S	*	*			trans	-105.4	112.6	163.1	-60	177.6	0	0	0	107.2
544	P	27.2	Very low	25.7	Very low	105 Å²	105	161.8 Å²	161.8	68%	0.682	82%	0.823	S	S	*	*			trans	-84.4	131.1	-175.4	32	-32.9	0	0	0	111.8
545	L	27.2	Very low	25.6	Very low	180 Å²	180	157.4 Å²	157.4	94%	0.942	82%	0.822	S	S	*	*			trans	-105.2	135.3	158.8	-103	169.9	0	0	0	109.9	Y547	L545-Y547 PolarHBondContact O-N 3.38Å
546	M	23.1	Very low	25.4	Very low	168 Å²	168	158.9 Å²	158.9	83%	0.828	82%	0.822	S	S	*	*	S	Bend	trans	-99.7	99.1	-147.7	-178.1	177	175.9	0	0	113.2
547	Y	25.9	Very low	25.3	Very low	226 Å²	226	157.1 Å²	157.1	89%	0.886	82%	0.819	S	S	*	*			trans	-147.2	79.2	153.9	-91.8	-66.9	0	0	0	110.6	L545	L545-Y547 PolarHBondContact O-N 3.38Å
548	R	23.7	Very low	25.3	Very low	240 Å²	240	155.7 Å²	155.7	91%	0.906	82%	0.816	S	S	*	*			trans	-92.3	96.7	175.2	-167.8	-177.7	-160.4	172.2	5	108.7	P550	R548-P550 WeakPolarHBondContact O-CD 3.34Å
549	F	26.6	Very low	25.5	Very low	188 Å²	188	154.7 Å²	154.7	83%	0.825	81%	0.811	S	S	*	*			trans	-59.6	122.2	167.4	-83.7	-85.1	0	0	0	109.1	R551	F549-R551 PolarHBondContact O-N 3.07Å
550	P	28.1	Very low	25.8	Very low	112 Å²	112	157.4 Å²	157.4	73%	0.727	81%	0.811	S	S	*	*			trans	-70.8	129.8	173.9	28.6	-32.5	0	0	0	109.7	R548	R548-P550 WeakPolarHBondContact O-CD 3.34Å
551	R	24.3	Very low	26	Very low	251 Å²	251	156.7 Å²	156.7	95%	0.947	81%	0.807	S	S	*	*			trans	-85	109.2	164	-102.4	-177.7	166.6	172.3	-4.5	108.5	F549	F549-R551 PolarHBondContact O-N 3.07Å
552	S	25.6	Very low	26.1	Very low	101 Å²	101	154.7 Å²	154.7	71%	0.706	80%	0.803	S	S	*	*			trans	-138.6	87.8	161.2	52.8	0	0	0	0	107
553	S	24.7	Very low	26.4	Very low	95 Å²	95	158.8 Å²	158.8	66%	0.664	81%	0.81	S	S	*	*				51.7	88.3	66.5	84.5	0	0	0	0	113.4
554	F	25.4	Very low	26.6	Very low	191 Å²	191	153.7 Å²	153.7	84%	0.838	80%	0.799	S	S	*	*			trans	-165.3	77.2	142.6	-102.4	-63	0	0	0	111.1	M556	F554-M556 PolarHBondContact O-N 3.18Å
555	A	24.8	Very low	26.7	Very low	99 Å²	99	155.7 Å²	155.7	82%	0.818	80%	0.804	S	S	*	*			trans	-88.1	87.5	161.5	0	0	0	0	0	108	N557	A555-N557 PolarHBondContact O-N 3.23Å
556	M	24.5	Very low	26.8	Very low	166 Å²	166	153.4 Å²	153.4	82%	0.818	79%	0.793	S	S	*	*			trans	-85.3	114	-175.6	-164.2	165	-176.1	0	0	110.9	F554	F554-M556 PolarHBondContact O-N 3.18Å
557	N	26.1	Very low	27	Very low	155 Å²	155	154.7 Å²	154.7	83%	0.829	80%	0.795	S	S	*	*			trans	-71.4	124.4	-179.7	-76.6	-35	0	0	0	112.7	A555	A555-N557 PolarHBondContact O-N 3.23Å
558	T	25.2	Very low	27.7	Very low	134 Å²	134	149.6 Å²	149.6	82%	0.822	79%	0.789	S	S	*	*			trans	-148.4	113.5	145.6	46.3	0	0	0	0	109.1
559	S	29	Very low	27.9	Very low	111 Å²	111	143.6 Å²	143.6	78%	0.776	78%	0.784	S	S	*	*				-180	159.7	85	41.9	0	0	0	0	109.6
560	K	31.3	Very low	27.8	Very low	183 Å²	183	143.7 Å²	143.7	80%	0.796	79%	0.786	S	S	*	*			cis	-154.4	126.2	-0.1	-124.9	166.7	-178.5	174.6	0	111.1
561	T	29.3	Very low	27.9	Very low	105 Å²	105	145 Å²	145	64%	0.644	79%	0.793	S	S	*	*			trans	43.3	113.9	138.7	57.9	0	0	0	0	123
562	N	28.4	Very low	28	Very low	143 Å²	143	135.9 Å²	135.9	77%	0.765	78%	0.776	S	S	*	*				96.3	135.3	119.3	-63.6	-0.8	0	0	0	123.2
563	K	30.2	Very low	28.1	Very low	211 Å²	211	140.4 Å²	140.4	92%	0.917	78%	0.784	S	S	*	*			trans	69.4	139.4	171.2	-55	178	-178	-176.1	0	114.2
564	G	28.1	Very low	28.2	Very low	63 Å²	63	141.6 Å²	141.6	65%	0.649	79%	0.786	S	S	*	*			cis	134.5	143.7	11.7	0	0	0	0	0	108.1
565	D	30.2	Very low	28.3	Very low	147 Å²	147	137.6 Å²	137.6	79%	0.786	78%	0.778	S	S	*	*			cis	-154	166.9	2.6	-64.7	-50.5	0	0	0	110.6
566	N	29.3	Very low	28.3	Very low	133 Å²	133	139 Å²	139	71%	0.711	77%	0.772	S	S	*	*			trans	62.4	116.7	147.5	-68.5	-23.9	0	0	0	125
567	F	26	Very low	28.5	Very low	195 Å²	195	137.9 Å²	137.9	86%	0.855	77%	0.769	S	S	*	*			trans	77.3	160	131.8	-72	-49	0	0	0	122.7
568	P	40.9	Very low	28.6	Very low	118 Å²	118	136 Å²	136	77%	0.766	76%	0.763	S	S	*	*			trans	-139	172.6	-143.5	43	-23.3	0	0	0	118.2
569	S	28.4	Very low	28.7	Very low	115 Å²	115	135.8 Å²	135.8	80%	0.804	76%	0.761	S	S	*	*			trans	-159	146	156.1	51.5	0	0	0	0	109.6
570	H	24.4	Very low	28.6	Very low	189 Å²	189	135.8 Å²	135.8	88%	0.875	76%	0.757	S	S	*	*			cis	101.2	78.6	26.9	-142.1	-47.5	0	0	0	115.5
571	V	30.7	Very low	28.4	Very low	141 Å²	141	131.7 Å²	131.7	86%	0.855	75%	0.752	S	S	*	*			trans	-155.4	134.6	148.8	-175.6	0	0	0	0	104.1
572	G	25.2	Very low	28.2	Very low	59 Å²	59	133.4 Å²	133.4	61%	0.608	76%	0.757	S	S	*	*				91.7	136.5	50.3	0	0	0	0	0	109.5
573	F	27.2	Very low	28.2	Very low	196 Å²	196	132.3 Å²	132.3	86%	0.86	76%	0.755	S	S	*	*			cis	-156.1	138	8.4	-131.9	-119.2	0	0	0	110.5
574	V	27.7	Very low	28.1	Very low	119 Å²	119	128.6 Å²	128.6	72%	0.721	75%	0.745	S	S	*	*			trans	72.3	156.3	133.7	164.6	0	0	0	0	122.8
575	T	26.5	Very low	28	Very low	108 Å²	108	134.8 Å²	134.8	66%	0.663	76%	0.755	S	S	*	*			trans	-121.2	-179.1	-169.8	40.6	0	0	0	0	113.1
576	D	26.7	Very low	27.8	Very low	129 Å²	129	132.2 Å²	132.2	69%	0.69	75%	0.749	S	S	*	*			trans	104.1	151.1	144	-62.7	-52.2	0	0	0	123.1
577	N	28.6	Very low	27.6	Very low	142 Å²	142	132.8 Å²	132.8	76%	0.759	75%	0.751	S	S	*	*			trans	80.7	116.2	169.4	-53.5	-51	0	0	0	117.6
578	T	26.7	Very low	27.9	Very low	115 Å²	115	132 Å²	132	71%	0.706	75%	0.754	S	S	*	*			cis	92.1	166.4	23.6	83.9	0	0	0	0	116.2
579	V	28.3	Very low	27.2	Very low	129 Å²	129	133.4 Å²	133.4	78%	0.782	76%	0.755	S	S	*	*			trans	82.4	142.9	179	-174.1	0	0	0	0	116.3
580	T	26.5	Very low	27.3	Very low	112 Å²	112	134.7 Å²	134.7	69%	0.687	75%	0.753	S	S	*	*				-170.4	162.9	-70.1	31.5	0	0	0	0	111.3
581	S	26.5	Very low	27.5	Very low	97 Å²	97	131.5 Å²	131.5	68%	0.678	75%	0.752	S	S	*	*			trans	66.2	157.1	149.2	55.4	0	0	0	0	120.3
582	N	26.3	Very low	27.6	Very low	141 Å²	141	130.1 Å²	130.1	75%	0.754	75%	0.746	S	S	*	*			cis	-168.5	176.5	-15.9	-101.6	-5	0	0	0	110.8
583	T	27.4	Very low	27.5	Very low	120 Å²	120	134.1 Å²	134.1	74%	0.736	75%	0.753	S	S	*	*			trans	65.6	150	156.7	45.6	0	0	0	0	118.8
584	D	29.5	Very low	27.6	Very low	132 Å²	132	133.2 Å²	133.2	71%	0.706	75%	0.751	S	S	*	*			cis	-154.6	-173.8	-5.4	-121.7	-30.6	0	0	0	113
585	F	24.6	Very low	27.5	Very low	193 Å²	193	138.5 Å²	138.5	85%	0.846	76%	0.758	S	S	*	*			trans	-91.1	-177.7	-175.8	-54.6	-92.3	0	0	0	113.7
586	S	26.5	Very low	27.6	Very low	94 Å²	94	143.2 Å²	143.2	66%	0.657	77%	0.765	S	S	*	*			cis	-161.8	172.8	15.1	75.2	0	0	0	0	114.8
587	N	26.2	Very low	27.6	Very low	144 Å²	144	147 Å²	147	77%	0.77	77%	0.769	S	S	*	*			trans	47.3	121.3	147.9	-60.4	-16.9	0	0	0	123.2
588	I	31.3	Very low	27.6	Very low	179 Å²	179	145.3 Å²	145.3	92%	0.918	76%	0.761	S	S	*	*				-168.4	168.6	114.6	-100.1	164.8	0	0	0	111.6
589	L	26.2	Very low	27.6	Very low	148 Å²	148	146.1 Å²	146.1	78%	0.775	77%	0.768	S	S	*	*			trans	-71.6	166.7	-159.8	-129.5	66.9	0	0	0	118.5
590	N	29.7	Very low	27.6	Very low	142 Å²	142	147.2 Å²	147.2	76%	0.759	77%	0.769	S	S	*	*			trans	95.4	113.1	152.7	-64.6	-18	0	0	0	122
591	S	28.6	Very low	27.7	Very low	122 Å²	122	149.3 Å²	149.3	85%	0.853	78%	0.775	S	S	*	*			trans	70.3	140.8	153.3	-137.4	0	0	0	0	119.1
592	P	33.4	Very low	27.7	Very low	112 Å²	112	150 Å²	150	73%	0.727	78%	0.777	S	S	*	*			trans	-100.1	143.3	-173.7	37.6	-31.9	0	0	0	113.6
593	D	24	Very low	28	Very low	142 Å²	142	149.2 Å²	149.2	76%	0.759	78%	0.78	S	S	*	*				-167.6	171.5	108.9	-124.1	-38.4	0	0	0	112.4
594	H	27.9	Very low	27.9	Very low	177 Å²	177	152.6 Å²	152.6	82%	0.819	78%	0.784	S	S	*	*			trans	55.4	110.3	169.3	-63	-57.6	0	0	0	119.4
595	R	26	Very low	27.7	Very low	230 Å²	230	151.2 Å²	151.2	87%	0.868	79%	0.785	S	S	*	*			trans	-121.1	128.6	165.5	-97.2	-166.4	-173	-168.1	5.2	112.3
596	Y	29.1	Very low	27.8	Very low	208 Å²	208	146.4 Å²	146.4	82%	0.816	78%	0.775	S	S	*	*			trans	56.4	99.2	155.3	-65.3	-81.3	0	0	0	121.4
597	R	25.7	Very low	27.8	Very low	207 Å²	207	147.7 Å²	147.7	78%	0.781	78%	0.779	S	S	*	*				-55	156.9	114.5	-87.9	-174.6	164.8	-132.1	14.3	110.6
598	D	29	Very low	27.8	Very low	107 Å²	107	147.9 Å²	147.9	57%	0.572	78%	0.78	S	S	*	*			cis	-142.7	178.2	-1.7	-86.3	-41.7	0	0	0	106.8
599	P	27.7	Very low	27.6	Very low	133 Å²	133	147.8 Å²	147.8	86%	0.864	78%	0.776	S	S	*	*				-129	152.8	123.3	36.9	-32.2	0	0	0	113.5
600	L	27.1	Very low	27.8	Very low	152 Å²	152	145.3 Å²	145.3	80%	0.796	77%	0.767	S	S	*	*			trans	-89.8	158.6	-173.3	-73	164.3	0	0	0	113.7
601	L	28.7	Very low	27.7	Very low	156 Å²	156	146.5 Å²	146.5	82%	0.817	77%	0.773	S	S	*	*			trans	66.1	115.9	156.6	-69.6	162.1	0	0	0	119.5
602	P	27.4	Very low	28.1	Very low	110 Å²	110	150.1 Å²	150.1	71%	0.714	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-80.7	145.7	148.7	34.5	-31	0	0	0	110.8
603	P	31.4	Very low	28.5	Very low	126 Å²	126	149.7 Å²	149.7	82%	0.818	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-71.8	134.1	171	29.5	-33.2	0	0	0	111.3
604	K	27	Very low	29.7	Very low	191 Å²	191	149.4 Å²	149.4	83%	0.83	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-71.3	162.9	157.9	-56.4	176	-179.1	176.5	0	107.6
605	S	25.2	Very low	31	Very low	103 Å²	103	142.4 Å²	142.4	72%	0.72	73%	0.734	S	S	*	*			cis	-160.4	-169.2	27.5	58.2	0	0	0	0	113.1
606	S	25.4	Very low	32.4	Very low	92 Å²	92	135 Å²	135	64%	0.643	71%	0.711	S	S	*	*			trans	71.3	99	153.3	33	0	0	0	0	119.1
607	T	27.2	Very low	34.1	Very low	120 Å²	120	126.6 Å²	126.6	74%	0.736	68%	0.679	S	S	*	*				42.7	119.6	124.5	54.8	0	0	0	0	119.1
608	D	26.3	Very low	35.9	Very low	148 Å²	148	120.2 Å²	120.2	79%	0.791	66%	0.663	S	S	*	*				-165.8	-178.7	80.5	-116.5	-39.1	0	0	0	115.2
609	Q	27.2	Very low	37.5	Very low	178 Å²	178	117.3 Å²	117.3	83%	0.832	65%	0.647	S	S	*	*			trans	-72.6	120.6	-169.8	-56.6	168.3	-2.2	0	0	115.1
610	V	30.1	Very low	39.2	Very low	96 Å²	96	114.9 Å²	114.9	58%	0.582	62%	0.624	S	S	*	*			trans	-145.3	127.1	146.7	-176.1	0	0	0	0	109.5	Y612	V610-Y612 HydrophobicContact CB-CD2 4.11Å; V610-Y612 HydrophobicContact CB-CE2 3.88Å; V610-Y612 HydrophobicContact CG1-CD2 4.32Å; V610-Y612 HydrophobicContact CG1-CE2 4.35Å; V610-Y612 WeakPolarHBondContact O-CD2 3.37Å; V610-Y612 PolarHBondContact O-N 3.41Å
611	N	28.4	Very low	40.9	Very low	167 Å²	167	109.6 Å²	109.6	89%	0.893	60%	0.6	S	S	*	*			trans	-72.4	92.2	163.9	-79.4	-19.9	0	0	0	108.7	S613	N611-S613 PolarHBondContact O-N 2.85Å
612	Y	36.1	Very low	42.7	Very low	198 Å²	198	103.7 Å²	103.7	78%	0.776	57%	0.57	S	S	*	*			trans	-65.6	99.8	176.6	-80.5	-85.7	0	0	0	110.7	V610 Q614	V610-Y612 HydrophobicContact CB-CD2 4.11Å; V610-Y612 HydrophobicContact CB-CE2 3.88Å; V610-Y612 HydrophobicContact CG1-CD2 4.32Å; V610-Y612 HydrophobicContact CG1-CE2 4.35Å; V610-Y612 WeakPolarHBondContact O-CD2 3.37Å; V610-Y612 PolarHBondContact O-N 3.41Å; Y612-Q614 PolarHBondContact O-N 3.35Å
613	S	41.9	Very low	44.6	Very low	103 Å²	103	100.5 Å²	100.5	72%	0.72	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-56.5	123.8	166.8	43.1	0	0	0	0	109.4	N611 S615	N611-S613 PolarHBondContact O-N 2.85Å; S613-S615 PolarHBondContact O-N 2.71Å
614	Q	48.5	Very low	46.7	Very low	135 Å²	135	97.3 Å²	97.3	63%	0.631	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-63.7	123.7	-172.7	-71.3	171.8	-25.3	0	0	110.4	Y612 N684	Y612-Q614 PolarHBondContact O-N 3.35Å; Q614-N684 PolarHBondContact OE1-ND2 2.81Å
615	S	56	Low	49	Very low	31 Å²	31	90.2 Å²	90.2	22%	0.217	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-80.5	122	178.3	65.2	0	0	0	0	110.3	R494 S613 F617	R494-S615 PolarHBondContact NE-OG 3.32Å; R494-S615 VanDerWaalsContact NE-OG 3.07Å; R494-S615 PolarHBondContact NH2-OG 2.84Å; S613-S615 PolarHBondContact O-N 2.71Å; S615-F617 VanDerWaalsContact O-CD2 3.22Å; S615-F617 WeakPolarHBondContact O-CD2 3.42Å; S615-F617 WeakPolarHBondContact O-CE2 3.34Å; S615-F617 PolarHBondContact O-N 3.44Å; S615-F617 WeakPolarHBondContact OG-CZ 3.4Å
616	N	55.1	Low	51.4	Low	73 Å²	73	91.3 Å²	91.3	39%	0.39	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-59.3	129.5	173.6	-72.6	-34.5	0	0	0	110.8	E495	E495-N616 HydrophobicContact CB-CB 4.23Å; E495-N616 PolarHBondContact N-O 3.25Å; E495-N616 WeakPolarHBondContact OE2-CB 3.39Å; E495-N616 PolarHBondContact OE2-ND2 3Å
617	F	65	Low	54	Low	32 Å²	32	87.4 Å²	87.4	14%	0.14	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.3	172.1	-64.2	-77.2	0	0	0	111.3	V492 Y493 R494 V506 S615 V681 K683	V492-F617 HydrophobicContact CG1-CB 4.03Å; V492-F617 HydrophobicContact CG1-CD1 4.05Å; V492-F617 HydrophobicContact CG1-CG 4.45Å; Y493-F617 CarbonylContact O-C 2.9Å; Y493-F617 WeakPolarHBondContact O-CA 2.88Å; R494-F617 HydrophobicContact CB-CE1 4.45Å; V506-F617 HydrophobicContact CG2-CE1 4.45Å; S615-F617 VanDerWaalsContact O-CD2 3.22Å; S615-F617 WeakPolarHBondContact O-CD2 3.42Å; S615-F617 WeakPolarHBondContact O-CE2 3.34Å; S615-F617 PolarHBondContact O-N 3.44Å; S615-F617 WeakPolarHBondContact OG-CZ 3.4Å; F617-V681 HydrophobicContact CB-CG1 4.29Å; F617-K683 PolarHBondContact N-O 2.91Å
618	V	63.1	Low	56.3	Low	74 Å²	74	82.6 Å²	82.6	45%	0.448	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.4	179.6	-177.7	0	0	0	0	109.9	Y493	Y493-V618 PolarHBondContact N-O 3.06Å; Y493-V618 PolarHBondContact O-N 3.36Å
619	M	63.7	Low	58.9	Low	46 Å²	46	75.7 Å²	75.7	23%	0.227	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	101.7	-178.5	172.5	172.9	157.9	0	0	111.4	V490 S621 V681	V490-M619 HydrophobicContact CG1-CE 3.65Å; V490-M619 HydrophobicContact CG1-CG 3.57Å; V490-M619 HydrophobicContact CG1-SD 3.7Å; V490-M619 HydrophobicContact CG2-CE 4.05Å; M619-S621 PolarHBondContact O-N 3.44Å; M619-S621 VanDerWaalsContact O-N 3.07Å; M619-V681 HydrophobicContact CB-CG2 3.64Å; M619-V681 HydrophobicContact CG-CG2 4.2Å; M619-V681 HydrophobicContact SD-CG2 3.6Å; M619-V681 VanDerWaalsContact SD-CG2 3.6Å
620	Q	62.1	Low	61.1	Low	81 Å²	81	74.8 Å²	74.8	38%	0.379	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	88.8	174.9	-160.2	175.9	17.3	0	0	110.5	Y491 Y493 T622	Y491-Q620 PolarHBondContact O-N 3.3Å; Y491-Q620 VanDerWaalsContact O-N 3.09Å; Y493-Q620 HydrophobicContact CD2-CB 4.01Å; Y493-Q620 HydrophobicContact CE2-CB 3.78Å; Q620-T622 PolarHBondContact O-N 3.01Å
621	S	63.6	Low	63.4	Low	41 Å²	41	77.2 Å²	77.2	29%	0.287	38%	0.384	S	S	.	.			trans	-81.3	10.3	176.4	69.2	0	0	0	0	114.2	S483 R484 M619	S483-S621 CarbonylContact C-O 3.58Å; S483-S621 WeakPolarHBondContact CA-O 3.4Å; S483-S621 PolarHBondContact OG-O 3.17Å; R484-S621 PolarHBondContact N-O 2.91Å; M619-S621 PolarHBondContact O-N 3.44Å; M619-S621 VanDerWaalsContact O-N 3.07Å
622	T	65.4	Low	65.8	Low	32 Å²	32	74.8 Å²	74.8	20%	0.196	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.4	-174.3	50.1	0	0	0	0	113	Q481 V482 Q620	Q481-T622 HydrophobicContact CB-CG2 4.43Å; V482-T622 CarbonylContact O-C 3.59Å; V482-T622 VanDerWaalsContact O-CA 3.31Å; V482-T622 WeakPolarHBondContact O-CA 3.27Å; Q620-T622 PolarHBondContact O-N 3.01Å
623	L	68.9	Low	68.1	Low	44 Å²	44	68.9 Å²	68.9	23%	0.23	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	137.7	161.7	176	146.5	0	0	0	108.5	Q481 V482 R484 L625	Q481-L623 CarbonylContact C-O 3.59Å; Q481-L623 WeakPolarHBondContact CA-O 3.34Å; V482-L623 HydrophobicContact CB-CB 4.46Å; V482-L623 HydrophobicContact CB-CD2 4.47Å; V482-L623 PolarHBondContact N-O 2.98Å; V482-L623 PolarHBondContact O-N 3.28Å; R484-L623 HydrophobicContact CG-CB 4.48Å; L623-L625 HydrophobicContact CD2-CD1 4.04Å; L623-L625 HydrophobicContact CD2-CD2 4.04Å; L623-L625 HydrophobicContact CD2-CG 3.75Å
624	V	74.9	Confident	70.1	Confident	58 Å²	58	64.3 Å²	64.3	35%	0.352	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	133.6	-175.1	-171.8	0	0	0	0	110	I479 F480 Q481	I479-V624 HydrophobicContact CG2-CG1 3.51Å; F480-V624 WeakPolarHBondContact O-CA 3.45Å; Q481-V624 HydrophobicContact CG-CG2 4.35Å
625	L	74.3	Confident	71.7	Confident	42 Å²	42	58 Å²	58	22%	0.22	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	149.7	173.6	-56.6	164.8	0	0	0	108.9	I479 F480 L623 L641 Y644	I479-L625 CarbonylContact C-O 3.1Å; I479-L625 WeakPolarHBondContact CA-O 3.23Å; F480-L625 HydrophobicContact CB-CB 4.3Å; F480-L625 PolarHBondContact N-O 2.75Å; F480-L625 PolarHBondContact O-N 3.06Å; L623-L625 HydrophobicContact CD2-CD1 4.04Å; L623-L625 HydrophobicContact CD2-CD2 4.04Å; L623-L625 HydrophobicContact CD2-CG 3.75Å; L625-L641 HydrophobicContact CB-CD2 4.35Å; L625-L641 HydrophobicContact CD1-CD2 4.25Å; L625-Y644 HydrophobicContact CD1-CD1 3.95Å; L625-Y644 HydrophobicContact CD1-CE1 4.34Å
626	K	77	Confident	73.1	Confident	127 Å²	127	60.9 Å²	60.9	55%	0.552	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	150.4	-177.3	-73.9	-160.9	168.3	-155.1	0	113	E477 F478 I479 L641	E477-K626 IonicContact OE2-NZ 3.34Å; E477-K626 PolarHBondContact OE2-NZ 3.34Å; F478-K626 CarbonylContact O-C 3.51Å; F478-K626 WeakPolarHBondContact O-CA 3.19Å; I479-K626 HydrophobicContact CG1-CG 4.32Å; K626-L641 WeakPolarHBondContact O-CD1 3.4Å
627	A	78.8	Confident	74.5	Confident	10 Å²	10	61.5 Å²	61.5	8%	0.083	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	165.7	168	0	0	0	0	0	110.7	E477 F478 L637 V638 L641	E477-A627 CarbonylContact C-O 3.57Å; E477-A627 VanDerWaalsContact CA-O 3.27Å; E477-A627 WeakPolarHBondContact CA-O 3.24Å; F478-A627 HydrophobicContact CB-CB 4.34Å; F478-A627 PolarHBondContact N-O 2.78Å; F478-A627 PolarHBondContact O-N 3.05Å; A627-L637 HydrophobicContact CB-CD2 3.4Å; A627-L637 VanDerWaalsContact CB-CD2 3.4Å; A627-V638 HydrophobicContact CB-CG2 3.69Å; A627-L641 HydrophobicContact CB-CD1 3.86Å
628	S	77	Confident	75.4	Confident	19 Å²	19	60 Å²	60	13%	0.133	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	147.7	-174.6	177	0	0	0	0	112.5	P474 E476 R630 W634	P474-S628 WeakPolarHBondContact CB-OG 3.41Å; P474-S628 WeakPolarHBondContact CG-OG 3.44Å; E476-S628 WeakPolarHBondContact O-CA 3.41Å; S628-R630 PolarHBondContact O-N 2.92Å; S628-W634 WeakPolarHBondContact O-CB 3.31Å
629	T	80	Confident	76.5	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.018	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-4.5	178.7	61.4	0	0	0	0	115.3	R206 P474 D475 E476 F478 Y631 W634	R206-T629 PolarHBondContact N-O 2.9Å; R206-T629 PolarHBondContact O-OG1 2.92Å; P474-T629 WeakPolarHBondContact CB-OG1 3.35Å; D475-T629 PolarHBondContact N-OG1 3.11Å; D475-T629 VanDerWaalsContact N-OG1 3.08Å; E476-T629 HydrophobicContact CB-CG2 4.21Å; E476-T629 PolarHBondContact N-OG1 3.39Å; E476-T629 PolarHBondContact O-N 3.04Å; F478-T629 HydrophobicContact CE2-CG2 3.9Å; F478-T629 HydrophobicContact CZ-CG2 4.46Å; T629-Y631 VanDerWaalsContact C-N 3.29Å; T629-Y631 PolarHBondContact O-N 3.49Å; T629-W634 HydrophobicContact CG2-CD2 4.11Å; T629-W634 HydrophobicContact CG2-CE3 4.25Å; T629-W634 HydrophobicContact CG2-CH2 4.35Å; T629-W634 HydrophobicContact CG2-CZ2 4.21Å; T629-W634 HydrophobicContact CG2-CZ3 4.37Å
630	R	74.4	Confident	77.7	Confident	158 Å²	158	60.8 Å²	60.8	60%	0.596	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-30.9	-178.5	-176.9	174.5	177.7	-179.7	-0.4	113.5	P474 S628	P474-R630 HydrophobicContact CB-CB 4.21Å; S628-R630 PolarHBondContact O-N 2.92Å
631	Y	76.5	Confident	78.8	Confident	148 Å²	148	58.7 Å²	58.7	58%	0.58	27%	0.274	S	S	*	.	S	Bend	trans	-92.7	145.2	-172.1	-58.8	-75.6	0	0	0	111.8	T629 W634	T629-Y631 VanDerWaalsContact C-N 3.29Å; T629-Y631 PolarHBondContact O-N 3.49Å; Y631-W634 WeakPolarHBondContact O-CB 3.4Å; Y631-W634 VanDerWaalsContact O-CD1 3.26Å; Y631-W634 PolarHBondContact O-N 3.12Å
632	F	80.4	Confident	79.8	Confident	116 Å²	116	57.4 Å²	57.4	51%	0.509	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	147.9	167.8	-176.6	-113.7	0	0	0	110.2	F202 W204 P205 W634	F202-F632 HydrophobicContact CB-CE2 4.26Å; F202-F632 HydrophobicContact CB-CZ 4.35Å; W204-F632 HydrophobicContact CE3-CE2 4.29Å; W204-F632 HydrophobicContact CZ3-CE2 4.37Å; P205-F632 HydrophobicContact CG-CB 4.4Å; F632-W634 VanDerWaalsContact C-N 3.26Å; F632-W634 PolarHBondContact O-N 2.98Å
633	M	84.1	Confident	80.9	Confident	74 Å²	74	57.1 Å²	57.1	37%	0.365	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	63	19.8	-173.6	-46.4	-150.3	85.2	0	0	116	F202 G203 R635 W636 L637	F202-M633 HydrophobicContact CB-CE 4.48Å; F202-M633 HydrophobicContact CD1-CE 3.57Å; F202-M633 HydrophobicContact CE1-CE 4.23Å; F202-M633 HydrophobicContact CG-CE 4.38Å; F202-M633 CarbonylContact O-C 3.58Å; F202-M633 VanDerWaalsContact O-CA 3.25Å; F202-M633 WeakPolarHBondContact O-CA 3.46Å; G203-M633 PolarHBondContact O-N 3.4Å; M633-R635 PolarHBondContact O-N 2.98Å; M633-W636 PolarHBondContact O-N 3.3Å; M633-L637 PolarHBondContact O-N 2.83Å
634	W	83.4	Confident	81.7	Confident	6 Å²	6	60.8 Å²	60.8	2%	0.023	27%	0.274	C	S	.	.	H	α-helix	trans	-54.9	-31.5	-175.8	63.2	-98.8	0	0	0	114	W204 F478 S628 T629 Y631 F632 W636 L637 V638 Y796	W204-W634 PolarHBondContact O-NE1 3.16Å; F478-W634 AromaticContact CE2-CE3 3.78Å; F478-W634 HydrophobicContact CE2-CE3 3.78Å; F478-W634 HydrophobicContact CE2-CH2 4.4Å; F478-W634 AromaticContact CE2-CZ3 3.52Å; F478-W634 HydrophobicContact CE2-CZ3 3.52Å; F478-W634 HydrophobicContact CZ-CE3 4.46Å; F478-W634 HydrophobicContact CZ-CH2 4.35Å; F478-W634 AromaticContact CZ-CZ3 3.74Å; F478-W634 HydrophobicContact CZ-CZ3 3.74Å; S628-W634 WeakPolarHBondContact O-CB 3.31Å; T629-W634 HydrophobicContact CG2-CD2 4.11Å; T629-W634 HydrophobicContact CG2-CE3 4.25Å; T629-W634 HydrophobicContact CG2-CH2 4.35Å; T629-W634 HydrophobicContact CG2-CZ2 4.21Å; T629-W634 HydrophobicContact CG2-CZ3 4.37Å; Y631-W634 WeakPolarHBondContact O-CB 3.4Å; Y631-W634 VanDerWaalsContact O-CD1 3.26Å; Y631-W634 PolarHBondContact O-N 3.12Å; F632-W634 VanDerWaalsContact C-N 3.26Å; F632-W634 PolarHBondContact O-N 2.98Å; W634-W636 VanDerWaalsContact C-N 3.27Å; W634-W636 PolarHBondContact O-N 3.36Å; W634-L637 PolarHBondContact O-N 3.04Å; W634-V638 HydrophobicContact CE3-CG2 4.24Å; W634-V638 WeakPolarHBondContact O-CB 3.18Å; W634-V638 VanDerWaalsContact O-CG2 3.23Å; W634-V638 WeakPolarHBondContact O-CG2 3.29Å; W634-V638 PolarHBondContact O-N 2.89Å; W634-Y796 HydrophobicContact CZ3-CG 4.42Å
635	R	82.4	Confident	82.2	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.015	26%	0.259	C	S	.	.	H	α-helix	trans	-58.9	-36.8	176.6	-73	-178.4	176.6	-78.6	-19	112.6	D199 I200 M633 F639 N794 Y796	D199-R635 PolarHBondContact O-NE 2.77Å; I200-R635 WeakPolarHBondContact O-CD 3.34Å; I200-R635 PolarHBondContact O-NE 2.76Å; M633-R635 PolarHBondContact O-N 2.98Å; R635-F639 PolarHBondContact O-N 3.1Å; R635-N794 PolarHBondContact NH1-OD1 2.81Å; R635-Y796 PolarHBondContact NH2-O 3.08Å
636	W	84.8	Confident	82.7	Confident	90 Å²	90	59.3 Å²	59.3	34%	0.341	26%	0.261	S	S	.	.	H	α-helix	trans	-75.2	-39.9	179.8	-72.5	85.2	0	0	0	112.1	F201 M633 W634 V638 F639 F640	F201-W636 PolarHBondContact O-NE1 3.25Å; M633-W636 PolarHBondContact O-N 3.3Å; W634-W636 VanDerWaalsContact C-N 3.27Å; W634-W636 PolarHBondContact O-N 3.36Å; W636-V638 VanDerWaalsContact C-N 3.33Å; W636-V638 PolarHBondContact O-N 3.08Å; W636-F639 HydrophobicContact CE3-CD1 4.32Å; W636-F639 WeakPolarHBondContact O-CB 3.48Å; W636-F639 PolarHBondContact O-N 2.96Å; W636-F640 HydrophobicContact CB-CE2 4.47Å; W636-F640 WeakPolarHBondContact O-CD2 3.39Å; W636-F640 PolarHBondContact O-N 3.02Å
637	L	84.7	Confident	83.2	Confident	87 Å²	87	55.4 Å²	55.4	46%	0.455	25%	0.245	S	C	.	.	H	α-helix	trans	-62.6	-41.1	173.8	-172.8	150.3	0	0	0	111.4	A627 M633 W634 F640 L641	A627-L637 HydrophobicContact CB-CD2 3.4Å; A627-L637 VanDerWaalsContact CB-CD2 3.4Å; M633-L637 PolarHBondContact O-N 2.83Å; W634-L637 PolarHBondContact O-N 3.04Å; L637-F640 PolarHBondContact O-N 2.71Å; L637-L641 HydrophobicContact CD2-CD1 3.82Å; L637-L641 WeakPolarHBondContact O-CG 3.29Å; L637-L641 PolarHBondContact O-N 3.28Å
638	V	84.4	Confident	83.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.2	-37.5	174.1	174.7	0	0	0	0	111.6	F478 F480 A627 W634 W636 C642 Y796	F478-V638 HydrophobicContact CB-CG1 4.47Å; F478-V638 HydrophobicContact CB-CG2 4.27Å; F478-V638 HydrophobicContact CD2-CG1 4.36Å; F478-V638 HydrophobicContact CD2-CG2 3.48Å; F478-V638 VanDerWaalsContact CD2-CG2 3.48Å; F478-V638 HydrophobicContact CE2-CG2 4.09Å; F478-V638 HydrophobicContact CG-CG1 4.2Å; F478-V638 HydrophobicContact CG-CG2 4.01Å; F480-V638 HydrophobicContact CE2-CG1 4.11Å; F480-V638 HydrophobicContact CZ-CG1 3.77Å; A627-V638 HydrophobicContact CB-CG2 3.69Å; W634-V638 HydrophobicContact CE3-CG2 4.24Å; W634-V638 WeakPolarHBondContact O-CB 3.18Å; W634-V638 VanDerWaalsContact O-CG2 3.23Å; W634-V638 WeakPolarHBondContact O-CG2 3.29Å; W634-V638 PolarHBondContact O-N 2.89Å; W636-V638 VanDerWaalsContact C-N 3.33Å; W636-V638 PolarHBondContact O-N 3.08Å; V638-C642 VanDerWaalsContact O-CB 3.29Å; V638-C642 WeakPolarHBondContact O-CB 3.41Å; V638-C642 PolarHBondContact O-N 3.17Å; V638-Y796 HydrophobicContact CG1-CD1 3.69Å; V638-Y796 HydrophobicContact CG1-CE1 3.31Å
639	F	86.3	Confident	83.7	Confident	13 Å²	13	60 Å²	60	6%	0.057	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-51.7	171.9	161.7	-107.4	0	0	0	112.3	R635 W636 L641 C642 T643 L783 H786	R635-F639 PolarHBondContact O-N 3.1Å; W636-F639 HydrophobicContact CE3-CD1 4.32Å; W636-F639 WeakPolarHBondContact O-CB 3.48Å; W636-F639 PolarHBondContact O-N 2.96Å; F639-L641 PolarHBondContact O-N 2.88Å; F639-C642 WeakPolarHBondContact O-CA 3.46Å; F639-C642 WeakPolarHBondContact O-CB 3.41Å; F639-C642 PolarHBondContact O-N 3.17Å; F639-C642 VanDerWaalsContact O-N 3.07Å; F639-T643 HydrophobicContact CD1-CG2 4.45Å; F639-T643 HydrophobicContact CD2-CG2 3.75Å; F639-T643 HydrophobicContact CE1-CG2 4.11Å; F639-T643 HydrophobicContact CE2-CG2 3.33Å; F639-T643 HydrophobicContact CG-CG2 4.29Å; F639-T643 HydrophobicContact CZ-CG2 3.54Å; F639-T643 WeakPolarHBondContact O-CG2 3.48Å; F639-T643 PolarHBondContact O-N 2.69Å; F639-L783 HydrophobicContact CE1-CD1 4.34Å; F639-L783 HydrophobicContact CE2-CB 4.43Å; F639-L783 HydrophobicContact CZ-CB 4.17Å; F639-L783 HydrophobicContact CZ-CD1 3.86Å; F639-H786 HydrophobicContact CD2-CB 3.81Å; F639-H786 AromaticContact CD2-CG 3.92Å; F639-H786 AromaticContact CD2-ND1 3.94Å; F639-H786 HydrophobicContact CE2-CB 4.13Å
640	F	88.1	Confident	83.9	Confident	123 Å²	123	60.9 Å²	60.9	54%	0.539	27%	0.266	S	S	.	.	H	α-helix	trans	-60.2	-44.3	-178.7	-69.2	-60.8	0	0	0	112.6	W636 L637 C642 T643 Y644	W636-F640 HydrophobicContact CB-CE2 4.47Å; W636-F640 WeakPolarHBondContact O-CD2 3.39Å; W636-F640 PolarHBondContact O-N 3.02Å; L637-F640 PolarHBondContact O-N 2.71Å; F640-C642 VanDerWaalsContact C-N 3.3Å; F640-C642 PolarHBondContact O-N 3.36Å; F640-T643 PolarHBondContact O-N 3.03Å; F640-T643 PolarHBondContact O-OG1 3.28Å; F640-Y644 PolarHBondContact O-N 3.2Å
641	L	85.3	Confident	84.4	Confident	38 Å²	38	55.6 Å²	55.6	20%	0.199	25%	0.25	C	S	.	.	H	α-helix	trans	-63.1	-36.5	174.7	-66.7	174.5	0	0	0	112.4	F480 L625 K626 A627 L637 F639 S645	F480-L641 HydrophobicContact CD2-CB 3.89Å; F480-L641 HydrophobicContact CD2-CD1 4.45Å; F480-L641 HydrophobicContact CE2-CB 3.81Å; F480-L641 HydrophobicContact CE2-CD1 4.45Å; L625-L641 HydrophobicContact CB-CD2 4.35Å; L625-L641 HydrophobicContact CD1-CD2 4.25Å; K626-L641 WeakPolarHBondContact O-CD1 3.4Å; A627-L641 HydrophobicContact CB-CD1 3.86Å; L637-L641 HydrophobicContact CD2-CD1 3.82Å; L637-L641 WeakPolarHBondContact O-CG 3.29Å; L637-L641 PolarHBondContact O-N 3.28Å; F639-L641 PolarHBondContact O-N 2.88Å; L641-S645 WeakPolarHBondContact O-CB 3.38Å; L641-S645 PolarHBondContact O-N 2.87Å
642	C	84.6	Confident	84.6	Confident	13 Å²	13	49.6 Å²	49.6	9%	0.088	23%	0.227	C	C	.	.	H	α-helix	trans	-63.9	-48.7	175.2	-168.8	0	0	0	0	111.5	F480 V638 F639 F640 Y644 S645 W646	F480-C642 HydrophobicContact CE1-CB 3.73Å; F480-C642 HydrophobicContact CZ-CB 3.88Å; V638-C642 VanDerWaalsContact O-CB 3.29Å; V638-C642 WeakPolarHBondContact O-CB 3.41Å; V638-C642 PolarHBondContact O-N 3.17Å; F639-C642 WeakPolarHBondContact O-CA 3.46Å; F639-C642 WeakPolarHBondContact O-CB 3.41Å; F639-C642 PolarHBondContact O-N 3.17Å; F639-C642 VanDerWaalsContact O-N 3.07Å; F640-C642 VanDerWaalsContact C-N 3.3Å; F640-C642 PolarHBondContact O-N 3.36Å; C642-Y644 VanDerWaalsContact C-N 3.31Å; C642-Y644 PolarHBondContact O-N 3.04Å; C642-S645 PolarHBondContact O-N 2.9Å; C642-S645 VanDerWaalsContact O-N 3.1Å; C642-S645 PolarHBondContact O-OG 2.92Å; C642-W646 PolarHBondContact O-N 2.9Å
643	T	88.1	Confident	84.8	Confident	26 Å²	26	48.2 Å²	48.2	16%	0.16	22%	0.219	C	C	.	.	H	α-helix	trans	-55.6	-45.1	180	73.2	0	0	0	0	111.9	F639 F640 W646 L647 S782	F639-T643 HydrophobicContact CD1-CG2 4.45Å; F639-T643 HydrophobicContact CD2-CG2 3.75Å; F639-T643 HydrophobicContact CE1-CG2 4.11Å; F639-T643 HydrophobicContact CE2-CG2 3.33Å; F639-T643 HydrophobicContact CG-CG2 4.29Å; F639-T643 HydrophobicContact CZ-CG2 3.54Å; F639-T643 WeakPolarHBondContact O-CG2 3.48Å; F639-T643 PolarHBondContact O-N 2.69Å; F640-T643 PolarHBondContact O-N 3.03Å; F640-T643 PolarHBondContact O-OG1 3.28Å; T643-W646 PolarHBondContact O-N 3.3Å; T643-L647 PolarHBondContact O-N 3.34Å; T643-S782 VanDerWaalsContact CG2-OG 3.31Å; T643-S782 WeakPolarHBondContact CG2-OG 3.44Å
644	Y	86.9	Confident	84.9	Confident	121 Å²	121	46.9 Å²	46.9	48%	0.475	21%	0.211	S	C	.	.	H	α-helix	trans	-66.1	-41.4	178.5	-178.6	-113	0	0	0	111.8	L625 F640 C642 W646 L647 I648	L625-Y644 HydrophobicContact CD1-CD1 3.95Å; L625-Y644 HydrophobicContact CD1-CE1 4.34Å; F640-Y644 PolarHBondContact O-N 3.2Å; C642-Y644 VanDerWaalsContact C-N 3.31Å; C642-Y644 PolarHBondContact O-N 3.04Å; Y644-W646 VanDerWaalsContact C-N 3.34Å; Y644-W646 PolarHBondContact O-N 2.87Å; Y644-L647 PolarHBondContact O-N 3.1Å; Y644-I648 HydrophobicContact CD1-CD1 4.16Å; Y644-I648 HydrophobicContact CD2-CD1 4.46Å; Y644-I648 HydrophobicContact CE1-CD1 3.72Å; Y644-I648 HydrophobicContact CE2-CD1 4.03Å; Y644-I648 WeakPolarHBondContact O-CG1 3.32Å; Y644-I648 PolarHBondContact O-N 3.38Å
645	S	84.7	Confident	84.9	Confident	6 Å²	6	49.9 Å²	49.9	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-63.4	-38.7	175.9	82.3	0	0	0	0	112.6	L641 C642 R649	L641-S645 WeakPolarHBondContact O-CB 3.38Å; L641-S645 PolarHBondContact O-N 2.87Å; C642-S645 PolarHBondContact O-N 2.9Å; C642-S645 VanDerWaalsContact O-N 3.1Å; C642-S645 PolarHBondContact O-OG 2.92Å; S645-R649 WeakPolarHBondContact O-CB 3.4Å; S645-R649 WeakPolarHBondContact O-CG 3.18Å; S645-R649 PolarHBondContact O-N 3.16Å; S645-R649 VanDerWaalsContact O-N 3.09Å
646	W	85	Confident	84.7	Confident	64 Å²	64	52 Å²	52	24%	0.242	24%	0.238	C	C	.	.	H	α-helix	trans	-69.8	-43.1	176.8	-85	19.9	0	0	0	111.9	C642 T643 Y644 I648 R649 S650 I778 A785 W1647	C642-W646 PolarHBondContact O-N 2.9Å; T643-W646 PolarHBondContact O-N 3.3Å; Y644-W646 VanDerWaalsContact C-N 3.34Å; Y644-W646 PolarHBondContact O-N 2.87Å; W646-I648 VanDerWaalsContact C-N 3.34Å; W646-I648 PolarHBondContact O-N 3.11Å; W646-R649 PolarHBondContact O-N 3.37Å; W646-S650 WeakPolarHBondContact O-CB 3.39Å; W646-S650 PolarHBondContact O-N 3.27Å; W646-I778 HydrophobicContact CB-CG2 4.02Å; W646-A785 HydrophobicContact CH2-CB 4.17Å; W646-A785 HydrophobicContact CZ3-CB 4.31Å; W646-W1647 HydrophobicContact CH2-CE3 4.5Å; W646-W1647 HydrophobicContact CZ2-CB 4.33Å; W646-W1647 WeakPolarHBondContact CZ2-O 3.14Å; W646-W1647 PolarHBondContact NE1-O 3.14Å
647	L	87.3	Confident	84.4	Confident	44 Å²	44	49 Å²	49	23%	0.23	23%	0.229	C	C	.	.	H	α-helix	trans	-53.2	-52.4	175.4	-167.9	93.5	0	0	0	110.6	T643 Y644 S650 L651 I778	T643-L647 PolarHBondContact O-N 3.34Å; Y644-L647 PolarHBondContact O-N 3.1Å; L647-S650 PolarHBondContact O-N 3.11Å; L647-L651 HydrophobicContact CD2-CD1 4.37Å; L647-L651 HydrophobicContact CG-CD1 4.1Å; L647-L651 WeakPolarHBondContact O-CB 3.21Å; L647-L651 VanDerWaalsContact O-CG 3.24Å; L647-L651 WeakPolarHBondContact O-CG 3.42Å; L647-L651 PolarHBondContact O-N 3.2Å; L647-I778 HydrophobicContact CB-CG2 4.44Å; L647-I778 HydrophobicContact CD1-CB 4.32Å; L647-I778 HydrophobicContact CD1-CD1 4.29Å; L647-I778 HydrophobicContact CD1-CG2 4.48Å
648	I	82.9	Confident	84.2	Confident	40 Å²	40	46 Å²	46	21%	0.205	21%	0.213	C	C	.	.	H	α-helix	trans	-64.9	-45.3	-179.4	-62.2	168.5	0	0	0	111.5	V482 Y644 W646 Q652	V482-I648 HydrophobicContact CG1-CB 3.97Å; V482-I648 HydrophobicContact CG1-CG2 3.52Å; Y644-I648 HydrophobicContact CD1-CD1 4.16Å; Y644-I648 HydrophobicContact CD2-CD1 4.46Å; Y644-I648 HydrophobicContact CE1-CD1 3.72Å; Y644-I648 HydrophobicContact CE2-CD1 4.03Å; Y644-I648 WeakPolarHBondContact O-CG1 3.32Å; Y644-I648 PolarHBondContact O-N 3.38Å; W646-I648 VanDerWaalsContact C-N 3.34Å; W646-I648 PolarHBondContact O-N 3.11Å; I648-Q652 WeakPolarHBondContact O-CG 3.44Å; I648-Q652 PolarHBondContact O-N 3.16Å
649	R	83.2	Confident	84.1	Confident	85 Å²	85	46 Å²	46	32%	0.321	21%	0.213	S	C	.	.	H	α-helix	trans	-62.4	-44.4	179.6	-74	174.3	94.1	144.3	-6.7	111.7	Q481 V482 S645 W646 Q652 Y653 E1651	Q481-R649 PolarHBondContact O-NH1 3.44Å; Q481-R649 VanDerWaalsContact O-NH1 3.08Å; V482-R649 HydrophobicContact CG1-CG 4.22Å; S645-R649 WeakPolarHBondContact O-CB 3.4Å; S645-R649 WeakPolarHBondContact O-CG 3.18Å; S645-R649 PolarHBondContact O-N 3.16Å; S645-R649 VanDerWaalsContact O-N 3.09Å; W646-R649 PolarHBondContact O-N 3.37Å; R649-Q652 PolarHBondContact O-N 3.08Å; R649-Y653 WeakPolarHBondContact O-CB 3.41Å; R649-Y653 PolarHBondContact O-N 3.22Å; R649-E1651 IonicContact CZ-OE1 3.18Å; R649-E1651 IonicContact NH2-OE1 2.71Å; R649-E1651 PolarHBondContact NH2-OE1 3.3Å
650	S	84.4	Confident	83.7	Confident	22 Å²	22	50.6 Å²	50.6	15%	0.154	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-46.5	-179.6	-175.9	0	0	0	0	112.4	W646 L647 Q652 Y653 F654 I778	W646-S650 WeakPolarHBondContact O-CB 3.39Å; W646-S650 PolarHBondContact O-N 3.27Å; L647-S650 PolarHBondContact O-N 3.11Å; S650-Q652 VanDerWaalsContact C-N 3.34Å; S650-Q652 PolarHBondContact O-N 3.13Å; S650-Y653 PolarHBondContact O-N 3.3Å; S650-F654 WeakPolarHBondContact O-CD2 3.37Å; S650-F654 PolarHBondContact O-N 3.49Å; S650-F654 WeakPolarHBondContact OG-CD2 3.31Å; S650-F654 VanDerWaalsContact OG-CE2 3.23Å; S650-F654 WeakPolarHBondContact OG-CE2 3.37Å; S650-I778 WeakPolarHBondContact OG-CD1 3.49Å
651	L	85.2	Confident	83	Confident	48 Å²	48	48 Å²	48	25%	0.251	22%	0.222	S	C	.	.	H	α-helix	trans	-58.7	-44.1	176.4	-71	170.3	0	0	0	111.6	L647 Y653 F655 I775	L647-L651 HydrophobicContact CD2-CD1 4.37Å; L647-L651 HydrophobicContact CG-CD1 4.1Å; L647-L651 WeakPolarHBondContact O-CB 3.21Å; L647-L651 VanDerWaalsContact O-CG 3.24Å; L647-L651 WeakPolarHBondContact O-CG 3.42Å; L647-L651 PolarHBondContact O-N 3.2Å; L651-Y653 VanDerWaalsContact C-N 3.34Å; L651-Y653 PolarHBondContact O-N 3.48Å; L651-F655 HydrophobicContact CD2-CD2 4.04Å; L651-F655 HydrophobicContact CD2-CE2 3.68Å; L651-F655 WeakPolarHBondContact O-CB 3.44Å; L651-F655 WeakPolarHBondContact O-CD2 3.37Å; L651-F655 PolarHBondContact O-N 3.26Å; L651-I775 HydrophobicContact CD2-CD1 4.38Å; L651-I775 HydrophobicContact CD2-CG1 3.92Å
652	Q	81.4	Confident	82.5	Confident	22 Å²	22	47.4 Å²	47.4	10%	0.103	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-38.9	174.2	-65.3	-172.9	38.7	0	0	112.3	S483 R485 C486 I648 R649 S650 V656 I657	S483-Q652 PolarHBondContact O-NE2 2.84Å; S483-Q652 PolarHBondContact O-OE1 2.79Å; R485-Q652 VanDerWaalsContact N-OE1 3.17Å; C486-Q652 HydrophobicContact CB-CG 3.98Å; C486-Q652 VanDerWaalsContact SG-CG 3.57Å; I648-Q652 WeakPolarHBondContact O-CG 3.44Å; I648-Q652 PolarHBondContact O-N 3.16Å; R649-Q652 PolarHBondContact O-N 3.08Å; S650-Q652 VanDerWaalsContact C-N 3.34Å; S650-Q652 PolarHBondContact O-N 3.13Å; Q652-V656 WeakPolarHBondContact O-CB 3.48Å; Q652-V656 PolarHBondContact O-N 3.15Å; Q652-I657 PolarHBondContact O-N 3.33Å; Q652-I657 VanDerWaalsContact O-N 3.11Å
653	Y	82.9	Confident	81.9	Confident	87 Å²	87	48.4 Å²	48.4	34%	0.341	23%	0.228	S	C	.	.	I	π-helix	trans	-68.4	-50.1	-176.9	-169	-109.6	0	0	0	112.5	R649 S650 L651 I657 I658	R649-Y653 WeakPolarHBondContact O-CB 3.41Å; R649-Y653 PolarHBondContact O-N 3.22Å; S650-Y653 PolarHBondContact O-N 3.3Å; L651-Y653 VanDerWaalsContact C-N 3.34Å; L651-Y653 PolarHBondContact O-N 3.48Å; Y653-I657 HydrophobicContact CD2-CB 3.98Å; Y653-I657 HydrophobicContact CD2-CD1 4.04Å; Y653-I657 HydrophobicContact CD2-CG2 4.03Å; Y653-I657 HydrophobicContact CE2-CG2 4.12Å; Y653-I657 PolarHBondContact O-N 3.44Å; Y653-I658 HydrophobicContact CD1-CD1 3.69Å; Y653-I658 HydrophobicContact CD1-CG1 4.17Å; Y653-I658 HydrophobicContact CE1-CD1 3.41Å; Y653-I658 VanDerWaalsContact CE1-CD1 3.41Å; Y653-I658 HydrophobicContact CE1-CG1 3.82Å; Y653-I658 PolarHBondContact O-N 2.87Å
654	F	86.6	Confident	81.3	Confident	45 Å²	45	48.4 Å²	48.4	20%	0.197	23%	0.228	C	C	.	.	I	π-helix	trans	-77.7	-35.5	-175	-73.3	-60.1	0	0	0	114.3	S650 I658 P659 S767 I770	S650-F654 WeakPolarHBondContact O-CD2 3.37Å; S650-F654 PolarHBondContact O-N 3.49Å; S650-F654 WeakPolarHBondContact OG-CD2 3.31Å; S650-F654 VanDerWaalsContact OG-CE2 3.23Å; S650-F654 WeakPolarHBondContact OG-CE2 3.37Å; F654-I658 HydrophobicContact CD1-CD1 3.73Å; F654-I658 HydrophobicContact CE1-CD1 3.95Å; F654-P659 WeakPolarHBondContact O-CD 3.41Å; F654-S767 WeakPolarHBondContact CA-OG 3.47Å; F654-S767 WeakPolarHBondContact CB-O 3.49Å; F654-S767 PolarHBondContact O-OG 3.16Å; F654-I770 HydrophobicContact CD1-CB 4.21Å; F654-I770 HydrophobicContact CD1-CG2 3.93Å; F654-I770 HydrophobicContact CD2-CG2 4.15Å; F654-I770 HydrophobicContact CE1-CB 4.21Å; F654-I770 HydrophobicContact CE1-CG2 3.58Å; F654-I770 HydrophobicContact CE2-CG2 3.81Å; F654-I770 HydrophobicContact CG-CG2 4.23Å; F654-I770 HydrophobicContact CZ-CG2 3.52Å
655	F	84.4	Confident	81	Confident	70 Å²	70	42.7 Å²	42.7	31%	0.307	21%	0.206	S	C	.	.	I	π-helix	trans	-88.2	-24.7	-179.7	-73	-69.6	0	0	0	114.3	L651 P659 I768 G771 V772	L651-F655 HydrophobicContact CD2-CD2 4.04Å; L651-F655 HydrophobicContact CD2-CE2 3.68Å; L651-F655 WeakPolarHBondContact O-CB 3.44Å; L651-F655 WeakPolarHBondContact O-CD2 3.37Å; L651-F655 PolarHBondContact O-N 3.26Å; F655-P659 WeakPolarHBondContact O-CG 3.41Å; F655-I768 HydrophobicContact CD1-CG2 4.35Å; F655-I768 HydrophobicContact CE1-CG2 4.15Å; F655-G771 VanDerWaalsContact CE2-C 3.42Å; F655-G771 WeakPolarHBondContact CE2-O 3.48Å; F655-V772 HydrophobicContact CE1-CG2 3.97Å; F655-V772 HydrophobicContact CZ-CB 4.44Å; F655-V772 HydrophobicContact CZ-CG2 3.7Å
656	V	77.1	Confident	80.8	Confident	48 Å²	48	46 Å²	46	29%	0.291	22%	0.218	S	C	.	.	I	π-helix	trans	-124.4	-47.1	-173.7	-179	0	0	0	0	113.3	C486 Q652 F660	C486-V656 VanDerWaalsContact SG-CG2 3.55Å; Q652-V656 WeakPolarHBondContact O-CB 3.48Å; Q652-V656 PolarHBondContact O-N 3.15Å; V656-F660 PolarHBondContact O-N 3.22Å
657	I	78.9	Confident	80.5	Confident	28 Å²	28	45.6 Å²	45.6	14%	0.144	22%	0.222	C	C	.	.	I	π-helix	trans	-72.8	-56.2	-172.7	-59.2	173.8	0	0	0	111.5	Q652 Y653 Q661 S662	Q652-I657 PolarHBondContact O-N 3.33Å; Q652-I657 VanDerWaalsContact O-N 3.11Å; Y653-I657 HydrophobicContact CD2-CB 3.98Å; Y653-I657 HydrophobicContact CD2-CD1 4.04Å; Y653-I657 HydrophobicContact CD2-CG2 4.03Å; Y653-I657 HydrophobicContact CE2-CG2 4.12Å; Y653-I657 PolarHBondContact O-N 3.44Å; I657-Q661 CarbonylContact O-C 3.45Å; I657-Q661 WeakPolarHBondContact O-CA 3.19Å; I657-Q661 PolarHBondContact O-N 3.31Å; I657-Q661 VanDerWaalsContact O-O 3.11Å; I657-S662 PolarHBondContact O-N 3.46Å
658	I	81.4	Confident	79.9	Confident	23 Å²	23	43.7 Å²	43.7	12%	0.118	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-54.2	-179.2	-64.7	162.2	0	0	0	113.3	Y653 F654 F660 S662 S665 S767	Y653-I658 HydrophobicContact CD1-CD1 3.69Å; Y653-I658 HydrophobicContact CD1-CG1 4.17Å; Y653-I658 HydrophobicContact CE1-CD1 3.41Å; Y653-I658 VanDerWaalsContact CE1-CD1 3.41Å; Y653-I658 HydrophobicContact CE1-CG1 3.82Å; Y653-I658 PolarHBondContact O-N 2.87Å; F654-I658 HydrophobicContact CD1-CD1 3.73Å; F654-I658 HydrophobicContact CE1-CD1 3.95Å; I658-F660 VanDerWaalsContact C-N 3.32Å; I658-F660 PolarHBondContact O-N 2.97Å; I658-S662 WeakPolarHBondContact O-CB 3.41Å; I658-S665 VanDerWaalsContact O-CB 3.24Å; I658-S665 WeakPolarHBondContact O-CB 3.31Å; I658-S767 VanDerWaalsContact CB-OG 3.32Å; I658-S767 WeakPolarHBondContact CB-OG 3.32Å; I658-S767 WeakPolarHBondContact CD1-OG 3.5Å
659	P	81.7	Confident	79.5	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-70.3	-23	-171.2	24.6	-33.8	0	0	0	114.6	F654 F655 S665 I768	F654-P659 WeakPolarHBondContact O-CD 3.41Å; F655-P659 WeakPolarHBondContact O-CG 3.41Å; P659-S665 WeakPolarHBondContact O-CB 3.45Å; P659-I768 HydrophobicContact CB-CD1 4.29Å; P659-I768 HydrophobicContact CB-CG1 4.4Å; P659-I768 HydrophobicContact CG-CG1 4.35Å
660	F	78.4	Confident	78.9	Confident	110 Å²	110	48.7 Å²	48.7	48%	0.482	24%	0.238	S	C	.	.	H	α-helix	trans	-126.9	-19.3	-174.1	-51.3	-67.5	0	0	0	115.4	V656 I658	V656-F660 PolarHBondContact O-N 3.22Å; I658-F660 VanDerWaalsContact C-N 3.32Å; I658-F660 PolarHBondContact O-N 2.97Å
661	Q	72.5	Confident	78.3	Confident	67 Å²	67	49.9 Å²	49.9	31%	0.313	24%	0.24	S	C	.	.	S	Bend	trans	-136.5	53	-173.6	-56	-177.6	-4	0	0	111.7	I657 Y677	I657-Q661 CarbonylContact O-C 3.45Å; I657-Q661 WeakPolarHBondContact O-CA 3.19Å; I657-Q661 PolarHBondContact O-N 3.31Å; I657-Q661 VanDerWaalsContact O-O 3.11Å; Q661-Y677 VanDerWaalsContact C-CE1 3.41Å; Q661-Y677 HydrophobicContact CB-CD1 4.18Å; Q661-Y677 HydrophobicContact CB-CE1 4.06Å; Q661-Y677 WeakPolarHBondContact O-CE1 3.41Å
662	S	75.9	Confident	77.2	Confident	27 Å²	27	55.8 Å²	55.8	19%	0.189	26%	0.259	C	S	.	.	S	Bend	trans	-144	158.8	177.6	178.7	0	0	0	0	112.6	I657 I658 V664 S665 V668	I657-S662 PolarHBondContact O-N 3.46Å; I658-S662 WeakPolarHBondContact O-CB 3.41Å; S662-V664 PolarHBondContact O-N 3.2Å; S662-V664 VanDerWaalsContact O-N 3.11Å; S662-V664 PolarHBondContact OG-N 3.22Å; S662-S665 VanDerWaalsContact O-CB 3.25Å; S662-S665 WeakPolarHBondContact O-CB 3.29Å; S662-S665 PolarHBondContact O-N 3.13Å; S662-S665 PolarHBondContact O-OG 2.98Å; S662-V668 WeakPolarHBondContact O-CG2 3.36Å
663	C	70.3	Confident	76.2	Confident	33 Å²	33	55.7 Å²	55.7	22%	0.223	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-25.3	169.6	-55.8	0	0	0	0	113.4	V668 N696 W756	C663-V668 WeakPolarHBondContact O-CG1 3.16Å; C663-N696 PolarHBondContact SG-ND2 2.99Å; C663-W756 HydrophobicContact CB-CZ2 4.19Å; C663-W756 PolarHBondContact O-NE1 3.12Å
664	V	76	Confident	75.4	Confident	27 Å²	27	52.3 Å²	52.3	16%	0.164	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	23.2	-171.6	-154.3	0	0	0	0	110.8	S662 W756 L759 C760 C763 S764	S662-V664 PolarHBondContact O-N 3.2Å; S662-V664 VanDerWaalsContact O-N 3.11Å; S662-V664 PolarHBondContact OG-N 3.22Å; V664-W756 HydrophobicContact CG2-CZ2 4.31Å; V664-L759 HydrophobicContact CG1-CB 4.47Å; V664-L759 HydrophobicContact CG1-CD2 4Å; V664-L759 HydrophobicContact CG1-CG 3.8Å; V664-C760 WeakPolarHBondContact O-CA 3.46Å; V664-C763 HydrophobicContact CB-CB 4.39Å; V664-C763 HydrophobicContact CG1-CB 3.74Å; V664-S764 PolarHBondContact O-OG 3.33Å; V664-S764 VanDerWaalsContact O-OG 3.1Å
665	S	80.7	Confident	74.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	-86.2	160.7	-179.9	64.8	0	0	0	0	112.8	I658 P659 S662 V667 V668 S764	I658-S665 VanDerWaalsContact O-CB 3.24Å; I658-S665 WeakPolarHBondContact O-CB 3.31Å; P659-S665 WeakPolarHBondContact O-CB 3.45Å; S662-S665 VanDerWaalsContact O-CB 3.25Å; S662-S665 WeakPolarHBondContact O-CB 3.29Å; S662-S665 PolarHBondContact O-N 3.13Å; S662-S665 PolarHBondContact O-OG 2.98Å; S665-V667 PolarHBondContact O-N 2.93Å; S665-V668 PolarHBondContact O-N 3.23Å; S665-S764 WeakPolarHBondContact CA-OG 3.33Å
666	Y	80.8	Confident	73.6	Confident	75 Å²	75	50.1 Å²	50.1	29%	0.294	24%	0.238	S	C	.	.	H	α-helix	trans	-54.3	-34	169.5	-62.7	-61.2	0	0	0	112.8	V668 L669 F670 S764 T765	Y666-V668 VanDerWaalsContact C-N 3.31Å; Y666-V668 PolarHBondContact O-N 3.41Å; Y666-L669 PolarHBondContact O-N 3.48Å; Y666-F670 WeakPolarHBondContact O-CD2 3.2Å; Y666-S764 PolarHBondContact N-OG 3.17Å; Y666-T765 WeakPolarHBondContact OH-CG2 3.19Å; Y666-T765 PolarHBondContact OH-N 2.85Å
667	V	78.5	Confident	72.8	Confident	56 Å²	56	49.6 Å²	49.6	34%	0.339	23%	0.231	S	C	.	.	H	α-helix	trans	-65.6	-33.2	-176.7	-175.2	0	0	0	0	111.8	S665 L669 F670 K671 I675	S665-V667 PolarHBondContact O-N 2.93Å; V667-L669 VanDerWaalsContact C-N 3.27Å; V667-L669 PolarHBondContact O-N 3.36Å; V667-F670 PolarHBondContact O-N 3.24Å; V667-K671 HydrophobicContact CG1-CB 4.34Å; V667-K671 HydrophobicContact CG1-CD 4.3Å; V667-K671 WeakPolarHBondContact O-CB 3.28Å; V667-K671 PolarHBondContact O-N 3.12Å; V667-I675 HydrophobicContact CB-CD1 4.07Å; V667-I675 HydrophobicContact CG1-CD1 3.76Å
668	V	74.5	Confident	71.9	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.024	24%	0.237	C	C	.	.	H	α-helix	trans	-66.6	-25.7	-178.9	165.9	0	0	0	0	113.3	S662 C663 S665 Y666 I675	S662-V668 WeakPolarHBondContact O-CG2 3.36Å; C663-V668 WeakPolarHBondContact O-CG1 3.16Å; S665-V668 PolarHBondContact O-N 3.23Å; Y666-V668 VanDerWaalsContact C-N 3.31Å; Y666-V668 PolarHBondContact O-N 3.41Å; V668-I675 HydrophobicContact CG2-CD1 3.54Å
669	L	74.1	Confident	71.2	Confident	48 Å²	48	54.2 Å²	54.2	25%	0.251	25%	0.249	S	C	.	.	H	α-helix	trans	-72.1	-38.8	-178.8	-59.8	-177.3	0	0	0	112.7	Y666 V667 P757 C760 I761	Y666-L669 PolarHBondContact O-N 3.48Å; V667-L669 VanDerWaalsContact C-N 3.27Å; V667-L669 PolarHBondContact O-N 3.36Å; L669-P757 HydrophobicContact CD2-CB 4.19Å; L669-C760 HydrophobicContact CD1-CB 3.88Å; L669-C760 HydrophobicContact CD2-CB 3.72Å; L669-C760 HydrophobicContact CG-CB 3.88Å; L669-I761 HydrophobicContact CD1-CG1 4.09Å
670	F	71.9	Confident	70.2	Confident	183 Å²	183	57.4 Å²	57.4	80%	0.803	26%	0.263	S	S	*	.	H	α-helix	trans	-103.7	-19.1	-171.9	-57	-73.1	0	0	0	113.3	Y666 V667	Y666-F670 WeakPolarHBondContact O-CD2 3.2Å; V667-F670 PolarHBondContact O-N 3.24Å
671	K	70.5	Confident	69.6	Low	46 Å²	46	53.2 Å²	53.2	20%	0.2	25%	0.246	C	C	.	.			trans	-82.3	127.2	179.2	-157.1	-175.7	-176.3	-158	0	111.2	V667 T673 S674 I675 T698	V667-K671 HydrophobicContact CG1-CB 4.34Å; V667-K671 HydrophobicContact CG1-CD 4.3Å; V667-K671 WeakPolarHBondContact O-CB 3.28Å; V667-K671 PolarHBondContact O-N 3.12Å; K671-T673 VanDerWaalsContact CD-O 3.3Å; K671-T673 WeakPolarHBondContact CD-O 3.45Å; K671-T673 VanDerWaalsContact CE-OG1 3.27Å; K671-T673 WeakPolarHBondContact CE-OG1 3.35Å; K671-T673 WeakPolarHBondContact CG-O 3.26Å; K671-S674 PolarHBondContact NZ-O 2.77Å; K671-I675 HydrophobicContact CD-CG1 3.89Å; K671-T698 HydrophobicContact CB-CG2 4.42Å; K671-T698 WeakPolarHBondContact O-CB 3.4Å; K671-T698 VanDerWaalsContact O-CG2 3.27Å; K671-T698 WeakPolarHBondContact O-CG2 3.34Å
672	R	61.6	Low	69.2	Low	173 Å²	173	53 Å²	53	65%	0.653	25%	0.247	S	C	*	.	S	Bend	trans	-77.7	-37	175.4	-177	170	170.1	160.8	-6.6	112.6	T698	R672-T698 PolarHBondContact O-OG1 3.31Å
673	T	61.2	Low	68.7	Low	20 Å²	20	56.6 Å²	56.6	12%	0.123	26%	0.259	C	S	.	.	S	Bend	trans	-94	157.6	-177.1	65.3	0	0	0	0	111.7	D521 K671 T698	D521-T673 HydrophobicContact CB-CG2 4.28Å; K671-T673 VanDerWaalsContact CD-O 3.3Å; K671-T673 WeakPolarHBondContact CD-O 3.45Å; K671-T673 VanDerWaalsContact CE-OG1 3.27Å; K671-T673 WeakPolarHBondContact CE-OG1 3.35Å; K671-T673 WeakPolarHBondContact CG-O 3.26Å; T673-T698 VanDerWaalsContact O-CG2 3.26Å; T673-T698 WeakPolarHBondContact O-CG2 3.16Å
674	S	65.6	Low	68	Low	15 Å²	15	59 Å²	59	11%	0.105	27%	0.27	C	S	.	.			trans	-60.3	160.1	-177.4	43.7	0	0	0	0	114.1	K671 Y676 N696	K671-S674 PolarHBondContact NZ-O 2.77Å; S674-Y676 WeakPolarHBondContact OG-CE2 3.21Å; S674-Y676 PolarHBondContact OG-OH 2.88Å; S674-N696 WeakPolarHBondContact CB-O 3.17Å
675	I	66.2	Low	67.3	Low	14 Å²	14	59.9 Å²	59.9	7%	0.072	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.4	176	-56.2	177.5	0	0	0	108.6	V667 V668 K671 Y677 Y695 N696	V667-I675 HydrophobicContact CB-CD1 4.07Å; V667-I675 HydrophobicContact CG1-CD1 3.76Å; V668-I675 HydrophobicContact CG2-CD1 3.54Å; K671-I675 HydrophobicContact CD-CG1 3.89Å; I675-Y677 HydrophobicContact CB-CE1 4.46Å; I675-Y677 HydrophobicContact CB-CE2 4.44Å; I675-Y677 WeakPolarHBondContact CB-OH 3.11Å; I675-Y677 HydrophobicContact CG2-CD1 4.5Å; I675-Y677 HydrophobicContact CG2-CE1 3.64Å; I675-Y677 HydrophobicContact CG2-CE2 4.36Å; I675-Y677 WeakPolarHBondContact CG2-OH 3.38Å; I675-Y677 WeakPolarHBondContact O-CE2 3.18Å; I675-Y695 CarbonylContact O-C 3.43Å; I675-Y695 WeakPolarHBondContact O-CA 3.48Å; I675-N696 PolarHBondContact N-O 3.33Å; I675-N696 PolarHBondContact O-N 2.83Å
676	Y	67.4	Low	66.4	Low	55 Å²	55	60.6 Å²	60.6	22%	0.216	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	142.2	-175.4	-63.9	-99.5	0	0	0	110.2	L523 S674 Y694 Y695	L523-Y676 HydrophobicContact CD1-CE2 3.81Å; L523-Y676 HydrophobicContact CD2-CD2 4.19Å; L523-Y676 HydrophobicContact CD2-CE2 4.22Å; L523-Y676 HydrophobicContact CG-CD2 4.41Å; L523-Y676 HydrophobicContact CG-CE2 4.16Å; S674-Y676 WeakPolarHBondContact OG-CE2 3.21Å; S674-Y676 PolarHBondContact OG-OH 2.88Å; Y676-Y694 WeakPolarHBondContact CA-O 3.49Å; Y676-Y695 HydrophobicContact CE1-CD1 4.49Å; Y676-Y695 HydrophobicContact CE1-CG 4.28Å
677	Y	60.6	Low	65.6	Low	37 Å²	37	62.5 Å²	62.5	15%	0.145	29%	0.292	C	S	.	.			trans	-119.4	-15	-167.3	-58.4	-73.6	0	0	0	116.1	Q661 I675 Y694 N696	Q661-Y677 VanDerWaalsContact C-CE1 3.41Å; Q661-Y677 HydrophobicContact CB-CD1 4.18Å; Q661-Y677 HydrophobicContact CB-CE1 4.06Å; Q661-Y677 WeakPolarHBondContact O-CE1 3.41Å; I675-Y677 HydrophobicContact CB-CE1 4.46Å; I675-Y677 HydrophobicContact CB-CE2 4.44Å; I675-Y677 WeakPolarHBondContact CB-OH 3.11Å; I675-Y677 HydrophobicContact CG2-CD1 4.5Å; I675-Y677 HydrophobicContact CG2-CE1 3.64Å; I675-Y677 HydrophobicContact CG2-CE2 4.36Å; I675-Y677 WeakPolarHBondContact CG2-OH 3.38Å; I675-Y677 WeakPolarHBondContact O-CE2 3.18Å; Y677-Y694 PolarHBondContact N-O 3.45Å; Y677-Y694 VanDerWaalsContact N-O 3.08Å; Y677-N696 HydrophobicContact CE2-CB 3.65Å; Y677-N696 WeakPolarHBondContact CE2-ND2 3.22Å
678	M	60.9	Low	64.8	Low	54 Å²	54	62.7 Å²	62.7	27%	0.266	29%	0.293	S	S	.	.			trans	-123.2	134	179.3	-75.1	-143.2	67	0	0	112.3	D691 Y694 M1654	M678-D691 HydrophobicContact CB-CB 4.48Å; M678-D691 PolarHBondContact O-N 2.78Å; M678-Y694 HydrophobicContact CB-CD2 4.47Å; M678-M1654 HydrophobicContact CG-CE 3.97Å; M678-M1654 HydrophobicContact SD-CE 3.52Å; M678-M1654 VanDerWaalsContact SD-CE 3.52Å; M678-M1654 HydrophobicContact SD-SD 3.87Å
679	Y	65.6	Low	64.4	Low	94 Å²	94	67.8 Å²	67.8	37%	0.369	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	128.4	166.1	-61.6	-75.6	0	0	0	108.2	V688 Y689 Y690	Y679-V688 HydrophobicContact CD1-CG1 3.88Å; Y679-V688 HydrophobicContact CG-CG1 4.1Å; Y679-Y689 CarbonylContact C-O 3.52Å; Y679-Y689 WeakPolarHBondContact CA-O 3.27Å; Y679-Y690 HydrophobicContact CD1-CD1 4.21Å; Y679-Y690 HydrophobicContact CD1-CE1 4.01Å; Y679-Y690 AromaticContact CE1-CD1 3.94Å; Y679-Y690 HydrophobicContact CE1-CD1 3.94Å; Y679-Y690 AromaticContact CE1-CE1 3.28Å; Y679-Y690 HydrophobicContact CE1-CE1 3.28Å; Y679-Y690 AromaticContact CE1-CZ 3.64Å; Y679-Y690 AromaticContact CZ-CE1 3.73Å
680	K	60.9	Low	63.9	Low	68 Å²	68	68.8 Å²	68.8	30%	0.296	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	152.6	165.1	-84.1	-178	169.1	163.2	0	109	V688 Y689 D691	K680-V688 CarbonylContact O-C 3.47Å; K680-V688 WeakPolarHBondContact O-CA 3.01Å; K680-Y689 HydrophobicContact CB-CD1 4.48Å; K680-Y689 HydrophobicContact CB-CD2 4.5Å; K680-Y689 HydrophobicContact CB-CE1 3.91Å; K680-Y689 HydrophobicContact CB-CE2 3.93Å; K680-Y689 PolarHBondContact N-O 3.18Å; K680-Y689 WeakPolarHBondContact O-CD1 3.37Å; K680-Y689 PolarHBondContact O-N 2.74Å; K680-D691 HydrophobicContact CD-CB 4.23Å; K680-D691 WeakPolarHBondContact CD-OD2 3.26Å; K680-D691 WeakPolarHBondContact CE-OD2 3.43Å; K680-D691 HydrophobicContact CG-CB 4.48Å; K680-D691 IonicContact NZ-OD2 3.96Å; K680-D691 PolarHBondContact NZ-OD2 3.49Å
681	V	66	Low	63.5	Low	21 Å²	21	60.9 Å²	60.9	13%	0.127	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	133.1	172.6	179.5	0	0	0	0	108.4	F617 M619 K683 Y687 V688	F617-V681 HydrophobicContact CB-CG1 4.29Å; M619-V681 HydrophobicContact CB-CG2 3.64Å; M619-V681 HydrophobicContact CG-CG2 4.2Å; M619-V681 HydrophobicContact SD-CG2 3.6Å; M619-V681 VanDerWaalsContact SD-CG2 3.6Å; V681-K683 PolarHBondContact O-N 3.43Å; V681-Y687 WeakPolarHBondContact CA-O 3.35Å; V681-V688 HydrophobicContact CG2-CG2 4.23Å
682	D	63.4	Low	62.8	Low	63 Å²	63	67 Å²	67	34%	0.337	31%	0.307	S	S	.	.			trans	-71.5	113.9	166.8	170.4	25.4	0	0	0	108.8	N684 S685 G686 Y687 Y689	D682-N684 PolarHBondContact O-N 2.73Å; D682-N684 PolarHBondContact OD1-N 3.37Å; D682-S685 WeakPolarHBondContact CB-OG 3.46Å; D682-S685 VanDerWaalsContact CG-OG 3.26Å; D682-S685 PolarHBondContact O-N 3.5Å; D682-S685 VanDerWaalsContact OD2-CB 3.29Å; D682-S685 WeakPolarHBondContact OD2-CB 3.32Å; D682-S685 PolarHBondContact OD2-OG 3.04Å; D682-G686 PolarHBondContact O-N 3.12Å; D682-Y687 PolarHBondContact N-O 2.82Å; D682-Y689 HydrophobicContact CB-CD1 4.28Å; D682-Y689 HydrophobicContact CB-CE1 4.09Å
683	K	66.2	Low	62.6	Low	102 Å²	102	62 Å²	62	44%	0.443	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-27.4	-171.7	-62.4	-178.1	-179	-179.3	0	113.2	F617 V681 D1659	F617-K683 PolarHBondContact N-O 2.91Å; V681-K683 PolarHBondContact O-N 3.43Å; K683-D1659 WeakPolarHBondContact CE-OD1 3.49Å; K683-D1659 IonicContact NZ-OD1 2.73Å; K683-D1659 PolarHBondContact NZ-OD1 3.15Å
684	N	54.6	Low	62.4	Low	84 Å²	84	63.3 Å²	63.3	45%	0.449	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-21.9	-172.6	-62.5	9.7	0	0	0	113.2	Q614 D682	Q614-N684 PolarHBondContact OE1-ND2 2.81Å; D682-N684 PolarHBondContact O-N 2.73Å; D682-N684 PolarHBondContact OD1-N 3.37Å
685	S	62	Low	62.4	Low	45 Å²	45	66.7 Å²	66.7	32%	0.315	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-16.7	-173.5	68.1	0	0	0	0	114.6	D682 Y687	D682-S685 WeakPolarHBondContact CB-OG 3.46Å; D682-S685 VanDerWaalsContact CG-OG 3.26Å; D682-S685 PolarHBondContact O-N 3.5Å; D682-S685 VanDerWaalsContact OD2-CB 3.29Å; D682-S685 WeakPolarHBondContact OD2-CB 3.32Å; D682-S685 PolarHBondContact OD2-OG 3.04Å; S685-Y687 PolarHBondContact O-N 3.39Å; S685-Y687 VanDerWaalsContact OG-CD2 3.25Å; S685-Y687 WeakPolarHBondContact OG-CD2 3.41Å; S685-Y687 PolarHBondContact OG-N 3.42Å
686	G	62.7	Low	62.3	Low	15 Å²	15	68.4 Å²	68.4	16%	0.155	33%	0.325	C	S	.	.			trans	74.5	1.4	-173.7	0	0	0	0	0	114.2	D682	D682-G686 PolarHBondContact O-N 3.12Å
687	Y	62.7	Low	62.2	Low	116 Å²	116	67.9 Å²	67.9	46%	0.455	33%	0.325	S	S	.	.			trans	-73	138.8	178.9	-69.4	-54.1	0	0	0	112.3	V681 D682 S685	V681-Y687 WeakPolarHBondContact CA-O 3.35Å; D682-Y687 PolarHBondContact N-O 2.82Å; S685-Y687 PolarHBondContact O-N 3.39Å; S685-Y687 VanDerWaalsContact OG-CD2 3.25Å; S685-Y687 WeakPolarHBondContact OG-CD2 3.41Å; S685-Y687 PolarHBondContact OG-N 3.42Å
688	V	63.4	Low	62.9	Low	59 Å²	59	66.2 Å²	66.2	36%	0.358	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	118.7	-178.5	-167.2	0	0	0	0	110.1	Y679 K680 V681	Y679-V688 HydrophobicContact CD1-CG1 3.88Å; Y679-V688 HydrophobicContact CG-CG1 4.1Å; K680-V688 CarbonylContact O-C 3.47Å; K680-V688 WeakPolarHBondContact O-CA 3.01Å; V681-V688 HydrophobicContact CG2-CG2 4.23Å
689	Y	64.4	Low	63.6	Low	112 Å²	112	65.3 Å²	65.3	44%	0.439	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	160.5	-178.3	69.3	-89.5	0	0	0	112.6	Y679 K680 D682	Y679-Y689 CarbonylContact C-O 3.52Å; Y679-Y689 WeakPolarHBondContact CA-O 3.27Å; K680-Y689 HydrophobicContact CB-CD1 4.48Å; K680-Y689 HydrophobicContact CB-CD2 4.5Å; K680-Y689 HydrophobicContact CB-CE1 3.91Å; K680-Y689 HydrophobicContact CB-CE2 3.93Å; K680-Y689 PolarHBondContact N-O 3.18Å; K680-Y689 WeakPolarHBondContact O-CD1 3.37Å; K680-Y689 PolarHBondContact O-N 2.74Å; D682-Y689 HydrophobicContact CB-CD1 4.28Å; D682-Y689 HydrophobicContact CB-CE1 4.09Å
690	Y	63.4	Low	63.9	Low	68 Å²	68	65.1 Å²	65.1	27%	0.267	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	129.4	177	-67.2	-77.9	0	0	0	111.4	L523 Y679 K692	L523-Y690 HydrophobicContact CD2-CD2 3.6Å; L523-Y690 HydrophobicContact CD2-CE2 4.09Å; L523-Y690 HydrophobicContact CD2-CG 4.18Å; Y679-Y690 HydrophobicContact CD1-CD1 4.21Å; Y679-Y690 HydrophobicContact CD1-CE1 4.01Å; Y679-Y690 AromaticContact CE1-CD1 3.94Å; Y679-Y690 HydrophobicContact CE1-CD1 3.94Å; Y679-Y690 AromaticContact CE1-CE1 3.28Å; Y679-Y690 HydrophobicContact CE1-CE1 3.28Å; Y679-Y690 AromaticContact CE1-CZ 3.64Å; Y679-Y690 AromaticContact CZ-CE1 3.73Å; Y690-K692 PolarHBondContact O-N 2.7Å
691	D	63.8	Low	64.5	Low	18 Å²	18	63.6 Å²	63.6	10%	0.096	32%	0.317	C	S	.	.			trans	-73.1	122.8	177	-166.2	-15.3	0	0	0	111.6	M678 K680 A693 Y694	M678-D691 HydrophobicContact CB-CB 4.48Å; M678-D691 PolarHBondContact O-N 2.78Å; K680-D691 HydrophobicContact CD-CB 4.23Å; K680-D691 WeakPolarHBondContact CD-OD2 3.26Å; K680-D691 WeakPolarHBondContact CE-OD2 3.43Å; K680-D691 HydrophobicContact CG-CB 4.48Å; K680-D691 IonicContact NZ-OD2 3.96Å; K680-D691 PolarHBondContact NZ-OD2 3.49Å; D691-A693 PolarHBondContact O-N 2.63Å; D691-A693 WeakPolarHBondContact OD1-CB 3.42Å; D691-A693 PolarHBondContact OD1-N 3.18Å; D691-Y694 HydrophobicContact CB-CD2 4.29Å; D691-Y694 PolarHBondContact O-N 3.13Å
692	K	57	Low	64.9	Low	175 Å²	175	66.7 Å²	66.7	76%	0.761	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-12.5	177.2	-66.8	179.4	-178.4	174	0	113.4	Y690 Y695	Y690-K692 PolarHBondContact O-N 2.7Å; K692-Y695 VanDerWaalsContact O-CD1 3.32Å; K692-Y695 WeakPolarHBondContact O-CD1 3.38Å
693	A	56.2	Low	65.6	Low	66 Å²	66	65.3 Å²	65.3	55%	0.545	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-29.4	170.9	0	0	0	0	0	112.9	D691	D691-A693 PolarHBondContact O-N 2.63Å; D691-A693 WeakPolarHBondContact OD1-CB 3.42Å; D691-A693 PolarHBondContact OD1-N 3.18Å
694	Y	56.6	Low	66	Low	49 Å²	49	69 Å²	69	19%	0.192	33%	0.333	C	S	.	.	S	Bend	trans	-115.3	65.3	-167.9	-65.5	-64.6	0	0	0	112.7	Y676 Y677 M678 D691 M1654 N1655	Y676-Y694 WeakPolarHBondContact CA-O 3.49Å; Y677-Y694 PolarHBondContact N-O 3.45Å; Y677-Y694 VanDerWaalsContact N-O 3.08Å; M678-Y694 HydrophobicContact CB-CD2 4.47Å; D691-Y694 HydrophobicContact CB-CD2 4.29Å; D691-Y694 PolarHBondContact O-N 3.13Å; Y694-M1654 HydrophobicContact CD1-CE 3.51Å; Y694-M1654 HydrophobicContact CD1-SD 4.33Å; Y694-M1654 HydrophobicContact CD2-CE 4.02Å; Y694-M1654 HydrophobicContact CD2-SD 4.38Å; Y694-M1654 HydrophobicContact CE1-CB 4.44Å; Y694-M1654 HydrophobicContact CE1-CE 3.49Å; Y694-M1654 VanDerWaalsContact CE1-CE 3.49Å; Y694-M1654 HydrophobicContact CE1-CG 4.06Å; Y694-M1654 HydrophobicContact CE1-SD 3.73Å; Y694-M1654 HydrophobicContact CE2-CE 4Å; Y694-M1654 HydrophobicContact CE2-SD 3.79Å; Y694-M1654 HydrophobicContact CG-CE 3.79Å; Y694-M1654 WeakPolarHBondContact OH-CA 3.46Å; Y694-N1655 PolarHBondContact OH-N 3.47Å; Y694-N1655 PolarHBondContact OH-O 3.34Å
695	Y	65.8	Low	66.9	Low	86 Å²	86	69 Å²	69	34%	0.337	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	146.2	170.6	78.7	-86.7	0	0	0	111.8	I675 Y676 K692 H697	I675-Y695 CarbonylContact O-C 3.43Å; I675-Y695 WeakPolarHBondContact O-CA 3.48Å; Y676-Y695 HydrophobicContact CE1-CD1 4.49Å; Y676-Y695 HydrophobicContact CE1-CG 4.28Å; K692-Y695 VanDerWaalsContact O-CD1 3.32Å; K692-Y695 WeakPolarHBondContact O-CD1 3.38Å; Y695-H697 AromaticContact CE2-CD2 3.75Å; Y695-H697 AromaticContact CE2-CE1 3.68Å; Y695-H697 AromaticContact CE2-NE2 3.38Å; Y695-H697 WeakPolarHBondContact CE2-NE2 3.27Å; Y695-H697 AromaticContact CZ-NE2 3.72Å; Y695-H697 PolarHBondContact OH-NE2 3.43Å
696	N	65.4	Low	67.7	Low	49 Å²	49	68.2 Å²	68.2	26%	0.262	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	141.3	170.2	-71.6	-40.9	0	0	0	110.2	C663 S674 I675 Y677	C663-N696 PolarHBondContact SG-ND2 2.99Å; S674-N696 WeakPolarHBondContact CB-O 3.17Å; I675-N696 PolarHBondContact N-O 3.33Å; I675-N696 PolarHBondContact O-N 2.83Å; Y677-N696 HydrophobicContact CE2-CB 3.65Å; Y677-N696 WeakPolarHBondContact CE2-ND2 3.22Å
697	H	65	Low	68.5	Low	45 Å²	45	72.7 Å²	72.7	21%	0.208	33%	0.334	C	S	.	.			trans	-70.4	138.6	175.5	-72.1	-92.3	0	0	0	110.8	Y695 S701 F702 Q705	Y695-H697 AromaticContact CE2-CD2 3.75Å; Y695-H697 AromaticContact CE2-CE1 3.68Å; Y695-H697 AromaticContact CE2-NE2 3.38Å; Y695-H697 WeakPolarHBondContact CE2-NE2 3.27Å; Y695-H697 AromaticContact CZ-NE2 3.72Å; Y695-H697 PolarHBondContact OH-NE2 3.43Å; H697-S701 PolarHBondContact ND1-OG 3.04Å; H697-F702 HydrophobicContact CB-CB 4.01Å; H697-Q705 PolarHBondContact NE2-NE2 3.36Å; H697-Q705 PolarHBondContact NE2-OE1 2.88Å
698	T	75.5	Confident	69	Low	2 Å²	2	70.4 Å²	70.4	1%	0.012	33%	0.332	C	S	.	.			trans	-76.8	162.9	164.1	56.9	0	0	0	0	109.7	K671 R672 T673 I700 S701 F702	K671-T698 HydrophobicContact CB-CG2 4.42Å; K671-T698 WeakPolarHBondContact O-CB 3.4Å; K671-T698 VanDerWaalsContact O-CG2 3.27Å; K671-T698 WeakPolarHBondContact O-CG2 3.34Å; R672-T698 PolarHBondContact O-OG1 3.31Å; T673-T698 VanDerWaalsContact O-CG2 3.26Å; T673-T698 WeakPolarHBondContact O-CG2 3.16Å; T698-I700 VanDerWaalsContact C-N 3.25Å; T698-I700 PolarHBondContact O-N 2.79Å; T698-I700 VanDerWaalsContact O-N 3.15Å; T698-S701 CarbonylContact O-C 3.56Å; T698-S701 WeakPolarHBondContact O-CA 3.26Å; T698-S701 WeakPolarHBondContact O-CB 3.46Å; T698-S701 PolarHBondContact O-N 3.43Å; T698-F702 PolarHBondContact O-N 2.81Å
699	L	74	Confident	69.4	Low	34 Å²	34	70.5 Å²	70.5	18%	0.178	33%	0.333	C	S	.	.	H	α-helix	trans	-51.4	-43.5	-175.2	178.8	143	0	0	0	113.1	S701 L703 L752 W756	L699-S701 VanDerWaalsContact C-N 3.32Å; L699-S701 PolarHBondContact O-N 3.41Å; L699-L703 HydrophobicContact CD2-CD1 3.76Å; L699-L703 HydrophobicContact CG-CD1 4.35Å; L699-L703 WeakPolarHBondContact O-CG 3.27Å; L699-L703 PolarHBondContact O-N 2.77Å; L699-L703 VanDerWaalsContact O-N 3.14Å; L699-L752 HydrophobicContact CG-CD2 4.37Å; L699-W756 HydrophobicContact CD1-CB 3.75Å; L699-W756 HydrophobicContact CD1-CG 4.05Å
700	I	73.5	Confident	69.8	Low	91 Å²	91	66.2 Å²	66.2	47%	0.467	32%	0.317	S	S	.	.	H	α-helix	trans	-65.8	-35.3	178.2	-61	168.4	0	0	0	111.6	T698 R704	T698-I700 VanDerWaalsContact C-N 3.25Å; T698-I700 PolarHBondContact O-N 2.79Å; T698-I700 VanDerWaalsContact O-N 3.15Å; I700-R704 WeakPolarHBondContact O-CG 3.2Å
701	S	72.1	Confident	70.1	Confident	36 Å²	36	71.3 Å²	71.3	25%	0.252	34%	0.336	S	S	.	.	H	α-helix	trans	-76	-41.2	179.9	-168.2	0	0	0	0	111.8	H697 T698 L699 R704 Q705	H697-S701 PolarHBondContact ND1-OG 3.04Å; T698-S701 CarbonylContact O-C 3.56Å; T698-S701 WeakPolarHBondContact O-CA 3.26Å; T698-S701 WeakPolarHBondContact O-CB 3.46Å; T698-S701 PolarHBondContact O-N 3.43Å; L699-S701 VanDerWaalsContact C-N 3.32Å; L699-S701 PolarHBondContact O-N 3.41Å; S701-R704 PolarHBondContact O-N 2.8Å; S701-Q705 PolarHBondContact O-N 2.67Å
702	F	75.6	Confident	70.2	Confident	85 Å²	85	77.7 Å²	77.7	37%	0.373	36%	0.359	S	S	.	.	H	α-helix	trans	-63.7	-46	177.8	-178.7	-98.5	0	0	0	112.1	H697 T698 R704 Q705 M706 L752	H697-F702 HydrophobicContact CB-CB 4.01Å; T698-F702 PolarHBondContact O-N 2.81Å; F702-R704 VanDerWaalsContact C-N 3.28Å; F702-R704 PolarHBondContact O-N 2.83Å; F702-Q705 PolarHBondContact O-N 2.83Å; F702-Q705 VanDerWaalsContact O-N 3.09Å; F702-M706 PolarHBondContact O-N 3.26Å; F702-L752 HydrophobicContact CD1-CD1 4.45Å; F702-L752 HydrophobicContact CD1-CD2 3.8Å; F702-L752 HydrophobicContact CE1-CD1 4.15Å; F702-L752 HydrophobicContact CE1-CD2 4.24Å
703	L	77.3	Confident	70.5	Confident	35 Å²	35	73.3 Å²	73.3	18%	0.183	34%	0.344	C	S	.	.	H	α-helix	trans	-55.7	-41.7	177	-75.9	168.7	0	0	0	112.1	L699 W707 T749 L752 V753	L699-L703 HydrophobicContact CD2-CD1 3.76Å; L699-L703 HydrophobicContact CG-CD1 4.35Å; L699-L703 WeakPolarHBondContact O-CG 3.27Å; L699-L703 PolarHBondContact O-N 2.77Å; L699-L703 VanDerWaalsContact O-N 3.14Å; L703-W707 VanDerWaalsContact O-CD1 3.3Å; L703-T749 HydrophobicContact CD2-CG2 3.96Å; L703-L752 HydrophobicContact CD2-CD2 3.77Å; L703-L752 HydrophobicContact CG-CD2 3.93Å; L703-V753 HydrophobicContact CD1-CG2 4.34Å
704	R	74.4	Confident	71	Confident	180 Å²	180	74.6 Å²	74.6	68%	0.679	33%	0.334	S	S	*	.	H	α-helix	trans	-62.8	-44.7	176.1	-72.2	176	173.8	-157.7	-5.2	112	I700 S701 F702	I700-R704 WeakPolarHBondContact O-CG 3.2Å; S701-R704 PolarHBondContact O-N 2.8Å; F702-R704 VanDerWaalsContact C-N 3.28Å; F702-R704 PolarHBondContact O-N 2.83Å
705	Q	73.6	Confident	71.3	Confident	82 Å²	82	77.6 Å²	77.6	38%	0.383	35%	0.35	S	S	.	.	H	α-helix	trans	-63.2	-46.9	-179.8	-168	-175.5	30.9	0	0	111.6	H697 S701 F702 W707 T708 T709	H697-Q705 PolarHBondContact NE2-NE2 3.36Å; H697-Q705 PolarHBondContact NE2-OE1 2.88Å; S701-Q705 PolarHBondContact O-N 2.67Å; F702-Q705 PolarHBondContact O-N 2.83Å; F702-Q705 VanDerWaalsContact O-N 3.09Å; Q705-W707 PolarHBondContact O-N 2.79Å; Q705-T708 PolarHBondContact O-N 3.47Å; Q705-T708 PolarHBondContact O-OG1 2.97Å; Q705-T709 PolarHBondContact O-N 3.31Å
706	M	79.5	Confident	71.2	Confident	29 Å²	29	80.4 Å²	80.4	14%	0.143	36%	0.364	C	S	.	.	H	α-helix	trans	-54.5	-47.2	-177.5	-170	-176.8	81.7	0	0	112.7	F702 T708 T709 L710 T748 T749	F702-M706 PolarHBondContact O-N 3.26Å; M706-T708 VanDerWaalsContact C-N 3.25Å; M706-T708 PolarHBondContact O-N 3.34Å; M706-T709 PolarHBondContact O-N 2.79Å; M706-T709 VanDerWaalsContact O-N 3.13Å; M706-L710 HydrophobicContact CE-CD1 4.41Å; M706-L710 HydrophobicContact CG-CD1 4.34Å; M706-L710 PolarHBondContact O-N 3.46Å; M706-L710 VanDerWaalsContact O-N 3.08Å; M706-T748 HydrophobicContact CE-CG2 4.41Å; M706-T748 HydrophobicContact SD-CG2 3.9Å; M706-T749 HydrophobicContact CE-CG2 3.51Å
707	W	78.7	Confident	70.9	Confident	109 Å²	109	80.6 Å²	80.6	41%	0.413	36%	0.363	S	S	.	.	H	α-helix	trans	-64	-26.1	178.4	-80.1	106.3	0	0	0	113.7	L703 Q705 Y741 T749	L703-W707 VanDerWaalsContact O-CD1 3.3Å; Q705-W707 PolarHBondContact O-N 2.79Å; W707-Y741 HydrophobicContact CZ3-CD1 4.45Å; W707-T749 HydrophobicContact CZ2-CG2 4.1Å
708	T	73.8	Confident	70.5	Confident	69 Å²	69	81.1 Å²	81.1	42%	0.423	37%	0.367	S	S	.	.	H	α-helix	trans	-75.8	-35.7	172.8	70.2	0	0	0	0	112.6	Q705 M706 R711 R712	Q705-T708 PolarHBondContact O-N 3.47Å; Q705-T708 PolarHBondContact O-OG1 2.97Å; M706-T708 VanDerWaalsContact C-N 3.25Å; M706-T708 PolarHBondContact O-N 3.34Å; T708-R711 PolarHBondContact O-N 3.22Å; T708-R712 PolarHBondContact O-N 3.24Å
709	T	72.1	Confident	69.5	Low	60 Å²	60	88.5 Å²	88.5	37%	0.368	40%	0.401	S	S	.	.	H	α-helix	trans	-70.9	-44.4	179.3	-58	0	0	0	0	111.8	Q705 M706 R711 R712 N713	Q705-T709 PolarHBondContact O-N 3.31Å; M706-T709 PolarHBondContact O-N 2.79Å; M706-T709 VanDerWaalsContact O-N 3.13Å; T709-R711 PolarHBondContact O-N 3.07Å; T709-R712 PolarHBondContact O-N 3.3Å; T709-N713 PolarHBondContact O-N 3.32Å; T709-N713 VanDerWaalsContact O-N 3.14Å
710	L	72.9	Confident	68.5	Low	22 Å²	22	93.9 Å²	93.9	12%	0.115	43%	0.425	C	S	.	.	H	α-helix	trans	-56.4	-38.3	175.2	-70.5	170.4	0	0	0	111.8	M706 R712 N713 T740 H744	M706-L710 HydrophobicContact CE-CD1 4.41Å; M706-L710 HydrophobicContact CG-CD1 4.34Å; M706-L710 PolarHBondContact O-N 3.46Å; M706-L710 VanDerWaalsContact O-N 3.08Å; L710-R712 VanDerWaalsContact C-N 3.34Å; L710-R712 PolarHBondContact O-N 2.87Å; L710-N713 PolarHBondContact O-N 3.18Å; L710-T740 HydrophobicContact CD2-CG2 4.3Å; L710-H744 HydrophobicContact CD2-CB 4.16Å
711	R	68.9	Low	67.3	Low	176 Å²	176	90.8 Å²	90.8	66%	0.664	41%	0.41	S	S	*	.	H	α-helix	trans	-64.4	-33.4	176.4	-168.8	178.1	-70.6	-161.3	-2.8	113	T708 T709	T708-R711 PolarHBondContact O-N 3.22Å; T709-R711 PolarHBondContact O-N 3.07Å
712	R	66.7	Low	66	Low	151 Å²	151	95.2 Å²	95.2	57%	0.57	43%	0.43	S	S	*	.	H	α-helix	trans	-76.4	-37.9	178.1	-67.5	173.7	-177.3	158.1	-0.1	113.2	T708 T709 L710 R714 Q715 K716	T708-R712 PolarHBondContact O-N 3.24Å; T709-R712 PolarHBondContact O-N 3.3Å; L710-R712 VanDerWaalsContact C-N 3.34Å; L710-R712 PolarHBondContact O-N 2.87Å; R712-R714 VanDerWaalsContact C-N 3.34Å; R712-R714 PolarHBondContact O-N 3.31Å; R712-Q715 PolarHBondContact O-N 3.31Å; R712-Q715 VanDerWaalsContact O-N 3.15Å; R712-K716 PolarHBondContact O-N 2.97Å
713	N	62.3	Low	64.3	Low	84 Å²	84	96 Å²	96	45%	0.449	45%	0.446	S	S	.	.	H	α-helix	trans	-65.8	-37.2	-176.5	-76	3.3	0	0	0	112.2	T709 L710 Q715 K716 F717	T709-N713 PolarHBondContact O-N 3.32Å; T709-N713 VanDerWaalsContact O-N 3.14Å; L710-N713 PolarHBondContact O-N 3.18Å; N713-Q715 PolarHBondContact O-N 3.41Å; N713-K716 PolarHBondContact O-N 2.93Å; N713-F717 PolarHBondContact O-N 2.93Å
714	R	67	Low	62.7	Low	93 Å²	93	99.4 Å²	99.4	35%	0.351	47%	0.468	S	S	.	.	H	α-helix	trans	-51.2	-53.8	167.9	176.4	-175.2	177.9	168.6	0.5	111.8	R712 K716 F717 D718 Y741	R712-R714 VanDerWaalsContact C-N 3.34Å; R712-R714 PolarHBondContact O-N 3.31Å; R714-K716 VanDerWaalsContact C-N 3.31Å; R714-K716 PolarHBondContact O-N 3.46Å; R714-F717 PolarHBondContact O-N 3.34Å; R714-D718 WeakPolarHBondContact CG-OD2 3.4Å; R714-D718 IonicContact NE-OD2 3.99Å; R714-D718 PolarHBondContact O-N 2.72Å; R714-D718 VanDerWaalsContact O-N 3.1Å; R714-Y741 WeakPolarHBondContact CD-OH 3.42Å
715	Q	62.8	Low	61.1	Low	112 Å²	112	94.1 Å²	94.1	52%	0.523	47%	0.47	S	S	.	.	H	α-helix	trans	-60.7	-38.7	-175.2	-65	174.2	-53.1	0	0	112.1	R712 N713 H719	R712-Q715 PolarHBondContact O-N 3.31Å; R712-Q715 VanDerWaalsContact O-N 3.15Å; N713-Q715 PolarHBondContact O-N 3.41Å; Q715-H719 PolarHBondContact O-CD2 3.44Å
716	K	63.9	Low	59.6	Low	144 Å²	144	99.3 Å²	99.3	63%	0.626	49%	0.491	S	S	*	.	H	α-helix	trans	-65.6	-43.6	176	-71.4	-171.9	173.7	-171.7	0	112.9	R712 N713 R714 H719 Q720	R712-K716 PolarHBondContact O-N 2.97Å; N713-K716 PolarHBondContact O-N 2.93Å; R714-K716 VanDerWaalsContact C-N 3.31Å; R714-K716 PolarHBondContact O-N 3.46Å; K716-H719 PolarHBondContact O-N 3.1Å; K716-Q720 PolarHBondContact O-N 3.42Å
717	F	59.8	Low	57.8	Low	54 Å²	54	106.5 Å²	106.5	24%	0.237	52%	0.522	C	S	.	.	H	α-helix	trans	-63.3	-42.9	-179.8	-175	-96	0	0	0	112.2	N713 R714 H719 Q720 L721 I732 H736	N713-F717 PolarHBondContact O-N 2.93Å; R714-F717 PolarHBondContact O-N 3.34Å; F717-H719 PolarHBondContact O-N 2.93Å; F717-H719 VanDerWaalsContact O-N 3.16Å; F717-Q720 PolarHBondContact O-N 3.46Å; F717-L721 HydrophobicContact CD1-CD1 4.2Å; F717-L721 HydrophobicContact CE1-CD1 3.54Å; F717-L721 HydrophobicContact CE2-CD1 4.43Å; F717-L721 HydrophobicContact CZ-CD1 3.69Å; F717-I732 HydrophobicContact CE1-CG2 4.36Å; F717-I732 HydrophobicContact CZ-CG2 3.75Å; F717-H736 WeakPolarHBondContact CB-CE1 3.33Å; F717-H736 HydrophobicContact CD1-CB 4.13Å; F717-H736 AromaticContact CD1-CE1 3.75Å; F717-H736 AromaticContact CD1-CG 3.66Å; F717-H736 AromaticContact CD1-ND1 3.27Å; F717-H736 VanDerWaalsContact CD1-ND1 3.27Å; F717-H736 WeakPolarHBondContact CD1-ND1 3.45Å; F717-H736 AromaticContact CD2-CD2 3.84Å; F717-H736 AromaticContact CD2-CE1 3.8Å; F717-H736 AromaticContact CD2-NE2 3.7Å; F717-H736 HydrophobicContact CE1-CB 3.59Å; F717-H736 AromaticContact CE1-CG 3.58Å; F717-H736 AromaticContact CE1-ND1 3.7Å; F717-H736 HydrophobicContact CE2-CB 4.45Å; F717-H736 AromaticContact CE2-CD2 3.83Å; F717-H736 AromaticContact CE2-CG 3.98Å; F717-H736 AromaticContact CG-CE1 3.37Å; F717-H736 WeakPolarHBondContact CG-CE1 3.13Å; F717-H736 AromaticContact CG-CG 3.87Å; F717-H736 AromaticContact CG-ND1 3.43Å; F717-H736 WeakPolarHBondContact CG-ND1 3.42Å; F717-H736 AromaticContact CG-NE2 3.78Å; F717-H736 HydrophobicContact CZ-CB 3.77Å; F717-H736 AromaticContact CZ-CG 3.74Å
718	D	56.4	Low	56.1	Low	55 Å²	55	112.5 Å²	112.5	29%	0.294	55%	0.545	S	S	.	.	H	α-helix	trans	-64.1	-18.3	178.9	-66.3	-31.2	0	0	0	112.5	R714 W737	R714-D718 WeakPolarHBondContact CG-OD2 3.4Å; R714-D718 IonicContact NE-OD2 3.99Å; R714-D718 PolarHBondContact O-N 2.72Å; R714-D718 VanDerWaalsContact O-N 3.1Å; D718-W737 PolarHBondContact OD1-NE1 2.75Å
719	H	53.9	Low	54.9	Low	157 Å²	157	113.9 Å²	113.9	73%	0.727	54%	0.542	S	S	*	.	H	α-helix	trans	-89	-31.2	176.5	-76.6	-57.5	0	0	0	115.7	Q715 K716 F717	Q715-H719 PolarHBondContact O-CD2 3.44Å; K716-H719 PolarHBondContact O-N 3.1Å; F717-H719 PolarHBondContact O-N 2.93Å; F717-H719 VanDerWaalsContact O-N 3.16Å
720	Q	52.6	Low	53.9	Low	148 Å²	148	121.5 Å²	121.5	69%	0.692	57%	0.566	S	S	*	*	H	α-helix	trans	-81.8	-16.8	-172.8	-70.3	-176.7	-65.3	0	0	114.1	K716 F717 L722	K716-Q720 PolarHBondContact O-N 3.42Å; F717-Q720 PolarHBondContact O-N 3.46Å; Q720-L722 PolarHBondContact O-N 3.02Å
721	L	49.2	Very low	53.1	Low	26 Å²	26	126.2 Å²	126.2	14%	0.136	59%	0.59	C	S	.	*	T	Hydrogen-bonded Turn	trans	-81.4	27.4	-168.2	-129.9	148.8	0	0	0	114.3	F717 W729 I732	F717-L721 HydrophobicContact CD1-CD1 4.2Å; F717-L721 HydrophobicContact CE1-CD1 3.54Å; F717-L721 HydrophobicContact CE2-CD1 4.43Å; F717-L721 HydrophobicContact CZ-CD1 3.69Å; L721-W729 HydrophobicContact CD2-CB 4.34Å; L721-W729 HydrophobicContact CD2-CG 4.34Å; L721-I732 HydrophobicContact CD1-CG2 4.09Å
722	L	45	Very low	52.8	Low	128 Å²	128	122 Å²	122	67%	0.67	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121	-10.5	-170.7	-139.7	77	0	0	0	114.9	Q720	Q720-L722 PolarHBondContact O-N 3.02Å
723	S	39.6	Very low	52.6	Low	103 Å²	103	119.5 Å²	119.5	72%	0.72	57%	0.57	S	S	*	*	S	Bend	trans	-115.9	-0.8	-163.5	58.5	0	0	0	0	116.5
724	T	43.4	Very low	52.9	Low	105 Å²	105	118.6 Å²	118.6	64%	0.644	57%	0.569	S	S	*	*			trans	-127.8	97.8	-175.2	42.5	0	0	0	0	112.6	W729	T724-W729 PolarHBondContact O-NE1 3.17Å
725	G	40.3	Very low	53.1	Low	69 Å²	69	119.2 Å²	119.2	71%	0.711	58%	0.578	S	S	*	*			trans	-91.1	104.4	179.5	0	0	0	0	0	113.2
726	F	43.6	Very low	53.4	Low	191 Å²	191	115.9 Å²	115.9	84%	0.838	56%	0.562	S	S	*	*	S	Bend	trans	-154.6	-26.2	158.6	-143	-95.3	0	0	0	114
727	F	40.9	Very low	53.7	Low	180 Å²	180	114 Å²	114	79%	0.789	55%	0.551	S	S	*	*	S	Bend	trans	-125	165.6	173.9	-85.7	-86.5	0	0	0	112.7	W729	F727-W729 PolarHBondContact O-NE1 2.96Å
728	R	42.4	Very low	54.4	Low	235 Å²	235	116.1 Å²	116.1	89%	0.887	56%	0.564	S	S	*	*			trans	-93	121.8	-161.4	-171.2	172.3	171.6	-172.1	-3.4	112.9	Y730	R728-Y730 PolarHBondContact O-N 2.56Å
729	W	49.4	Very low	55.4	Low	99 Å²	99	120 Å²	120	38%	0.375	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.2	-3.2	-155.2	-59.9	-16.8	0	0	0	119.1	L721 T724 F727 I731	L721-W729 HydrophobicContact CD2-CB 4.34Å; L721-W729 HydrophobicContact CD2-CG 4.34Å; T724-W729 PolarHBondContact O-NE1 3.17Å; F727-W729 PolarHBondContact O-NE1 2.96Å; W729-I731 PolarHBondContact O-N 3.19Å
730	Y	51.2	Low	56.6	Low	219 Å²	219	113 Å²	113	86%	0.859	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-26.2	-163.8	-160.5	-98.6	0	0	0	115.7	R728	R728-Y730 PolarHBondContact O-N 2.56Å
731	I	55.4	Low	57.7	Low	122 Å²	122	109.1 Å²	109.1	63%	0.626	52%	0.522	S	S	*	.	S	Bend	trans	-84.6	-27.1	-167.9	-63.7	170.8	0	0	0	113.2	W729 P734 I735	W729-I731 PolarHBondContact O-N 3.19Å; I731-P734 WeakPolarHBondContact O-CD 3.35Å; I731-I735 HydrophobicContact CG2-CD1 3.94Å
732	I	63.5	Low	59	Low	87 Å²	87	113 Å²	113	45%	0.446	54%	0.542	S	S	.	.	H	α-helix	trans	-77.5	-32.7	-161.1	-67.6	168.6	0	0	0	113.3	F717 L721 H736	F717-I732 HydrophobicContact CE1-CG2 4.36Å; F717-I732 HydrophobicContact CZ-CG2 3.75Å; L721-I732 HydrophobicContact CD1-CG2 4.09Å; I732-H736 PolarHBondContact O-N 2.87Å
733	R	62.5	Low	60.3	Low	99 Å²	99	110.3 Å²	110.3	37%	0.374	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-53.1	-173.6	-67.2	-178.2	177.7	178.7	-1.6	114.9	I735 H736 W737	R733-I735 VanDerWaalsContact C-N 3.31Å; R733-I735 PolarHBondContact O-N 3.09Å; R733-H736 PolarHBondContact O-N 2.8Å; R733-W737 PolarHBondContact O-N 3.15Å
734	P	68.3	Low	62	Low	64 Å²	64	109.6 Å²	109.6	42%	0.416	51%	0.513	S	S	.	.	H	α-helix	trans	-65.7	-32.7	-176.5	25.1	-34.8	0	0	0	113.3	I731 W737 I738	I731-P734 WeakPolarHBondContact O-CD 3.35Å; P734-W737 PolarHBondContact O-N 3.45Å; P734-I738 WeakPolarHBondContact O-CG1 3.42Å; P734-I738 PolarHBondContact O-N 2.77Å
735	I	70.7	Confident	63.8	Low	106 Å²	106	104.6 Å²	104.6	54%	0.544	48%	0.482	S	S	.	.	H	α-helix	trans	-60.9	-47.4	177.2	-60.5	174.7	0	0	0	110.1	I731 R733 W737 I738 W739	I731-I735 HydrophobicContact CG2-CD1 3.94Å; R733-I735 VanDerWaalsContact C-N 3.31Å; R733-I735 PolarHBondContact O-N 3.09Å; I735-W737 VanDerWaalsContact C-N 3.32Å; I735-W737 PolarHBondContact O-N 2.89Å; I735-I738 PolarHBondContact O-N 3Å; I735-W739 WeakPolarHBondContact O-CB 3.06Å; I735-W739 PolarHBondContact O-N 3Å
736	H	70.2	Confident	65.8	Low	43 Å²	43	104.8 Å²	104.8	20%	0.199	47%	0.469	C	S	.	.	H	α-helix	trans	-62.5	-36.4	177.3	-175.4	-104.2	0	0	0	112.8	F717 I732 R733 T740	F717-H736 WeakPolarHBondContact CB-CE1 3.33Å; F717-H736 HydrophobicContact CD1-CB 4.13Å; F717-H736 AromaticContact CD1-CE1 3.75Å; F717-H736 AromaticContact CD1-CG 3.66Å; F717-H736 AromaticContact CD1-ND1 3.27Å; F717-H736 VanDerWaalsContact CD1-ND1 3.27Å; F717-H736 WeakPolarHBondContact CD1-ND1 3.45Å; F717-H736 AromaticContact CD2-CD2 3.84Å; F717-H736 AromaticContact CD2-CE1 3.8Å; F717-H736 AromaticContact CD2-NE2 3.7Å; F717-H736 HydrophobicContact CE1-CB 3.59Å; F717-H736 AromaticContact CE1-CG 3.58Å; F717-H736 AromaticContact CE1-ND1 3.7Å; F717-H736 HydrophobicContact CE2-CB 4.45Å; F717-H736 AromaticContact CE2-CD2 3.83Å; F717-H736 AromaticContact CE2-CG 3.98Å; F717-H736 AromaticContact CG-CE1 3.37Å; F717-H736 WeakPolarHBondContact CG-CE1 3.13Å; F717-H736 AromaticContact CG-CG 3.87Å; F717-H736 AromaticContact CG-ND1 3.43Å; F717-H736 WeakPolarHBondContact CG-ND1 3.42Å; F717-H736 AromaticContact CG-NE2 3.78Å; F717-H736 HydrophobicContact CZ-CB 3.77Å; F717-H736 AromaticContact CZ-CG 3.74Å; I732-H736 PolarHBondContact O-N 2.87Å; R733-H736 PolarHBondContact O-N 2.8Å; H736-T740 WeakPolarHBondContact O-CB 3.08Å; H736-T740 PolarHBondContact O-N 2.85Å; H736-T740 PolarHBondContact O-OG1 2.97Å
737	W	69.9	Low	67.5	Low	105 Å²	105	100.5 Å²	100.5	40%	0.398	45%	0.454	S	S	.	.	H	α-helix	trans	-67.4	-45	177.7	-63.1	-8.4	0	0	0	112.6	D718 R733 P734 I735 T740 Y741	D718-W737 PolarHBondContact OD1-NE1 2.75Å; R733-W737 PolarHBondContact O-N 3.15Å; P734-W737 PolarHBondContact O-N 3.45Å; I735-W737 VanDerWaalsContact C-N 3.32Å; I735-W737 PolarHBondContact O-N 2.89Å; W737-T740 PolarHBondContact O-N 2.83Å; W737-Y741 PolarHBondContact O-N 3.06Å
738	I	74.7	Confident	69.3	Low	98 Å²	98	94.2 Å²	94.2	50%	0.503	43%	0.431	S	S	.	.	H	α-helix	trans	-61.4	-47.7	176.7	-70.4	168.1	0	0	0	110.3	P734 I735 T740 I742	P734-I738 WeakPolarHBondContact O-CG1 3.42Å; P734-I738 PolarHBondContact O-N 2.77Å; I735-I738 PolarHBondContact O-N 3Å; I738-T740 PolarHBondContact O-N 3.35Å; I738-I742 HydrophobicContact CG2-CD1 4.42Å; I738-I742 PolarHBondContact O-N 3.22Å; I738-I742 VanDerWaalsContact O-N 3.11Å
739	W	77.9	Confident	71.3	Confident	137 Å²	137	84.1 Å²	84.1	52%	0.519	40%	0.395	S	S	.	.	I	π-helix	trans	-57.8	-45.2	177.6	-173.7	-99.2	0	0	0	112.6	I735 I743 H744	I735-W739 WeakPolarHBondContact O-CB 3.06Å; I735-W739 PolarHBondContact O-N 3Å; W739-I743 HydrophobicContact CD2-CD1 4.46Å; W739-I743 HydrophobicContact CE3-CD1 3.56Å; W739-I743 HydrophobicContact CE3-CG2 4.43Å; W739-I743 HydrophobicContact CH2-CG2 4.48Å; W739-I743 HydrophobicContact CZ3-CD1 3.84Å; W739-I743 HydrophobicContact CZ3-CG2 4.3Å; W739-H744 AromaticContact CD1-CD2 3.58Å; W739-H744 AromaticContact CD1-NE2 3.88Å; W739-H744 AromaticContact CE2-CD2 3.81Å; W739-H744 AromaticContact CE2-NE2 3.51Å; W739-H744 AromaticContact CZ2-NE2 3.74Å; W739-H744 AromaticContact NE1-CD2 3.21Å; W739-H744 PolarHBondContact NE1-CD2 2.94Å; W739-H744 AromaticContact NE1-NE2 3.01Å; W739-H744 PolarHBondContact NE1-NE2 3.23Å; W739-H744 PolarHBondContact O-N 3.46Å; W739-H744 VanDerWaalsContact O-N 3.13Å
740	T	77.6	Confident	72.9	Confident	9 Å²	9	85.5 Å²	85.5	6%	0.055	41%	0.408	C	S	.	.	I	π-helix	trans	-69.3	-41	-175	-58.4	0	0	0	0	113.6	L710 H736 W737 I738	L710-T740 HydrophobicContact CD2-CG2 4.3Å; H736-T740 WeakPolarHBondContact O-CB 3.08Å; H736-T740 PolarHBondContact O-N 2.85Å; H736-T740 PolarHBondContact O-OG1 2.97Å; W737-T740 PolarHBondContact O-N 2.83Å; I738-T740 PolarHBondContact O-N 3.35Å
741	Y	76.7	Confident	74.4	Confident	66 Å²	66	79.7 Å²	79.7	26%	0.259	39%	0.39	S	S	.	.	I	π-helix	trans	-97.9	-43.9	-172.4	-73.2	-72.7	0	0	0	114.6	W707 R714 W737 G745 V746	W707-Y741 HydrophobicContact CZ3-CD1 4.45Å; R714-Y741 WeakPolarHBondContact CD-OH 3.42Å; W737-Y741 PolarHBondContact O-N 3.06Å; Y741-G745 VanDerWaalsContact O-CA 3.25Å; Y741-G745 WeakPolarHBondContact O-CA 3.11Å; Y741-G745 PolarHBondContact O-N 2.85Å; Y741-V746 PolarHBondContact O-N 2.96Å
742	I	75.2	Confident	75.5	Confident	108 Å²	108	75.1 Å²	75.1	55%	0.554	37%	0.367	S	S	*	.	I	π-helix	trans	-81.3	-50.6	-172.9	-59.3	179.8	0	0	0	109.5	I738	I738-I742 HydrophobicContact CG2-CD1 4.42Å; I738-I742 PolarHBondContact O-N 3.22Å; I738-I742 VanDerWaalsContact O-N 3.11Å
743	I	74	Confident	76.4	Confident	71 Å²	71	74.8 Å²	74.8	36%	0.364	37%	0.369	S	S	.	.	I	π-helix	trans	-78.7	-54.2	-176.5	-62.9	171.3	0	0	0	110.7	W739 L747	W739-I743 HydrophobicContact CD2-CD1 4.46Å; W739-I743 HydrophobicContact CE3-CD1 3.56Å; W739-I743 HydrophobicContact CE3-CG2 4.43Å; W739-I743 HydrophobicContact CH2-CG2 4.48Å; W739-I743 HydrophobicContact CZ3-CD1 3.84Å; W739-I743 HydrophobicContact CZ3-CG2 4.3Å; I743-L747 WeakPolarHBondContact O-CB 3.25Å
744	H	74.6	Confident	77.4	Confident	88 Å²	88	75.3 Å²	75.3	41%	0.407	38%	0.383	S	S	.	.	I	π-helix	trans	-80.3	-20.5	-178.9	-82.5	-66.5	0	0	0	115.5	L710 W739 T748	L710-H744 HydrophobicContact CD2-CB 4.16Å; W739-H744 AromaticContact CD1-CD2 3.58Å; W739-H744 AromaticContact CD1-NE2 3.88Å; W739-H744 AromaticContact CE2-CD2 3.81Å; W739-H744 AromaticContact CE2-NE2 3.51Å; W739-H744 AromaticContact CZ2-NE2 3.74Å; W739-H744 AromaticContact NE1-CD2 3.21Å; W739-H744 PolarHBondContact NE1-CD2 2.94Å; W739-H744 AromaticContact NE1-NE2 3.01Å; W739-H744 PolarHBondContact NE1-NE2 3.23Å; W739-H744 PolarHBondContact O-N 3.46Å; W739-H744 VanDerWaalsContact O-N 3.13Å; H744-T748 WeakPolarHBondContact O-CB 3.48Å; H744-T748 PolarHBondContact O-OG1 3.29Å
745	G	81.2	Confident	78.2	Confident	0 Å²	0	78 Å²	78	0%	0	39%	0.388	C	S	.	.	I	π-helix	trans	-91.2	-79.6	-180	0	0	0	0	0	113	Y741 T748 T749	Y741-G745 VanDerWaalsContact O-CA 3.25Å; Y741-G745 WeakPolarHBondContact O-CA 3.11Å; Y741-G745 PolarHBondContact O-N 2.85Å; G745-T748 PolarHBondContact O-N 3.23Å; G745-T749 PolarHBondContact O-N 2.64Å; G745-T749 VanDerWaalsContact O-N 3.12Å
746	V	81.2	Confident	78.8	Confident	73 Å²	73	76.4 Å²	76.4	44%	0.442	38%	0.376	S	S	.	.	I	π-helix	trans	-61.3	-50.6	-168.6	-179	0	0	0	0	112.1	Y741 T748 T749 M750	Y741-V746 PolarHBondContact O-N 2.96Å; V746-T748 VanDerWaalsContact C-N 3.34Å; V746-T748 PolarHBondContact O-N 2.89Å; V746-T749 PolarHBondContact O-N 3.41Å; V746-T749 VanDerWaalsContact O-N 3.14Å; V746-T749 PolarHBondContact O-OG1 2.98Å; V746-M750 PolarHBondContact O-N 3.07Å; V746-M750 VanDerWaalsContact O-N 3.16Å
747	L	79.2	Confident	79.5	Confident	101 Å²	101	76.6 Å²	76.6	53%	0.529	38%	0.38	S	S	.	.	I	π-helix	trans	-58.5	-45.5	-178.7	-175.9	63.1	0	0	0	111.7	I743 T749 M750 I751	I743-L747 WeakPolarHBondContact O-CB 3.25Å; L747-T749 VanDerWaalsContact C-N 3.35Å; L747-T749 PolarHBondContact O-N 2.79Å; L747-M750 PolarHBondContact O-N 2.91Å; L747-I751 HydrophobicContact CD1-CD1 4.28Å; L747-I751 HydrophobicContact CG-CD1 4.01Å; L747-I751 WeakPolarHBondContact O-CG1 3.18Å; L747-I751 PolarHBondContact O-N 3.47Å; L747-I751 VanDerWaalsContact O-N 3.1Å
748	T	79.2	Confident	80.2	Confident	49 Å²	49	75.1 Å²	75.1	30%	0.301	38%	0.383	S	S	.	.	H	α-helix	trans	-59.1	-41.8	176.3	-47.4	0	0	0	0	112.2	M706 H744 G745 V746 L752	M706-T748 HydrophobicContact CE-CG2 4.41Å; M706-T748 HydrophobicContact SD-CG2 3.9Å; H744-T748 WeakPolarHBondContact O-CB 3.48Å; H744-T748 PolarHBondContact O-OG1 3.29Å; G745-T748 PolarHBondContact O-N 3.23Å; V746-T748 VanDerWaalsContact C-N 3.34Å; V746-T748 PolarHBondContact O-N 2.89Å; T748-L752 WeakPolarHBondContact O-CB 3.19Å; T748-L752 PolarHBondContact O-N 3.42Å
749	T	84.3	Confident	80.8	Confident	22 Å²	22	72.7 Å²	72.7	14%	0.135	37%	0.371	C	S	.	.	H	α-helix	trans	-64.2	-40.1	177.6	57	0	0	0	0	113.3	L703 M706 W707 G745 V746 L747 L752 V753	L703-T749 HydrophobicContact CD2-CG2 3.96Å; M706-T749 HydrophobicContact CE-CG2 3.51Å; W707-T749 HydrophobicContact CZ2-CG2 4.1Å; G745-T749 PolarHBondContact O-N 2.64Å; G745-T749 VanDerWaalsContact O-N 3.12Å; V746-T749 PolarHBondContact O-N 3.41Å; V746-T749 VanDerWaalsContact O-N 3.14Å; V746-T749 PolarHBondContact O-OG1 2.98Å; L747-T749 VanDerWaalsContact C-N 3.35Å; L747-T749 PolarHBondContact O-N 2.79Å; T749-L752 PolarHBondContact O-N 2.95Å; T749-V753 WeakPolarHBondContact O-CG2 3.29Å; T749-V753 PolarHBondContact O-N 3.4Å
750	M	83.2	Confident	81.1	Confident	129 Å²	129	66.1 Å²	66.1	64%	0.635	35%	0.346	S	S	*	.	H	α-helix	trans	-67.4	-42.9	179.7	-70.4	-64.2	175	0	0	111.7	V746 L747 V754	V746-M750 PolarHBondContact O-N 3.07Å; V746-M750 VanDerWaalsContact O-N 3.16Å; L747-M750 PolarHBondContact O-N 2.91Å; M750-V754 PolarHBondContact O-N 2.76Å
751	I	82.2	Confident	81.6	Confident	96 Å²	96	69.9 Å²	69.9	49%	0.492	37%	0.365	S	S	.	.	H	α-helix	trans	-60.3	-47.4	174.4	-65.8	167.1	0	0	0	110.3	L747 V753 V754 F755	L747-I751 HydrophobicContact CD1-CD1 4.28Å; L747-I751 HydrophobicContact CG-CD1 4.01Å; L747-I751 WeakPolarHBondContact O-CG1 3.18Å; L747-I751 PolarHBondContact O-N 3.47Å; L747-I751 VanDerWaalsContact O-N 3.1Å; I751-V753 PolarHBondContact O-N 3.25Å; I751-V754 PolarHBondContact O-N 2.84Å; I751-F755 HydrophobicContact CG2-CB 4.42Å; I751-F755 WeakPolarHBondContact O-CB 3.11Å; I751-F755 PolarHBondContact O-N 3.36Å
752	L	79.9	Confident	82.2	Confident	27 Å²	27	71.5 Å²	71.5	14%	0.141	38%	0.377	C	S	.	.	H	α-helix	trans	-62.2	-40.3	-175.7	-156.1	95.1	0	0	0	112.9	L699 F702 L703 T748 T749 W756	L699-L752 HydrophobicContact CG-CD2 4.37Å; F702-L752 HydrophobicContact CD1-CD1 4.45Å; F702-L752 HydrophobicContact CD1-CD2 3.8Å; F702-L752 HydrophobicContact CE1-CD1 4.15Å; F702-L752 HydrophobicContact CE1-CD2 4.24Å; L703-L752 HydrophobicContact CD2-CD2 3.77Å; L703-L752 HydrophobicContact CG-CD2 3.93Å; T748-L752 WeakPolarHBondContact O-CB 3.19Å; T748-L752 PolarHBondContact O-N 3.42Å; T749-L752 PolarHBondContact O-N 2.95Å; L752-W756 HydrophobicContact CD1-CE3 4.25Å; L752-W756 WeakPolarHBondContact O-CB 3.46Å; L752-W756 PolarHBondContact O-N 2.95Å; L752-W756 VanDerWaalsContact O-N 3.11Å
753	V	82.6	Confident	82.7	Confident	79 Å²	79	68.3 Å²	68.3	48%	0.479	36%	0.364	S	S	.	.	H	α-helix	trans	-70.2	-33.5	-177.4	172.5	0	0	0	0	112.5	L703 T749 I751 P757	L703-V753 HydrophobicContact CD1-CG2 4.34Å; T749-V753 WeakPolarHBondContact O-CG2 3.29Å; T749-V753 PolarHBondContact O-N 3.4Å; I751-V753 PolarHBondContact O-N 3.25Å; V753-P757 WeakPolarHBondContact O-CD 3.42Å; V753-P757 VanDerWaalsContact O-CG 3.31Å; V753-P757 WeakPolarHBondContact O-CG 3.49Å
754	V	82.9	Confident	83.4	Confident	110 Å²	110	64.9 Å²	64.9	67%	0.667	35%	0.346	S	S	*	.	H	α-helix	trans	-85.9	-42.3	179.3	179.9	0	0	0	0	111.9	M750 I751 T758	M750-V754 PolarHBondContact O-N 2.76Å; I751-V754 PolarHBondContact O-N 2.84Å; V754-T758 PolarHBondContact O-OG1 3.42Å; V754-T758 VanDerWaalsContact O-OG1 3.12Å
755	F	85.1	Confident	84.1	Confident	122 Å²	122	63.8 Å²	63.8	54%	0.535	35%	0.346	S	S	.	.	H	α-helix	trans	-82.5	-36.7	-171.6	-171	-105	0	0	0	113.4	I751 T758 L759	I751-F755 HydrophobicContact CG2-CB 4.42Å; I751-F755 WeakPolarHBondContact O-CB 3.11Å; I751-F755 PolarHBondContact O-N 3.36Å; F755-T758 PolarHBondContact O-OG1 3.12Å; F755-L759 HydrophobicContact CD1-CD2 4.43Å; F755-L759 HydrophobicContact CE1-CB 4.5Å; F755-L759 HydrophobicContact CE1-CD1 4.19Å; F755-L759 HydrophobicContact CE1-CD2 3.98Å; F755-L759 HydrophobicContact CE1-CG 4.46Å; F755-L759 HydrophobicContact CZ-CD1 4.22Å; F755-L759 WeakPolarHBondContact O-CB 3.35Å; F755-L759 PolarHBondContact O-N 3.5Å
756	W	83.4	Confident	84.5	Confident	72 Å²	72	66.7 Å²	66.7	27%	0.273	36%	0.364	S	S	.	.	H	α-helix	trans	-69.1	-40.8	-174.1	-159	-86.3	0	0	0	114.1	C663 V664 L699 L752 T758 L759 C760	C663-W756 HydrophobicContact CB-CZ2 4.19Å; C663-W756 PolarHBondContact O-NE1 3.12Å; V664-W756 HydrophobicContact CG2-CZ2 4.31Å; L699-W756 HydrophobicContact CD1-CB 3.75Å; L699-W756 HydrophobicContact CD1-CG 4.05Å; L752-W756 HydrophobicContact CD1-CE3 4.25Å; L752-W756 WeakPolarHBondContact O-CB 3.46Å; L752-W756 PolarHBondContact O-N 2.95Å; L752-W756 VanDerWaalsContact O-N 3.11Å; W756-T758 PolarHBondContact O-N 2.66Å; W756-L759 PolarHBondContact O-N 3.39Å; W756-C760 PolarHBondContact O-N 3.18Å; W756-C760 PolarHBondContact O-SG 2.81Å; W756-C760 VanDerWaalsContact O-SG 3.35Å
757	P	84.4	Confident	84.9	Confident	46 Å²	46	63.3 Å²	63.3	30%	0.299	34%	0.343	S	S	.	.	H	α-helix	trans	-65.8	-39.4	178.8	-23	35.7	0	0	0	113.5	L669 V753 I761	L669-P757 HydrophobicContact CD2-CB 4.19Å; V753-P757 WeakPolarHBondContact O-CD 3.42Å; V753-P757 VanDerWaalsContact O-CG 3.31Å; V753-P757 WeakPolarHBondContact O-CG 3.49Å; P757-I761 PolarHBondContact O-N 2.9Å
758	T	84.9	Confident	85.3	Confident	74 Å²	74	61.6 Å²	61.6	45%	0.454	33%	0.334	S	S	.	.	H	α-helix	trans	-67.7	-42.9	176.3	46	0	0	0	0	110.9	V754 F755 W756 C760 I761 I762	V754-T758 PolarHBondContact O-OG1 3.42Å; V754-T758 VanDerWaalsContact O-OG1 3.12Å; F755-T758 PolarHBondContact O-OG1 3.12Å; W756-T758 PolarHBondContact O-N 2.66Å; T758-C760 PolarHBondContact O-N 3.45Å; T758-I761 PolarHBondContact O-N 2.98Å; T758-I762 WeakPolarHBondContact O-CG1 3.2Å; T758-I762 PolarHBondContact O-N 2.97Å; T758-I762 VanDerWaalsContact O-N 3.1Å
759	L	86.7	Confident	85.9	Confident	47 Å²	47	64.1 Å²	64.1	25%	0.246	35%	0.349	C	S	.	.	H	α-helix	trans	-58	-45.6	173.8	-170.4	72.6	0	0	0	112.5	V664 F755 W756 I761 I762 C763	V664-L759 HydrophobicContact CG1-CB 4.47Å; V664-L759 HydrophobicContact CG1-CD2 4Å; V664-L759 HydrophobicContact CG1-CG 3.8Å; F755-L759 HydrophobicContact CD1-CD2 4.43Å; F755-L759 HydrophobicContact CE1-CB 4.5Å; F755-L759 HydrophobicContact CE1-CD1 4.19Å; F755-L759 HydrophobicContact CE1-CD2 3.98Å; F755-L759 HydrophobicContact CE1-CG 4.46Å; F755-L759 HydrophobicContact CZ-CD1 4.22Å; F755-L759 WeakPolarHBondContact O-CB 3.35Å; F755-L759 PolarHBondContact O-N 3.5Å; W756-L759 PolarHBondContact O-N 3.39Å; L759-I761 VanDerWaalsContact C-N 3.34Å; L759-I761 PolarHBondContact O-N 3.48Å; L759-I762 PolarHBondContact O-N 2.64Å; L759-C763 VanDerWaalsContact O-CB 3.31Å; L759-C763 WeakPolarHBondContact O-CB 3.35Å; L759-C763 PolarHBondContact O-N 3.09Å; L759-C763 PolarHBondContact O-SG 3.21Å; L759-C763 VanDerWaalsContact O-SG 3.35Å
760	C	84.4	Confident	86	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-57	-43.7	178	-73.9	0	0	0	0	113.5	V664 L669 W756 T758 S764	V664-C760 WeakPolarHBondContact O-CA 3.46Å; L669-C760 HydrophobicContact CD1-CB 3.88Å; L669-C760 HydrophobicContact CD2-CB 3.72Å; L669-C760 HydrophobicContact CG-CB 3.88Å; W756-C760 PolarHBondContact O-N 3.18Å; W756-C760 PolarHBondContact O-SG 2.81Å; W756-C760 VanDerWaalsContact O-SG 3.35Å; T758-C760 PolarHBondContact O-N 3.45Å; C760-S764 WeakPolarHBondContact O-CB 3.14Å; C760-S764 PolarHBondContact O-N 3.22Å; C760-S764 PolarHBondContact O-OG 3.43Å
761	I	87.5	Confident	86.2	Confident	87 Å²	87	60.6 Å²	60.6	45%	0.446	33%	0.331	S	S	.	.	H	α-helix	trans	-69.1	-44.3	-179.2	-64.3	169.9	0	0	0	110.4	L669 P757 T758 L759 T765	L669-I761 HydrophobicContact CD1-CG1 4.09Å; P757-I761 PolarHBondContact O-N 2.9Å; T758-I761 PolarHBondContact O-N 2.98Å; L759-I761 VanDerWaalsContact C-N 3.34Å; L759-I761 PolarHBondContact O-N 3.48Å; I761-T765 WeakPolarHBondContact O-CG2 3.46Å; I761-T765 PolarHBondContact O-N 3.37Å; I761-T765 PolarHBondContact O-OG1 2.72Å
762	I	89.5	Confident	86.5	Confident	100 Å²	100	60.4 Å²	60.4	51%	0.513	33%	0.334	S	S	.	.	H	α-helix	trans	-67.3	-47	-179.3	-65.6	166.9	0	0	0	110.9	T758 L759 S764 T765 T766	T758-I762 WeakPolarHBondContact O-CG1 3.2Å; T758-I762 PolarHBondContact O-N 2.97Å; T758-I762 VanDerWaalsContact O-N 3.1Å; L759-I762 PolarHBondContact O-N 2.64Å; I762-S764 PolarHBondContact O-N 2.81Å; I762-T765 PolarHBondContact O-OG1 2.88Å; I762-T766 HydrophobicContact CG2-CG2 4.36Å; I762-T766 WeakPolarHBondContact O-CB 3.11Å; I762-T766 VanDerWaalsContact O-CG2 3.32Å; I762-T766 WeakPolarHBondContact O-CG2 3.34Å; I762-T766 PolarHBondContact O-N 2.69Å; I762-T766 PolarHBondContact O-OG1 3.05Å
763	C	87.3	Confident	87	Confident	41 Å²	41	64.5 Å²	64.5	28%	0.277	36%	0.356	S	S	.	.	H	α-helix	trans	-65.8	-38.1	179.1	-69.2	0	0	0	0	112.1	V664 L759 T766 S767	V664-C763 HydrophobicContact CB-CB 4.39Å; V664-C763 HydrophobicContact CG1-CB 3.74Å; L759-C763 VanDerWaalsContact O-CB 3.31Å; L759-C763 WeakPolarHBondContact O-CB 3.35Å; L759-C763 PolarHBondContact O-N 3.09Å; L759-C763 PolarHBondContact O-SG 3.21Å; L759-C763 VanDerWaalsContact O-SG 3.35Å; C763-T766 WeakPolarHBondContact CA-OG1 3.44Å; C763-T766 PolarHBondContact O-OG1 3.49Å; C763-S767 WeakPolarHBondContact O-CB 3.35Å; C763-S767 PolarHBondContact O-N 2.86Å
764	S	88.5	Confident	87.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-72.9	-36.9	-179.4	-59.8	0	0	0	0	112.7	V664 S665 Y666 C760 I762	V664-S764 PolarHBondContact O-OG 3.33Å; V664-S764 VanDerWaalsContact O-OG 3.1Å; S665-S764 WeakPolarHBondContact CA-OG 3.33Å; Y666-S764 PolarHBondContact N-OG 3.17Å; C760-S764 WeakPolarHBondContact O-CB 3.14Å; C760-S764 PolarHBondContact O-N 3.22Å; C760-S764 PolarHBondContact O-OG 3.43Å; I762-S764 PolarHBondContact O-N 2.81Å
765	T	88.6	Confident	87.4	Confident	64 Å²	64	60.3 Å²	60.3	39%	0.393	33%	0.326	S	S	.	.	H	α-helix	trans	-68.2	-51.1	173	46.5	0	0	0	0	111.8	Y666 I761 I762 S767 I768 V769	Y666-T765 WeakPolarHBondContact OH-CG2 3.19Å; Y666-T765 PolarHBondContact OH-N 2.85Å; I761-T765 WeakPolarHBondContact O-CG2 3.46Å; I761-T765 PolarHBondContact O-N 3.37Å; I761-T765 PolarHBondContact O-OG1 2.72Å; I762-T765 PolarHBondContact O-OG1 2.88Å; T765-S767 VanDerWaalsContact C-N 3.3Å; T765-S767 PolarHBondContact O-N 3.04Å; T765-I768 PolarHBondContact O-N 3.14Å; T765-V769 PolarHBondContact O-N 3.31Å
766	T	89	Confident	87.5	Confident	62 Å²	62	58.3 Å²	58.3	38%	0.38	33%	0.325	S	S	.	.	H	α-helix	trans	-63.4	-34.9	-177.7	52.9	0	0	0	0	112.1	I762 C763 I768 V769 I770	I762-T766 HydrophobicContact CG2-CG2 4.36Å; I762-T766 WeakPolarHBondContact O-CB 3.11Å; I762-T766 VanDerWaalsContact O-CG2 3.32Å; I762-T766 WeakPolarHBondContact O-CG2 3.34Å; I762-T766 PolarHBondContact O-N 2.69Å; I762-T766 PolarHBondContact O-OG1 3.05Å; C763-T766 WeakPolarHBondContact CA-OG1 3.44Å; C763-T766 PolarHBondContact O-OG1 3.49Å; T766-I768 VanDerWaalsContact C-N 3.34Å; T766-I768 PolarHBondContact O-N 2.72Å; T766-V769 PolarHBondContact O-N 3.42Å; T766-I770 WeakPolarHBondContact O-CB 3.44Å; T766-I770 WeakPolarHBondContact O-CD1 3.31Å; T766-I770 VanDerWaalsContact O-CG1 3.24Å; T766-I770 WeakPolarHBondContact O-CG1 3.35Å; T766-I770 PolarHBondContact O-N 2.91Å
767	S	90.5	Very high	87.7	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.014	33%	0.329	C	S	.	.	H	α-helix	trans	-53.6	-46.6	173.6	-177.8	0	0	0	0	113.1	F654 I658 C763 T765 V769 I770 G771	F654-S767 WeakPolarHBondContact CA-OG 3.47Å; F654-S767 WeakPolarHBondContact CB-O 3.49Å; F654-S767 PolarHBondContact O-OG 3.16Å; I658-S767 VanDerWaalsContact CB-OG 3.32Å; I658-S767 WeakPolarHBondContact CB-OG 3.32Å; I658-S767 WeakPolarHBondContact CD1-OG 3.5Å; C763-S767 WeakPolarHBondContact O-CB 3.35Å; C763-S767 PolarHBondContact O-N 2.86Å; T765-S767 VanDerWaalsContact C-N 3.3Å; T765-S767 PolarHBondContact O-N 3.04Å; S767-V769 PolarHBondContact O-N 3.05Å; S767-I770 PolarHBondContact O-N 3.34Å; S767-G771 PolarHBondContact O-N 3.18Å
768	I	87.5	Confident	87.9	Confident	65 Å²	65	55.9 Å²	55.9	33%	0.333	32%	0.317	S	S	.	.	H	α-helix	trans	-67.8	-39.4	-177.5	-63	170.1	0	0	0	110.4	F655 P659 T765 T766 G771 V772	F655-I768 HydrophobicContact CD1-CG2 4.35Å; F655-I768 HydrophobicContact CE1-CG2 4.15Å; P659-I768 HydrophobicContact CB-CD1 4.29Å; P659-I768 HydrophobicContact CB-CG1 4.4Å; P659-I768 HydrophobicContact CG-CG1 4.35Å; T765-I768 PolarHBondContact O-N 3.14Å; T766-I768 VanDerWaalsContact C-N 3.34Å; T766-I768 PolarHBondContact O-N 2.72Å; I768-G771 PolarHBondContact O-N 3.48Å; I768-V772 PolarHBondContact O-N 3.4Å
769	V	91.1	Very high	88	Confident	101 Å²	101	55.3 Å²	55.3	61%	0.612	32%	0.315	S	S	*	.	H	α-helix	trans	-64.2	-45.1	175.9	179.7	0	0	0	0	111.2	T765 T766 S767 G771 V772 L773	T765-V769 PolarHBondContact O-N 3.31Å; T766-V769 PolarHBondContact O-N 3.42Å; S767-V769 PolarHBondContact O-N 3.05Å; V769-G771 VanDerWaalsContact C-N 3.3Å; V769-G771 PolarHBondContact O-N 2.86Å; V769-V772 PolarHBondContact O-N 3.18Å; V769-L773 PolarHBondContact O-N 3.08Å; V769-L773 VanDerWaalsContact O-N 3.09Å
770	I	87.7	Confident	88.1	Confident	78 Å²	78	58.8 Å²	58.8	40%	0.4	33%	0.333	S	S	.	.	H	α-helix	trans	-62.5	-39	175.3	-66	163.4	0	0	0	110.4	F654 T766 S767 V772 L773 S774	F654-I770 HydrophobicContact CD1-CB 4.21Å; F654-I770 HydrophobicContact CD1-CG2 3.93Å; F654-I770 HydrophobicContact CD2-CG2 4.15Å; F654-I770 HydrophobicContact CE1-CB 4.21Å; F654-I770 HydrophobicContact CE1-CG2 3.58Å; F654-I770 HydrophobicContact CE2-CG2 3.81Å; F654-I770 HydrophobicContact CG-CG2 4.23Å; F654-I770 HydrophobicContact CZ-CG2 3.52Å; T766-I770 WeakPolarHBondContact O-CB 3.44Å; T766-I770 WeakPolarHBondContact O-CD1 3.31Å; T766-I770 VanDerWaalsContact O-CG1 3.24Å; T766-I770 WeakPolarHBondContact O-CG1 3.35Å; T766-I770 PolarHBondContact O-N 2.91Å; S767-I770 PolarHBondContact O-N 3.34Å; I770-V772 PolarHBondContact O-N 2.95Å; I770-L773 PolarHBondContact O-N 2.86Å; I770-S774 VanDerWaalsContact O-CB 3.31Å; I770-S774 WeakPolarHBondContact O-CB 3.43Å; I770-S774 PolarHBondContact O-N 2.93Å
771	G	87.2	Confident	88.3	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-56.3	-46.2	175.6	0	0	0	0	0	113.1	F655 S767 I768 V769 S774	F655-G771 VanDerWaalsContact CE2-C 3.42Å; F655-G771 WeakPolarHBondContact CE2-O 3.48Å; S767-G771 PolarHBondContact O-N 3.18Å; I768-G771 PolarHBondContact O-N 3.48Å; V769-G771 VanDerWaalsContact C-N 3.3Å; V769-G771 PolarHBondContact O-N 2.86Å; G771-S774 WeakPolarHBondContact O-CB 3.37Å; G771-S774 PolarHBondContact O-N 3.23Å; G771-S774 PolarHBondContact O-OG 3.01Å
772	V	88.7	Confident	88.2	Confident	91 Å²	91	59.4 Å²	59.4	55%	0.552	34%	0.337	S	S	*	.	H	α-helix	trans	-63.3	-47.7	174.6	177.6	0	0	0	0	111	F655 I768 V769 I770 S774	F655-V772 HydrophobicContact CE1-CG2 3.97Å; F655-V772 HydrophobicContact CZ-CB 4.44Å; F655-V772 HydrophobicContact CZ-CG2 3.7Å; I768-V772 PolarHBondContact O-N 3.4Å; V769-V772 PolarHBondContact O-N 3.18Å; I770-V772 PolarHBondContact O-N 2.95Å; V772-S774 PolarHBondContact O-N 2.73Å
773	L	89	Confident	88.2	Confident	114 Å²	114	58 Å²	58	60%	0.597	33%	0.33	S	S	*	.	H	α-helix	trans	-64.7	-23.8	-179.1	-152.3	74.9	0	0	0	112.7	V769 I770 I775 P776 V777	V769-L773 PolarHBondContact O-N 3.08Å; V769-L773 VanDerWaalsContact O-N 3.09Å; I770-L773 PolarHBondContact O-N 2.86Å; L773-I775 VanDerWaalsContact C-N 3.3Å; L773-I775 PolarHBondContact O-N 2.79Å; L773-P776 WeakPolarHBondContact O-CD 3.41Å; L773-V777 HydrophobicContact CG-CG2 4.18Å; L773-V777 WeakPolarHBondContact O-CB 3.29Å; L773-V777 WeakPolarHBondContact O-CG2 3.22Å; L773-V777 PolarHBondContact O-N 3.5Å
774	S	85.7	Confident	88.2	Confident	7 Å²	7	60.5 Å²	60.5	5%	0.049	34%	0.34	C	S	.	.	H	α-helix	trans	-67.5	-23.6	-173.6	80.4	0	0	0	0	114.5	I770 G771 V772 V777 I778	I770-S774 VanDerWaalsContact O-CB 3.31Å; I770-S774 WeakPolarHBondContact O-CB 3.43Å; I770-S774 PolarHBondContact O-N 2.93Å; G771-S774 WeakPolarHBondContact O-CB 3.37Å; G771-S774 PolarHBondContact O-N 3.23Å; G771-S774 PolarHBondContact O-OG 3.01Å; V772-S774 PolarHBondContact O-N 2.73Å; S774-V777 PolarHBondContact O-N 3.33Å; S774-I778 WeakPolarHBondContact O-CB 3.48Å; S774-I778 WeakPolarHBondContact O-CD1 3.33Å; S774-I778 WeakPolarHBondContact O-CG1 3.46Å; S774-I778 PolarHBondContact O-N 2.81Å
775	I	87.8	Confident	88	Confident	93 Å²	93	61.9 Å²	61.9	48%	0.477	35%	0.352	S	S	.	.	H	α-helix	trans	-59.8	-56.4	-176.7	-63.2	171.1	0	0	0	112.1	L651 L773 P779	L651-I775 HydrophobicContact CD2-CD1 4.38Å; L651-I775 HydrophobicContact CD2-CG1 3.92Å; L773-I775 VanDerWaalsContact C-N 3.3Å; L773-I775 PolarHBondContact O-N 2.79Å; I775-P779 WeakPolarHBondContact O-CD 3.39Å
776	P	88.3	Confident	87.8	Confident	80 Å²	80	59.4 Å²	59.4	52%	0.519	34%	0.336	S	S	.	.	H	α-helix	trans	-77.1	-25.8	173.4	30	-36.4	0	0	0	113.5	L773	L773-P776 WeakPolarHBondContact O-CD 3.41Å
777	V	88.3	Confident	87.6	Confident	56 Å²	56	60.9 Å²	60.9	34%	0.339	34%	0.341	S	S	.	.	H	α-helix	trans	-79.9	-29.6	-173.3	173	0	0	0	0	112.8	L773 S774 L780 L781	L773-V777 HydrophobicContact CG-CG2 4.18Å; L773-V777 WeakPolarHBondContact O-CB 3.29Å; L773-V777 WeakPolarHBondContact O-CG2 3.22Å; L773-V777 PolarHBondContact O-N 3.5Å; S774-V777 PolarHBondContact O-N 3.33Å; V777-L780 PolarHBondContact O-N 2.97Å; V777-L781 HydrophobicContact CG1-CD1 3.67Å; V777-L781 HydrophobicContact CG1-CG 3.9Å; V777-L781 WeakPolarHBondContact O-CB 3.37Å; V777-L781 WeakPolarHBondContact O-CG 3.3Å; V777-L781 PolarHBondContact O-N 3.07Å
778	I	87.9	Confident	87.2	Confident	12 Å²	12	64.6 Å²	64.6	6%	0.062	36%	0.36	C	S	.	.	H	α-helix	trans	-65.7	-46.8	179.2	-71.4	163.7	0	0	0	113.1	W646 L647 S650 S774 L780 L781 S782	W646-I778 HydrophobicContact CB-CG2 4.02Å; L647-I778 HydrophobicContact CB-CG2 4.44Å; L647-I778 HydrophobicContact CD1-CB 4.32Å; L647-I778 HydrophobicContact CD1-CD1 4.29Å; L647-I778 HydrophobicContact CD1-CG2 4.48Å; S650-I778 WeakPolarHBondContact OG-CD1 3.49Å; S774-I778 WeakPolarHBondContact O-CB 3.48Å; S774-I778 WeakPolarHBondContact O-CD1 3.33Å; S774-I778 WeakPolarHBondContact O-CG1 3.46Å; S774-I778 PolarHBondContact O-N 2.81Å; I778-L780 VanDerWaalsContact C-N 3.28Å; I778-L780 PolarHBondContact O-N 3.33Å; I778-L781 PolarHBondContact O-N 3.33Å; I778-S782 WeakPolarHBondContact O-CB 3.38Å; I778-S782 PolarHBondContact O-N 3.5Å
779	P	87.8	Confident	86.7	Confident	61 Å²	61	62.1 Å²	62.1	40%	0.396	35%	0.351	S	S	.	.	H	α-helix	trans	-57.4	-41.4	175.4	-27.4	35.9	0	0	0	112.5	I775 S782 L783	I775-P779 WeakPolarHBondContact O-CD 3.39Å; P779-S782 PolarHBondContact O-N 3.35Å; P779-L783 WeakPolarHBondContact O-CB 3.27Å; P779-L783 PolarHBondContact O-N 2.95Å
780	L	88.5	Confident	85.9	Confident	120 Å²	120	58 Å²	58	63%	0.628	33%	0.325	S	S	*	.	H	α-helix	trans	-67.6	-46.1	176.7	-68.7	171.2	0	0	0	112.3	V777 I778 S782 L783 L784	V777-L780 PolarHBondContact O-N 2.97Å; I778-L780 VanDerWaalsContact C-N 3.28Å; I778-L780 PolarHBondContact O-N 3.33Å; L780-S782 VanDerWaalsContact C-N 3.28Å; L780-S782 PolarHBondContact O-N 2.86Å; L780-L783 PolarHBondContact O-N 2.76Å; L780-L784 VanDerWaalsContact O-CB 3.26Å; L780-L784 WeakPolarHBondContact O-CB 3.49Å; L780-L784 PolarHBondContact O-N 3.46Å
781	L	87.2	Confident	85.3	Confident	95 Å²	95	58.3 Å²	58.3	50%	0.497	33%	0.327	S	S	.	.	H	α-helix	trans	-62.7	-34.2	174.1	-82.7	176.3	0	0	0	112.3	V777 I778 A785	V777-L781 HydrophobicContact CG1-CD1 3.67Å; V777-L781 HydrophobicContact CG1-CG 3.9Å; V777-L781 WeakPolarHBondContact O-CB 3.37Å; V777-L781 WeakPolarHBondContact O-CG 3.3Å; V777-L781 PolarHBondContact O-N 3.07Å; I778-L781 PolarHBondContact O-N 3.33Å; L781-A785 WeakPolarHBondContact O-CB 3.47Å; L781-A785 PolarHBondContact O-N 3.09Å
782	S	87	Confident	84.9	Confident	5 Å²	5	63.5 Å²	63.5	4%	0.035	35%	0.35	C	S	.	.	H	α-helix	trans	-75.7	-40	179.5	-165.4	0	0	0	0	111.2	T643 I778 P779 L780 A785 H786	T643-S782 VanDerWaalsContact CG2-OG 3.31Å; T643-S782 WeakPolarHBondContact CG2-OG 3.44Å; I778-S782 WeakPolarHBondContact O-CB 3.38Å; I778-S782 PolarHBondContact O-N 3.5Å; P779-S782 PolarHBondContact O-N 3.35Å; L780-S782 VanDerWaalsContact C-N 3.28Å; L780-S782 PolarHBondContact O-N 2.86Å; S782-A785 CarbonylContact O-C 3.52Å; S782-A785 PolarHBondContact O-N 2.88Å; S782-H786 WeakPolarHBondContact O-CB 3.35Å; S782-H786 PolarHBondContact O-N 3.44Å
783	L	88.1	Confident	84.2	Confident	71 Å²	71	63.1 Å²	63.1	37%	0.372	34%	0.339	S	S	.	.	H	α-helix	trans	-60.5	-47.7	170.3	-173.8	84.1	0	0	0	110.4	F639 P779 L780 A785 H786 L787	F639-L783 HydrophobicContact CE1-CD1 4.34Å; F639-L783 HydrophobicContact CE2-CB 4.43Å; F639-L783 HydrophobicContact CZ-CB 4.17Å; F639-L783 HydrophobicContact CZ-CD1 3.86Å; P779-L783 WeakPolarHBondContact O-CB 3.27Å; P779-L783 PolarHBondContact O-N 2.95Å; L780-L783 PolarHBondContact O-N 2.76Å; L783-A785 VanDerWaalsContact C-N 3.33Å; L783-A785 PolarHBondContact O-N 3.2Å; L783-H786 PolarHBondContact O-N 2.92Å; L783-L787 HydrophobicContact CG-CD1 4.28Å; L783-L787 WeakPolarHBondContact O-CG 3.05Å; L783-L787 PolarHBondContact O-N 2.78Å
784	L	88.4	Confident	83.4	Confident	93 Å²	93	58.2 Å²	58.2	49%	0.487	31%	0.313	S	S	.	.	H	α-helix	trans	-60.2	-43	175.7	-170.2	73.7	0	0	0	111.1	L780 H786 L787 L788	L780-L784 VanDerWaalsContact O-CB 3.26Å; L780-L784 WeakPolarHBondContact O-CB 3.49Å; L780-L784 PolarHBondContact O-N 3.46Å; L784-H786 VanDerWaalsContact C-N 3.34Å; L784-H786 PolarHBondContact O-N 2.8Å; L784-L787 PolarHBondContact O-N 3.09Å; L784-L788 HydrophobicContact CD2-CD1 4.29Å; L784-L788 HydrophobicContact CG-CD1 3.86Å; L784-L788 HydrophobicContact CG-CG 4.35Å; L784-L788 WeakPolarHBondContact O-CB 3.48Å; L784-L788 WeakPolarHBondContact O-CG 3.28Å; L784-L788 PolarHBondContact O-N 3.37Å
785	A	84.2	Confident	82.5	Confident	30 Å²	30	58.6 Å²	58.6	25%	0.248	32%	0.316	C	S	.	.	H	α-helix	trans	-69.1	-28.4	176.4	0	0	0	0	0	113.1	W646 L781 S782 L783 G789	W646-A785 HydrophobicContact CH2-CB 4.17Å; W646-A785 HydrophobicContact CZ3-CB 4.31Å; L781-A785 WeakPolarHBondContact O-CB 3.47Å; L781-A785 PolarHBondContact O-N 3.09Å; S782-A785 CarbonylContact O-C 3.52Å; S782-A785 PolarHBondContact O-N 2.88Å; L783-A785 VanDerWaalsContact C-N 3.33Å; L783-A785 PolarHBondContact O-N 3.2Å; A785-G789 WeakPolarHBondContact O-CA 3.09Å; A785-G789 PolarHBondContact O-N 2.9Å
786	H	84.3	Confident	81.8	Confident	11 Å²	11	55.6 Å²	55.6	5%	0.051	30%	0.299	C	S	.	.	H	α-helix	trans	-72.1	-46.3	172.8	-168.6	87.1	0	0	0	110.7	F639 S782 L783 L784 G789 L790 Y796	F639-H786 HydrophobicContact CD2-CB 3.81Å; F639-H786 AromaticContact CD2-CG 3.92Å; F639-H786 AromaticContact CD2-ND1 3.94Å; F639-H786 HydrophobicContact CE2-CB 4.13Å; S782-H786 WeakPolarHBondContact O-CB 3.35Å; S782-H786 PolarHBondContact O-N 3.44Å; L783-H786 PolarHBondContact O-N 2.92Å; L784-H786 VanDerWaalsContact C-N 3.34Å; L784-H786 PolarHBondContact O-N 2.8Å; H786-G789 WeakPolarHBondContact O-CA 3.41Å; H786-G789 PolarHBondContact O-N 3.01Å; H786-G789 VanDerWaalsContact O-N 3.1Å; H786-L790 WeakPolarHBondContact O-CG 3.45Å; H786-L790 PolarHBondContact O-N 2.99Å; H786-Y796 AromaticContact CE1-CE2 3.7Å; H786-Y796 AromaticContact ND1-CE2 3.75Å
787	L	84	Confident	80.6	Confident	93 Å²	93	52.4 Å²	52.4	49%	0.487	28%	0.278	S	S	.	.	H	α-helix	trans	-63.3	-45	174.6	-67.4	170.2	0	0	0	112.1	L783 L784 G789 L790 L791	L783-L787 HydrophobicContact CG-CD1 4.28Å; L783-L787 WeakPolarHBondContact O-CG 3.05Å; L783-L787 PolarHBondContact O-N 2.78Å; L784-L787 PolarHBondContact O-N 3.09Å; L787-G789 VanDerWaalsContact C-N 3.25Å; L787-G789 PolarHBondContact O-N 2.7Å; L787-L790 PolarHBondContact O-N 2.85Å; L787-L791 WeakPolarHBondContact O-CB 3.5Å; L787-L791 PolarHBondContact O-N 3.32Å
788	L	82.6	Confident	78.9	Confident	80 Å²	80	50.8 Å²	50.8	42%	0.419	27%	0.269	S	S	.	.	H	α-helix	trans	-66.4	-26.2	171.7	-69.4	172.3	0	0	0	112.1	L784 L791 F792	L784-L788 HydrophobicContact CD2-CD1 4.29Å; L784-L788 HydrophobicContact CG-CD1 3.86Å; L784-L788 HydrophobicContact CG-CG 4.35Å; L784-L788 WeakPolarHBondContact O-CB 3.48Å; L784-L788 WeakPolarHBondContact O-CG 3.28Å; L784-L788 PolarHBondContact O-N 3.37Å; L788-L791 PolarHBondContact O-N 2.76Å; L788-F792 HydrophobicContact CB-CD2 4.35Å; L788-F792 HydrophobicContact CD2-CD2 3.78Å; L788-F792 HydrophobicContact CD2-CE2 3.63Å; L788-F792 WeakPolarHBondContact O-CA 3.2Å; L788-F792 VanDerWaalsContact O-CB 3.27Å; L788-F792 WeakPolarHBondContact O-CB 3.34Å; L788-F792 PolarHBondContact O-N 3.27Å
789	G	76.1	Confident	77.1	Confident	13 Å²	13	54.7 Å²	54.7	13%	0.134	29%	0.293	C	S	.	.	H	α-helix	trans	-69.5	-50.9	171.8	0	0	0	0	0	111.6	A785 H786 L787 L791 F792 W793	A785-G789 WeakPolarHBondContact O-CA 3.09Å; A785-G789 PolarHBondContact O-N 2.9Å; H786-G789 WeakPolarHBondContact O-CA 3.41Å; H786-G789 PolarHBondContact O-N 3.01Å; H786-G789 VanDerWaalsContact O-N 3.1Å; L787-G789 VanDerWaalsContact C-N 3.25Å; L787-G789 PolarHBondContact O-N 2.7Å; G789-L791 PolarHBondContact O-N 3.33Å; G789-L791 VanDerWaalsContact O-N 3.12Å; G789-F792 PolarHBondContact O-N 3.31Å; G789-W793 CarbonylContact C-O 3.51Å; G789-W793 WeakPolarHBondContact CA-O 3.49Å; G789-W793 CarbonylContact O-C 3.59Å; G789-W793 WeakPolarHBondContact O-CA 3.32Å; G789-W793 PolarHBondContact O-N 2.95Å
790	L	75.9	Confident	75	Confident	14 Å²	14	59.6 Å²	59.6	7%	0.073	32%	0.315	C	S	.	.	H	α-helix	trans	-55.1	-30.7	172.8	-65.2	168.9	0	0	0	112.1	I200 H786 L787 P807 L808	I200-L790 HydrophobicContact CG2-CD2 3.73Å; I200-L790 VanDerWaalsContact O-CD2 3.26Å; I200-L790 WeakPolarHBondContact O-CD2 3.42Å; H786-L790 WeakPolarHBondContact O-CG 3.45Å; H786-L790 PolarHBondContact O-N 2.99Å; L787-L790 PolarHBondContact O-N 2.85Å; L790-P807 WeakPolarHBondContact O-CG 3.12Å; L790-L808 HydrophobicContact CB-CD1 4.44Å; L790-L808 WeakPolarHBondContact O-CB 3.48Å; L790-L808 WeakPolarHBondContact O-CD1 3.19Å; L790-L808 WeakPolarHBondContact O-CG 3.22Å; L790-L808 PolarHBondContact O-N 3.49Å
791	L	75	Confident	73.1	Confident	85 Å²	85	56.1 Å²	56.1	45%	0.445	31%	0.308	S	S	.	.	H	α-helix	trans	-90.2	-40.2	179.8	-145.8	152.4	0	0	0	113.9	L787 L788 G789 I806	L787-L791 WeakPolarHBondContact O-CB 3.5Å; L787-L791 PolarHBondContact O-N 3.32Å; L788-L791 PolarHBondContact O-N 2.76Å; G789-L791 PolarHBondContact O-N 3.33Å; G789-L791 VanDerWaalsContact O-N 3.12Å; L791-I806 WeakPolarHBondContact O-CA 3.45Å; L791-I806 WeakPolarHBondContact O-CG2 3.31Å
792	F	78.5	Confident	71.6	Confident	109 Å²	109	55.1 Å²	55.1	48%	0.478	31%	0.309	S	S	.	.	H	α-helix	trans	-122.9	-22.8	-170.5	-63.1	-75.1	0	0	0	116.3	L788 G789 I806	L788-F792 HydrophobicContact CB-CD2 4.35Å; L788-F792 HydrophobicContact CD2-CD2 3.78Å; L788-F792 HydrophobicContact CD2-CE2 3.63Å; L788-F792 WeakPolarHBondContact O-CA 3.2Å; L788-F792 VanDerWaalsContact O-CB 3.27Å; L788-F792 WeakPolarHBondContact O-CB 3.34Å; L788-F792 PolarHBondContact O-N 3.27Å; G789-F792 PolarHBondContact O-N 3.31Å; F792-I806 HydrophobicContact CD1-CG2 4.43Å; F792-I806 PolarHBondContact O-N 2.88Å
793	W	73.9	Confident	70.4	Confident	84 Å²	84	59.9 Å²	59.9	32%	0.318	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-154.8	110.6	178.6	-179.2	-82.5	0	0	0	113.4	G789 A795 R804 L805 W1647	G789-W793 CarbonylContact C-O 3.51Å; G789-W793 WeakPolarHBondContact CA-O 3.49Å; G789-W793 CarbonylContact O-C 3.59Å; G789-W793 WeakPolarHBondContact O-CA 3.32Å; G789-W793 PolarHBondContact O-N 2.95Å; W793-A795 PolarHBondContact O-N 3.04Å; W793-R804 CarbonylContact C-O 3.6Å; W793-R804 VanDerWaalsContact CA-O 3.25Å; W793-R804 WeakPolarHBondContact CA-O 3.47Å; W793-R804 HydrophobicContact CD2-CB 4.17Å; W793-R804 HydrophobicContact CE3-CB 4.17Å; W793-R804 HydrophobicContact CH2-CB 3.75Å; W793-R804 HydrophobicContact CZ2-CB 3.72Å; W793-R804 HydrophobicContact CZ2-CG 4.35Å; W793-R804 HydrophobicContact CZ3-CB 3.98Å; W793-L805 HydrophobicContact CE3-CD2 3.66Å; W793-L805 HydrophobicContact CE3-CG 3.83Å; W793-L805 HydrophobicContact CZ3-CD1 4.49Å; W793-L805 HydrophobicContact CZ3-CD2 3.99Å; W793-L805 HydrophobicContact CZ3-CG 3.82Å; W793-W1647 HydrophobicContact CB-CZ2 4.23Å; W793-W1647 AromaticContact CD1-CE2 3.85Å; W793-W1647 AromaticContact CD1-NE1 3.04Å; W793-W1647 HydrophobicContact CG-CZ2 4.16Å; W793-W1647 AromaticContact CG-NE1 3.84Å; W793-W1647 AromaticContact NE1-CD1 3.93Å; W793-W1647 AromaticContact NE1-NE1 3.21Å
794	N	72.4	Confident	69.4	Low	10 Å²	10	59.5 Å²	59.5	5%	0.053	33%	0.328	C	S	.	.			trans	-76	99.3	173.4	-154.1	-17.4	0	0	0	110	R635 Y796 T797 R804 P807	R635-N794 PolarHBondContact NH1-OD1 2.81Å; N794-Y796 PolarHBondContact O-N 3.31Å; N794-Y796 PolarHBondContact OD1-N 3.03Å; N794-Y796 PolarHBondContact OD1-O 2.84Å; N794-T797 HydrophobicContact CB-CG2 3.63Å; N794-T797 WeakPolarHBondContact ND2-CG2 3.36Å; N794-R804 PolarHBondContact N-O 3.12Å; N794-P807 HydrophobicContact CB-CB 3.82Å; N794-P807 HydrophobicContact CB-CG 3.75Å
795	A	67.3	Low	68.3	Low	15 Å²	15	60.4 Å²	60.4	12%	0.124	33%	0.333	C	S	.	.	S	Bend	trans	-69.7	-12.8	173.1	0	0	0	0	0	113	W793 C1645	W793-A795 PolarHBondContact O-N 3.04Å; A795-C1645 PolarHBondContact O-SG 3.41Å
796	Y	71.7	Confident	67.9	Low	30 Å²	30	62.2 Å²	62.2	12%	0.118	34%	0.338	C	S	.	.			trans	-123.8	61.3	-170.6	-37.1	-68.5	0	0	0	111.2	F478 W634 R635 V638 H786 N794	F478-Y796 HydrophobicContact CD1-CD1 4.5Å; F478-Y796 HydrophobicContact CE1-CD1 4.13Å; F478-Y796 HydrophobicContact CZ-CD1 4.48Å; W634-Y796 HydrophobicContact CZ3-CG 4.42Å; R635-Y796 PolarHBondContact NH2-O 3.08Å; V638-Y796 HydrophobicContact CG1-CD1 3.69Å; V638-Y796 HydrophobicContact CG1-CE1 3.31Å; H786-Y796 AromaticContact CE1-CE2 3.7Å; H786-Y796 AromaticContact ND1-CE2 3.75Å; N794-Y796 PolarHBondContact O-N 3.31Å; N794-Y796 PolarHBondContact OD1-N 3.03Å; N794-Y796 PolarHBondContact OD1-O 2.84Å
797	T	63.6	Low	67.3	Low	13 Å²	13	61.9 Å²	61.9	8%	0.08	34%	0.336	C	S	.	.			trans	-115.9	126.4	171.4	53.5	0	0	0	0	109.5	N794 R804	N794-T797 HydrophobicContact CB-CG2 3.63Å; N794-T797 WeakPolarHBondContact ND2-CG2 3.36Å; T797-R804 PolarHBondContact O-NH2 2.88Å; T797-R804 WeakPolarHBondContact OG1-CG 3.42Å; T797-R804 PolarHBondContact OG1-NE 3.09Å
798	P	53	Low	66.9	Low	22 Å²	22	58.7 Å²	58.7	14%	0.143	32%	0.319	C	S	.	.			trans	-58.7	155.2	175.5	25.3	-33.8	0	0	0	111.9	D475 E476 L800	D475-P798 HydrophobicContact CB-CB 4.3Å; E476-P798 HydrophobicContact CG-CB 4.07Å; P798-L800 PolarHBondContact O-N 3.39Å
799	V	50.4	Low	66.7	Low	95 Å²	95	60.2 Å²	60.2	58%	0.576	32%	0.323	S	S	*	.	S	Bend	trans	-55.3	-23.4	-171.4	-170.6	0	0	0	0	113.8
800	L	42	Very low	66.9	Low	164 Å²	164	60.8 Å²	60.8	86%	0.859	32%	0.322	S	S	*	.	S	Bend	trans	-110.6	74	179	-81.3	68.1	0	0	0	112.4	P798	P798-L800 PolarHBondContact O-N 3.39Å
801	G	49.6	Very low	67	Low	46 Å²	46	60.6 Å²	60.6	47%	0.474	32%	0.321	S	S	.	.	S	Bend	trans	157.5	141.5	158.9	0	0	0	0	0	118.3
802	S	55.7	Low	67.4	Low	75 Å²	75	60.6 Å²	60.6	52%	0.524	32%	0.321	S	S	.	.	S	Bend	trans	63.2	167.2	175.8	-133.5	0	0	0	0	116.6	E810	S802-E810 VanDerWaalsContact OG-CD 3.26Å; S802-E810 PolarHBondContact OG-OE2 3.45Å
803	N	61.5	Low	67.6	Low	105 Å²	105	60 Å²	60	56%	0.561	32%	0.318	S	S	*	.			trans	-76.5	149.3	171.8	-63.8	-72.5	0	0	0	110.1	E810	N803-E810 PolarHBondContact N-OE2 3.42Å; N803-E810 PolarHBondContact ND2-OE1 3.37Å
804	R	66.6	Low	68.1	Low	63 Å²	63	61.1 Å²	61.1	24%	0.238	32%	0.323	C	S	.	.	S	Bend	trans	-83.3	-15.4	175.5	-69	-175.1	172.9	176.4	-3.2	113.4	W793 N794 T797 S1643	W793-R804 CarbonylContact C-O 3.6Å; W793-R804 VanDerWaalsContact CA-O 3.25Å; W793-R804 WeakPolarHBondContact CA-O 3.47Å; W793-R804 HydrophobicContact CD2-CB 4.17Å; W793-R804 HydrophobicContact CE3-CB 4.17Å; W793-R804 HydrophobicContact CH2-CB 3.75Å; W793-R804 HydrophobicContact CZ2-CB 3.72Å; W793-R804 HydrophobicContact CZ2-CG 4.35Å; W793-R804 HydrophobicContact CZ3-CB 3.98Å; N794-R804 PolarHBondContact N-O 3.12Å; T797-R804 PolarHBondContact O-NH2 2.88Å; T797-R804 WeakPolarHBondContact OG1-CG 3.42Å; T797-R804 PolarHBondContact OG1-NE 3.09Å; R804-S1643 PolarHBondContact NH2-OG 3.28Å
805	L	66.4	Low	68.5	Low	112 Å²	112	61.9 Å²	61.9	59%	0.586	33%	0.326	S	S	*	.	B	Isolated β-bridge	trans	-89.4	131.8	-174.3	-79.5	159.6	0	0	0	112.1	W793	W793-L805 HydrophobicContact CE3-CD2 3.66Å; W793-L805 HydrophobicContact CE3-CG 3.83Å; W793-L805 HydrophobicContact CZ3-CD1 4.49Å; W793-L805 HydrophobicContact CZ3-CD2 3.99Å; W793-L805 HydrophobicContact CZ3-CG 3.82Å
806	I	75	Confident	69.3	Low	68 Å²	68	64.8 Å²	64.8	35%	0.349	34%	0.336	S	S	.	.	S	Bend	trans	51.4	56.3	172.3	-31.9	-177.4	0	0	0	113.3	L791 F792 L808 F809 E810	L791-I806 WeakPolarHBondContact O-CA 3.45Å; L791-I806 WeakPolarHBondContact O-CG2 3.31Å; F792-I806 HydrophobicContact CD1-CG2 4.43Å; F792-I806 PolarHBondContact O-N 2.88Å; I806-L808 PolarHBondContact O-N 3.3Å; I806-F809 HydrophobicContact CB-CB 4.15Å; I806-F809 HydrophobicContact CG2-CB 3.37Å; I806-F809 HydrophobicContact CG2-CG 4.22Å; I806-F809 CarbonylContact O-C 2.8Å; I806-F809 WeakPolarHBondContact O-CA 3.46Å; I806-F809 WeakPolarHBondContact O-CB 3.44Å; I806-F809 PolarHBondContact O-N 3.31Å; I806-E810 PolarHBondContact O-N 3.24Å
807	P	71.8	Confident	70	Confident	4 Å²	4	66.1 Å²	66.1	3%	0.026	35%	0.345	C	S	.	.	H	α-helix	trans	-70.4	-34.8	-161.4	34	-41.3	0	0	0	113.5	I200 L790 N794 F809 E810 I811	I200-P807 HydrophobicContact CD1-CB 3.79Å; I200-P807 HydrophobicContact CD1-CG 4.34Å; L790-P807 WeakPolarHBondContact O-CG 3.12Å; N794-P807 HydrophobicContact CB-CB 3.82Å; N794-P807 HydrophobicContact CB-CG 3.75Å; P807-F809 VanDerWaalsContact C-N 3.26Å; P807-F809 PolarHBondContact O-N 3.1Å; P807-E810 PolarHBondContact O-N 2.85Å; P807-I811 WeakPolarHBondContact O-CG1 3.36Å; P807-I811 PolarHBondContact O-N 3.25Å
808	L	75.5	Confident	71.1	Confident	25 Å²	25	69.4 Å²	69.4	13%	0.131	36%	0.362	C	S	.	.	H	α-helix	trans	-61.6	-35.8	170.1	-95.7	170.9	0	0	0	111.8	I200 F201 L790 I806 I812	I200-L808 HydrophobicContact CG2-CD2 4.31Å; I200-L808 HydrophobicContact CG2-CG 4.13Å; F201-L808 HydrophobicContact CE2-CD2 3.87Å; F201-L808 HydrophobicContact CZ-CD1 4.05Å; F201-L808 HydrophobicContact CZ-CD2 4.05Å; L790-L808 HydrophobicContact CB-CD1 4.44Å; L790-L808 WeakPolarHBondContact O-CB 3.48Å; L790-L808 WeakPolarHBondContact O-CD1 3.19Å; L790-L808 WeakPolarHBondContact O-CG 3.22Å; L790-L808 PolarHBondContact O-N 3.49Å; I806-L808 PolarHBondContact O-N 3.3Å; L808-I812 HydrophobicContact CD2-CD1 4.11Å; L808-I812 VanDerWaalsContact O-CB 3.27Å; L808-I812 WeakPolarHBondContact O-CB 3.44Å; L808-I812 VanDerWaalsContact O-CG1 3.23Å; L808-I812 WeakPolarHBondContact O-CG1 3.24Å; L808-I812 PolarHBondContact O-N 3.43Å
809	F	79.6	Confident	72.5	Confident	113 Å²	113	70.4 Å²	70.4	50%	0.496	36%	0.364	S	S	.	.	H	α-helix	trans	-78	-31.9	176.3	-161.7	-91.8	0	0	0	111.8	I806 P807 F813 Y814	I806-F809 HydrophobicContact CB-CB 4.15Å; I806-F809 HydrophobicContact CG2-CB 3.37Å; I806-F809 HydrophobicContact CG2-CG 4.22Å; I806-F809 CarbonylContact O-C 2.8Å; I806-F809 WeakPolarHBondContact O-CA 3.46Å; I806-F809 WeakPolarHBondContact O-CB 3.44Å; I806-F809 PolarHBondContact O-N 3.31Å; P807-F809 VanDerWaalsContact C-N 3.26Å; P807-F809 PolarHBondContact O-N 3.1Å; F809-F813 HydrophobicContact CD1-CB 3.68Å; F809-F813 HydrophobicContact CD1-CG 4.22Å; F809-F813 HydrophobicContact CD2-CB 4.33Å; F809-F813 HydrophobicContact CD2-CD2 4.46Å; F809-F813 HydrophobicContact CE1-CB 3.57Å; F809-F813 HydrophobicContact CE1-CD1 4.05Å; F809-F813 AromaticContact CE1-CD2 3.91Å; F809-F813 HydrophobicContact CE1-CD2 3.91Å; F809-F813 AromaticContact CE1-CG 3.57Å; F809-F813 HydrophobicContact CE1-CG 3.57Å; F809-F813 HydrophobicContact CE2-CB 4.24Å; F809-F813 AromaticContact CE2-CD2 3.66Å; F809-F813 HydrophobicContact CE2-CD2 3.66Å; F809-F813 HydrophobicContact CE2-CE2 4.31Å; F809-F813 HydrophobicContact CE2-CG 4.14Å; F809-F813 HydrophobicContact CG-CB 4.07Å; F809-F813 HydrophobicContact CZ-CB 3.87Å; F809-F813 HydrophobicContact CZ-CD1 4.2Å; F809-F813 AromaticContact CZ-CD2 3.33Å; F809-F813 HydrophobicContact CZ-CD2 3.33Å; F809-F813 AromaticContact CZ-CE2 3.84Å; F809-F813 HydrophobicContact CZ-CE2 3.84Å; F809-F813 AromaticContact CZ-CG 3.53Å; F809-F813 HydrophobicContact CZ-CG 3.53Å; F809-F813 HydrophobicContact CZ-CZ 4.46Å; F809-F813 VanDerWaalsContact O-CA 3.27Å; F809-F813 WeakPolarHBondContact O-CA 3.38Å; F809-F813 WeakPolarHBondContact O-CB 3.38Å; F809-F813 PolarHBondContact O-N 3.29Å; F809-Y814 PolarHBondContact O-N 2.73Å
810	E	80.2	Confident	74.2	Confident	24 Å²	24	66.2 Å²	66.2	11%	0.112	34%	0.339	C	S	.	.	I	π-helix	trans	-63.3	-42.5	169.3	-172.4	172.6	-140.6	0	0	110.6	S802 N803 I806 P807 Y814 Q815	S802-E810 VanDerWaalsContact OG-CD 3.26Å; S802-E810 PolarHBondContact OG-OE2 3.45Å; N803-E810 PolarHBondContact N-OE2 3.42Å; N803-E810 PolarHBondContact ND2-OE1 3.37Å; I806-E810 PolarHBondContact O-N 3.24Å; P807-E810 PolarHBondContact O-N 2.85Å; E810-Y814 HydrophobicContact CG-CD1 3.97Å; E810-Y814 CarbonylContact O-C 3.32Å; E810-Y814 VanDerWaalsContact O-CA 3.22Å; E810-Y814 WeakPolarHBondContact O-CA 3.28Å; E810-Y814 WeakPolarHBondContact O-CB 3.33Å; E810-Y814 PolarHBondContact O-N 2.89Å; E810-Q815 PolarHBondContact O-N 3.18Å
811	I	76.8	Confident	76.4	Confident	11 Å²	11	60.7 Å²	60.7	6%	0.056	31%	0.312	C	S	.	.	I	π-helix	trans	-72	-50.9	177	-60.8	-176.9	0	0	0	111.5	S196 I197 I200 P807 Q815 F816	S196-I811 WeakPolarHBondContact O-CD1 3.11Å; I197-I811 HydrophobicContact CD1-CG2 4.37Å; I197-I811 HydrophobicContact CG1-CG2 3.57Å; I200-I811 HydrophobicContact CD1-CD1 3.34Å; I200-I811 HydrophobicContact CD1-CG1 4.18Å; I200-I811 HydrophobicContact CG1-CD1 3.7Å; P807-I811 WeakPolarHBondContact O-CG1 3.36Å; P807-I811 PolarHBondContact O-N 3.25Å; I811-Q815 HydrophobicContact CG2-CB 4.47Å; I811-Q815 WeakPolarHBondContact O-CB 3.41Å; I811-Q815 PolarHBondContact O-N 3.5Å; I811-F816 PolarHBondContact O-N 2.86Å
812	I	83	Confident	78.3	Confident	84 Å²	84	61.2 Å²	61.2	43%	0.431	31%	0.306	S	S	.	.	I	π-helix	trans	-69	-43.2	-176.8	-65.8	167.4	0	0	0	111.5	L808 F816 L817	L808-I812 HydrophobicContact CD2-CD1 4.11Å; L808-I812 VanDerWaalsContact O-CB 3.27Å; L808-I812 WeakPolarHBondContact O-CB 3.44Å; L808-I812 VanDerWaalsContact O-CG1 3.23Å; L808-I812 WeakPolarHBondContact O-CG1 3.24Å; L808-I812 PolarHBondContact O-N 3.43Å; I812-F816 WeakPolarHBondContact O-CB 3.36Å; I812-L817 VanDerWaalsContact O-CB 3.3Å; I812-L817 WeakPolarHBondContact O-CB 3.33Å; I812-L817 PolarHBondContact O-N 3.4Å
813	F	84.7	Confident	79.9	Confident	97 Å²	97	58 Å²	58	43%	0.425	28%	0.283	S	S	.	.	I	π-helix	trans	-95.3	-33.8	-172.4	-144.7	-80.8	0	0	0	113.3	F809 L817 L818	F809-F813 HydrophobicContact CD1-CB 3.68Å; F809-F813 HydrophobicContact CD1-CG 4.22Å; F809-F813 HydrophobicContact CD2-CB 4.33Å; F809-F813 HydrophobicContact CD2-CD2 4.46Å; F809-F813 HydrophobicContact CE1-CB 3.57Å; F809-F813 HydrophobicContact CE1-CD1 4.05Å; F809-F813 AromaticContact CE1-CD2 3.91Å; F809-F813 HydrophobicContact CE1-CD2 3.91Å; F809-F813 AromaticContact CE1-CG 3.57Å; F809-F813 HydrophobicContact CE1-CG 3.57Å; F809-F813 HydrophobicContact CE2-CB 4.24Å; F809-F813 AromaticContact CE2-CD2 3.66Å; F809-F813 HydrophobicContact CE2-CD2 3.66Å; F809-F813 HydrophobicContact CE2-CE2 4.31Å; F809-F813 HydrophobicContact CE2-CG 4.14Å; F809-F813 HydrophobicContact CG-CB 4.07Å; F809-F813 HydrophobicContact CZ-CB 3.87Å; F809-F813 HydrophobicContact CZ-CD1 4.2Å; F809-F813 AromaticContact CZ-CD2 3.33Å; F809-F813 HydrophobicContact CZ-CD2 3.33Å; F809-F813 AromaticContact CZ-CE2 3.84Å; F809-F813 HydrophobicContact CZ-CE2 3.84Å; F809-F813 AromaticContact CZ-CG 3.53Å; F809-F813 HydrophobicContact CZ-CG 3.53Å; F809-F813 HydrophobicContact CZ-CZ 4.46Å; F809-F813 VanDerWaalsContact O-CA 3.27Å; F809-F813 WeakPolarHBondContact O-CA 3.38Å; F809-F813 WeakPolarHBondContact O-CB 3.38Å; F809-F813 PolarHBondContact O-N 3.29Å; F813-L817 HydrophobicContact CD1-CD2 4.14Å; F813-L817 HydrophobicContact CD2-CD2 3.95Å; F813-L817 HydrophobicContact CE1-CD2 3.94Å; F813-L817 HydrophobicContact CE2-CD2 3.76Å; F813-L817 HydrophobicContact CG-CD2 4.15Å; F813-L817 HydrophobicContact CZ-CD2 3.75Å; F813-L817 WeakPolarHBondContact O-CB 3.35Å; F813-L818 WeakPolarHBondContact O-CB 3.48Å; F813-L818 PolarHBondContact O-N 2.95Å
814	Y	83.6	Confident	81.2	Confident	107 Å²	107	56.5 Å²	56.5	42%	0.42	27%	0.271	S	S	.	.	I	π-helix	trans	-96.1	-46.3	177.7	173.1	-105.5	0	0	0	113.3	F809 E810 L818 K819	F809-Y814 PolarHBondContact O-N 2.73Å; E810-Y814 HydrophobicContact CG-CD1 3.97Å; E810-Y814 CarbonylContact O-C 3.32Å; E810-Y814 VanDerWaalsContact O-CA 3.22Å; E810-Y814 WeakPolarHBondContact O-CA 3.28Å; E810-Y814 WeakPolarHBondContact O-CB 3.33Å; E810-Y814 PolarHBondContact O-N 2.89Å; Y814-L818 HydrophobicContact CD2-CB 4.22Å; Y814-L818 HydrophobicContact CD2-CD2 3.82Å; Y814-L818 HydrophobicContact CE2-CD2 4.2Å; Y814-L818 CarbonylContact O-C 3.37Å; Y814-L818 VanDerWaalsContact O-CB 3.25Å; Y814-L818 WeakPolarHBondContact O-CB 3.47Å; Y814-L818 PolarHBondContact O-N 3.19Å; Y814-K819 HydrophobicContact CD1-CD 4.14Å; Y814-K819 HydrophobicContact CE1-CD 3.66Å; Y814-K819 HydrophobicContact CE1-CG 4.4Å; Y814-K819 HydrophobicContact CE2-CD 4.3Å; Y814-K819 HydrophobicContact CE2-CG 4.19Å; Y814-K819 VanDerWaalsContact O-CG 3.29Å; Y814-K819 WeakPolarHBondContact O-CG 3.27Å; Y814-K819 PolarHBondContact O-N 3.39Å
815	Q	80.2	Confident	82.4	Confident	27 Å²	27	59.9 Å²	59.9	13%	0.126	29%	0.288	C	S	.	.	I	π-helix	trans	-77.7	-56.9	179.1	-57.9	-177.2	-1.6	0	0	112.7	A193 E810 I811 K819 S820	A193-Q815 HydrophobicContact CB-CB 3.92Å; E810-Q815 PolarHBondContact O-N 3.18Å; I811-Q815 HydrophobicContact CG2-CB 4.47Å; I811-Q815 WeakPolarHBondContact O-CB 3.41Å; I811-Q815 PolarHBondContact O-N 3.5Å; Q815-K819 CarbonylContact O-C 3.5Å; Q815-K819 WeakPolarHBondContact O-CB 3.31Å; Q815-K819 PolarHBondContact O-N 2.75Å; Q815-S820 PolarHBondContact O-N 2.91Å; Q815-S820 VanDerWaalsContact O-N 3.1Å
816	F	84.4	Confident	83.4	Confident	76 Å²	76	57.1 Å²	57.1	33%	0.333	28%	0.275	S	S	.	.	I	π-helix	trans	-72.2	-60.4	-178.7	179	-89.6	0	0	0	111.3	L190 A193 I811 I812 S820 V821	L190-F816 HydrophobicContact CD1-CD2 3.66Å; L190-F816 HydrophobicContact CD1-CE2 3.54Å; A193-F816 HydrophobicContact CB-CB 4.01Å; I811-F816 PolarHBondContact O-N 2.86Å; I812-F816 WeakPolarHBondContact O-CB 3.36Å; F816-S820 VanDerWaalsContact O-CB 3.27Å; F816-S820 WeakPolarHBondContact O-CB 3.39Å; F816-S820 PolarHBondContact O-N 3.07Å; F816-V821 HydrophobicContact CD1-CG2 4.47Å; F816-V821 HydrophobicContact CE1-CG2 4.16Å; F816-V821 HydrophobicContact CZ-CG2 4.46Å; F816-V821 PolarHBondContact O-N 2.79Å
817	L	87	Confident	84.1	Confident	58 Å²	58	53.9 Å²	53.9	30%	0.304	26%	0.259	S	S	.	.	I	π-helix	trans	-71.4	-52.1	-176.9	-167.4	73.1	0	0	0	112.1	I812 F813 V821 V822	I812-L817 VanDerWaalsContact O-CB 3.3Å; I812-L817 WeakPolarHBondContact O-CB 3.33Å; I812-L817 PolarHBondContact O-N 3.4Å; F813-L817 HydrophobicContact CD1-CD2 4.14Å; F813-L817 HydrophobicContact CD2-CD2 3.95Å; F813-L817 HydrophobicContact CE1-CD2 3.94Å; F813-L817 HydrophobicContact CE2-CD2 3.76Å; F813-L817 HydrophobicContact CG-CD2 4.15Å; F813-L817 HydrophobicContact CZ-CD2 3.75Å; F813-L817 WeakPolarHBondContact O-CB 3.35Å; L817-V821 HydrophobicContact CD1-CB 4.39Å; L817-V821 PolarHBondContact O-N 2.84Å; L817-V822 HydrophobicContact CG-CG2 4.24Å; L817-V822 WeakPolarHBondContact O-CB 3.22Å; L817-V822 VanDerWaalsContact O-CG2 3.31Å; L817-V822 WeakPolarHBondContact O-CG2 3.43Å; L817-V822 PolarHBondContact O-N 3.18Å
818	L	86	Confident	84.8	Confident	82 Å²	82	56 Å²	56	43%	0.429	27%	0.272	S	S	.	.	I	π-helix	trans	-76.6	-54.2	-174.7	-144.5	82.1	0	0	0	114.1	F813 Y814 V822 Q823	F813-L818 WeakPolarHBondContact O-CB 3.48Å; F813-L818 PolarHBondContact O-N 2.95Å; Y814-L818 HydrophobicContact CD2-CB 4.22Å; Y814-L818 HydrophobicContact CD2-CD2 3.82Å; Y814-L818 HydrophobicContact CE2-CD2 4.2Å; Y814-L818 CarbonylContact O-C 3.37Å; Y814-L818 VanDerWaalsContact O-CB 3.25Å; Y814-L818 WeakPolarHBondContact O-CB 3.47Å; Y814-L818 PolarHBondContact O-N 3.19Å; L818-V822 HydrophobicContact CD1-CG1 4.44Å; L818-Q823 VanDerWaalsContact O-CB 3.31Å; L818-Q823 WeakPolarHBondContact O-CB 3.19Å; L818-Q823 PolarHBondContact O-N 2.99Å
819	K	83.3	Confident	85.6	Confident	42 Å²	42	58.7 Å²	58.7	18%	0.183	29%	0.285	C	S	.	.	I	π-helix	trans	-82	-18.2	-174.1	-64.6	172.1	101.2	-155.3	0	114.7	E189 Y814 Q815 Q823	E189-K819 HydrophobicContact CB-CB 4.24Å; E189-K819 HydrophobicContact CG-CB 4.2Å; E189-K819 IonicContact OE1-NZ 2.71Å; E189-K819 VanDerWaalsContact OE2-CE 3.24Å; E189-K819 WeakPolarHBondContact OE2-CE 3.45Å; E189-K819 IonicContact OE2-NZ 2.7Å; E189-K819 PolarHBondContact OE2-NZ 3.02Å; Y814-K819 HydrophobicContact CD1-CD 4.14Å; Y814-K819 HydrophobicContact CE1-CD 3.66Å; Y814-K819 HydrophobicContact CE1-CG 4.4Å; Y814-K819 HydrophobicContact CE2-CD 4.3Å; Y814-K819 HydrophobicContact CE2-CG 4.19Å; Y814-K819 VanDerWaalsContact O-CG 3.29Å; Y814-K819 WeakPolarHBondContact O-CG 3.27Å; Y814-K819 PolarHBondContact O-N 3.39Å; Q815-K819 CarbonylContact O-C 3.5Å; Q815-K819 WeakPolarHBondContact O-CB 3.31Å; Q815-K819 PolarHBondContact O-N 2.75Å; K819-Q823 VanDerWaalsContact O-CB 3.25Å; K819-Q823 WeakPolarHBondContact O-CB 3.24Å; K819-Q823 VanDerWaalsContact O-CD 3.29Å; K819-Q823 PolarHBondContact O-OE1 3.11Å
820	S	85.5	Confident	86	Confident	7 Å²	7	54.2 Å²	54.2	5%	0.049	27%	0.268	C	S	.	.	I	π-helix	trans	-103.6	-76.1	169.3	-169.9	0	0	0	0	111.9	S186 L190 Q815 F816 Q823 F824	S186-S820 WeakPolarHBondContact O-CB 3.4Å; S186-S820 PolarHBondContact O-OG 3.42Å; L190-S820 WeakPolarHBondContact CB-OG 3.34Å; Q815-S820 PolarHBondContact O-N 2.91Å; Q815-S820 VanDerWaalsContact O-N 3.1Å; F816-S820 VanDerWaalsContact O-CB 3.27Å; F816-S820 WeakPolarHBondContact O-CB 3.39Å; F816-S820 PolarHBondContact O-N 3.07Å; S820-Q823 PolarHBondContact O-N 3.04Å; S820-F824 VanDerWaalsContact O-CB 3.25Å; S820-F824 WeakPolarHBondContact O-CB 3.31Å; S820-F824 PolarHBondContact O-N 3.37Å
821	V	87.6	Confident	86.2	Confident	49 Å²	49	53.4 Å²	53.4	30%	0.297	27%	0.265	S	S	.	.	I	π-helix	trans	-63.4	-54.4	-167.7	-178.4	0	0	0	0	112.5	F816 L817 F824 F825	F816-V821 HydrophobicContact CD1-CG2 4.47Å; F816-V821 HydrophobicContact CE1-CG2 4.16Å; F816-V821 HydrophobicContact CZ-CG2 4.46Å; F816-V821 PolarHBondContact O-N 2.79Å; L817-V821 HydrophobicContact CD1-CB 4.39Å; L817-V821 PolarHBondContact O-N 2.84Å; V821-F824 PolarHBondContact O-N 2.97Å; V821-F825 HydrophobicContact CG1-CD2 4.08Å; V821-F825 HydrophobicContact CG1-CE2 3.92Å; V821-F825 WeakPolarHBondContact O-CD2 3.46Å; V821-F825 PolarHBondContact O-N 3.33Å
822	V	89.3	Confident	86.8	Confident	56 Å²	56	59.2 Å²	59.2	34%	0.339	29%	0.291	S	S	.	.	I	π-helix	trans	-69.4	-42	-179.9	174.8	0	0	0	0	110.4	L817 L818 F824 F825 V826	L817-V822 HydrophobicContact CG-CG2 4.24Å; L817-V822 WeakPolarHBondContact O-CB 3.22Å; L817-V822 VanDerWaalsContact O-CG2 3.31Å; L817-V822 WeakPolarHBondContact O-CG2 3.43Å; L817-V822 PolarHBondContact O-N 3.18Å; L818-V822 HydrophobicContact CD1-CG1 4.44Å; V822-F824 VanDerWaalsContact C-N 3.3Å; V822-F824 PolarHBondContact O-N 3.08Å; V822-F825 PolarHBondContact O-N 3.31Å; V822-V826 HydrophobicContact CG1-CG2 3.72Å; V822-V826 WeakPolarHBondContact O-CB 3.49Å; V822-V826 WeakPolarHBondContact O-CG2 3.38Å; V822-V826 PolarHBondContact O-N 3.19Å
823	Q	89	Confident	87.1	Confident	9 Å²	9	59.4 Å²	59.4	4%	0.042	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-37.9	174.6	176.2	171.3	-47.3	0	0	112.3	F181 S182 L818 K819 S820 S827	F181-Q823 HydrophobicContact CD1-CG 4.48Å; F181-Q823 HydrophobicContact CD2-CG 3.87Å; F181-Q823 VanDerWaalsContact CD2-OE1 3.3Å; F181-Q823 HydrophobicContact CE1-CG 4.21Å; F181-Q823 HydrophobicContact CE2-CB 4.07Å; F181-Q823 HydrophobicContact CE2-CG 3.57Å; F181-Q823 HydrophobicContact CG-CG 4.33Å; F181-Q823 HydrophobicContact CZ-CB 4.26Å; F181-Q823 HydrophobicContact CZ-CG 3.76Å; S182-Q823 PolarHBondContact O-NE2 3.41Å; L818-Q823 VanDerWaalsContact O-CB 3.31Å; L818-Q823 WeakPolarHBondContact O-CB 3.19Å; L818-Q823 PolarHBondContact O-N 2.99Å; K819-Q823 VanDerWaalsContact O-CB 3.25Å; K819-Q823 WeakPolarHBondContact O-CB 3.24Å; K819-Q823 VanDerWaalsContact O-CD 3.29Å; K819-Q823 PolarHBondContact O-OE1 3.11Å; S820-Q823 PolarHBondContact O-N 3.04Å; Q823-S827 WeakPolarHBondContact O-CB 3.48Å; Q823-S827 PolarHBondContact O-N 3.25Å; Q823-S827 PolarHBondContact O-OG 3.48Å
824	F	89.6	Confident	87.4	Confident	72 Å²	72	58.8 Å²	58.8	32%	0.316	29%	0.292	S	S	.	.	H	α-helix	trans	-60.9	-57.6	174.6	-180	-92.8	0	0	0	110.3	I183 S820 V821 V822 V826 S827 V828	I183-F824 HydrophobicContact CG2-CD2 4.07Å; I183-F824 HydrophobicContact CG2-CE2 3.82Å; S820-F824 VanDerWaalsContact O-CB 3.25Å; S820-F824 WeakPolarHBondContact O-CB 3.31Å; S820-F824 PolarHBondContact O-N 3.37Å; V821-F824 PolarHBondContact O-N 2.97Å; V822-F824 VanDerWaalsContact C-N 3.3Å; V822-F824 PolarHBondContact O-N 3.08Å; F824-V826 PolarHBondContact O-N 3.05Å; F824-S827 PolarHBondContact O-N 2.74Å; F824-S827 PolarHBondContact O-OG 2.65Å; F824-V828 HydrophobicContact CE1-CG2 4.47Å; F824-V828 WeakPolarHBondContact O-CG2 3.34Å; F824-V828 PolarHBondContact O-N 3.3Å
825	F	91.2	Very high	87.7	Confident	134 Å²	134	54 Å²	54	59%	0.588	27%	0.274	S	S	*	.	H	α-helix	trans	-63.5	-38.8	-179.9	-70.6	-63	0	0	0	113.1	V821 V822 L829	V821-F825 HydrophobicContact CG1-CD2 4.08Å; V821-F825 HydrophobicContact CG1-CE2 3.92Å; V821-F825 WeakPolarHBondContact O-CD2 3.46Å; V821-F825 PolarHBondContact O-N 3.33Å; V822-F825 PolarHBondContact O-N 3.31Å; F825-L829 WeakPolarHBondContact O-CB 3.23Å; F825-L829 PolarHBondContact O-N 2.89Å
826	V	89.2	Confident	88.2	Confident	54 Å²	54	55.3 Å²	55.3	33%	0.327	29%	0.285	S	S	.	.	H	α-helix	trans	-71.2	-37.6	177.8	171.1	0	0	0	0	111.7	F181 V822 F824 L829 C830	F181-V826 HydrophobicContact CE1-CG1 4.44Å; F181-V826 HydrophobicContact CZ-CG1 4.12Å; V822-V826 HydrophobicContact CG1-CG2 3.72Å; V822-V826 WeakPolarHBondContact O-CB 3.49Å; V822-V826 WeakPolarHBondContact O-CG2 3.38Å; V822-V826 PolarHBondContact O-N 3.19Å; F824-V826 PolarHBondContact O-N 3.05Å; V826-L829 PolarHBondContact O-N 3.34Å; V826-C830 WeakPolarHBondContact O-CB 3.36Å; V826-C830 PolarHBondContact O-N 2.95Å; V826-C830 PolarHBondContact O-SG 3.38Å
827	S	88.2	Confident	88.5	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-69.2	-38.8	176	58.4	0	0	0	0	111.8	I183 Q823 F824 C830 A831	I183-S827 WeakPolarHBondContact CG1-OG 3.3Å; Q823-S827 WeakPolarHBondContact O-CB 3.48Å; Q823-S827 PolarHBondContact O-N 3.25Å; Q823-S827 PolarHBondContact O-OG 3.48Å; F824-S827 PolarHBondContact O-N 2.74Å; F824-S827 PolarHBondContact O-OG 2.65Å; S827-C830 PolarHBondContact O-N 2.65Å; S827-A831 VanDerWaalsContact O-CB 3.26Å; S827-A831 WeakPolarHBondContact O-CB 3.37Å; S827-A831 PolarHBondContact O-N 3.22Å
828	V	88.1	Confident	88.7	Confident	50 Å²	50	60.2 Å²	60.2	30%	0.303	30%	0.303	S	S	.	.	H	α-helix	trans	-61.5	-50.8	170.2	172.6	0	0	0	0	111	I183 F824 C830 A831 F832	I183-V828 HydrophobicContact CD1-CG2 3.79Å; I183-V828 HydrophobicContact CG1-CG2 4.02Å; F824-V828 HydrophobicContact CE1-CG2 4.47Å; F824-V828 WeakPolarHBondContact O-CG2 3.34Å; F824-V828 PolarHBondContact O-N 3.3Å; V828-C830 VanDerWaalsContact C-N 3.31Å; V828-C830 PolarHBondContact O-N 3.46Å; V828-A831 PolarHBondContact O-N 3.3Å; V828-F832 HydrophobicContact CG1-CD2 4.06Å; V828-F832 WeakPolarHBondContact O-CD2 3.47Å; V828-F832 PolarHBondContact O-N 3.06Å
829	L	90.4	Very high	89.1	Confident	80 Å²	80	58 Å²	58	42%	0.419	29%	0.291	S	S	.	.	H	α-helix	trans	-59.6	-41.4	177.3	-167.7	89.2	0	0	0	111.7	F825 V826 I833 L834	F825-L829 WeakPolarHBondContact O-CB 3.23Å; F825-L829 PolarHBondContact O-N 2.89Å; V826-L829 PolarHBondContact O-N 3.34Å; L829-I833 HydrophobicContact CD1-CD1 4.12Å; L829-I833 CarbonylContact O-C 3.54Å; L829-I833 WeakPolarHBondContact O-CA 3.33Å; L829-I833 WeakPolarHBondContact O-CB 3.35Å; L829-I833 PolarHBondContact O-N 3.31Å; L829-L834 HydrophobicContact CD2-CD1 3.82Å; L829-L834 HydrophobicContact CD2-CG 4.24Å; L829-L834 HydrophobicContact CG-CD1 4.35Å; L829-L834 HydrophobicContact CG-CG 4.33Å; L829-L834 PolarHBondContact O-N 2.75Å
830	C	87.8	Confident	89.5	Confident	19 Å²	19	59.8 Å²	59.8	13%	0.128	30%	0.304	C	S	.	.	I	π-helix	trans	-67.4	-48	178.1	-79.2	0	0	0	0	112.3	F175 V826 S827 V828 C835	F175-C830 HydrophobicContact CD1-CB 3.94Å; F175-C830 HydrophobicContact CD2-CB 3.74Å; F175-C830 HydrophobicContact CE1-CB 3.87Å; F175-C830 HydrophobicContact CE2-CB 3.66Å; F175-C830 HydrophobicContact CG-CB 3.89Å; F175-C830 HydrophobicContact CZ-CB 3.74Å; V826-C830 WeakPolarHBondContact O-CB 3.36Å; V826-C830 PolarHBondContact O-N 2.95Å; V826-C830 PolarHBondContact O-SG 3.38Å; S827-C830 PolarHBondContact O-N 2.65Å; V828-C830 VanDerWaalsContact C-N 3.31Å; V828-C830 PolarHBondContact O-N 3.46Å; C830-C835 WeakPolarHBondContact O-CB 3.19Å; C830-C835 PolarHBondContact O-N 2.88Å; C830-C835 PolarHBondContact O-SG 2.94Å
831	A	86.2	Confident	89.8	Confident	7 Å²	7	64.1 Å²	64.1	6%	0.058	33%	0.326	C	S	.	.	I	π-helix	trans	-61.7	-52.3	-179.6	0	0	0	0	0	111.9	F175 I176 S827 V828	F175-A831 HydrophobicContact CB-CB 3.92Å; I176-A831 HydrophobicContact CG1-CB 4.31Å; S827-A831 VanDerWaalsContact O-CB 3.26Å; S827-A831 WeakPolarHBondContact O-CB 3.37Å; S827-A831 PolarHBondContact O-N 3.22Å; V828-A831 PolarHBondContact O-N 3.3Å
832	F	88.4	Confident	90	Very high	134 Å²	134	63.7 Å²	63.7	59%	0.588	32%	0.321	S	S	*	.	I	π-helix	trans	-96.4	-19.3	-166.9	-62.9	-72.3	0	0	0	114.8	I176 V828 P836	I176-F832 HydrophobicContact CD1-CZ 4.27Å; V828-F832 HydrophobicContact CG1-CD2 4.06Å; V828-F832 WeakPolarHBondContact O-CD2 3.47Å; V828-F832 PolarHBondContact O-N 3.06Å; F832-P836 VanDerWaalsContact O-CG 3.31Å; F832-P836 WeakPolarHBondContact O-CG 3.4Å
833	I	90.3	Very high	90.1	Very high	88 Å²	88	63.8 Å²	63.8	45%	0.451	32%	0.319	S	S	.	.	I	π-helix	trans	-123.2	-56.9	-175.2	-58.1	-179.9	0	0	0	112	L829 P836 I837	L829-I833 HydrophobicContact CD1-CD1 4.12Å; L829-I833 CarbonylContact O-C 3.54Å; L829-I833 WeakPolarHBondContact O-CA 3.33Å; L829-I833 WeakPolarHBondContact O-CB 3.35Å; L829-I833 PolarHBondContact O-N 3.31Å; I833-P836 WeakPolarHBondContact O-CD 3.27Å; I833-P836 WeakPolarHBondContact O-CG 2.98Å; I833-I837 HydrophobicContact CG2-CD1 3.74Å; I833-I837 WeakPolarHBondContact O-CB 3.32Å; I833-I837 VanDerWaalsContact O-CG1 3.26Å; I833-I837 WeakPolarHBondContact O-CG1 3.32Å; I833-I837 PolarHBondContact O-N 2.98Å; I833-I837 VanDerWaalsContact O-N 3.16Å
834	L	89.6	Confident	90.3	Very high	83 Å²	83	68.3 Å²	68.3	44%	0.435	34%	0.344	S	S	.	.	I	π-helix	trans	-73.7	-36.1	-175	-59.5	173.8	0	0	0	113.1	L829 W838	L829-L834 HydrophobicContact CD2-CD1 3.82Å; L829-L834 HydrophobicContact CD2-CG 4.24Å; L829-L834 HydrophobicContact CG-CD1 4.35Å; L829-L834 HydrophobicContact CG-CG 4.33Å; L829-L834 PolarHBondContact O-N 2.75Å; L834-W838 WeakPolarHBondContact O-CB 3.44Å; L834-W838 PolarHBondContact O-N 3.12Å
835	C	89.8	Confident	90.4	Very high	7 Å²	7	70.6 Å²	70.6	5%	0.047	35%	0.353	C	S	.	.	H	α-helix	trans	-59.6	-50.5	174	-90.8	0	0	0	0	113.4	V167 C830 W838 F839	V167-C835 HydrophobicContact CG1-CB 4.3Å; C830-C835 WeakPolarHBondContact O-CB 3.19Å; C830-C835 PolarHBondContact O-N 2.88Å; C830-C835 PolarHBondContact O-SG 2.94Å; C835-W838 PolarHBondContact O-N 3.19Å; C835-F839 WeakPolarHBondContact O-CB 3.49Å; C835-F839 PolarHBondContact O-N 3.36Å
836	P	90.3	Very high	90.4	Very high	54 Å²	54	64.3 Å²	64.3	35%	0.351	33%	0.326	S	S	.	.	H	α-helix	trans	-66.8	-38.1	176.5	20.4	-29	0	0	0	113.3	F832 I833 F839 V840	F832-P836 VanDerWaalsContact O-CG 3.31Å; F832-P836 WeakPolarHBondContact O-CG 3.4Å; I833-P836 WeakPolarHBondContact O-CD 3.27Å; I833-P836 WeakPolarHBondContact O-CG 2.98Å; P836-F839 WeakPolarHBondContact O-CB 3.41Å; P836-F839 PolarHBondContact O-N 3.47Å; P836-V840 WeakPolarHBondContact O-CG2 3.37Å; P836-V840 PolarHBondContact O-N 3.47Å; P836-V840 VanDerWaalsContact O-N 3.08Å
837	I	92.6	Very high	90.5	Very high	90 Å²	90	64.9 Å²	64.9	46%	0.462	33%	0.329	S	S	.	.	H	α-helix	trans	-63.8	-46.3	174.4	-68	171.5	0	0	0	110.8	I833 F839 V840 L841	I833-I837 HydrophobicContact CG2-CD1 3.74Å; I833-I837 WeakPolarHBondContact O-CB 3.32Å; I833-I837 VanDerWaalsContact O-CG1 3.26Å; I833-I837 WeakPolarHBondContact O-CG1 3.32Å; I833-I837 PolarHBondContact O-N 2.98Å; I833-I837 VanDerWaalsContact O-N 3.16Å; I837-F839 VanDerWaalsContact C-N 3.3Å; I837-F839 PolarHBondContact O-N 3.22Å; I837-V840 PolarHBondContact O-N 2.7Å; I837-L841 HydrophobicContact CG2-CD1 3.86Å; I837-L841 HydrophobicContact CG2-CG 4.35Å; I837-L841 WeakPolarHBondContact O-CB 3.47Å; I837-L841 WeakPolarHBondContact O-CG 3.27Å; I837-L841 PolarHBondContact O-N 3.47Å
838	W	91.2	Very high	90.7	Very high	147 Å²	147	68.4 Å²	68.4	56%	0.557	35%	0.351	S	S	*	.	H	α-helix	trans	-63.3	-35.8	176.3	-178	-88.1	0	0	0	112	L834 C835 L841 H842	L834-W838 WeakPolarHBondContact O-CB 3.44Å; L834-W838 PolarHBondContact O-N 3.12Å; C835-W838 PolarHBondContact O-N 3.19Å; W838-L841 PolarHBondContact O-N 3.31Å; W838-H842 AromaticContact NE1-CD2 3.71Å; W838-H842 WeakPolarHBondContact O-CB 3.15Å; W838-H842 PolarHBondContact O-N 3.36Å
839	F	92.6	Very high	90.8	Very high	37 Å²	37	68.7 Å²	68.7	16%	0.162	35%	0.348	C	S	.	.	H	α-helix	trans	-60.4	-48.7	173.1	168	-111.4	0	0	0	111.8	A164 F165 V168 C835 P836 I837 H842 L843	A164-F839 HydrophobicContact CB-CD2 4.13Å; A164-F839 HydrophobicContact CB-CE2 4.19Å; A164-F839 WeakPolarHBondContact O-CD2 3.49Å; F165-F839 AromaticContact CD1-CE2 3.98Å; F165-F839 HydrophobicContact CD1-CE2 3.98Å; F165-F839 HydrophobicContact CD1-CZ 4.05Å; F165-F839 HydrophobicContact CE1-CE2 4.2Å; F165-F839 AromaticContact CE1-CZ 3.83Å; F165-F839 HydrophobicContact CE1-CZ 3.83Å; F165-F839 HydrophobicContact CG-CE2 4.15Å; F165-F839 HydrophobicContact CZ-CZ 4.2Å; V168-F839 HydrophobicContact CG2-CB 3.41Å; V168-F839 VanDerWaalsContact CG2-CB 3.41Å; V168-F839 HydrophobicContact CG2-CD1 3.71Å; V168-F839 HydrophobicContact CG2-CD2 3.71Å; V168-F839 HydrophobicContact CG2-CE1 4.39Å; V168-F839 HydrophobicContact CG2-CE2 4.38Å; V168-F839 HydrophobicContact CG2-CG 3.31Å; C835-F839 WeakPolarHBondContact O-CB 3.49Å; C835-F839 PolarHBondContact O-N 3.36Å; P836-F839 WeakPolarHBondContact O-CB 3.41Å; P836-F839 PolarHBondContact O-N 3.47Å; I837-F839 VanDerWaalsContact C-N 3.3Å; I837-F839 PolarHBondContact O-N 3.22Å; F839-H842 PolarHBondContact O-N 3.01Å; F839-L843 VanDerWaalsContact O-CB 3.27Å; F839-L843 WeakPolarHBondContact O-CB 3.41Å; F839-L843 PolarHBondContact O-N 2.8Å
840	V	92.6	Very high	90.8	Very high	78 Å²	78	67.7 Å²	67.7	47%	0.473	34%	0.341	S	S	.	.	H	α-helix	trans	-63.2	-44	177.6	174.5	0	0	0	0	111.2	P836 I837 L843 L844	P836-V840 WeakPolarHBondContact O-CG2 3.37Å; P836-V840 PolarHBondContact O-N 3.47Å; P836-V840 VanDerWaalsContact O-N 3.08Å; I837-V840 PolarHBondContact O-N 2.7Å; V840-L843 PolarHBondContact O-N 3.3Å; V840-L844 HydrophobicContact CG1-CD1 4.2Å; V840-L844 WeakPolarHBondContact O-CB 3.37Å; V840-L844 WeakPolarHBondContact O-CG 3.32Å; V840-L844 PolarHBondContact O-N 3.36Å
841	L	92.5	Very high	90.9	Very high	98 Å²	98	71.4 Å²	71.4	51%	0.513	36%	0.359	S	S	.	.	H	α-helix	trans	-65.5	-39.2	176.6	-70.9	174.8	0	0	0	112.6	I837 W838 F845	I837-L841 HydrophobicContact CG2-CD1 3.86Å; I837-L841 HydrophobicContact CG2-CG 4.35Å; I837-L841 WeakPolarHBondContact O-CB 3.47Å; I837-L841 WeakPolarHBondContact O-CG 3.27Å; I837-L841 PolarHBondContact O-N 3.47Å; W838-L841 PolarHBondContact O-N 3.31Å; L841-F845 WeakPolarHBondContact O-CB 3.19Å; L841-F845 PolarHBondContact O-N 3.36Å
842	H	90.9	Very high	91.1	Very high	40 Å²	40	76.1 Å²	76.1	19%	0.185	38%	0.383	C	S	.	.	H	α-helix	trans	-73	-32.4	177.9	-169	-65.2	0	0	0	111.4	W838 F839 T846	W838-H842 AromaticContact NE1-CD2 3.71Å; W838-H842 WeakPolarHBondContact O-CB 3.15Å; W838-H842 PolarHBondContact O-N 3.36Å; F839-H842 PolarHBondContact O-N 3.01Å; H842-T846 VanDerWaalsContact O-CG2 3.31Å; H842-T846 WeakPolarHBondContact O-CG2 3.15Å; H842-T846 PolarHBondContact O-N 2.87Å; H842-T846 PolarHBondContact O-OG1 3.03Å; H842-T846 VanDerWaalsContact O-OG1 3.09Å
843	L	91.3	Very high	91	Very high	58 Å²	58	74.4 Å²	74.4	30%	0.304	37%	0.373	S	S	.	.	H	α-helix	trans	-66.4	-47.7	172.1	-172.4	78.3	0	0	0	111.1	L161 F839 V840 T846 V847	L161-L843 HydrophobicContact CD1-CD1 3.77Å; F839-L843 VanDerWaalsContact O-CB 3.27Å; F839-L843 WeakPolarHBondContact O-CB 3.41Å; F839-L843 PolarHBondContact O-N 2.8Å; V840-L843 PolarHBondContact O-N 3.3Å; L843-T846 PolarHBondContact O-N 2.98Å; L843-T846 PolarHBondContact O-OG1 3.25Å; L843-T846 VanDerWaalsContact O-OG1 3.08Å; L843-V847 WeakPolarHBondContact O-CG2 3.43Å; L843-V847 PolarHBondContact O-N 3.04Å; L843-V847 VanDerWaalsContact O-N 3.12Å
844	L	93.1	Very high	90.8	Very high	105 Å²	105	73.2 Å²	73.2	55%	0.55	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-48	172.5	-77.8	167	0	0	0	110.6	V840 T846 V847 T848	V840-L844 HydrophobicContact CG1-CD1 4.2Å; V840-L844 WeakPolarHBondContact O-CB 3.37Å; V840-L844 WeakPolarHBondContact O-CG 3.32Å; V840-L844 PolarHBondContact O-N 3.36Å; L844-T846 PolarHBondContact O-N 3.42Å; L844-V847 PolarHBondContact O-N 3.24Å; L844-T848 WeakPolarHBondContact O-CB 3.37Å; L844-T848 PolarHBondContact O-N 2.61Å; L844-T848 PolarHBondContact O-OG1 3.35Å
845	F	92.1	Very high	90.8	Very high	119 Å²	119	75.1 Å²	75.1	52%	0.522	38%	0.38	S	S	.	.	H	α-helix	trans	-60.7	-40.5	178.5	177	-108.2	0	0	0	112.7	L841 T848 K849	L841-F845 WeakPolarHBondContact O-CB 3.19Å; L841-F845 PolarHBondContact O-N 3.36Å; F845-T848 PolarHBondContact O-N 2.84Å; F845-K849 HydrophobicContact CE1-CD 3.89Å; F845-K849 HydrophobicContact CZ-CB 4.43Å; F845-K849 HydrophobicContact CZ-CD 4.14Å; F845-K849 WeakPolarHBondContact O-CA 3.37Å; F845-K849 WeakPolarHBondContact O-CB 3.42Å; F845-K849 PolarHBondContact O-N 3.26Å
846	T	90.7	Very high	90.7	Very high	3 Å²	3	79.5 Å²	79.5	2%	0.018	40%	0.395	C	S	.	.	H	α-helix	trans	-70.1	-36.7	178.5	51.6	0	0	0	0	112.7	D160 H842 L843 L844 F850	D160-T846 HydrophobicContact CB-CG2 3.51Å; H842-T846 VanDerWaalsContact O-CG2 3.31Å; H842-T846 WeakPolarHBondContact O-CG2 3.15Å; H842-T846 PolarHBondContact O-N 2.87Å; H842-T846 PolarHBondContact O-OG1 3.03Å; H842-T846 VanDerWaalsContact O-OG1 3.09Å; L843-T846 PolarHBondContact O-N 2.98Å; L843-T846 PolarHBondContact O-OG1 3.25Å; L843-T846 VanDerWaalsContact O-OG1 3.08Å; L844-T846 PolarHBondContact O-N 3.42Å; T846-F850 VanDerWaalsContact O-CB 3.27Å; T846-F850 WeakPolarHBondContact O-CB 3.25Å; T846-F850 PolarHBondContact O-N 2.9Å
847	V	92.4	Very high	90.4	Very high	65 Å²	65	77.4 Å²	77.4	39%	0.394	38%	0.381	S	S	.	.	H	α-helix	trans	-64.7	-49.2	171.8	173.8	0	0	0	0	110.8	F157 L843 L844 F850 L851	F157-V847 HydrophobicContact CE2-CG2 4.3Å; L843-V847 WeakPolarHBondContact O-CG2 3.43Å; L843-V847 PolarHBondContact O-N 3.04Å; L843-V847 VanDerWaalsContact O-N 3.12Å; L844-V847 PolarHBondContact O-N 3.24Å; V847-F850 PolarHBondContact O-N 2.71Å; V847-L851 HydrophobicContact CG1-CD1 4.23Å; V847-L851 WeakPolarHBondContact O-CG 3.32Å; V847-L851 PolarHBondContact O-N 3.28Å
848	T	91.8	Very high	90	Very high	74 Å²	74	74.7 Å²	74.7	45%	0.454	37%	0.372	S	S	.	.	H	α-helix	trans	-62.5	-45.7	177.3	-56.2	0	0	0	0	111.6	L844 F845 F850 L851 L852	L844-T848 WeakPolarHBondContact O-CB 3.37Å; L844-T848 PolarHBondContact O-N 2.61Å; L844-T848 PolarHBondContact O-OG1 3.35Å; F845-T848 PolarHBondContact O-N 2.84Å; T848-F850 VanDerWaalsContact C-N 3.34Å; T848-F850 PolarHBondContact O-N 2.9Å; T848-L851 PolarHBondContact O-N 2.56Å; T848-L852 HydrophobicContact CG2-CD1 4.49Å; T848-L852 VanDerWaalsContact O-CB 3.24Å; T848-L852 WeakPolarHBondContact O-CB 3.47Å; T848-L852 PolarHBondContact O-N 2.8Å
849	K	89.5	Confident	89.6	Confident	56 Å²	56	72.9 Å²	72.9	24%	0.243	37%	0.368	C	S	.	.	H	α-helix	trans	-58.4	-42.1	176.1	176	-171.5	178.2	-172.6	0	111.9	D160 F845 Y853	D160-K849 IonicContact OD2-NZ 3.72Å; D160-K849 PolarHBondContact OD2-NZ 3.42Å; F845-K849 HydrophobicContact CE1-CD 3.89Å; F845-K849 HydrophobicContact CZ-CB 4.43Å; F845-K849 HydrophobicContact CZ-CD 4.14Å; F845-K849 WeakPolarHBondContact O-CA 3.37Å; F845-K849 WeakPolarHBondContact O-CB 3.42Å; F845-K849 PolarHBondContact O-N 3.26Å; K849-Y853 HydrophobicContact CD-CE2 4.27Å; K849-Y853 HydrophobicContact CG-CD2 3.72Å; K849-Y853 HydrophobicContact CG-CE2 3.7Å; K849-Y853 WeakPolarHBondContact O-CB 3.4Å; K849-Y853 PolarHBondContact O-N 2.7Å
850	F	90.2	Very high	89	Confident	59 Å²	59	71.2 Å²	71.2	26%	0.259	36%	0.361	S	S	.	.	H	α-helix	trans	-63.1	-47.6	176	172.7	-104.9	0	0	0	111.6	I153 H154 F157 T846 V847 T848 T854	I153-F850 HydrophobicContact CG2-CD2 3.68Å; I153-F850 HydrophobicContact CG2-CE2 3.85Å; H154-F850 AromaticContact ND1-CE2 3.86Å; F157-F850 HydrophobicContact CB-CB 4.5Å; F157-F850 HydrophobicContact CB-CD2 3.76Å; F157-F850 HydrophobicContact CB-CE2 4.35Å; F157-F850 HydrophobicContact CB-CG 4.31Å; F157-F850 HydrophobicContact CD2-CB 3.67Å; F157-F850 HydrophobicContact CD2-CD2 4.25Å; F157-F850 AromaticContact CD2-CG 3.93Å; F157-F850 HydrophobicContact CD2-CG 3.93Å; F157-F850 HydrophobicContact CE2-CB 4.26Å; F157-F850 HydrophobicContact CG-CB 4.3Å; F157-F850 HydrophobicContact CG-CD2 4.02Å; F157-F850 HydrophobicContact CG-CG 4.13Å; T846-F850 VanDerWaalsContact O-CB 3.27Å; T846-F850 WeakPolarHBondContact O-CB 3.25Å; T846-F850 PolarHBondContact O-N 2.9Å; V847-F850 PolarHBondContact O-N 2.71Å; T848-F850 VanDerWaalsContact C-N 3.34Å; T848-F850 PolarHBondContact O-N 2.9Å; F850-T854 VanDerWaalsContact O-CB 3.29Å; F850-T854 WeakPolarHBondContact O-CB 3.41Å; F850-T854 PolarHBondContact O-N 3.44Å; F850-T854 PolarHBondContact O-OG1 3.25Å
851	L	91.2	Very high	88.2	Confident	97 Å²	97	68.8 Å²	68.8	51%	0.508	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-47.6	175.6	-68.1	168.9	0	0	0	111.7	V847 T848 T854 L855	V847-L851 HydrophobicContact CG1-CD1 4.23Å; V847-L851 WeakPolarHBondContact O-CG 3.32Å; V847-L851 PolarHBondContact O-N 3.28Å; T848-L851 PolarHBondContact O-N 2.56Å; L851-T854 PolarHBondContact O-N 2.97Å; L851-L855 WeakPolarHBondContact O-CB 3.29Å; L851-L855 WeakPolarHBondContact O-CG 3.24Å; L851-L855 PolarHBondContact O-N 2.87Å
852	L	89.6	Confident	87.6	Confident	107 Å²	107	70 Å²	70	56%	0.56	34%	0.343	S	S	*	.	H	α-helix	trans	-71.3	-37.9	-174	-145.6	161.3	0	0	0	111.6	T848 L855 W856	T848-L852 HydrophobicContact CG2-CD1 4.49Å; T848-L852 VanDerWaalsContact O-CB 3.24Å; T848-L852 WeakPolarHBondContact O-CB 3.47Å; T848-L852 PolarHBondContact O-N 2.8Å; L852-L855 PolarHBondContact O-N 3.38Å; L852-W856 WeakPolarHBondContact O-CB 3.5Å; L852-W856 PolarHBondContact O-N 3.06Å
853	Y	86	Confident	86.7	Confident	98 Å²	98	72.5 Å²	72.5	38%	0.384	36%	0.357	S	S	.	.	H	α-helix	trans	-69.3	-36.3	169.3	-78.6	-37.7	0	0	0	113	K849 L855 W856 D857	K849-Y853 HydrophobicContact CD-CE2 4.27Å; K849-Y853 HydrophobicContact CG-CD2 3.72Å; K849-Y853 HydrophobicContact CG-CE2 3.7Å; K849-Y853 WeakPolarHBondContact O-CB 3.4Å; K849-Y853 PolarHBondContact O-N 2.7Å; Y853-L855 VanDerWaalsContact C-N 3.3Å; Y853-L855 PolarHBondContact O-N 3.33Å; Y853-W856 PolarHBondContact O-N 3.18Å; Y853-D857 WeakPolarHBondContact O-CB 3.29Å; Y853-D857 PolarHBondContact O-N 3Å
854	T	87.4	Confident	85.6	Confident	62 Å²	62	72.6 Å²	72.6	38%	0.38	36%	0.36	S	S	.	.	H	α-helix	trans	-64	-39	175.6	-58	0	0	0	0	111.1	F850 L851 A858	F850-T854 VanDerWaalsContact O-CB 3.29Å; F850-T854 WeakPolarHBondContact O-CB 3.41Å; F850-T854 PolarHBondContact O-N 3.44Å; F850-T854 PolarHBondContact O-OG1 3.25Å; L851-T854 PolarHBondContact O-N 2.97Å; T854-A858 VanDerWaalsContact O-CB 3.3Å; T854-A858 WeakPolarHBondContact O-CB 3.47Å; T854-A858 PolarHBondContact O-N 3.05Å
855	L	89.2	Confident	84.3	Confident	123 Å²	123	68.7 Å²	68.7	64%	0.644	34%	0.339	S	S	*	.	H	α-helix	trans	-70.5	-40	173	-70.4	169.2	0	0	0	112.6	L851 L852 Y853 A858 F859	L851-L855 WeakPolarHBondContact O-CB 3.29Å; L851-L855 WeakPolarHBondContact O-CG 3.24Å; L851-L855 PolarHBondContact O-N 2.87Å; L852-L855 PolarHBondContact O-N 3.38Å; Y853-L855 VanDerWaalsContact C-N 3.3Å; Y853-L855 PolarHBondContact O-N 3.33Å; L855-A858 PolarHBondContact O-N 3.46Å; L855-F859 VanDerWaalsContact O-CB 3.24Å; L855-F859 WeakPolarHBondContact O-CB 3.35Å; L855-F859 PolarHBondContact O-N 3.06Å
856	W	87.6	Confident	83	Confident	100 Å²	100	69.4 Å²	69.4	38%	0.379	34%	0.341	S	S	.	.	H	α-helix	trans	-68.7	-48	179.6	180	-105.6	0	0	0	112.4	W145 L852 Y853 A858 F859 V860	W145-W856 PolarHBondContact O-NE1 2.86Å; L852-W856 WeakPolarHBondContact O-CB 3.5Å; L852-W856 PolarHBondContact O-N 3.06Å; Y853-W856 PolarHBondContact O-N 3.18Å; W856-A858 VanDerWaalsContact C-N 3.26Å; W856-A858 PolarHBondContact O-N 3.39Å; W856-F859 HydrophobicContact CE3-CD1 4.32Å; W856-F859 HydrophobicContact CZ3-CD1 4.2Å; W856-F859 HydrophobicContact CZ3-CE1 4.44Å; W856-F859 PolarHBondContact O-N 3.47Å; W856-F859 VanDerWaalsContact O-N 3.15Å; W856-V860 HydrophobicContact CD2-CG2 3.71Å; W856-V860 HydrophobicContact CE3-CG2 4.12Å; W856-V860 HydrophobicContact CG-CG2 4.25Å; W856-V860 HydrophobicContact CH2-CG2 3.97Å; W856-V860 HydrophobicContact CZ2-CG2 3.52Å; W856-V860 HydrophobicContact CZ3-CG2 4.24Å; W856-V860 WeakPolarHBondContact O-CB 3.16Å; W856-V860 WeakPolarHBondContact O-CG2 3.42Å; W856-V860 PolarHBondContact O-N 2.68Å
857	D	82.9	Confident	80.8	Confident	10 Å²	10	75.4 Å²	75.4	5%	0.053	37%	0.373	C	S	.	.	H	α-helix	trans	-60.3	-40	175.3	-99.2	37.2	0	0	0	110.3	L147 N148 G149 I153 Y853 F861	L147-D857 WeakPolarHBondContact CA-OD1 3.42Å; L147-D857 HydrophobicContact CD1-CB 3.92Å; N148-D857 PolarHBondContact N-OD1 3.35Å; N148-D857 VanDerWaalsContact N-OD1 3.12Å; N148-D857 PolarHBondContact N-OD2 2.86Å; N148-D857 VanDerWaalsContact N-OD2 3.1Å; G149-D857 PolarHBondContact N-OD2 3.46Å; I153-D857 HydrophobicContact CD1-CB 4.09Å; Y853-D857 WeakPolarHBondContact O-CB 3.29Å; Y853-D857 PolarHBondContact O-N 3Å; D857-F861 WeakPolarHBondContact O-CB 3.42Å; D857-F861 PolarHBondContact O-N 3.2Å
858	A	84.3	Confident	78.8	Confident	33 Å²	33	77.7 Å²	77.7	27%	0.273	39%	0.386	S	S	.	.	H	α-helix	trans	-62.7	-47.6	173.2	0	0	0	0	0	112.2	T854 L855 W856 Y862	T854-A858 VanDerWaalsContact O-CB 3.3Å; T854-A858 WeakPolarHBondContact O-CB 3.47Å; T854-A858 PolarHBondContact O-N 3.05Å; L855-A858 PolarHBondContact O-N 3.46Å; W856-A858 VanDerWaalsContact C-N 3.26Å; W856-A858 PolarHBondContact O-N 3.39Å; A858-Y862 HydrophobicContact CB-CD2 4.49Å; A858-Y862 WeakPolarHBondContact O-CB 3.12Å; A858-Y862 WeakPolarHBondContact O-CD2 3.35Å; A858-Y862 PolarHBondContact O-N 2.82Å
859	F	84.2	Confident	77	Confident	108 Å²	108	75.7 Å²	75.7	47%	0.474	37%	0.374	S	S	.	.	H	α-helix	trans	-62.3	-55.3	-179.9	179.6	-92.6	0	0	0	111.9	L855 W856 F861 Y862 L863	L855-F859 VanDerWaalsContact O-CB 3.24Å; L855-F859 WeakPolarHBondContact O-CB 3.35Å; L855-F859 PolarHBondContact O-N 3.06Å; W856-F859 HydrophobicContact CE3-CD1 4.32Å; W856-F859 HydrophobicContact CZ3-CD1 4.2Å; W856-F859 HydrophobicContact CZ3-CE1 4.44Å; W856-F859 PolarHBondContact O-N 3.47Å; W856-F859 VanDerWaalsContact O-N 3.15Å; F859-F861 VanDerWaalsContact C-N 3.28Å; F859-F861 PolarHBondContact O-N 3.1Å; F859-Y862 PolarHBondContact O-N 3.36Å; F859-L863 HydrophobicContact CD2-CD1 4.04Å; F859-L863 HydrophobicContact CE1-CD1 4.47Å; F859-L863 HydrophobicContact CE2-CD1 3.42Å; F859-L863 VanDerWaalsContact CE2-CD1 3.42Å; F859-L863 HydrophobicContact CZ-CD1 3.67Å; F859-L863 VanDerWaalsContact O-CB 3.26Å; F859-L863 WeakPolarHBondContact O-CB 3.31Å; F859-L863 PolarHBondContact O-N 3.06Å
860	V	79.7	Confident	75.2	Confident	2 Å²	2	81 Å²	81	1%	0.012	39%	0.393	C	S	.	.	I	π-helix	trans	-61.5	-38.2	179.5	174.5	0	0	0	0	111	L146 L147 W856 V864 F865	L146-V860 HydrophobicContact CD2-CG1 4.27Å; L146-V860 WeakPolarHBondContact O-CG1 3.21Å; L147-V860 HydrophobicContact CD1-CB 4.4Å; L147-V860 HydrophobicContact CD1-CG1 4.4Å; W856-V860 HydrophobicContact CD2-CG2 3.71Å; W856-V860 HydrophobicContact CE3-CG2 4.12Å; W856-V860 HydrophobicContact CG-CG2 4.25Å; W856-V860 HydrophobicContact CH2-CG2 3.97Å; W856-V860 HydrophobicContact CZ2-CG2 3.52Å; W856-V860 HydrophobicContact CZ3-CG2 4.24Å; W856-V860 WeakPolarHBondContact O-CB 3.16Å; W856-V860 WeakPolarHBondContact O-CG2 3.42Å; W856-V860 PolarHBondContact O-N 2.68Å; V860-V864 HydrophobicContact CG1-CB 4.14Å; V860-V864 HydrophobicContact CG1-CG2 4.37Å; V860-V864 WeakPolarHBondContact O-CA 3.15Å; V860-V864 WeakPolarHBondContact O-CB 3.46Å; V860-V864 PolarHBondContact O-N 3.11Å; V860-F865 HydrophobicContact CG1-CD2 3.84Å; V860-F865 HydrophobicContact CG1-CE2 4.17Å; V860-F865 PolarHBondContact O-N 3.46Å
861	F	76.3	Confident	73.4	Confident	28 Å²	28	80 Å²	80	12%	0.123	39%	0.39	C	S	.	.	I	π-helix	trans	-63.2	-50	174.5	-175.1	-99.3	0	0	0	112.7	R117 I120 R121 L147 D857 F859 K866	R117-F861 WeakPolarHBondContact O-CE2 3.4Å; R117-F861 WeakPolarHBondContact O-CZ 3.45Å; I120-F861 HydrophobicContact CG2-CD2 4.25Å; I120-F861 HydrophobicContact CG2-CE2 4.27Å; R121-F861 HydrophobicContact CB-CD2 4.15Å; R121-F861 HydrophobicContact CB-CE2 3.75Å; R121-F861 HydrophobicContact CB-CZ 3.97Å; R121-F861 HydrophobicContact CG-CD2 4.5Å; R121-F861 HydrophobicContact CG-CE1 4.5Å; R121-F861 HydrophobicContact CG-CE2 4.38Å; R121-F861 HydrophobicContact CG-CZ 4.36Å; R121-F861 VanDerWaalsContact NH1-CD1 3.3Å; L147-F861 HydrophobicContact CD1-CB 4.46Å; D857-F861 WeakPolarHBondContact O-CB 3.42Å; D857-F861 PolarHBondContact O-N 3.2Å; F859-F861 VanDerWaalsContact C-N 3.28Å; F859-F861 PolarHBondContact O-N 3.1Å; F861-K866 WeakPolarHBondContact O-CB 3.44Å; F861-K866 PolarHBondContact O-N 3.08Å; F861-K866 VanDerWaalsContact O-N 3.12Å
862	Y	79.4	Confident	71.5	Confident	123 Å²	123	76.9 Å²	76.9	48%	0.482	38%	0.375	S	S	.	.	I	π-helix	trans	-79.3	-23.7	-175.3	-74.3	-59.4	0	0	0	114.8	R121 A858 F859 K866	R121-Y862 VanDerWaalsContact NH1-CZ 3.32Å; R121-Y862 PolarHBondContact NH1-OH 3.39Å; R121-Y862 VanDerWaalsContact NH1-OH 3.13Å; R121-Y862 PolarHBondContact NH2-OH 3.05Å; A858-Y862 HydrophobicContact CB-CD2 4.49Å; A858-Y862 WeakPolarHBondContact O-CB 3.12Å; A858-Y862 WeakPolarHBondContact O-CD2 3.35Å; A858-Y862 PolarHBondContact O-N 2.82Å; F859-Y862 PolarHBondContact O-N 3.36Å; Y862-K866 VanDerWaalsContact O-CB 3.24Å; Y862-K866 WeakPolarHBondContact O-CB 3.24Å; Y862-K866 VanDerWaalsContact O-CD 3.22Å; Y862-K866 WeakPolarHBondContact O-CD 3.25Å
863	L	72.5	Confident	69.3	Low	93 Å²	93	74.8 Å²	74.8	49%	0.487	37%	0.369	S	S	.	.	I	π-helix	trans	-112.4	-35.7	-172.7	-126.5	169.8	0	0	0	113.6	F859 L867	F859-L863 HydrophobicContact CD2-CD1 4.04Å; F859-L863 HydrophobicContact CE1-CD1 4.47Å; F859-L863 HydrophobicContact CE2-CD1 3.42Å; F859-L863 VanDerWaalsContact CE2-CD1 3.42Å; F859-L863 HydrophobicContact CZ-CD1 3.67Å; F859-L863 VanDerWaalsContact O-CB 3.26Å; F859-L863 WeakPolarHBondContact O-CB 3.31Å; F859-L863 PolarHBondContact O-N 3.06Å; L863-L867 WeakPolarHBondContact O-CD1 3.21Å
864	V	67.9	Low	67.4	Low	59 Å²	59	75.7 Å²	75.7	36%	0.358	38%	0.377	S	S	.	.	I	π-helix	trans	-96.9	-63.6	178.1	-173.8	0	0	0	0	110.6	V860 K866 L867 V868	V860-V864 HydrophobicContact CG1-CB 4.14Å; V860-V864 HydrophobicContact CG1-CG2 4.37Å; V860-V864 WeakPolarHBondContact O-CA 3.15Å; V860-V864 WeakPolarHBondContact O-CB 3.46Å; V860-V864 PolarHBondContact O-N 3.11Å; V864-K866 VanDerWaalsContact C-N 3.25Å; V864-K866 PolarHBondContact O-N 3.22Å; V864-L867 PolarHBondContact O-N 3.21Å; V864-V868 PolarHBondContact O-N 3.32Å
865	F	65.4	Low	65.5	Low	23 Å²	23	78.8 Å²	78.8	10%	0.101	39%	0.387	C	S	.	.	I	π-helix	trans	-67	-22.7	-175	-90	-98.8	0	0	0	114.1	I120 I142 L146 V860 L867 T869	I120-F865 HydrophobicContact CD1-CD1 4.24Å; I120-F865 HydrophobicContact CD1-CE1 4.38Å; I120-F865 HydrophobicContact CG2-CD1 4.17Å; I120-F865 HydrophobicContact CG2-CE1 4.47Å; I142-F865 HydrophobicContact CD1-CE1 3.81Å; I142-F865 HydrophobicContact CD1-CZ 3.84Å; I142-F865 HydrophobicContact CG1-CE1 4.46Å; I142-F865 HydrophobicContact CG1-CZ 4.26Å; I142-F865 HydrophobicContact CG2-CZ 4.08Å; L146-F865 HydrophobicContact CD2-CE2 4.3Å; V860-F865 HydrophobicContact CG1-CD2 3.84Å; V860-F865 HydrophobicContact CG1-CE2 4.17Å; V860-F865 PolarHBondContact O-N 3.46Å; F865-L867 VanDerWaalsContact C-N 3.31Å; F865-T869 HydrophobicContact CB-CG2 4.4Å; F865-T869 HydrophobicContact CD1-CG2 3.44Å; F865-T869 VanDerWaalsContact CD1-CG2 3.44Å; F865-T869 HydrophobicContact CE1-CG2 3.83Å; F865-T869 HydrophobicContact CG-CG2 4.02Å
866	K	63.7	Low	63.9	Low	134 Å²	134	77.3 Å²	77.3	58%	0.583	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-22.7	173.6	-164.2	-177.6	179.1	-171.5	0	113.4	F861 Y862 V864	F861-K866 WeakPolarHBondContact O-CB 3.44Å; F861-K866 PolarHBondContact O-N 3.08Å; F861-K866 VanDerWaalsContact O-N 3.12Å; Y862-K866 VanDerWaalsContact O-CB 3.24Å; Y862-K866 WeakPolarHBondContact O-CB 3.24Å; Y862-K866 VanDerWaalsContact O-CD 3.22Å; Y862-K866 WeakPolarHBondContact O-CD 3.25Å; V864-K866 VanDerWaalsContact C-N 3.25Å; V864-K866 PolarHBondContact O-N 3.22Å
867	L	46.3	Very low	62.4	Low	130 Å²	130	78 Å²	78	68%	0.681	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.6	-31.1	-168.7	-78.1	164	0	0	0	114.1	L863 V864 F865	L863-L867 WeakPolarHBondContact O-CD1 3.21Å; V864-L867 PolarHBondContact O-N 3.21Å; F865-L867 VanDerWaalsContact C-N 3.31Å
868	V	50.5	Low	61.3	Low	112 Å²	112	80.4 Å²	80.4	68%	0.679	42%	0.416	S	S	*	.			trans	-136.1	82	-169.8	-169.3	0	0	0	0	111.3	V864	V864-V868 PolarHBondContact O-N 3.32Å
869	T	53.5	Low	60.1	Low	32 Å²	32	80 Å²	80	20%	0.196	41%	0.41	C	S	.	.			trans	-139.4	121.3	167.7	51.6	0	0	0	0	112.5	V112 F865	V112-T869 WeakPolarHBondContact CG2-OG1 3.01Å; F865-T869 HydrophobicContact CB-CG2 4.4Å; F865-T869 HydrophobicContact CD1-CG2 3.44Å; F865-T869 VanDerWaalsContact CD1-CG2 3.44Å; F865-T869 HydrophobicContact CE1-CG2 3.83Å; F865-T869 HydrophobicContact CG-CG2 4.02Å
870	R	52.1	Low	59	Low	167 Å²	167	80.7 Å²	80.7	63%	0.63	41%	0.413	S	S	*	.			trans	-131.8	153	163.5	-82.7	177.7	149.6	-174.3	-8.5	108.2	L109	L109-R870 HydrophobicContact CB-CG 4.03Å; L109-R870 VanDerWaalsContact CB-CZ 3.44Å; L109-R870 HydrophobicContact CD2-CB 4.41Å; L109-R870 PolarHBondContact O-NE 2.89Å; L109-R870 PolarHBondContact O-NH2 3.12Å
871	I	52.2	Low	58	Low	40 Å²	40	84.9 Å²	84.9	21%	0.205	43%	0.428	C	S	.	.			trans	-78.8	132.7	-170.6	-57.4	170.2	0	0	0	110	F106 V128 W140	F106-I871 HydrophobicContact CD1-CG2 4.48Å; F106-I871 HydrophobicContact CE1-CG2 3.88Å; V128-I871 HydrophobicContact CG1-CD1 4.1Å; W140-I871 HydrophobicContact CZ2-CG2 4.15Å
872	P	50	Low	57	Low	31 Å²	31	84.6 Å²	84.6	20%	0.201	43%	0.43	C	S	.	.			trans	-78.8	141.2	-177.8	31.2	-34.9	0	0	0	113	W140	W140-P872 HydrophobicContact CH2-CG 4.42Å; W140-P872 HydrophobicContact CZ3-CG 4.03Å
873	C	44.7	Very low	55.4	Low	63 Å²	63	84.7 Å²	84.7	43%	0.426	44%	0.439	S	S	.	.	S	Bend	trans	-83.9	-12.8	-175.4	-45.8	0	0	0	0	114.8	F106	F106-C873 HydrophobicContact CB-CB 4.42Å; F106-C873 WeakPolarHBondContact CB-SG 3.14Å; F106-C873 HydrophobicContact CD2-CB 3.94Å; F106-C873 HydrophobicContact CG-CB 4.35Å
874	Q	45.1	Very low	53.9	Low	117 Å²	117	83.5 Å²	83.5	55%	0.547	43%	0.433	S	S	.	.	S	Bend	trans	-143.5	163	177.2	-79.6	-172.7	-37.2	0	0	109.9	N876	Q874-N876 PolarHBondContact O-N 3.41Å; Q874-N876 VanDerWaalsContact O-N 3.15Å
875	E	48.8	Very low	52.6	Low	126 Å²	126	87 Å²	87	59%	0.589	46%	0.457	S	S	*	.			trans	-71.4	106.3	179	-61.6	-161.3	152.1	0	0	111.5
876	N	54.1	Low	51.3	Low	92 Å²	92	95.4 Å²	95.4	49%	0.492	49%	0.494	S	S	.	.	B	Isolated β-bridge	trans	-107.4	154.7	176.9	-67.3	-18.8	0	0	0	109.7	Q874 S878 V879	Q874-N876 PolarHBondContact O-N 3.41Å; Q874-N876 VanDerWaalsContact O-N 3.15Å; N876-S878 PolarHBondContact O-N 3.09Å; N876-V879 CarbonylContact O-C 3.47Å; N876-V879 PolarHBondContact O-N 3.38Å
877	C	56.2	Low	50.2	Low	116 Å²	116	91.7 Å²	91.7	78%	0.784	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-27	-176.5	-71.6	0	0	0	0	114.4
878	S	60.4	Low	49.8	Very low	59 Å²	59	90.2 Å²	90.2	41%	0.413	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-28.6	-178.1	-42	0	0	0	0	114.7	S143 N876	S143-S878 WeakPolarHBondContact CB-O 3.44Å; S143-S878 PolarHBondContact N-O 3Å; S143-S878 PolarHBondContact OG-O 3.39Å; N876-S878 PolarHBondContact O-N 3.09Å
879	V	59.9	Low	49.5	Very low	25 Å²	25	90.7 Å²	90.7	15%	0.152	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	118	-179.8	-166.2	0	0	0	0	109	W140 N876	W140-V879 HydrophobicContact CB-CG1 4.28Å; W140-V879 HydrophobicContact CE3-CG1 3.91Å; N876-V879 CarbonylContact O-C 3.47Å; N876-V879 PolarHBondContact O-N 3.38Å
880	K	60.2	Low	49.4	Very low	122 Å²	122	91.6 Å²	91.6	53%	0.53	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	149.8	175.3	-69.9	-173.8	175.2	-175.8	0	110.1	K141	K141-K880 PolarHBondContact N-O 3.45Å; K141-K880 PolarHBondContact O-N 2.86Å
881	R	59.4	Low	49.5	Very low	90 Å²	90	88.5 Å²	88.5	34%	0.34	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	140.2	164.5	-73.9	-179.1	166.7	-146.1	-6	108.6	H138 W140 N883	H138-R881 PolarHBondContact CD2-NH2 2.88Å; H138-R881 PolarHBondContact NE2-NH1 2.72Å; H138-R881 PolarHBondContact NE2-NH2 3.26Å; W140-R881 HydrophobicContact CD2-CG 4.33Å; W140-R881 HydrophobicContact CE3-CG 3.96Å; W140-R881 HydrophobicContact CH2-CG 4.09Å; W140-R881 HydrophobicContact CZ2-CG 4.39Å; W140-R881 HydrophobicContact CZ3-CG 3.84Å; R881-N883 PolarHBondContact O-N 3.38Å
882	S	55.4	Low	49.6	Very low	23 Å²	23	86.8 Å²	86.8	16%	0.161	46%	0.462	C	S	.	.			trans	-77.9	116.1	173.7	-160.3	0	0	0	0	108.5	A139 D884	A139-S882 WeakPolarHBondContact O-CB 3.39Å; A139-S882 PolarHBondContact O-N 3.35Å; S882-D884 WeakPolarHBondContact CB-OD2 3.41Å; S882-D884 PolarHBondContact O-N 2.7Å; S882-D884 PolarHBondContact OG-OD2 3.12Å
883	N	45.3	Very low	50	Low	125 Å²	125	85.7 Å²	85.7	67%	0.668	45%	0.454	S	S	*	.			trans	-77.8	56.5	171.3	-75.9	-13.9	0	0	0	110.2	R881	R881-N883 PolarHBondContact O-N 3.38Å
884	D	41.4	Very low	51.1	Low	68 Å²	68	85 Å²	85	36%	0.364	45%	0.446	S	S	.	.			trans	-69.7	122.8	166.8	-74.2	-68	0	0	0	108.2	S882 K886 T887	S882-D884 WeakPolarHBondContact CB-OD2 3.41Å; S882-D884 PolarHBondContact O-N 2.7Å; S882-D884 PolarHBondContact OG-OD2 3.12Å; D884-K886 PolarHBondContact O-N 2.87Å; D884-T887 PolarHBondContact O-N 2.91Å; D884-T887 PolarHBondContact O-OG1 2.99Å
885	P	40.3	Very low	52.2	Low	131 Å²	131	79.5 Å²	79.5	85%	0.851	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	6.6	-172.5	27.5	-35.7	0	0	0	114.2
886	K	37.5	Very low	53.2	Low	201 Å²	201	78.2 Å²	78.2	87%	0.874	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-11.7	179.7	-64.1	-179.1	179.5	176.2	0	113.7	D884	D884-K886 PolarHBondContact O-N 2.87Å
887	T	40	Very low	54.1	Low	56 Å²	56	74.5 Å²	74.5	34%	0.344	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131	-7	-167.1	23.4	0	0	0	0	116.4	D884 R889	D884-T887 PolarHBondContact O-N 2.91Å; D884-T887 PolarHBondContact O-OG1 2.99Å; T887-R889 PolarHBondContact O-N 2.63Å
888	V	39.3	Very low	54.9	Low	98 Å²	98	70.7 Å²	70.7	59%	0.594	36%	0.362	S	S	*	.			trans	-91	93.8	178.4	-174.7	0	0	0	0	111
889	R	44.3	Very low	55.5	Low	122 Å²	122	67.9 Å²	67.9	46%	0.46	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-70.7	125.4	167.1	-67.8	-152.8	-177.7	118.3	-10.4	109.9	E136 T887 K1063 I1065	E136-R889 VanDerWaalsContact CG-NH1 3.31Å; E136-R889 WeakPolarHBondContact OE1-CD 3.24Å; E136-R889 WeakPolarHBondContact OE1-CG 3.35Å; E136-R889 IonicContact OE1-CZ 3.83Å; E136-R889 IonicContact OE1-NE 2.59Å; E136-R889 IonicContact OE1-NH1 2.66Å; E136-R889 PolarHBondContact OE1-NH1 3.43Å; T887-R889 PolarHBondContact O-N 2.63Å; R889-K1063 VanDerWaalsContact CA-O 3.29Å; R889-K1063 WeakPolarHBondContact CA-O 3.23Å; R889-K1063 WeakPolarHBondContact CB-O 3.49Å; R889-K1063 VanDerWaalsContact CG-O 3.32Å; R889-K1063 WeakPolarHBondContact CG-O 3.2Å; R889-I1065 HydrophobicContact CB-CD1 4.26Å; R889-I1065 HydrophobicContact CB-CG1 4.23Å
890	S	51.8	Low	56.3	Low	51 Å²	51	66.8 Å²	66.8	36%	0.357	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	127.7	-176.1	88.2	0	0	0	0	111.6	C892 N1064 I1065	S890-C892 PolarHBondContact O-N 2.84Å; S890-C892 PolarHBondContact O-SG 2.84Å; S890-C892 VanDerWaalsContact O-SG 3.36Å; S890-C892 PolarHBondContact OG-SG 3.25Å; S890-C892 VanDerWaalsContact OG-SG 3.36Å; S890-N1064 WeakPolarHBondContact O-CA 3.2Å; S890-N1064 WeakPolarHBondContact O-CB 3.47Å; S890-N1064 PolarHBondContact OG-OD1 3.46Å; S890-I1065 PolarHBondContact O-N 3.47Å
891	I	54.2	Low	57.2	Low	103 Å²	103	61.1 Å²	61.1	53%	0.528	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	121.5	177.3	-57.2	174.8	0	0	0	108.6	I1065 I1067	I891-I1065 WeakPolarHBondContact CA-O 3.42Å; I891-I1065 HydrophobicContact CG1-CB 4.41Å; I891-I1067 HydrophobicContact CG2-CD1 3.64Å; I891-I1067 HydrophobicContact CG2-CG1 4.22Å
892	C	54.1	Low	57.9	Low	3 Å²	3	57 Å²	57	2%	0.02	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142.8	-174.1	-58.9	0	0	0	0	110.7	S890 K990 I1065 T1066 I1067	S890-C892 PolarHBondContact O-N 2.84Å; S890-C892 PolarHBondContact O-SG 2.84Å; S890-C892 VanDerWaalsContact O-SG 3.36Å; S890-C892 PolarHBondContact OG-SG 3.25Å; S890-C892 VanDerWaalsContact OG-SG 3.36Å; C892-K990 HydrophobicContact CB-CB 4.43Å; C892-K990 HydrophobicContact CB-CD 4.05Å; C892-K990 HydrophobicContact CB-CG 4.27Å; C892-K990 VanDerWaalsContact SG-CD 3.59Å; C892-K990 VanDerWaalsContact SG-CE 3.52Å; C892-K990 PolarHBondContact SG-NZ 3.47Å; C892-I1065 PolarHBondContact N-O 3.3Å; C892-T1066 WeakPolarHBondContact O-CA 3.3Å; C892-I1067 PolarHBondContact O-N 2.81Å
893	L	58.7	Low	59	Low	9 Å²	9	56 Å²	56	5%	0.047	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	125.1	177.2	-71	167.4	0	0	0	110.2	V95 F985 R988 I989 K990 I1067 L1069	V95-L893 HydrophobicContact CG2-CD1 4.11Å; V95-L893 HydrophobicContact CG2-CD2 3.68Å; V95-L893 HydrophobicContact CG2-CG 4.38Å; L893-F985 HydrophobicContact CD1-CD2 4.04Å; L893-F985 HydrophobicContact CD1-CE2 3.65Å; L893-F985 HydrophobicContact CD1-CZ 4.12Å; L893-R988 HydrophobicContact CD1-CB 4.32Å; L893-R988 PolarHBondContact N-O 2.88Å; L893-I989 HydrophobicContact CB-CG1 3.92Å; L893-I989 HydrophobicContact CD1-CG1 4.3Å; L893-I989 CarbonylContact O-C 3.58Å; L893-I989 WeakPolarHBondContact O-CA 3.19Å; L893-K990 PolarHBondContact O-N 3.18Å; L893-I1067 HydrophobicContact CD2-CB 4.17Å; L893-I1067 HydrophobicContact CD2-CG2 4.32Å; L893-L1069 HydrophobicContact CB-CD1 3.98Å; L893-L1069 HydrophobicContact CD1-CD1 4.27Å; L893-L1069 HydrophobicContact CD2-CD1 4.02Å; L893-L1069 HydrophobicContact CG-CD1 4.32Å
894	L	66.6	Low	60.7	Low	47 Å²	47	50.1 Å²	50.1	25%	0.246	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	103.8	178.1	176.9	64.6	0	0	0	109.5	I1060 I1067 P1068 L1069	L894-I1060 HydrophobicContact CD1-CD1 3.82Å; L894-I1067 PolarHBondContact N-O 3.48Å; L894-P1068 WeakPolarHBondContact O-CA 3.42Å; L894-L1069 PolarHBondContact O-N 3.4Å
895	A	68	Low	62.5	Low	2 Å²	2	46.9 Å²	46.9	2%	0.017	24%	0.24	C	C	.	.			trans	-83.7	155.9	170	0	0	0	0	0	111.4	I900 I989 L1069	A895-I900 HydrophobicContact CB-CD1 4.03Å; A895-I900 HydrophobicContact CB-CG1 4.09Å; A895-I989 HydrophobicContact CB-CG2 3.79Å; A895-L1069 HydrophobicContact CB-CD2 4.29Å
896	R	70.2	Confident	64.3	Low	100 Å²	100	40.6 Å²	40.6	38%	0.377	20%	0.199	S	C	.	.			trans	-84.6	153.4	171.9	-53.1	173.2	-64.4	-177.9	7.1	109.7	E898 D899 I900	R896-E898 VanDerWaalsContact C-N 3.28Å; R896-E898 PolarHBondContact O-N 3.45Å; R896-D899 VanDerWaalsContact CB-OD2 3.24Å; R896-D899 WeakPolarHBondContact CB-OD2 3.47Å; R896-D899 WeakPolarHBondContact CG-OD2 3.31Å; R896-D899 IonicContact CZ-OD1 2.69Å; R896-D899 IonicContact CZ-OD2 3.95Å; R896-D899 PolarHBondContact N-OD2 3.12Å; R896-D899 IonicContact NE-OD1 3.23Å; R896-D899 PolarHBondContact NE-OD1 3.28Å; R896-D899 IonicContact NE-OD2 3.8Å; R896-D899 PolarHBondContact NE-OD2 2.76Å; R896-D899 VanDerWaalsContact NE-OD2 3.14Å; R896-D899 IonicContact NH2-OD1 2.86Å; R896-D899 PolarHBondContact NH2-OD1 3.35Å; R896-D899 IonicContact NH2-OD2 2.92Å; R896-D899 WeakPolarHBondContact O-CB 3.32Å; R896-D899 PolarHBondContact O-N 3.5Å; R896-D899 VanDerWaalsContact O-N 3.16Å; R896-I900 PolarHBondContact O-N 3.1Å
897	P	72.9	Confident	66.4	Low	14 Å²	14	31.4 Å²	31.4	9%	0.091	16%	0.159	C	C	.	.	H	α-helix	trans	-59.6	-38.3	178.8	23.1	-32.2	0	0	0	112.1	D899 I900 L901 L998 T999	P897-D899 VanDerWaalsContact C-N 3.3Å; P897-D899 PolarHBondContact O-N 3.25Å; P897-I900 PolarHBondContact O-N 2.88Å; P897-L901 VanDerWaalsContact O-CG 3.24Å; P897-L901 WeakPolarHBondContact O-CG 3.46Å; P897-L901 PolarHBondContact O-N 2.83Å; P897-L998 HydrophobicContact CG-CD2 4.35Å; P897-T999 WeakPolarHBondContact CA-OG1 3.41Å; P897-T999 WeakPolarHBondContact CB-OG1 3.26Å
898	E	73.8	Confident	68.5	Low	36 Å²	36	28.7 Å²	28.7	17%	0.168	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-39.6	176.6	-63.9	87.5	168.6	0	0	112.6	R896 I900 L901 I902 R1081	R896-E898 VanDerWaalsContact C-N 3.28Å; R896-E898 PolarHBondContact O-N 3.45Å; E898-I900 VanDerWaalsContact C-N 3.31Å; E898-I900 PolarHBondContact O-N 2.83Å; E898-L901 PolarHBondContact O-N 3.05Å; E898-I902 WeakPolarHBondContact O-CG1 3.21Å; E898-I902 PolarHBondContact O-N 2.96Å; E898-R1081 IonicContact OE1-CZ 3.79Å; E898-R1081 VanDerWaalsContact OE1-CZ 3.23Å; E898-R1081 IonicContact OE1-NE 2.69Å; E898-R1081 PolarHBondContact OE1-NE 3.37Å; E898-R1081 IonicContact OE1-NH2 2.63Å; E898-R1081 PolarHBondContact OE1-NH2 3.02Å
899	D	72.2	Confident	70.6	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.5	-40.3	-178.1	-49.9	-22.6	0	0	0	111.2	F90 R896 P897 I903 I1071	F90-D899 HydrophobicContact CE1-CB 4.16Å; F90-D899 HydrophobicContact CZ-CB 4.42Å; R896-D899 VanDerWaalsContact CB-OD2 3.24Å; R896-D899 WeakPolarHBondContact CB-OD2 3.47Å; R896-D899 WeakPolarHBondContact CG-OD2 3.31Å; R896-D899 IonicContact CZ-OD1 2.69Å; R896-D899 IonicContact CZ-OD2 3.95Å; R896-D899 PolarHBondContact N-OD2 3.12Å; R896-D899 IonicContact NE-OD1 3.23Å; R896-D899 PolarHBondContact NE-OD1 3.28Å; R896-D899 IonicContact NE-OD2 3.8Å; R896-D899 PolarHBondContact NE-OD2 2.76Å; R896-D899 VanDerWaalsContact NE-OD2 3.14Å; R896-D899 IonicContact NH2-OD1 2.86Å; R896-D899 PolarHBondContact NH2-OD1 3.35Å; R896-D899 IonicContact NH2-OD2 2.92Å; R896-D899 WeakPolarHBondContact O-CB 3.32Å; R896-D899 PolarHBondContact O-N 3.5Å; R896-D899 VanDerWaalsContact O-N 3.16Å; P897-D899 VanDerWaalsContact C-N 3.3Å; P897-D899 PolarHBondContact O-N 3.25Å; D899-I903 PolarHBondContact O-N 3.39Å; D899-I1071 HydrophobicContact CB-CD1 3.85Å; D899-I1071 WeakPolarHBondContact OD1-CD1 3.35Å
900	I	77.4	Confident	72.4	Confident	2 Å²	2	19.9 Å²	19.9	1%	0.01	10%	0.099	C	C	.	.	H	α-helix	trans	-77.7	-33.3	-179.9	-60.8	177.7	0	0	0	111.2	A895 R896 P897 E898 I903 L904 L991 T999 L1048 F1052	A895-I900 HydrophobicContact CB-CD1 4.03Å; A895-I900 HydrophobicContact CB-CG1 4.09Å; R896-I900 PolarHBondContact O-N 3.1Å; P897-I900 PolarHBondContact O-N 2.88Å; E898-I900 VanDerWaalsContact C-N 3.31Å; E898-I900 PolarHBondContact O-N 2.83Å; I900-I903 CarbonylContact O-C 3.59Å; I900-I903 WeakPolarHBondContact O-CB 3.16Å; I900-I903 PolarHBondContact O-N 3.25Å; I900-L904 PolarHBondContact O-N 2.89Å; I900-L991 HydrophobicContact CD1-CD1 3.72Å; I900-L991 HydrophobicContact CD1-CD2 3.83Å; I900-L991 HydrophobicContact CD1-CG 4.01Å; I900-T999 HydrophobicContact CB-CG2 3.97Å; I900-T999 HydrophobicContact CG2-CG2 3.78Å; I900-L1048 HydrophobicContact CG2-CD1 3.89Å; I900-L1048 HydrophobicContact CG2-CD2 3.9Å; I900-F1052 HydrophobicContact CG1-CZ 4.12Å; I900-F1052 HydrophobicContact CG2-CE2 4.22Å; I900-F1052 HydrophobicContact CG2-CZ 4.28Å
901	L	78.1	Confident	74.1	Confident	3 Å²	3	18 Å²	18	2%	0.016	9%	0.085	C	C	.	.	H	α-helix	trans	-71.1	-33.9	175.5	-66.9	167.9	0	0	0	112.3	P897 E898 I903 L904 G905 T999 L1002 F1080 I1084	P897-L901 VanDerWaalsContact O-CG 3.24Å; P897-L901 WeakPolarHBondContact O-CG 3.46Å; P897-L901 PolarHBondContact O-N 2.83Å; E898-L901 PolarHBondContact O-N 3.05Å; L901-I903 VanDerWaalsContact C-N 3.3Å; L901-L904 HydrophobicContact CD2-CD2 4.2Å; L901-L904 PolarHBondContact O-N 3.17Å; L901-G905 PolarHBondContact O-N 3.1Å; L901-T999 HydrophobicContact CD2-CG2 4.45Å; L901-T999 HydrophobicContact CG-CG2 4.41Å; L901-L1002 HydrophobicContact CD1-CB 3.71Å; L901-L1002 HydrophobicContact CD1-CD1 4.05Å; L901-L1002 HydrophobicContact CD2-CB 4.34Å; L901-F1080 VanDerWaalsContact C-CZ 3.43Å; L901-F1080 HydrophobicContact CB-CE1 3.6Å; L901-F1080 HydrophobicContact CB-CZ 4.03Å; L901-F1080 VanDerWaalsContact O-CZ 3.23Å; L901-F1080 WeakPolarHBondContact O-CZ 3.33Å; L901-I1084 HydrophobicContact CD1-CD1 4.16Å
902	I	75.4	Confident	75.5	Confident	2 Å²	2	13.1 Å²	13.1	1%	0.01	6%	0.06	C	C	.	.	H	α-helix	trans	-59.3	-45	169.5	-72.3	164.5	0	0	0	109.7	E898 V906 L1076 F1080	E898-I902 WeakPolarHBondContact O-CG1 3.21Å; E898-I902 PolarHBondContact O-N 2.96Å; I902-V906 WeakPolarHBondContact O-CG2 3.45Å; I902-V906 PolarHBondContact O-N 3.2Å; I902-L1076 HydrophobicContact CD1-CD2 4.35Å; I902-L1076 HydrophobicContact CD1-CG 4.39Å; I902-L1076 HydrophobicContact CG2-CD2 4.48Å; I902-F1080 HydrophobicContact CD1-CB 4.36Å; I902-F1080 HydrophobicContact CD1-CG 4.39Å; I902-F1080 HydrophobicContact CG1-CB 4.08Å; I902-F1080 HydrophobicContact CG1-CD1 3.78Å; I902-F1080 HydrophobicContact CG1-CD2 3.75Å; I902-F1080 HydrophobicContact CG1-CE1 4.09Å; I902-F1080 HydrophobicContact CG1-CE2 4.06Å; I902-F1080 HydrophobicContact CG1-CG 3.6Å; I902-F1080 HydrophobicContact CG1-CZ 4.23Å
903	I	77	Confident	77	Confident	3 Å²	3	13.1 Å²	13.1	2%	0.015	6%	0.06	C	C	.	.	H	α-helix	trans	-54.3	-66.5	167.6	-82.4	171.1	0	0	0	108.4	F90 D899 I900 L901 G905 V906 Q907 F986 L1048 F1052	F90-I903 HydrophobicContact CD2-CD1 4.27Å; F90-I903 HydrophobicContact CE2-CD1 3.39Å; F90-I903 HydrophobicContact CE2-CG1 3.75Å; F90-I903 HydrophobicContact CZ-CD1 3.56Å; F90-I903 HydrophobicContact CZ-CG1 4.03Å; D899-I903 PolarHBondContact O-N 3.39Å; I900-I903 CarbonylContact O-C 3.59Å; I900-I903 WeakPolarHBondContact O-CB 3.16Å; I900-I903 PolarHBondContact O-N 3.25Å; L901-I903 VanDerWaalsContact C-N 3.3Å; I903-G905 VanDerWaalsContact C-N 3.26Å; I903-G905 PolarHBondContact O-N 3.27Å; I903-V906 VanDerWaalsContact O-CB 3.27Å; I903-V906 WeakPolarHBondContact O-CB 3.45Å; I903-V906 PolarHBondContact O-N 3.33Å; I903-Q907 HydrophobicContact CG2-CG 4.18Å; I903-Q907 WeakPolarHBondContact O-CG 3.27Å; I903-F986 HydrophobicContact CD1-CE1 4.4Å; I903-L1048 HydrophobicContact CG2-CD2 4.14Å; I903-F1052 HydrophobicContact CB-CE2 4.47Å; I903-F1052 HydrophobicContact CB-CZ 4.47Å; I903-F1052 HydrophobicContact CD1-CE1 4.33Å; I903-F1052 HydrophobicContact CD1-CE2 4.09Å; I903-F1052 HydrophobicContact CD1-CZ 3.52Å; I903-F1052 HydrophobicContact CG2-CE2 3.85Å; I903-F1052 HydrophobicContact CG2-CZ 4.31Å
904	L	82.2	Confident	78.3	Confident	1 Å²	1	14.7 Å²	14.7	1%	0.005	7%	0.068	C	C	.	.	H	α-helix	trans	-45.2	-43.2	-177.2	178.4	55.6	0	0	0	115.8	I900 L901 Q907 L908 L1006 T1007 C1044 P1236	I900-L904 PolarHBondContact O-N 2.89Å; L901-L904 HydrophobicContact CD2-CD2 4.2Å; L901-L904 PolarHBondContact O-N 3.17Å; L904-Q907 PolarHBondContact O-N 3.34Å; L904-Q907 VanDerWaalsContact O-N 3.16Å; L904-L908 HydrophobicContact CD1-CD1 4.38Å; L904-L908 HydrophobicContact CD1-CG 4.4Å; L904-L908 HydrophobicContact CG-CD1 4.4Å; L904-L908 PolarHBondContact O-N 3.47Å; L904-L1006 HydrophobicContact CG-CD2 4.42Å; L904-T1007 HydrophobicContact CD1-CG2 3.86Å; L904-T1007 HydrophobicContact CD2-CG2 3.78Å; L904-T1007 HydrophobicContact CG-CG2 4.05Å; L904-C1044 WeakPolarHBondContact CD1-O 3.29Å; L904-C1044 HydrophobicContact CD2-CB 3.58Å; L904-P1236 HydrophobicContact CD1-CG 4.05Å
905	G	79.1	Confident	79.2	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-65.8	-40.4	179.8	0	0	0	0	0	114.8	L901 I903 Q907	L901-G905 PolarHBondContact O-N 3.1Å; I903-G905 VanDerWaalsContact C-N 3.26Å; I903-G905 PolarHBondContact O-N 3.27Å; G905-Q907 PolarHBondContact O-N 3.34Å
906	V	77.4	Confident	80.1	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-50.8	-26	171.9	158.8	0	0	0	0	111.4	L76 V86 I902 I903 E909 L977	L76-V906 HydrophobicContact CD1-CG2 3.47Å; L76-V906 VanDerWaalsContact CD1-CG2 3.47Å; V86-V906 HydrophobicContact CG1-CG2 4.11Å; I902-V906 WeakPolarHBondContact O-CG2 3.45Å; I902-V906 PolarHBondContact O-N 3.2Å; I903-V906 VanDerWaalsContact O-CB 3.27Å; I903-V906 WeakPolarHBondContact O-CB 3.45Å; I903-V906 PolarHBondContact O-N 3.33Å; V906-E909 WeakPolarHBondContact O-CB 3.46Å; V906-L977 HydrophobicContact CB-CD1 4.44Å; V906-L977 HydrophobicContact CB-CD2 4.07Å; V906-L977 HydrophobicContact CG1-CB 3.71Å; V906-L977 HydrophobicContact CG1-CD1 3.66Å; V906-L977 HydrophobicContact CG1-CD2 3.56Å; V906-L977 HydrophobicContact CG1-CG 3.79Å; V906-L977 HydrophobicContact CG2-CD2 3.7Å; V906-L977 WeakPolarHBondContact O-CD1 3.2Å
907	Q	82.4	Confident	80.9	Confident	7 Å²	7	9.9 Å²	9.9	3%	0.033	5%	0.048	C	C	.	.	H	α-helix	trans	-118.5	-17.6	-151.6	-41.8	-103.2	-28.9	0	0	113.6	I903 L904 G905 E909 N1234 F1235	I903-Q907 HydrophobicContact CG2-CG 4.18Å; I903-Q907 WeakPolarHBondContact O-CG 3.27Å; L904-Q907 PolarHBondContact O-N 3.34Å; L904-Q907 VanDerWaalsContact O-N 3.16Å; G905-Q907 PolarHBondContact O-N 3.34Å; Q907-E909 VanDerWaalsContact C-N 3.32Å; Q907-N1234 WeakPolarHBondContact CA-O 3.49Å; Q907-N1234 WeakPolarHBondContact CB-O 3.37Å; Q907-N1234 VanDerWaalsContact CD-C 3.4Å; Q907-N1234 WeakPolarHBondContact CG-O 3.47Å; Q907-N1234 PolarHBondContact OE1-O 2.71Å; Q907-F1235 VanDerWaalsContact CB-CA 3.4Å; Q907-F1235 VanDerWaalsContact OE1-CA 3.29Å; Q907-F1235 PolarHBondContact OE1-O 3.26Å
908	L	84.2	Confident	81.4	Confident	0 Å²	0	12 Å²	12	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-65.5	-33.7	151.6	-65.5	160.6	0	0	0	111.8	L904 Y910 L911 E912 L1006 T1007 F1010 L1043	L904-L908 HydrophobicContact CD1-CD1 4.38Å; L904-L908 HydrophobicContact CD1-CG 4.4Å; L904-L908 HydrophobicContact CG-CD1 4.4Å; L904-L908 PolarHBondContact O-N 3.47Å; L908-Y910 PolarHBondContact O-N 3.41Å; L908-L911 PolarHBondContact O-N 3.44Å; L908-L911 VanDerWaalsContact O-N 3.1Å; L908-E912 PolarHBondContact O-N 3.37Å; L908-E912 VanDerWaalsContact O-N 3.09Å; L908-L1006 HydrophobicContact CD1-CD2 3.46Å; L908-L1006 VanDerWaalsContact CD1-CD2 3.46Å; L908-T1007 HydrophobicContact CD1-CG2 3.75Å; L908-T1007 HydrophobicContact CD2-CG2 4.14Å; L908-T1007 HydrophobicContact CG-CG2 4.4Å; L908-F1010 HydrophobicContact CB-CD1 3.7Å; L908-F1010 HydrophobicContact CB-CD2 4.36Å; L908-F1010 HydrophobicContact CB-CE1 3.8Å; L908-F1010 HydrophobicContact CB-CE2 4.44Å; L908-F1010 HydrophobicContact CB-CG 4.01Å; L908-F1010 HydrophobicContact CB-CZ 4.18Å; L908-F1010 HydrophobicContact CD1-CB 4.05Å; L908-F1010 HydrophobicContact CD1-CG 4.17Å; L908-L1043 HydrophobicContact CD2-CD2 4.07Å; L908-L1043 HydrophobicContact CD2-CG 4.39Å
909	E	82.1	Confident	82	Confident	4 Å²	4	10.9 Å²	10.9	2%	0.019	6%	0.058	C	C	.	.	H	α-helix	trans	-60.1	-34.4	178	-170.3	174.1	146.8	0	0	111.6	S74 F75 V906 Q907 E912 L913 R973 F1010 L1232	S74-E909 VanDerWaalsContact CA-OE1 3.27Å; S74-E909 WeakPolarHBondContact CA-OE1 3.3Å; S74-E909 VanDerWaalsContact CA-OE2 3.25Å; S74-E909 WeakPolarHBondContact CA-OE2 3.37Å; S74-E909 WeakPolarHBondContact CB-OE1 3.4Å; S74-E909 WeakPolarHBondContact CB-OE2 3.17Å; S74-E909 VanDerWaalsContact OG-CD 3.31Å; S74-E909 PolarHBondContact OG-OE1 3.41Å; S74-E909 VanDerWaalsContact OG-OE1 3.1Å; S74-E909 PolarHBondContact OG-OE2 3.38Å; F75-E909 PolarHBondContact N-OE2 2.58Å; V906-E909 WeakPolarHBondContact O-CB 3.46Å; Q907-E909 VanDerWaalsContact C-N 3.32Å; E909-E912 PolarHBondContact O-N 3Å; E909-L913 PolarHBondContact O-N 3.32Å; E909-R973 IonicContact OE1-CZ 2.92Å; E909-R973 IonicContact OE1-NE 2.7Å; E909-R973 IonicContact OE1-NH2 3.82Å; E909-R973 PolarHBondContact OE1-NH2 2.91Å; E909-F1010 HydrophobicContact CB-CZ 4.38Å; E909-L1232 HydrophobicContact CG-CD2 3.88Å; E909-L1232 WeakPolarHBondContact OE1-CD2 3.34Å
910	Y	83.3	Confident	82.5	Confident	31 Å²	31	11 Å²	11	12%	0.122	6%	0.058	C	C	.	.	H	α-helix	trans	-72.1	-35.1	174.9	-172.5	-110.9	0	0	0	114.1	L908 E912 L913 N914 Y970 A974 P1233 N1234 F1235	L908-Y910 PolarHBondContact O-N 3.41Å; Y910-E912 VanDerWaalsContact C-N 3.31Å; Y910-E912 PolarHBondContact O-N 3.35Å; Y910-L913 HydrophobicContact CD2-CD2 4.24Å; Y910-L913 PolarHBondContact O-N 2.98Å; Y910-N914 VanDerWaalsContact CD1-ND2 3.31Å; Y910-N914 WeakPolarHBondContact CD1-ND2 3.32Å; Y910-N914 WeakPolarHBondContact CE1-ND2 3.28Å; Y910-N914 VanDerWaalsContact O-CG 3.23Å; Y910-N914 PolarHBondContact O-N 3.05Å; Y910-N914 PolarHBondContact O-ND2 2.89Å; Y910-Y970 HydrophobicContact CE2-CE2 4.34Å; Y910-Y970 PolarHBondContact OH-OH 3.23Å; Y910-A974 HydrophobicContact CE2-CB 4.17Å; Y910-P1233 HydrophobicContact CD2-CB 3.18Å; Y910-P1233 HydrophobicContact CE2-CB 3.28Å; Y910-P1233 HydrophobicContact CE2-CG 4.27Å; Y910-P1233 HydrophobicContact CG-CB 3.99Å; Y910-N1234 VanDerWaalsContact CB-N 3.34Å; Y910-N1234 WeakPolarHBondContact CD1-OD1 3.47Å; Y910-N1234 WeakPolarHBondContact CE1-OD1 3.49Å; Y910-N1234 VanDerWaalsContact CZ-OD1 3.25Å; Y910-F1235 HydrophobicContact CD1-CD2 4.16Å; Y910-F1235 HydrophobicContact CD1-CE1 4.01Å; Y910-F1235 AromaticContact CD1-CE2 3.48Å; Y910-F1235 HydrophobicContact CD1-CE2 3.48Å; Y910-F1235 VanDerWaalsContact CD1-CE2 3.48Å; Y910-F1235 AromaticContact CD1-CZ 3.4Å; Y910-F1235 HydrophobicContact CD1-CZ 3.4Å; Y910-F1235 HydrophobicContact CE1-CD2 4.28Å; Y910-F1235 HydrophobicContact CE1-CE1 4.41Å; Y910-F1235 AromaticContact CE1-CE2 3.29Å; Y910-F1235 HydrophobicContact CE1-CE2 3.29Å; Y910-F1235 AromaticContact CE1-CZ 3.39Å; Y910-F1235 HydrophobicContact CE1-CZ 3.39Å
911	L	86	Confident	82.9	Confident	10 Å²	10	13.1 Å²	13.1	5%	0.052	7%	0.068	C	C	.	.	H	α-helix	trans	-62.2	-41.1	172.4	-71.8	-178.9	0	0	0	111.3	L908 N914 L915 W1029 F1033 F1235 L1237	L908-L911 PolarHBondContact O-N 3.44Å; L908-L911 VanDerWaalsContact O-N 3.1Å; L911-N914 PolarHBondContact O-N 3.48Å; L911-L915 PolarHBondContact O-N 2.73Å; L911-W1029 HydrophobicContact CD1-CZ2 4.42Å; L911-F1033 HydrophobicContact CD2-CZ 3.97Å; L911-F1235 HydrophobicContact CD2-CE1 3.82Å; L911-F1235 HydrophobicContact CG-CE1 4.47Å; L911-L1237 HydrophobicContact CD1-CD2 3.49Å; L911-L1237 VanDerWaalsContact CD1-CD2 3.49Å
912	E	85	Confident	83.2	Confident	2 Å²	2	17 Å²	17	1%	0.009	9%	0.089	C	C	.	.	H	α-helix	trans	-62.5	-43.8	171.9	-169.8	-163.8	170.1	0	0	111.6	L908 E909 Y910 N914 L915 W916 F1010 R1014 R1018	L908-E912 PolarHBondContact O-N 3.37Å; L908-E912 VanDerWaalsContact O-N 3.09Å; E909-E912 PolarHBondContact O-N 3Å; Y910-E912 VanDerWaalsContact C-N 3.31Å; Y910-E912 PolarHBondContact O-N 3.35Å; E912-N914 VanDerWaalsContact C-N 3.3Å; E912-N914 PolarHBondContact O-N 3.24Å; E912-L915 CarbonylContact O-C 3.38Å; E912-L915 WeakPolarHBondContact O-CB 3.17Å; E912-L915 PolarHBondContact O-N 3.24Å; E912-L915 VanDerWaalsContact O-N 3.08Å; E912-W916 PolarHBondContact O-N 2.96Å; E912-F1010 HydrophobicContact CB-CE1 4.2Å; E912-R1014 IonicContact OE1-NE 3.93Å; E912-R1014 IonicContact OE1-NH2 3.72Å; E912-R1014 IonicContact OE2-CZ 3.98Å; E912-R1014 IonicContact OE2-NE 2.7Å; E912-R1014 PolarHBondContact OE2-NE 3.36Å; E912-R1014 IonicContact OE2-NH2 3.14Å; E912-R1014 PolarHBondContact OE2-NH2 3.39Å; E912-R1018 VanDerWaalsContact CG-NE 3.33Å; E912-R1018 IonicContact OE1-CZ 2.68Å; E912-R1018 VanDerWaalsContact OE1-CZ 3.24Å; E912-R1018 IonicContact OE1-NE 2.61Å; E912-R1018 PolarHBondContact OE1-NE 3.23Å; E912-R1018 IonicContact OE1-NH2 3.38Å; E912-R1018 PolarHBondContact OE1-NH2 2.82Å
913	L	84.5	Confident	83.6	Confident	3 Å²	3	18 Å²	18	2%	0.016	9%	0.094	C	C	.	.	H	α-helix	trans	-61.8	-37.3	-179.3	-172	70.6	0	0	0	112.6	L71 E909 Y910 L915 W916 K917 Y970 R973	L71-L913 HydrophobicContact CD2-CD1 4.07Å; E909-L913 PolarHBondContact O-N 3.32Å; Y910-L913 HydrophobicContact CD2-CD2 4.24Å; Y910-L913 PolarHBondContact O-N 2.98Å; L913-L915 VanDerWaalsContact C-N 3.33Å; L913-L915 PolarHBondContact O-N 3.21Å; L913-W916 HydrophobicContact CD1-CD2 4.43Å; L913-W916 HydrophobicContact CD1-CE3 3.87Å; L913-W916 HydrophobicContact CD1-CZ3 4.48Å; L913-W916 PolarHBondContact O-N 3.19Å; L913-K917 PolarHBondContact O-N 3.18Å; L913-Y970 HydrophobicContact CD2-CD2 3.81Å; L913-Y970 HydrophobicContact CD2-CE2 3.97Å; L913-Y970 HydrophobicContact CG-CD2 3.78Å; L913-Y970 HydrophobicContact CG-CE2 4.01Å; L913-R973 HydrophobicContact CD1-CB 4.29Å; L913-R973 HydrophobicContact CD1-CG 3.91Å; L913-R973 HydrophobicContact CD2-CB 3.85Å; L913-R973 HydrophobicContact CD2-CG 3.81Å; L913-R973 WeakPolarHBondContact CD2-O 3.12Å
914	N	87.2	Confident	83.9	Confident	42 Å²	42	17.9 Å²	17.9	23%	0.225	9%	0.093	C	C	.	.	H	α-helix	trans	-63.1	-38.4	173.8	-66.3	-35	0	0	0	112	Y910 L911 E912 S918 Y970	Y910-N914 VanDerWaalsContact CD1-ND2 3.31Å; Y910-N914 WeakPolarHBondContact CD1-ND2 3.32Å; Y910-N914 WeakPolarHBondContact CE1-ND2 3.28Å; Y910-N914 VanDerWaalsContact O-CG 3.23Å; Y910-N914 PolarHBondContact O-N 3.05Å; Y910-N914 PolarHBondContact O-ND2 2.89Å; L911-N914 PolarHBondContact O-N 3.48Å; E912-N914 VanDerWaalsContact C-N 3.3Å; E912-N914 PolarHBondContact O-N 3.24Å; N914-S918 PolarHBondContact O-N 2.82Å; N914-S918 VanDerWaalsContact O-N 3.16Å; N914-S918 PolarHBondContact O-OG 3.24Å; N914-Y970 VanDerWaalsContact OD1-CE2 3.29Å; N914-Y970 WeakPolarHBondContact OD1-CE2 3.26Å; N914-Y970 PolarHBondContact OD1-OH 2.94Å
915	L	85.1	Confident	84.1	Confident	13 Å²	13	21.6 Å²	21.6	7%	0.068	11%	0.109	C	C	.	.	H	α-helix	trans	-71.3	-40.9	174.1	-68.5	172	0	0	0	111.9	L911 E912 L913 K917 S918 Q919 I1015 R1018 I1019 L1022	L911-L915 PolarHBondContact O-N 2.73Å; E912-L915 CarbonylContact O-C 3.38Å; E912-L915 WeakPolarHBondContact O-CB 3.17Å; E912-L915 PolarHBondContact O-N 3.24Å; E912-L915 VanDerWaalsContact O-N 3.08Å; L913-L915 VanDerWaalsContact C-N 3.33Å; L913-L915 PolarHBondContact O-N 3.21Å; L915-K917 PolarHBondContact O-N 3.48Å; L915-S918 WeakPolarHBondContact O-CB 3.2Å; L915-S918 PolarHBondContact O-N 3.39Å; L915-Q919 WeakPolarHBondContact O-CB 3.42Å; L915-Q919 PolarHBondContact O-N 2.96Å; L915-I1015 HydrophobicContact CD1-CG2 3.6Å; L915-R1018 HydrophobicContact CB-CB 4.28Å; L915-I1019 HydrophobicContact CD1-CG1 4.07Å; L915-I1019 HydrophobicContact CD2-CG1 4.5Å; L915-L1022 HydrophobicContact CB-CD1 4.5Å; L915-L1022 HydrophobicContact CD2-CD1 4.01Å
916	W	86.1	Confident	84.4	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-59.5	-43.7	173.4	171.3	92.6	0	0	0	111.5	V69 Q70 L71 P72 E912 L913 S918 Q919 M920 I966	V69-W916 HydrophobicContact CG1-CH2 3.67Å; V69-W916 HydrophobicContact CG1-CZ2 3.89Å; Q70-W916 WeakPolarHBondContact O-CZ2 3.25Å; Q70-W916 PolarHBondContact O-NE1 3.01Å; L71-W916 HydrophobicContact CD2-CE3 4.16Å; L71-W916 HydrophobicContact CD2-CH2 3.49Å; L71-W916 VanDerWaalsContact CD2-CH2 3.49Å; L71-W916 HydrophobicContact CD2-CZ2 3.84Å; L71-W916 HydrophobicContact CD2-CZ3 3.66Å; L71-W916 HydrophobicContact CG-CH2 4.34Å; L71-W916 HydrophobicContact CG-CZ2 4.36Å; P72-W916 HydrophobicContact CG-CB 3.88Å; P72-W916 HydrophobicContact CG-CD2 4.41Å; P72-W916 HydrophobicContact CG-CG 3.7Å; E912-W916 PolarHBondContact O-N 2.96Å; L913-W916 HydrophobicContact CD1-CD2 4.43Å; L913-W916 HydrophobicContact CD1-CE3 3.87Å; L913-W916 HydrophobicContact CD1-CZ3 4.48Å; L913-W916 PolarHBondContact O-N 3.19Å; W916-S918 PolarHBondContact O-N 3.44Å; W916-Q919 WeakPolarHBondContact O-CB 3.44Å; W916-Q919 PolarHBondContact O-N 3.46Å; W916-M920 HydrophobicContact CD2-CG 4.03Å; W916-M920 HydrophobicContact CG-CG 4.49Å; W916-M920 HydrophobicContact CH2-CG 4.19Å; W916-M920 HydrophobicContact CZ2-CG 3.66Å; W916-M920 WeakPolarHBondContact O-CG 3.42Å; W916-M920 PolarHBondContact O-N 3.1Å; W916-I966 HydrophobicContact CH2-CG2 4.35Å; W916-I966 HydrophobicContact CZ3-CG2 4.15Å
917	K	87.2	Confident	84.6	Confident	32 Å²	32	25 Å²	25	14%	0.139	12%	0.124	C	C	.	.	H	α-helix	trans	-56.6	-52.1	174	175.9	176.9	178.6	176.1	0	110.2	L913 L915 Q919 M920 E921 I966 E967 Y970	L913-K917 PolarHBondContact O-N 3.18Å; L915-K917 PolarHBondContact O-N 3.48Å; K917-Q919 VanDerWaalsContact C-N 3.29Å; K917-Q919 PolarHBondContact O-N 2.99Å; K917-M920 PolarHBondContact O-N 3.16Å; K917-E921 WeakPolarHBondContact CE-OE1 3.17Å; K917-E921 HydrophobicContact CG-CG 4.49Å; K917-E921 WeakPolarHBondContact O-CG 3.5Å; K917-E921 PolarHBondContact O-N 3.15Å; K917-I966 HydrophobicContact CG-CG2 4.08Å; K917-E967 WeakPolarHBondContact CE-OE2 3.42Å; K917-E967 IonicContact NZ-OE1 2.69Å; K917-E967 PolarHBondContact NZ-OE1 3.36Å; K917-E967 IonicContact NZ-OE2 2.73Å; K917-E967 PolarHBondContact NZ-OE2 2.66Å; K917-Y970 HydrophobicContact CB-CD2 3.92Å; K917-Y970 HydrophobicContact CB-CE2 4.33Å; K917-Y970 HydrophobicContact CD-CD1 4.01Å; K917-Y970 HydrophobicContact CD-CD2 3.78Å; K917-Y970 HydrophobicContact CD-CE1 4.25Å; K917-Y970 HydrophobicContact CD-CE2 4.03Å; K917-Y970 HydrophobicContact CD-CG 3.78Å; K917-Y970 HydrophobicContact CG-CD2 4.34Å
918	S	84.8	Confident	84.6	Confident	58 Å²	58	25.8 Å²	25.8	41%	0.406	13%	0.128	S	C	.	.	H	α-helix	trans	-57.6	-41.2	178.5	-54.6	0	0	0	0	112.3	N914 L915 W916 L922	N914-S918 PolarHBondContact O-N 2.82Å; N914-S918 VanDerWaalsContact O-N 3.16Å; N914-S918 PolarHBondContact O-OG 3.24Å; L915-S918 WeakPolarHBondContact O-CB 3.2Å; L915-S918 PolarHBondContact O-N 3.39Å; W916-S918 PolarHBondContact O-N 3.44Å; S918-L922 PolarHBondContact O-N 2.72Å; S918-L922 VanDerWaalsContact O-N 3.13Å
919	Q	84.9	Confident	84.5	Confident	13 Å²	13	29.5 Å²	29.5	6%	0.061	15%	0.148	C	C	.	.	H	α-helix	trans	-63.9	-47.1	177.2	-171.9	-173	-5.8	0	0	111.4	L915 W916 K917 L922 I923 L1022	L915-Q919 WeakPolarHBondContact O-CB 3.42Å; L915-Q919 PolarHBondContact O-N 2.96Å; W916-Q919 WeakPolarHBondContact O-CB 3.44Å; W916-Q919 PolarHBondContact O-N 3.46Å; K917-Q919 VanDerWaalsContact C-N 3.29Å; K917-Q919 PolarHBondContact O-N 2.99Å; Q919-L922 PolarHBondContact O-N 2.64Å; Q919-I923 WeakPolarHBondContact O-CG1 3.37Å; Q919-I923 PolarHBondContact O-N 3.43Å; Q919-L1022 HydrophobicContact CB-CD2 4.29Å; Q919-L1022 HydrophobicContact CB-CG 4.36Å
920	M	82.3	Confident	84.5	Confident	3 Å²	3	31 Å²	31	2%	0.015	16%	0.158	C	C	.	.	H	α-helix	trans	-67.9	-38.2	178.9	-65.9	-56.6	97	0	0	112.1	V23 W916 K917 L922 I923 A924 I966	V23-M920 HydrophobicContact CB-CE 3.97Å; V23-M920 HydrophobicContact CG1-CE 3.98Å; V23-M920 HydrophobicContact CG1-SD 4.16Å; V23-M920 HydrophobicContact CG2-CE 3.74Å; V23-M920 HydrophobicContact CG2-SD 4.48Å; W916-M920 HydrophobicContact CD2-CG 4.03Å; W916-M920 HydrophobicContact CG-CG 4.49Å; W916-M920 HydrophobicContact CH2-CG 4.19Å; W916-M920 HydrophobicContact CZ2-CG 3.66Å; W916-M920 WeakPolarHBondContact O-CG 3.42Å; W916-M920 PolarHBondContact O-N 3.1Å; K917-M920 PolarHBondContact O-N 3.16Å; M920-L922 VanDerWaalsContact C-N 3.3Å; M920-L922 PolarHBondContact O-N 2.87Å; M920-I923 HydrophobicContact CE-CD1 3.78Å; M920-I923 PolarHBondContact O-N 2.82Å; M920-A924 WeakPolarHBondContact O-CB 3.04Å; M920-A924 PolarHBondContact O-N 2.94Å; M920-I966 HydrophobicContact CB-CD1 3.7Å; M920-I966 HydrophobicContact CB-CG1 3.94Å; M920-I966 HydrophobicContact CB-CG2 4.08Å
921	E	85.8	Confident	84.3	Confident	47 Å²	47	30.3 Å²	30.3	22%	0.22	16%	0.155	C	C	.	.	H	α-helix	trans	-61	-38.1	174.2	-75.4	-160.7	-143.5	0	0	112.4	K917 A924 K925 L963	K917-E921 WeakPolarHBondContact CE-OE1 3.17Å; K917-E921 HydrophobicContact CG-CG 4.49Å; K917-E921 WeakPolarHBondContact O-CG 3.5Å; K917-E921 PolarHBondContact O-N 3.15Å; E921-A924 PolarHBondContact O-N 3.04Å; E921-K925 WeakPolarHBondContact O-CB 3.03Å; E921-K925 VanDerWaalsContact O-CD 3.31Å; E921-K925 WeakPolarHBondContact O-CD 3.45Å; E921-K925 WeakPolarHBondContact O-CG 3.07Å; E921-K925 PolarHBondContact O-N 2.88Å; E921-K925 IonicContact OE2-NZ 2.61Å; E921-K925 PolarHBondContact OE2-NZ 2.45Å; E921-L963 HydrophobicContact CB-CD2 3.91Å; E921-L963 HydrophobicContact CG-CD2 3.6Å
922	L	85	Confident	84	Confident	85 Å²	85	33.3 Å²	33.3	45%	0.445	17%	0.171	S	C	.	.	H	α-helix	trans	-67.4	-43.7	178.1	-168.6	152.9	0	0	0	111.2	S918 Q919 M920 A924 K925 K926 L1022	S918-L922 PolarHBondContact O-N 2.72Å; S918-L922 VanDerWaalsContact O-N 3.13Å; Q919-L922 PolarHBondContact O-N 2.64Å; M920-L922 VanDerWaalsContact C-N 3.3Å; M920-L922 PolarHBondContact O-N 2.87Å; L922-A924 PolarHBondContact O-N 2.9Å; L922-K925 PolarHBondContact O-N 3.09Å; L922-K926 PolarHBondContact O-N 3.1Å; L922-L1022 HydrophobicContact CD1-CD2 4.12Å
923	I	84.1	Confident	83.7	Confident	23 Å²	23	39 Å²	39	12%	0.118	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-38.7	175.3	-61.1	172.9	0	0	0	111.1	W64 F67 Q919 M920 K925 K926	W64-I923 HydrophobicContact CH2-CG2 4.44Å; W64-I923 HydrophobicContact CZ2-CG2 3.76Å; W64-I923 PolarHBondContact NE1-O 3.29Å; W64-I923 VanDerWaalsContact NE1-O 3.13Å; F67-I923 HydrophobicContact CE2-CG2 4.15Å; Q919-I923 WeakPolarHBondContact O-CG1 3.37Å; Q919-I923 PolarHBondContact O-N 3.43Å; M920-I923 HydrophobicContact CE-CD1 3.78Å; M920-I923 PolarHBondContact O-N 2.82Å; I923-K925 VanDerWaalsContact C-N 3.31Å; I923-K925 PolarHBondContact O-N 3.24Å; I923-K926 WeakPolarHBondContact O-CB 2.94Å; I923-K926 PolarHBondContact O-N 3.08Å
924	A	83.8	Confident	83.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.7	-30.6	175.6	0	0	0	0	0	113.4	F67 M920 E921 L922 T959 W962 L963 I966	F67-A924 HydrophobicContact CE2-CB 4.14Å; F67-A924 HydrophobicContact CZ-CB 3.97Å; M920-A924 WeakPolarHBondContact O-CB 3.04Å; M920-A924 PolarHBondContact O-N 2.94Å; E921-A924 PolarHBondContact O-N 3.04Å; L922-A924 PolarHBondContact O-N 2.9Å; A924-T959 VanDerWaalsContact O-CB 3.25Å; A924-T959 WeakPolarHBondContact O-CB 3.17Å; A924-T959 PolarHBondContact O-OG1 3.1Å; A924-T959 VanDerWaalsContact O-OG1 3.07Å; A924-W962 HydrophobicContact CB-CB 4.09Å; A924-W962 HydrophobicContact CB-CE3 4.42Å; A924-L963 HydrophobicContact CB-CD2 4.22Å; A924-I966 HydrophobicContact CB-CD1 4.12Å
925	K	86.5	Confident	82.5	Confident	79 Å²	79	40.8 Å²	40.8	34%	0.343	21%	0.206	S	C	.	.	H	α-helix	trans	-83.9	-21.5	177.3	-68.4	162.5	-165.2	167.3	0	113.2	E921 L922 I923 I928 N929	E921-K925 WeakPolarHBondContact O-CB 3.03Å; E921-K925 VanDerWaalsContact O-CD 3.31Å; E921-K925 WeakPolarHBondContact O-CD 3.45Å; E921-K925 WeakPolarHBondContact O-CG 3.07Å; E921-K925 PolarHBondContact O-N 2.88Å; E921-K925 IonicContact OE2-NZ 2.61Å; E921-K925 PolarHBondContact OE2-NZ 2.45Å; L922-K925 PolarHBondContact O-N 3.09Å; I923-K925 VanDerWaalsContact C-N 3.31Å; I923-K925 PolarHBondContact O-N 3.24Å; K925-I928 WeakPolarHBondContact O-CB 3.07Å; K925-I928 PolarHBondContact O-N 3.36Å; K925-N929 PolarHBondContact O-N 3.29Å; K925-N929 VanDerWaalsContact O-N 3.16Å
926	K	84.9	Confident	81.8	Confident	67 Å²	67	46.9 Å²	46.9	29%	0.291	23%	0.234	S	C	.	.	H	α-helix	trans	-45.5	-48.1	-178	-170.5	170.8	-179.2	171.6	0	116.1	E25 W64 L922 I923 I928 N929 V930	E25-K926 IonicContact OE1-NZ 3.22Å; E25-K926 PolarHBondContact OE1-NZ 3.07Å; E25-K926 IonicContact OE2-NZ 2.71Å; W64-K926 HydrophobicContact CZ2-CB 4.38Å; W64-K926 HydrophobicContact CZ2-CD 4.44Å; L922-K926 PolarHBondContact O-N 3.1Å; I923-K926 WeakPolarHBondContact O-CB 2.94Å; I923-K926 PolarHBondContact O-N 3.08Å; K926-I928 VanDerWaalsContact C-N 3.31Å; K926-I928 PolarHBondContact O-N 3.15Å; K926-N929 PolarHBondContact O-N 3.39Å; K926-V930 WeakPolarHBondContact O-CG2 3.32Å; K926-V930 PolarHBondContact O-N 2.95Å
927	P	82.4	Confident	81	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.019	26%	0.258	C	S	.	.	H	α-helix	trans	-67.4	-27.5	180	25.5	-34.5	0	0	0	113.7	F62 Y931 L955 W962	F62-P927 HydrophobicContact CE2-CB 4.22Å; F62-P927 HydrophobicContact CZ-CB 4.39Å; F62-P927 WeakPolarHBondContact O-CB 3.1Å; P927-Y931 WeakPolarHBondContact O-CB 3.4Å; P927-Y931 PolarHBondContact O-N 2.86Å; P927-L955 HydrophobicContact CB-CD2 4.1Å; P927-W962 HydrophobicContact CG-CZ3 4.09Å
928	I	81.1	Confident	79.9	Confident	24 Å²	24	50.7 Å²	50.7	12%	0.123	26%	0.262	C	S	.	.	H	α-helix	trans	-71.4	-40.3	172.3	-65.3	175.9	0	0	0	110.3	K925 K926 Y931 N932 L955 T959	K925-I928 WeakPolarHBondContact O-CB 3.07Å; K925-I928 PolarHBondContact O-N 3.36Å; K926-I928 VanDerWaalsContact C-N 3.31Å; K926-I928 PolarHBondContact O-N 3.15Å; I928-Y931 PolarHBondContact O-N 2.94Å; I928-N932 PolarHBondContact O-N 3.43Å; I928-N932 PolarHBondContact O-ND2 3.15Å; I928-L955 HydrophobicContact CG1-CB 4.2Å; I928-T959 HydrophobicContact CD1-CG2 3.5Å
929	N	82.8	Confident	78.6	Confident	78 Å²	78	52.8 Å²	52.8	42%	0.417	28%	0.277	S	S	.	.	H	α-helix	trans	-62.7	-45.6	176.4	-66.6	7.9	0	0	0	111.2	K925 K926 Y931 N932 E933	K925-N929 PolarHBondContact O-N 3.29Å; K925-N929 VanDerWaalsContact O-N 3.16Å; K926-N929 PolarHBondContact O-N 3.39Å; N929-Y931 VanDerWaalsContact C-N 3.33Å; N929-Y931 PolarHBondContact O-N 3.03Å; N929-N932 PolarHBondContact O-N 2.7Å; N929-N932 VanDerWaalsContact O-N 3.14Å; N929-E933 WeakPolarHBondContact O-CG 3.4Å; N929-E933 PolarHBondContact O-N 2.91Å
930	V	82	Confident	77.2	Confident	36 Å²	36	57 Å²	57	22%	0.218	31%	0.307	C	S	.	.	H	α-helix	trans	-62.2	-38.6	175.9	173.4	0	0	0	0	111.8	F62 K926 E933 F934	F62-V930 HydrophobicContact CE1-CG1 4.43Å; F62-V930 HydrophobicContact CE1-CG2 4.29Å; K926-V930 WeakPolarHBondContact O-CG2 3.32Å; K926-V930 PolarHBondContact O-N 2.95Å; V930-E933 PolarHBondContact O-N 2.8Å; V930-F934 VanDerWaalsContact O-CB 3.26Å; V930-F934 WeakPolarHBondContact O-CB 3.45Å; V930-F934 PolarHBondContact O-N 3.48Å
931	Y	79.2	Confident	75.7	Confident	16 Å²	16	61.4 Å²	61.4	6%	0.063	33%	0.33	C	S	.	.	H	α-helix	trans	-62.3	-42.3	172.6	175	-103.5	0	0	0	112.4	L61 P927 I928 N929 F934 L935 V951 A952 L955	L61-Y931 HydrophobicContact CD1-CD2 3.85Å; L61-Y931 HydrophobicContact CD1-CE2 4.32Å; L61-Y931 HydrophobicContact CD2-CD2 4.05Å; P927-Y931 WeakPolarHBondContact O-CB 3.4Å; P927-Y931 PolarHBondContact O-N 2.86Å; I928-Y931 PolarHBondContact O-N 2.94Å; N929-Y931 VanDerWaalsContact C-N 3.33Å; N929-Y931 PolarHBondContact O-N 3.03Å; Y931-F934 PolarHBondContact O-N 3.17Å; Y931-L935 HydrophobicContact CD1-CD1 4.07Å; Y931-L935 HydrophobicContact CE1-CD1 3.5Å; Y931-L935 HydrophobicContact CE1-CG 4.31Å; Y931-L935 HydrophobicContact CE2-CD1 4.42Å; Y931-L935 HydrophobicContact CE2-CG 4.44Å; Y931-L935 WeakPolarHBondContact O-CG 3.26Å; Y931-L935 PolarHBondContact O-N 2.85Å; Y931-V951 HydrophobicContact CD2-CG1 4.27Å; Y931-V951 HydrophobicContact CE2-CB 4.48Å; Y931-V951 HydrophobicContact CE2-CG1 3.68Å; Y931-A952 HydrophobicContact CE1-CB 3.71Å; Y931-L955 HydrophobicContact CD1-CD1 4.47Å; Y931-L955 HydrophobicContact CD2-CD1 4.08Å; Y931-L955 HydrophobicContact CG-CD1 3.96Å
932	N	78.9	Confident	73.6	Confident	74 Å²	74	64.7 Å²	64.7	40%	0.396	36%	0.356	S	S	.	.	H	α-helix	trans	-68.1	-40.7	177.1	-66.3	-21.6	0	0	0	112.4	I928 N929 F934 L935 Q936	I928-N932 PolarHBondContact O-N 3.43Å; I928-N932 PolarHBondContact O-ND2 3.15Å; N929-N932 PolarHBondContact O-N 2.7Å; N929-N932 VanDerWaalsContact O-N 3.14Å; N932-F934 VanDerWaalsContact C-N 3.34Å; N932-L935 PolarHBondContact O-N 3.24Å; N932-Q936 WeakPolarHBondContact O-CG 3.46Å; N932-Q936 PolarHBondContact O-N 2.94Å
933	E	79.8	Confident	71.5	Confident	121 Å²	121	64.7 Å²	64.7	57%	0.565	36%	0.356	S	S	*	.	H	α-helix	trans	-63.1	-40.4	173.4	-73.1	169.3	-167.9	0	0	111.2	N929 V930 Q936 S937	N929-E933 WeakPolarHBondContact O-CG 3.4Å; N929-E933 PolarHBondContact O-N 2.91Å; V930-E933 PolarHBondContact O-N 2.8Å; E933-Q936 PolarHBondContact O-N 3.13Å; E933-S937 PolarHBondContact O-N 2.74Å
934	F	75.4	Confident	69.6	Low	21 Å²	21	68.5 Å²	68.5	9%	0.092	39%	0.385	C	S	.	.	H	α-helix	trans	-62.9	-46.4	174.9	-178.5	-108.3	0	0	0	111.5	V56 V57 C60 L61 V930 Y931 N932 Q936 S937 L938 L946	V56-F934 HydrophobicContact CG1-CE2 4.28Å; V57-F934 HydrophobicContact CG2-CE1 3.93Å; V57-F934 HydrophobicContact CG2-CZ 3.73Å; C60-F934 HydrophobicContact CB-CD2 4.31Å; C60-F934 HydrophobicContact CB-CE2 4.31Å; L61-F934 HydrophobicContact CD2-CB 4.38Å; L61-F934 HydrophobicContact CD2-CD1 4.29Å; L61-F934 HydrophobicContact CD2-CG 4.41Å; V930-F934 VanDerWaalsContact O-CB 3.26Å; V930-F934 WeakPolarHBondContact O-CB 3.45Å; V930-F934 PolarHBondContact O-N 3.48Å; Y931-F934 PolarHBondContact O-N 3.17Å; N932-F934 VanDerWaalsContact C-N 3.34Å; F934-Q936 VanDerWaalsContact C-N 3.33Å; F934-Q936 PolarHBondContact O-N 2.99Å; F934-S937 PolarHBondContact O-N 3.47Å; F934-S937 VanDerWaalsContact O-N 3.15Å; F934-S937 PolarHBondContact O-OG 3.43Å; F934-L938 HydrophobicContact CD1-CD1 3.96Å; F934-L938 HydrophobicContact CE1-CD1 3.46Å; F934-L938 VanDerWaalsContact CE1-CD1 3.46Å; F934-L938 HydrophobicContact CE1-CG 4.41Å; F934-L938 HydrophobicContact CE2-CD1 4.37Å; F934-L938 HydrophobicContact CZ-CD1 3.7Å; F934-L938 HydrophobicContact CZ-CG 4.36Å; F934-L938 PolarHBondContact O-N 3.01Å; F934-L946 HydrophobicContact CE1-CD2 4.14Å
935	L	69.6	Low	67.8	Low	62 Å²	62	73.7 Å²	73.7	33%	0.325	42%	0.416	S	S	.	.	H	α-helix	trans	-59.6	-40.7	173.3	-73.9	178.1	0	0	0	112.5	Y931 N932 L938 S939 L946	Y931-L935 HydrophobicContact CD1-CD1 4.07Å; Y931-L935 HydrophobicContact CE1-CD1 3.5Å; Y931-L935 HydrophobicContact CE1-CG 4.31Å; Y931-L935 HydrophobicContact CE2-CD1 4.42Å; Y931-L935 HydrophobicContact CE2-CG 4.44Å; Y931-L935 WeakPolarHBondContact O-CG 3.26Å; Y931-L935 PolarHBondContact O-N 2.85Å; N932-L935 PolarHBondContact O-N 3.24Å; L935-L938 PolarHBondContact O-N 3.34Å; L935-S939 PolarHBondContact O-N 3.15Å; L935-S939 VanDerWaalsContact O-N 3.15Å; L935-L946 HydrophobicContact CD2-CD2 4.06Å
936	Q	71.8	Confident	66.1	Low	141 Å²	141	73.2 Å²	73.2	66%	0.659	42%	0.417	S	S	*	.	H	α-helix	trans	-63.9	-39.5	174.5	-75.1	-179.4	-4	0	0	111.9	N932 E933 F934 L938 S939	N932-Q936 WeakPolarHBondContact O-CG 3.46Å; N932-Q936 PolarHBondContact O-N 2.94Å; E933-Q936 PolarHBondContact O-N 3.13Å; F934-Q936 VanDerWaalsContact C-N 3.33Å; F934-Q936 PolarHBondContact O-N 2.99Å; Q936-L938 VanDerWaalsContact C-N 3.34Å; Q936-L938 PolarHBondContact O-N 2.91Å; Q936-S939 WeakPolarHBondContact O-CB 3.46Å; Q936-S939 PolarHBondContact O-N 3.26Å; Q936-S939 PolarHBondContact O-OG 3.31Å
937	S	69.8	Low	64.4	Low	73 Å²	73	73.5 Å²	73.5	51%	0.51	43%	0.428	S	S	.	.	H	α-helix	trans	-64	-38.4	176.3	80.1	0	0	0	0	112.6	E933 F934 S939 S940	E933-S937 PolarHBondContact O-N 2.74Å; F934-S937 PolarHBondContact O-N 3.47Å; F934-S937 VanDerWaalsContact O-N 3.15Å; F934-S937 PolarHBondContact O-OG 3.43Å; S937-S939 VanDerWaalsContact C-N 3.31Å; S937-S939 PolarHBondContact O-N 3.22Å; S937-S940 PolarHBondContact O-OG 3.23Å
938	L	62.4	Low	63	Low	40 Å²	40	79.1 Å²	79.1	21%	0.209	46%	0.458	C	S	.	.	H	α-helix	trans	-74.7	-13.4	177.2	-69.8	179.5	0	0	0	114.3	F934 L935 Q936 S940 L941 L946	F934-L938 HydrophobicContact CD1-CD1 3.96Å; F934-L938 HydrophobicContact CE1-CD1 3.46Å; F934-L938 VanDerWaalsContact CE1-CD1 3.46Å; F934-L938 HydrophobicContact CE1-CG 4.41Å; F934-L938 HydrophobicContact CE2-CD1 4.37Å; F934-L938 HydrophobicContact CZ-CD1 3.7Å; F934-L938 HydrophobicContact CZ-CG 4.36Å; F934-L938 PolarHBondContact O-N 3.01Å; L935-L938 PolarHBondContact O-N 3.34Å; Q936-L938 VanDerWaalsContact C-N 3.34Å; Q936-L938 PolarHBondContact O-N 2.91Å; L938-S940 PolarHBondContact O-N 2.83Å; L938-L941 HydrophobicContact CD2-CD1 4.23Å; L938-L941 PolarHBondContact O-N 3.46Å; L938-L946 HydrophobicContact CD1-CD2 3.96Å
939	S	59	Low	61.9	Low	103 Å²	103	80.5 Å²	80.5	72%	0.72	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-15	179.8	69.5	0	0	0	0	114.7	L935 Q936 S937 L941	L935-S939 PolarHBondContact O-N 3.15Å; L935-S939 VanDerWaalsContact O-N 3.15Å; Q936-S939 WeakPolarHBondContact O-CB 3.46Å; Q936-S939 PolarHBondContact O-N 3.26Å; Q936-S939 PolarHBondContact O-OG 3.31Å; S937-S939 VanDerWaalsContact C-N 3.31Å; S937-S939 PolarHBondContact O-N 3.22Å; S939-L941 VanDerWaalsContact C-N 3.35Å
940	S	55.4	Low	60.9	Low	101 Å²	101	80.8 Å²	80.8	71%	0.706	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-15.3	172.9	60.5	0	0	0	0	114.5	S937 L938	S937-S940 PolarHBondContact O-OG 3.23Å; L938-S940 PolarHBondContact O-N 2.83Å
941	L	50.3	Low	60.1	Low	95 Å²	95	80.4 Å²	80.4	50%	0.497	47%	0.468	S	S	.	.	S	Bend	trans	-108.8	132.4	-178.6	-72.1	168.7	0	0	0	111.1	L938 S939 L943	L938-L941 HydrophobicContact CD2-CD1 4.23Å; L938-L941 PolarHBondContact O-N 3.46Å; S939-L941 VanDerWaalsContact C-N 3.35Å; L941-L943 HydrophobicContact CB-CD1 4.46Å; L941-L943 PolarHBondContact O-N 3.04Å
942	P	41.1	Very low	59.7	Low	116 Å²	116	80.7 Å²	80.7	75%	0.753	47%	0.473	S	S	*	.			trans	-79.9	51.1	179.7	35	-36.9	0	0	0	112.5
943	L	42	Very low	59.4	Low	85 Å²	85	80.3 Å²	80.3	45%	0.445	47%	0.471	S	S	.	.			trans	-96	97.2	175.2	-97.6	72.1	0	0	0	110.7	L53 L941 V945	L53-L943 HydrophobicContact CD2-CD2 3.99Å; L941-L943 HydrophobicContact CB-CD1 4.46Å; L941-L943 PolarHBondContact O-N 3.04Å; L943-V945 PolarHBondContact O-N 3.23Å; L943-V945 VanDerWaalsContact O-N 3.08Å
944	S	44	Very low	59.2	Low	103 Å²	103	77.4 Å²	77.4	72%	0.72	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-70.7	4.6	172.8	60.6	0	0	0	0	114.5	S947	S944-S947 PolarHBondContact O-OG 3.13Å
945	V	46	Very low	59.4	Low	110 Å²	110	76.6 Å²	76.6	67%	0.667	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-84	-21.2	-167.7	-176.4	0	0	0	0	112.8	L943 S947	L943-V945 PolarHBondContact O-N 3.23Å; L943-V945 VanDerWaalsContact O-N 3.08Å; V945-S947 VanDerWaalsContact C-N 3.28Å; V945-S947 PolarHBondContact O-N 3.26Å
946	L	49.6	Very low	59.9	Low	68 Å²	68	76.1 Å²	76.1	36%	0.356	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-93.1	34.1	178.9	-151.5	73.2	0	0	0	113.1	F934 L935 L938	F934-L946 HydrophobicContact CE1-CD2 4.14Å; L935-L946 HydrophobicContact CD2-CD2 4.06Å; L938-L946 HydrophobicContact CD1-CD2 3.96Å
947	S	50.6	Low	60.3	Low	74 Å²	74	73 Å²	73	52%	0.517	45%	0.447	S	S	.	.			trans	-96.4	7.3	179.4	54.4	0	0	0	0	114.3	S944 V945 N949	S944-S947 PolarHBondContact O-OG 3.13Å; V945-S947 VanDerWaalsContact C-N 3.28Å; V945-S947 PolarHBondContact O-N 3.26Å; S947-N949 VanDerWaalsContact C-N 3.33Å; S947-N949 PolarHBondContact O-N 3.01Å; S947-N949 PolarHBondContact O-OD1 3.5Å
948	D	51.7	Low	60.9	Low	121 Å²	121	73.3 Å²	73.3	65%	0.647	44%	0.439	S	S	*	.			trans	-74.2	83.7	171.6	-84.1	-15.6	0	0	0	110.8	T950 V951	D948-T950 PolarHBondContact O-N 3.11Å; D948-T950 PolarHBondContact O-OG1 3.37Å; D948-V951 PolarHBondContact O-N 3.44Å
949	N	58.4	Low	62	Low	52 Å²	52	71.7 Å²	71.7	28%	0.278	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.1	-20.4	-179.9	-72.5	-3.3	0	0	0	115.6	S515 D516 S947 V951 A952 D953	S515-N949 PolarHBondContact O-ND2 3.47Å; S515-N949 VanDerWaalsContact O-ND2 3.12Å; S515-N949 PolarHBondContact OG-ND2 2.96Å; D516-N949 WeakPolarHBondContact OD2-CB 3.11Å; D516-N949 PolarHBondContact OD2-ND2 3.12Å; S947-N949 VanDerWaalsContact C-N 3.33Å; S947-N949 PolarHBondContact O-N 3.01Å; S947-N949 PolarHBondContact O-OD1 3.5Å; N949-V951 PolarHBondContact O-N 2.9Å; N949-A952 WeakPolarHBondContact O-CA 3.43Å; N949-A952 WeakPolarHBondContact O-CB 3.36Å; N949-A952 PolarHBondContact O-N 2.89Å; N949-D953 PolarHBondContact O-N 3.17Å
950	T	61.3	Low	63.3	Low	85 Å²	85	73.7 Å²	73.7	52%	0.521	42%	0.422	S	S	.	.	H	α-helix	trans	-44.1	-35.2	174.1	65	0	0	0	0	114.2	D948 T954	D948-T950 PolarHBondContact O-N 3.11Å; D948-T950 PolarHBondContact O-OG1 3.37Å; T950-T954 WeakPolarHBondContact O-CB 3Å; T950-T954 PolarHBondContact O-N 3.31Å; T950-T954 PolarHBondContact O-OG1 3.36Å
951	V	66.9	Low	64.7	Low	28 Å²	28	72.1 Å²	72.1	17%	0.17	41%	0.411	C	S	.	.	H	α-helix	trans	-66.2	-51.2	175.8	175.1	0	0	0	0	111	F31 Y931 D948 N949 D953 T954 L955	F31-V951 HydrophobicContact CD1-CG1 4.29Å; F31-V951 HydrophobicContact CE1-CB 4.29Å; F31-V951 HydrophobicContact CE1-CG1 3.66Å; F31-V951 HydrophobicContact CE1-CG2 4.1Å; F31-V951 HydrophobicContact CZ-CG1 4.11Å; Y931-V951 HydrophobicContact CD2-CG1 4.27Å; Y931-V951 HydrophobicContact CE2-CB 4.48Å; Y931-V951 HydrophobicContact CE2-CG1 3.68Å; D948-V951 PolarHBondContact O-N 3.44Å; N949-V951 PolarHBondContact O-N 2.9Å; V951-D953 VanDerWaalsContact C-N 3.32Å; V951-D953 PolarHBondContact O-N 2.87Å; V951-T954 PolarHBondContact O-N 3.47Å; V951-L955 HydrophobicContact CG1-CD1 4.12Å; V951-L955 PolarHBondContact O-N 3.08Å
952	A	70	Confident	66.4	Low	21 Å²	21	68.7 Å²	68.7	17%	0.174	39%	0.391	C	S	.	.	H	α-helix	trans	-61.9	-40	178.1	0	0	0	0	0	111.6	Y931 N949 L955 N956	Y931-A952 HydrophobicContact CE1-CB 3.71Å; N949-A952 WeakPolarHBondContact O-CA 3.43Å; N949-A952 WeakPolarHBondContact O-CB 3.36Å; N949-A952 PolarHBondContact O-N 2.89Å; A952-L955 PolarHBondContact O-N 3.22Å; A952-N956 VanDerWaalsContact O-CB 3.3Å; A952-N956 WeakPolarHBondContact O-CB 3.2Å; A952-N956 PolarHBondContact O-N 3.18Å; A952-N956 PolarHBondContact O-ND2 2.82Å
953	D	71.4	Confident	68.6	Low	67 Å²	67	65.3 Å²	65.3	36%	0.358	37%	0.367	S	S	.	.	H	α-helix	trans	-71.6	-34.5	-179.7	-121.6	12.3	0	0	0	112.3	N949 V951 N956 T957	N949-D953 PolarHBondContact O-N 3.17Å; V951-D953 VanDerWaalsContact C-N 3.32Å; V951-D953 PolarHBondContact O-N 2.87Å; D953-N956 PolarHBondContact O-N 2.88Å; D953-T957 WeakPolarHBondContact O-CB 3.21Å; D953-T957 WeakPolarHBondContact O-CG2 3.23Å; D953-T957 PolarHBondContact O-N 2.87Å; D953-T957 PolarHBondContact O-OG1 3.25Å
954	T	76.5	Confident	70.8	Confident	60 Å²	60	64.4 Å²	64.4	37%	0.368	37%	0.368	S	S	.	.	H	α-helix	trans	-67.3	-39.2	172.7	-56.1	0	0	0	0	111.9	F31 T950 V951 T957 K958	F31-T954 HydrophobicContact CE2-CG2 4.21Å; F31-T954 HydrophobicContact CZ-CG2 4.26Å; T950-T954 WeakPolarHBondContact O-CB 3Å; T950-T954 PolarHBondContact O-N 3.31Å; T950-T954 PolarHBondContact O-OG1 3.36Å; V951-T954 PolarHBondContact O-N 3.47Å; T954-T957 WeakPolarHBondContact CA-OG1 3.44Å; T954-T957 PolarHBondContact O-OG1 3.07Å; T954-T957 VanDerWaalsContact O-OG1 3.11Å; T954-K958 WeakPolarHBondContact O-CG 3.38Å; T954-K958 PolarHBondContact O-N 3.18Å
955	L	78.9	Confident	72.8	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.021	35%	0.353	C	S	.	.	H	α-helix	trans	-65.4	-49.1	172.3	-82.8	158.5	0	0	0	111.7	F31 T63 P927 I928 Y931 V951 A952 T957 K958 T959	F31-L955 HydrophobicContact CE2-CG 4.45Å; T63-L955 HydrophobicContact CG2-CD2 3.55Å; P927-L955 HydrophobicContact CB-CD2 4.1Å; I928-L955 HydrophobicContact CG1-CB 4.2Å; Y931-L955 HydrophobicContact CD1-CD1 4.47Å; Y931-L955 HydrophobicContact CD2-CD1 4.08Å; Y931-L955 HydrophobicContact CG-CD1 3.96Å; V951-L955 HydrophobicContact CG1-CD1 4.12Å; V951-L955 PolarHBondContact O-N 3.08Å; A952-L955 PolarHBondContact O-N 3.22Å; L955-T957 PolarHBondContact O-N 2.9Å; L955-K958 PolarHBondContact O-N 3.36Å; L955-T959 PolarHBondContact O-N 2.73Å; L955-T959 PolarHBondContact O-OG1 2.89Å
956	N	80.4	Confident	74.8	Confident	52 Å²	52	58 Å²	58	28%	0.278	32%	0.321	S	S	.	.	H	α-helix	trans	-59.9	-41.5	179.2	-86.9	-65.2	0	0	0	112.9	A952 D953 R960	A952-N956 VanDerWaalsContact O-CB 3.3Å; A952-N956 WeakPolarHBondContact O-CB 3.2Å; A952-N956 PolarHBondContact O-N 3.18Å; A952-N956 PolarHBondContact O-ND2 2.82Å; D953-N956 PolarHBondContact O-N 2.88Å; N956-R960 WeakPolarHBondContact O-CB 3.49Å; N956-R960 WeakPolarHBondContact O-CG 3.34Å; N956-R960 PolarHBondContact O-N 3.31Å
957	T	81.4	Confident	76.7	Confident	76 Å²	76	58.3 Å²	58.3	47%	0.466	32%	0.321	S	S	.	.	H	α-helix	trans	-68.1	-41.3	177.6	46.7	0	0	0	0	112.1	D953 T954 L955 C961	D953-T957 WeakPolarHBondContact O-CB 3.21Å; D953-T957 WeakPolarHBondContact O-CG2 3.23Å; D953-T957 PolarHBondContact O-N 2.87Å; D953-T957 PolarHBondContact O-OG1 3.25Å; T954-T957 WeakPolarHBondContact CA-OG1 3.44Å; T954-T957 PolarHBondContact O-OG1 3.07Å; T954-T957 VanDerWaalsContact O-OG1 3.11Å; L955-T957 PolarHBondContact O-N 2.9Å; T957-C961 PolarHBondContact O-N 3.45Å
958	K	82.7	Confident	78.3	Confident	78 Å²	78	60.9 Å²	60.9	34%	0.339	32%	0.323	S	S	.	.	H	α-helix	trans	-58.7	-51.9	171.8	-77.2	-171.4	-179.8	-168.8	0	112	T63 T954 L955 R960 C961 W962	T63-K958 HydrophobicContact CG2-CD 4.04Å; T63-K958 PolarHBondContact OG1-NZ 3.27Å; T954-K958 WeakPolarHBondContact O-CG 3.38Å; T954-K958 PolarHBondContact O-N 3.18Å; L955-K958 PolarHBondContact O-N 3.36Å; K958-R960 PolarHBondContact O-N 3.1Å; K958-C961 VanDerWaalsContact O-CB 3.27Å; K958-C961 WeakPolarHBondContact O-CB 3.48Å; K958-C961 PolarHBondContact O-N 2.71Å; K958-C961 VanDerWaalsContact O-N 3.08Å; K958-W962 HydrophobicContact CB-CH2 3.88Å; K958-W962 HydrophobicContact CB-CZ2 3.97Å; K958-W962 HydrophobicContact CB-CZ3 4.29Å; K958-W962 HydrophobicContact CD-CH2 4.31Å; K958-W962 HydrophobicContact CD-CZ2 4.25Å; K958-W962 PolarHBondContact O-N 2.91Å; K958-W962 VanDerWaalsContact O-N 3.14Å
959	T	85	Confident	79.9	Confident	7 Å²	7	56 Å²	56	4%	0.043	30%	0.298	C	S	.	.	H	α-helix	trans	-70.6	-29.9	-178.8	-23	0	0	0	0	114.1	A924 I928 L955 C961 W962 L963	A924-T959 VanDerWaalsContact O-CB 3.25Å; A924-T959 WeakPolarHBondContact O-CB 3.17Å; A924-T959 PolarHBondContact O-OG1 3.1Å; A924-T959 VanDerWaalsContact O-OG1 3.07Å; I928-T959 HydrophobicContact CD1-CG2 3.5Å; L955-T959 PolarHBondContact O-N 2.73Å; L955-T959 PolarHBondContact O-OG1 2.89Å; T959-C961 PolarHBondContact O-N 3.39Å; T959-W962 VanDerWaalsContact CA-CE3 3.46Å; T959-W962 PolarHBondContact O-N 3.15Å; T959-W962 WeakPolarHBondContact OG1-CZ3 3.22Å; T959-L963 HydrophobicContact CG2-CD1 4.09Å; T959-L963 WeakPolarHBondContact O-CB 3.11Å; T959-L963 VanDerWaalsContact O-CG 3.23Å; T959-L963 WeakPolarHBondContact O-CG 3.29Å; T959-L963 PolarHBondContact O-N 2.73Å
960	R	85.3	Confident	81.3	Confident	144 Å²	144	54.6 Å²	54.6	54%	0.543	29%	0.289	S	S	.	.	H	α-helix	trans	-57.4	-38.3	169	-74.4	170.5	-162.9	149.5	8.7	111.5	N956 K958 S964	N956-R960 WeakPolarHBondContact O-CB 3.49Å; N956-R960 WeakPolarHBondContact O-CG 3.34Å; N956-R960 PolarHBondContact O-N 3.31Å; K958-R960 PolarHBondContact O-N 3.1Å; R960-S964 PolarHBondContact O-N 3.11Å; R960-S964 VanDerWaalsContact O-N 3.07Å
961	C	85.5	Confident	82.5	Confident	69 Å²	69	53.7 Å²	53.7	47%	0.466	28%	0.281	S	S	.	.	H	α-helix	trans	-63.9	-50.4	174.5	-166.7	0	0	0	0	111.6	T957 K958 T959 L963 S964 L965	T957-C961 PolarHBondContact O-N 3.45Å; K958-C961 VanDerWaalsContact O-CB 3.27Å; K958-C961 WeakPolarHBondContact O-CB 3.48Å; K958-C961 PolarHBondContact O-N 2.71Å; K958-C961 VanDerWaalsContact O-N 3.08Å; T959-C961 PolarHBondContact O-N 3.39Å; C961-L963 PolarHBondContact O-N 2.83Å; C961-S964 PolarHBondContact O-N 3.38Å; C961-S964 VanDerWaalsContact O-N 3.15Å; C961-S964 PolarHBondContact O-OG 2.79Å; C961-L965 WeakPolarHBondContact O-CG 3.16Å; C961-L965 PolarHBondContact O-N 3.47Å; C961-L965 VanDerWaalsContact O-N 3.09Å
962	W	85.2	Confident	83.1	Confident	22 Å²	22	59 Å²	59	8%	0.083	30%	0.298	C	S	.	.	H	α-helix	trans	-59.5	-44.2	177.9	-57.4	-38.3	0	0	0	112.6	W64 F67 A924 P927 K958 T959 S964 L965 I966	W64-W962 HydrophobicContact CB-CH2 4.06Å; W64-W962 HydrophobicContact CB-CZ2 3.87Å; W64-W962 AromaticContact CD1-CE3 3.83Å; W64-W962 AromaticContact CD1-CH2 3.59Å; W64-W962 AromaticContact CD1-CZ3 3.48Å; W64-W962 VanDerWaalsContact CD1-CZ3 3.48Å; W64-W962 HydrophobicContact CG-CH2 4.14Å; W64-W962 HydrophobicContact CG-CZ2 4.37Å; W64-W962 HydrophobicContact CG-CZ3 4.42Å; F67-W962 VanDerWaalsContact CB-CD1 3.49Å; F67-W962 HydrophobicContact CB-CG 4.07Å; F67-W962 HydrophobicContact CD1-CB 4.28Å; F67-W962 HydrophobicContact CD1-CG 4.42Å; F67-W962 HydrophobicContact CD2-CD2 4.28Å; F67-W962 HydrophobicContact CD2-CG 4.2Å; F67-W962 HydrophobicContact CG-CB 4.29Å; F67-W962 AromaticContact CG-CD1 3.88Å; F67-W962 HydrophobicContact CG-CD2 4.46Å; F67-W962 AromaticContact CG-CG 3.97Å; F67-W962 HydrophobicContact CG-CG 3.97Å; A924-W962 HydrophobicContact CB-CB 4.09Å; A924-W962 HydrophobicContact CB-CE3 4.42Å; P927-W962 HydrophobicContact CG-CZ3 4.09Å; K958-W962 HydrophobicContact CB-CH2 3.88Å; K958-W962 HydrophobicContact CB-CZ2 3.97Å; K958-W962 HydrophobicContact CB-CZ3 4.29Å; K958-W962 HydrophobicContact CD-CH2 4.31Å; K958-W962 HydrophobicContact CD-CZ2 4.25Å; K958-W962 PolarHBondContact O-N 2.91Å; K958-W962 VanDerWaalsContact O-N 3.14Å; T959-W962 VanDerWaalsContact CA-CE3 3.46Å; T959-W962 PolarHBondContact O-N 3.15Å; T959-W962 WeakPolarHBondContact OG1-CZ3 3.22Å; W962-S964 VanDerWaalsContact C-N 3.31Å; W962-S964 PolarHBondContact O-N 2.97Å; W962-L965 WeakPolarHBondContact O-CB 3.17Å; W962-L965 PolarHBondContact O-N 3.16Å; W962-L965 VanDerWaalsContact O-N 3.11Å; W962-I966 WeakPolarHBondContact O-CG1 3.31Å; W962-I966 PolarHBondContact O-N 2.76Å
963	L	88.6	Confident	83.5	Confident	45 Å²	45	59.9 Å²	59.9	24%	0.236	30%	0.296	C	S	.	.	H	α-helix	trans	-59.1	-41.3	175	-66.2	172.6	0	0	0	111.7	E921 A924 T959 C961 L965 I966 E967	E921-L963 HydrophobicContact CB-CD2 3.91Å; E921-L963 HydrophobicContact CG-CD2 3.6Å; A924-L963 HydrophobicContact CB-CD2 4.22Å; T959-L963 HydrophobicContact CG2-CD1 4.09Å; T959-L963 WeakPolarHBondContact O-CB 3.11Å; T959-L963 VanDerWaalsContact O-CG 3.23Å; T959-L963 WeakPolarHBondContact O-CG 3.29Å; T959-L963 PolarHBondContact O-N 2.73Å; C961-L963 PolarHBondContact O-N 2.83Å; L963-L965 VanDerWaalsContact C-N 3.3Å; L963-L965 PolarHBondContact O-N 2.72Å; L963-I966 HydrophobicContact CD2-CD1 4.5Å; L963-I966 PolarHBondContact O-N 2.74Å; L963-E967 WeakPolarHBondContact O-CB 3.39Å; L963-E967 PolarHBondContact O-N 3.23Å
964	S	86.9	Confident	83.9	Confident	67 Å²	67	57.2 Å²	57.2	47%	0.469	28%	0.284	S	S	.	.	H	α-helix	trans	-66.7	-28.8	176.5	79.1	0	0	0	0	113.8	R960 C961 W962 K968	R960-S964 PolarHBondContact O-N 3.11Å; R960-S964 VanDerWaalsContact O-N 3.07Å; C961-S964 PolarHBondContact O-N 3.38Å; C961-S964 VanDerWaalsContact O-N 3.15Å; C961-S964 PolarHBondContact O-OG 2.79Å; W962-S964 VanDerWaalsContact C-N 3.31Å; W962-S964 PolarHBondContact O-N 2.97Å; S964-K968 VanDerWaalsContact O-CB 3.26Å; S964-K968 WeakPolarHBondContact O-CB 3.27Å; S964-K968 PolarHBondContact O-N 2.9Å
965	L	87.3	Confident	83.8	Confident	78 Å²	78	61.7 Å²	61.7	41%	0.408	30%	0.298	S	S	.	.	H	α-helix	trans	-74.2	-44	175.1	-68.9	169.8	0	0	0	111.3	V69 C961 W962 L963 K968 S969	V69-L965 HydrophobicContact CG2-CB 4.35Å; C961-L965 WeakPolarHBondContact O-CG 3.16Å; C961-L965 PolarHBondContact O-N 3.47Å; C961-L965 VanDerWaalsContact O-N 3.09Å; W962-L965 WeakPolarHBondContact O-CB 3.17Å; W962-L965 PolarHBondContact O-N 3.16Å; W962-L965 VanDerWaalsContact O-N 3.11Å; L963-L965 VanDerWaalsContact C-N 3.3Å; L963-L965 PolarHBondContact O-N 2.72Å; L965-K968 PolarHBondContact O-N 2.77Å; L965-S969 PolarHBondContact O-N 2.78Å; L965-S969 PolarHBondContact O-OG 2.95Å
966	I	86.7	Confident	83.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.2	-47.7	173.7	-63.3	158.9	0	0	0	110.2	F67 W916 K917 M920 A924 W962 L963 K968 S969 Y970	F67-I966 HydrophobicContact CE1-CD1 3.83Å; F67-I966 HydrophobicContact CE1-CG1 4.03Å; F67-I966 HydrophobicContact CZ-CD1 4.17Å; W916-I966 HydrophobicContact CH2-CG2 4.35Å; W916-I966 HydrophobicContact CZ3-CG2 4.15Å; K917-I966 HydrophobicContact CG-CG2 4.08Å; M920-I966 HydrophobicContact CB-CD1 3.7Å; M920-I966 HydrophobicContact CB-CG1 3.94Å; M920-I966 HydrophobicContact CB-CG2 4.08Å; A924-I966 HydrophobicContact CB-CD1 4.12Å; W962-I966 WeakPolarHBondContact O-CG1 3.31Å; W962-I966 PolarHBondContact O-N 2.76Å; L963-I966 HydrophobicContact CD2-CD1 4.5Å; L963-I966 PolarHBondContact O-N 2.74Å; I966-K968 VanDerWaalsContact C-N 3.31Å; I966-K968 PolarHBondContact O-N 2.74Å; I966-S969 PolarHBondContact O-N 2.74Å; I966-S969 PolarHBondContact O-OG 3.12Å; I966-Y970 WeakPolarHBondContact O-CB 3.45Å; I966-Y970 PolarHBondContact O-N 2.76Å
967	E	89.2	Confident	82.9	Confident	74 Å²	74	59.5 Å²	59.5	35%	0.346	29%	0.287	S	S	.	.	H	α-helix	trans	-59.2	-42	176.6	-169.3	67.6	-102.7	0	0	111.3	K917 L963 N971	K917-E967 WeakPolarHBondContact CE-OE2 3.42Å; K917-E967 IonicContact NZ-OE1 2.69Å; K917-E967 PolarHBondContact NZ-OE1 3.36Å; K917-E967 IonicContact NZ-OE2 2.73Å; K917-E967 PolarHBondContact NZ-OE2 2.66Å; L963-E967 WeakPolarHBondContact O-CB 3.39Å; L963-E967 PolarHBondContact O-N 3.23Å; E967-N971 WeakPolarHBondContact O-CB 3.26Å; E967-N971 PolarHBondContact O-N 2.95Å; E967-N971 PolarHBondContact O-ND2 3.34Å; E967-N971 PolarHBondContact OE1-ND2 3.16Å
968	K	85.7	Confident	82.2	Confident	129 Å²	129	60.2 Å²	60.2	56%	0.561	29%	0.285	S	S	*	.	H	α-helix	trans	-70.8	-36.5	-179.8	-173.8	178.7	179.2	-176.4	0	113.4	S964 L965 I966 R972	S964-K968 VanDerWaalsContact O-CB 3.26Å; S964-K968 WeakPolarHBondContact O-CB 3.27Å; S964-K968 PolarHBondContact O-N 2.9Å; L965-K968 PolarHBondContact O-N 2.77Å; I966-K968 VanDerWaalsContact C-N 3.31Å; I966-K968 PolarHBondContact O-N 2.74Å; K968-R972 WeakPolarHBondContact O-CG 3.38Å; K968-R972 PolarHBondContact O-N 3.41Å
969	S	85.6	Confident	81.3	Confident	17 Å²	17	57.5 Å²	57.5	12%	0.119	28%	0.275	C	S	.	.	H	α-helix	trans	-72.3	-41.7	174.7	58.8	0	0	0	0	111.3	V69 L965 I966 R972 R973	V69-S969 VanDerWaalsContact CG1-OG 3.23Å; V69-S969 WeakPolarHBondContact CG1-OG 3.38Å; L965-S969 PolarHBondContact O-N 2.78Å; L965-S969 PolarHBondContact O-OG 2.95Å; I966-S969 PolarHBondContact O-N 2.74Å; I966-S969 PolarHBondContact O-OG 3.12Å; S969-R972 PolarHBondContact O-N 3.19Å; S969-R973 WeakPolarHBondContact O-CB 3.36Å; S969-R973 PolarHBondContact O-N 3.31Å
970	Y	87.6	Confident	79.8	Confident	23 Å²	23	64.5 Å²	64.5	9%	0.09	31%	0.307	C	S	.	.	H	α-helix	trans	-56.8	-49.3	173.2	172.5	-94.9	0	0	0	111.7	Y910 L913 N914 K917 I966 R972 R973 A974	Y910-Y970 HydrophobicContact CE2-CE2 4.34Å; Y910-Y970 PolarHBondContact OH-OH 3.23Å; L913-Y970 HydrophobicContact CD2-CD2 3.81Å; L913-Y970 HydrophobicContact CD2-CE2 3.97Å; L913-Y970 HydrophobicContact CG-CD2 3.78Å; L913-Y970 HydrophobicContact CG-CE2 4.01Å; N914-Y970 VanDerWaalsContact OD1-CE2 3.29Å; N914-Y970 WeakPolarHBondContact OD1-CE2 3.26Å; N914-Y970 PolarHBondContact OD1-OH 2.94Å; K917-Y970 HydrophobicContact CB-CD2 3.92Å; K917-Y970 HydrophobicContact CB-CE2 4.33Å; K917-Y970 HydrophobicContact CD-CD1 4.01Å; K917-Y970 HydrophobicContact CD-CD2 3.78Å; K917-Y970 HydrophobicContact CD-CE1 4.25Å; K917-Y970 HydrophobicContact CD-CE2 4.03Å; K917-Y970 HydrophobicContact CD-CG 3.78Å; K917-Y970 HydrophobicContact CG-CD2 4.34Å; I966-Y970 WeakPolarHBondContact O-CB 3.45Å; I966-Y970 PolarHBondContact O-N 2.76Å; Y970-R972 VanDerWaalsContact C-N 3.26Å; Y970-R972 PolarHBondContact O-N 2.84Å; Y970-R973 CarbonylContact O-C 3.46Å; Y970-R973 WeakPolarHBondContact O-CA 3.09Å; Y970-R973 PolarHBondContact O-N 2.67Å; Y970-A974 WeakPolarHBondContact O-CB 3.37Å; Y970-A974 PolarHBondContact O-N 2.8Å
971	N	85.5	Confident	78.2	Confident	66 Å²	66	62 Å²	62	35%	0.353	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-9.7	-179.7	-76.5	-79.6	0	0	0	114.8	E967	E967-N971 WeakPolarHBondContact O-CB 3.26Å; E967-N971 PolarHBondContact O-N 2.95Å; E967-N971 PolarHBondContact O-ND2 3.34Å; E967-N971 PolarHBondContact OE1-ND2 3.16Å
972	R	80.2	Confident	76.6	Confident	141 Å²	141	64.9 Å²	64.9	53%	0.532	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-50.3	165.9	-79.7	175	168.3	-175.7	-8.6	110	K968 S969 Y970 A974 D1231	K968-R972 WeakPolarHBondContact O-CG 3.38Å; K968-R972 PolarHBondContact O-N 3.41Å; S969-R972 PolarHBondContact O-N 3.19Å; Y970-R972 VanDerWaalsContact C-N 3.26Å; Y970-R972 PolarHBondContact O-N 2.84Å; R972-A974 PolarHBondContact O-N 2.94Å; R972-D1231 WeakPolarHBondContact O-CB 3.12Å; R972-D1231 VanDerWaalsContact O-OD2 3.11Å
973	R	78.4	Confident	75.2	Confident	38 Å²	38	67.7 Å²	67.7	14%	0.143	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	26.9	165.3	-150.1	101	-167.9	131.2	2.5	111.3	L71 E909 L913 S969 Y970 D1231 L1232	L71-R973 HydrophobicContact CD1-CB 4.41Å; L71-R973 HydrophobicContact CD2-CB 4.19Å; L71-R973 HydrophobicContact CD2-CG 4.34Å; E909-R973 IonicContact OE1-CZ 2.92Å; E909-R973 IonicContact OE1-NE 2.7Å; E909-R973 IonicContact OE1-NH2 3.82Å; E909-R973 PolarHBondContact OE1-NH2 2.91Å; L913-R973 HydrophobicContact CD1-CB 4.29Å; L913-R973 HydrophobicContact CD1-CG 3.91Å; L913-R973 HydrophobicContact CD2-CB 3.85Å; L913-R973 HydrophobicContact CD2-CG 3.81Å; L913-R973 WeakPolarHBondContact CD2-O 3.12Å; S969-R973 WeakPolarHBondContact O-CB 3.36Å; S969-R973 PolarHBondContact O-N 3.31Å; Y970-R973 CarbonylContact O-C 3.46Å; Y970-R973 WeakPolarHBondContact O-CA 3.09Å; Y970-R973 PolarHBondContact O-N 2.67Å; R973-D1231 VanDerWaalsContact CD-OD1 3.31Å; R973-D1231 WeakPolarHBondContact CD-OD1 3.31Å; R973-D1231 IonicContact CZ-OD1 3.75Å; R973-D1231 PolarHBondContact N-OD2 3.27Å; R973-D1231 IonicContact NE-OD1 2.71Å; R973-D1231 IonicContact NH1-OD1 2.63Å; R973-D1231 PolarHBondContact NH1-OD1 3.41Å; R973-L1232 HydrophobicContact CB-CB 4.27Å; R973-L1232 HydrophobicContact CG-CB 3.76Å; R973-L1232 HydrophobicContact CG-CD1 4.24Å; R973-L1232 HydrophobicContact CG-CD2 3.43Å; R973-L1232 VanDerWaalsContact CG-CD2 3.43Å; R973-L1232 HydrophobicContact CG-CG 3.87Å; R973-L1232 VanDerWaalsContact NH1-CD1 3.25Å; R973-L1232 WeakPolarHBondContact O-CB 3.41Å
974	A	80	Confident	73.6	Confident	11 Å²	11	74.9 Å²	74.9	9%	0.091	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-157.9	44.4	176.1	0	0	0	0	0	116.9	Y910 Y970 R972 L1232 P1233	Y910-A974 HydrophobicContact CE2-CB 4.17Å; Y970-A974 WeakPolarHBondContact O-CB 3.37Å; Y970-A974 PolarHBondContact O-N 2.8Å; R972-A974 PolarHBondContact O-N 2.94Å; A974-L1232 CarbonylContact C-O 2.99Å; A974-L1232 WeakPolarHBondContact CA-O 3.07Å; A974-L1232 PolarHBondContact N-O 3.14Å; A974-P1233 VanDerWaalsContact C-CG 3.44Å; A974-P1233 HydrophobicContact CB-CB 3.71Å; A974-P1233 HydrophobicContact CB-CG 3.72Å
975	K	73.7	Confident	72.2	Confident	155 Å²	155	73.4 Å²	73.4	67%	0.674	35%	0.351	S	S	*	.	S	Bend	trans	-140.2	18.2	166.6	-66.4	-168	174.8	-163.4	0	120.3	L1232	K975-L1232 CarbonylContact C-O 3.21Å; K975-L1232 WeakPolarHBondContact CA-O 3.08Å; K975-L1232 PolarHBondContact N-O 3.32Å
976	A	68.5	Low	70.9	Confident	5 Å²	5	70.3 Å²	70.3	4%	0.041	33%	0.334	C	S	.	.	S	Bend	trans	-156.8	-29.4	-167.1	0	0	0	0	0	118.1	N85 V86 E978 I1230 D1231 L1232	N85-A976 VanDerWaalsContact OD1-C 3.31Å; N85-A976 VanDerWaalsContact OD1-CA 3.24Å; N85-A976 WeakPolarHBondContact OD1-CA 3.36Å; N85-A976 WeakPolarHBondContact OD1-CB 3.47Å; N85-A976 PolarHBondContact OD1-O 3.39Å; V86-A976 PolarHBondContact N-O 3.06Å; V86-A976 VanDerWaalsContact N-O 3.1Å; A976-E978 PolarHBondContact O-N 3Å; A976-E978 VanDerWaalsContact O-N 3.12Å; A976-I1230 HydrophobicContact CB-CG2 4Å; A976-D1231 CarbonylContact C-O 3.58Å; A976-D1231 VanDerWaalsContact CB-C 3.48Å; A976-D1231 HydrophobicContact CB-CB 4.4Å; A976-D1231 WeakPolarHBondContact CB-O 2.98Å; A976-L1232 PolarHBondContact N-O 3.14Å
977	L	71.3	Confident	69.6	Low	4 Å²	4	77.8 Å²	77.8	2%	0.021	36%	0.363	C	S	.	.	S	Bend	trans	-63.3	-14.2	156.8	-76.7	172.9	0	0	0	108.3	L76 V86 V906 V979 D1231 L1232 P1233	L76-L977 HydrophobicContact CD1-CD2 4.1Å; V86-L977 HydrophobicContact CB-CD2 4.14Å; V86-L977 HydrophobicContact CG2-CD2 3.31Å; V86-L977 HydrophobicContact CG2-CG 4.36Å; V906-L977 HydrophobicContact CB-CD1 4.44Å; V906-L977 HydrophobicContact CB-CD2 4.07Å; V906-L977 HydrophobicContact CG1-CB 3.71Å; V906-L977 HydrophobicContact CG1-CD1 3.66Å; V906-L977 HydrophobicContact CG1-CD2 3.56Å; V906-L977 HydrophobicContact CG1-CG 3.79Å; V906-L977 HydrophobicContact CG2-CD2 3.7Å; V906-L977 WeakPolarHBondContact O-CD1 3.2Å; L977-V979 PolarHBondContact O-N 3.23Å; L977-D1231 PolarHBondContact N-O 3.43Å; L977-L1232 HydrophobicContact CD1-CB 4.04Å; L977-L1232 HydrophobicContact CD1-CD1 4.23Å; L977-L1232 HydrophobicContact CD1-CD2 3.87Å; L977-L1232 HydrophobicContact CD1-CG 3.41Å; L977-L1232 VanDerWaalsContact CD1-CG 3.41Å; L977-L1232 HydrophobicContact CG-CB 4.11Å; L977-L1232 HydrophobicContact CG-CD1 4.12Å; L977-L1232 HydrophobicContact CG-CG 3.7Å; L977-L1232 VanDerWaalsContact CG-N 3.34Å; L977-L1232 VanDerWaalsContact N-CA 3.27Å; L977-L1232 PolarHBondContact N-O 2.89Å; L977-P1233 CarbonylContact C-O 3.21Å; L977-P1233 WeakPolarHBondContact CB-O 3.43Å
978	E	67.1	Low	68.3	Low	92 Å²	92	80.8 Å²	80.8	43%	0.43	37%	0.371	S	S	.	.			trans	-56.5	97.9	-179	-141.6	-178.3	151.5	0	0	109.4	A976 Q980 P1233	A976-E978 PolarHBondContact O-N 3Å; A976-E978 VanDerWaalsContact O-N 3.12Å; E978-Q980 PolarHBondContact O-N 3.33Å; E978-P1233 HydrophobicContact CB-CG 4.39Å; E978-P1233 HydrophobicContact CG-CG 4.3Å; E978-P1233 PolarHBondContact N-O 3.15Å; E978-P1233 VanDerWaalsContact N-O 3.08Å
979	V	63.1	Low	67.5	Low	21 Å²	21	74.6 Å²	74.6	13%	0.127	34%	0.344	C	S	.	.			trans	-60.7	113.6	173.6	-173.6	0	0	0	0	106.9	L977 T981 F986	L977-V979 PolarHBondContact O-N 3.23Å; V979-T981 PolarHBondContact O-N 3.03Å; V979-F986 HydrophobicContact CG1-CE1 4.32Å; V979-F986 HydrophobicContact CG1-CE2 3.95Å; V979-F986 HydrophobicContact CG1-CZ 3.49Å; V979-F986 VanDerWaalsContact CG1-CZ 3.49Å
980	Q	54.8	Low	66.8	Low	153 Å²	153	74.9 Å²	74.9	72%	0.715	34%	0.343	S	S	*	.			trans	-67.6	94.6	-178.2	-68.4	-170.9	21.6	0	0	109.5	E978 N982	E978-Q980 PolarHBondContact O-N 3.33Å; Q980-N982 PolarHBondContact O-N 3.47Å
981	T	51.1	Low	66.1	Low	91 Å²	91	73.9 Å²	73.9	56%	0.558	34%	0.339	S	S	*	.			trans	-76.9	80.7	-167.5	38.5	0	0	0	0	112.2	V979 S983	V979-T981 PolarHBondContact O-N 3.03Å; T981-S983 PolarHBondContact O-N 3.14Å
982	N	53	Low	65.5	Low	131 Å²	131	72.5 Å²	72.5	70%	0.701	33%	0.334	S	S	*	.			trans	-68.3	86.9	165	-130.5	-21.8	0	0	0	108.7	Q980 R984 F985	Q980-N982 PolarHBondContact O-N 3.47Å; N982-R984 PolarHBondContact O-N 2.85Å; N982-F985 WeakPolarHBondContact O-CB 3.26Å; N982-F985 PolarHBondContact O-N 2.71Å
983	S	54.8	Low	65.2	Low	81 Å²	81	69.1 Å²	69.1	57%	0.566	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-7.3	-157.3	64.2	0	0	0	0	117.1	T981 R987	T981-S983 PolarHBondContact O-N 3.14Å; S983-R987 WeakPolarHBondContact O-CD 3.24Å; S983-R987 WeakPolarHBondContact O-CG 3.32Å
984	R	54.7	Low	65.1	Low	196 Å²	196	77.5 Å²	77.5	74%	0.74	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-24.4	172.4	-63.3	-180	-179.8	171.4	-0.4	113.7	N982	N982-R984 PolarHBondContact O-N 2.85Å
985	F	58.1	Low	65.1	Low	35 Å²	35	79.2 Å²	79.2	15%	0.154	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-61.5	-176.4	175.1	-99.5	0	0	0	111.2	D92 L893 N982 R987 R988 I989 L1069	D92-F985 HydrophobicContact CB-CD2 4.49Å; D92-F985 HydrophobicContact CB-CE2 3.91Å; D92-F985 HydrophobicContact CB-CZ 4.45Å; D92-F985 WeakPolarHBondContact OD2-CD2 3.34Å; D92-F985 VanDerWaalsContact OD2-CE2 3.24Å; D92-F985 WeakPolarHBondContact OD2-CE2 3.31Å; L893-F985 HydrophobicContact CD1-CD2 4.04Å; L893-F985 HydrophobicContact CD1-CE2 3.65Å; L893-F985 HydrophobicContact CD1-CZ 4.12Å; N982-F985 WeakPolarHBondContact O-CB 3.26Å; N982-F985 PolarHBondContact O-N 2.71Å; F985-R987 PolarHBondContact O-N 3.5Å; F985-R987 VanDerWaalsContact O-N 3.15Å; F985-R988 WeakPolarHBondContact O-CB 3.24Å; F985-R988 PolarHBondContact O-N 3.15Å; F985-I989 HydrophobicContact CE1-CD1 4.17Å; F985-L1069 HydrophobicContact CZ-CD1 4.11Å
986	F	59.2	Low	65.4	Low	14 Å²	14	72.7 Å²	72.7	6%	0.061	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-60.2	-31	-175.1	-67.6	-80.5	0	0	0	113.2	I903 V979 R988 I989 F1052	I903-F986 HydrophobicContact CD1-CE1 4.4Å; V979-F986 HydrophobicContact CG1-CE1 4.32Å; V979-F986 HydrophobicContact CG1-CE2 3.95Å; V979-F986 HydrophobicContact CG1-CZ 3.49Å; V979-F986 VanDerWaalsContact CG1-CZ 3.49Å; F986-R988 PolarHBondContact O-N 2.95Å; F986-R988 VanDerWaalsContact O-N 3.09Å; F986-I989 HydrophobicContact CD1-CD1 3.87Å; F986-I989 WeakPolarHBondContact O-CB 3.4Å; F986-I989 PolarHBondContact O-N 3.13Å; F986-I989 VanDerWaalsContact O-N 3.12Å; F986-F1052 CarbonylContact C-O 3.58Å; F986-F1052 HydrophobicContact CB-CD1 4.23Å; F986-F1052 AromaticContact CD1-CD1 3.8Å; F986-F1052 HydrophobicContact CD1-CD1 3.8Å; F986-F1052 AromaticContact CD1-CE1 3.79Å; F986-F1052 HydrophobicContact CD1-CE1 3.79Å; F986-F1052 HydrophobicContact CE1-CE1 4.34Å; F986-F1052 HydrophobicContact CG-CD1 4.5Å
987	R	60.3	Low	66	Low	157 Å²	157	77.9 Å²	77.9	59%	0.592	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-60.6	-13.7	173.1	-75.6	-174.4	178.1	-153.4	-1.8	115.1	S983 F985 F1052 Q1055	S983-R987 WeakPolarHBondContact O-CD 3.24Å; S983-R987 WeakPolarHBondContact O-CG 3.32Å; F985-R987 PolarHBondContact O-N 3.5Å; F985-R987 VanDerWaalsContact O-N 3.15Å; R987-F1052 WeakPolarHBondContact CA-O 3.39Å; R987-F1052 PolarHBondContact N-O 3.13Å; R987-Q1055 WeakPolarHBondContact O-CB 3.08Å; R987-Q1055 PolarHBondContact O-OE1 3.25Å; R987-Q1055 VanDerWaalsContact O-OE1 3.08Å
988	R	61	Low	66.5	Low	136 Å²	136	81.4 Å²	81.4	51%	0.513	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-98.2	-0.7	177.8	-66.7	-179.4	173.5	-178.9	-3.1	113.7	L893 F985 F986	L893-R988 HydrophobicContact CD1-CB 4.32Å; L893-R988 PolarHBondContact N-O 2.88Å; F985-R988 WeakPolarHBondContact O-CB 3.24Å; F985-R988 PolarHBondContact O-N 3.15Å; F986-R988 PolarHBondContact O-N 2.95Å; F986-R988 VanDerWaalsContact O-N 3.09Å
989	I	68.7	Low	67.2	Low	0 Å²	0	77.2 Å²	77.2	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	131.6	-179.9	-60.7	177.3	0	0	0	109.6	L893 A895 F985 F986 F1052 V1056 L1069	L893-I989 HydrophobicContact CB-CG1 3.92Å; L893-I989 HydrophobicContact CD1-CG1 4.3Å; L893-I989 CarbonylContact O-C 3.58Å; L893-I989 WeakPolarHBondContact O-CA 3.19Å; A895-I989 HydrophobicContact CB-CG2 3.79Å; F985-I989 HydrophobicContact CE1-CD1 4.17Å; F986-I989 HydrophobicContact CD1-CD1 3.87Å; F986-I989 WeakPolarHBondContact O-CB 3.4Å; F986-I989 PolarHBondContact O-N 3.13Å; F986-I989 VanDerWaalsContact O-N 3.12Å; I989-F1052 HydrophobicContact CB-CD1 4.32Å; I989-F1052 HydrophobicContact CD1-CD1 3.93Å; I989-F1052 HydrophobicContact CD1-CE1 3.84Å; I989-F1052 HydrophobicContact CG2-CD1 4.46Å; I989-V1056 HydrophobicContact CB-CG2 4.26Å; I989-V1056 HydrophobicContact CG2-CG2 4.21Å; I989-V1056 WeakPolarHBondContact O-CG2 2.98Å; I989-L1069 HydrophobicContact CD1-CD2 4.45Å
990	K	71.3	Confident	68.3	Low	23 Å²	23	77.7 Å²	77.7	10%	0.1	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	154.4	175.9	-61.5	-171.5	-173.7	165.6	0	110.5	C892 L893 I1060	C892-K990 HydrophobicContact CB-CB 4.43Å; C892-K990 HydrophobicContact CB-CD 4.05Å; C892-K990 HydrophobicContact CB-CG 4.27Å; C892-K990 VanDerWaalsContact SG-CD 3.59Å; C892-K990 VanDerWaalsContact SG-CE 3.52Å; C892-K990 PolarHBondContact SG-NZ 3.47Å; L893-K990 PolarHBondContact O-N 3.18Å; K990-I1060 HydrophobicContact CB-CD1 4.37Å; K990-I1060 HydrophobicContact CB-CG1 3.79Å
991	L	72.3	Confident	69.6	Low	1 Å²	1	75.2 Å²	75.2	1%	0.005	35%	0.353	C	S	.	.			trans	-109.9	154	176.2	-71.9	164.9	0	0	0	111	I900 N995 L996 V1056 I1060	I900-L991 HydrophobicContact CD1-CD1 3.72Å; I900-L991 HydrophobicContact CD1-CD2 3.83Å; I900-L991 HydrophobicContact CD1-CG 4.01Å; L991-N995 HydrophobicContact CD2-CB 4.01Å; L991-L996 HydrophobicContact CB-CB 3.89Å; L991-L996 HydrophobicContact CD1-CB 4.27Å; L991-L996 HydrophobicContact CD1-CD1 3.81Å; L991-V1056 HydrophobicContact CD1-CG1 4.06Å; L991-I1060 WeakPolarHBondContact O-CG1 3.25Å; L991-I1060 PolarHBondContact O-N 3.28Å; L991-I1060 VanDerWaalsContact O-N 3.11Å
992	S	74.7	Confident	71	Confident	37 Å²	37	73.3 Å²	73.3	26%	0.259	34%	0.339	S	S	.	.			trans	-71.3	152.5	162.8	66.7	0	0	0	0	109	R994 N995 L996	S992-R994 VanDerWaalsContact C-N 3.25Å; S992-R994 PolarHBondContact O-N 3.43Å; S992-N995 CarbonylContact O-C 3.53Å; S992-N995 PolarHBondContact O-N 2.98Å; S992-N995 VanDerWaalsContact OG-CB 3.3Å; S992-N995 WeakPolarHBondContact OG-CB 3.32Å; S992-N995 PolarHBondContact OG-N 2.9Å; S992-N995 PolarHBondContact OG-OD1 3.12Å; S992-L996 WeakPolarHBondContact O-CB 2.96Å; S992-L996 PolarHBondContact O-N 3.12Å
993	D	73.9	Confident	72.4	Confident	71 Å²	71	67.1 Å²	67.1	38%	0.38	31%	0.306	S	S	.	.	H	α-helix	trans	-53.3	-42.1	-179.1	174.9	71.1	0	0	0	113	L996 K997	D993-L996 PolarHBondContact O-N 3.01Å; D993-K997 WeakPolarHBondContact O-CB 3.37Å; D993-K997 WeakPolarHBondContact O-CG 2.97Å; D993-K997 PolarHBondContact O-N 2.8Å; D993-K997 WeakPolarHBondContact OD1-CE 3.45Å; D993-K997 IonicContact OD1-NZ 3.06Å; D993-K997 PolarHBondContact OD1-NZ 3.44Å; D993-K997 IonicContact OD2-NZ 2.69Å; D993-K997 PolarHBondContact OD2-NZ 3.38Å
994	R	75.8	Confident	73.8	Confident	213 Å²	213	64.4 Å²	64.4	80%	0.804	29%	0.287	S	S	*	.	H	α-helix	trans	-62.6	-44	174.3	-65.3	-177.7	-177.7	168.7	1.3	112.4	S992 L998	S992-R994 VanDerWaalsContact C-N 3.25Å; S992-R994 PolarHBondContact O-N 3.43Å; R994-L998 VanDerWaalsContact O-CB 3.29Å; R994-L998 WeakPolarHBondContact O-CB 3.31Å; R994-L998 PolarHBondContact O-N 3.22Å
995	N	78.8	Confident	75.1	Confident	47 Å²	47	57 Å²	57	25%	0.251	26%	0.261	S	S	.	.	H	α-helix	trans	-74.5	-31.4	179.7	-67.9	11.4	0	0	0	112	L991 S992 L998 T999	L991-N995 HydrophobicContact CD2-CB 4.01Å; S992-N995 CarbonylContact O-C 3.53Å; S992-N995 PolarHBondContact O-N 2.98Å; S992-N995 VanDerWaalsContact OG-CB 3.3Å; S992-N995 WeakPolarHBondContact OG-CB 3.32Å; S992-N995 PolarHBondContact OG-N 2.9Å; S992-N995 PolarHBondContact OG-OD1 3.12Å; N995-L998 PolarHBondContact O-N 3.12Å; N995-T999 VanDerWaalsContact O-CB 3.26Å; N995-T999 WeakPolarHBondContact O-CB 3.42Å; N995-T999 PolarHBondContact O-N 3.26Å; N995-T999 PolarHBondContact O-OG1 3.43Å
996	L	81.6	Confident	76.2	Confident	19 Å²	19	56.1 Å²	56.1	10%	0.099	26%	0.258	C	S	.	.	H	α-helix	trans	-64.8	-52.4	173.6	179.8	61.7	0	0	0	109.8	L991 S992 D993 L998 T999 L1000 F1057	L991-L996 HydrophobicContact CB-CB 3.89Å; L991-L996 HydrophobicContact CD1-CB 4.27Å; L991-L996 HydrophobicContact CD1-CD1 3.81Å; S992-L996 WeakPolarHBondContact O-CB 2.96Å; S992-L996 PolarHBondContact O-N 3.12Å; D993-L996 PolarHBondContact O-N 3.01Å; L996-L998 VanDerWaalsContact C-N 3.29Å; L996-L998 PolarHBondContact O-N 3.18Å; L996-T999 PolarHBondContact O-N 3.15Å; L996-L1000 HydrophobicContact CD1-CD1 4.28Å; L996-L1000 HydrophobicContact CD1-CG 4.38Å; L996-L1000 HydrophobicContact CG-CD1 4.26Å; L996-L1000 WeakPolarHBondContact O-CB 3.06Å; L996-L1000 VanDerWaalsContact O-CG 3.32Å; L996-L1000 WeakPolarHBondContact O-CG 3.08Å; L996-L1000 PolarHBondContact O-N 2.91Å; L996-F1057 HydrophobicContact CD1-CD1 4.14Å; L996-F1057 HydrophobicContact CD1-CE1 4.46Å
997	K	80.7	Confident	77.4	Confident	113 Å²	113	55.5 Å²	55.5	49%	0.491	26%	0.255	S	S	.	.	H	α-helix	trans	-57	-41.4	174.4	-73.4	166.3	-179.9	160.7	0	111.6	D993 N1001	D993-K997 WeakPolarHBondContact O-CB 3.37Å; D993-K997 WeakPolarHBondContact O-CG 2.97Å; D993-K997 PolarHBondContact O-N 2.8Å; D993-K997 WeakPolarHBondContact OD1-CE 3.45Å; D993-K997 IonicContact OD1-NZ 3.06Å; D993-K997 PolarHBondContact OD1-NZ 3.44Å; D993-K997 IonicContact OD2-NZ 2.69Å; D993-K997 PolarHBondContact OD2-NZ 3.38Å; K997-N1001 WeakPolarHBondContact O-CA 2.23Å; K997-N1001 WeakPolarHBondContact O-CB 2.22Å; K997-N1001 PolarHBondContact O-N 3.38Å; K997-N1001 PolarHBondContact O-OD1 2.91Å
998	L	81.6	Confident	78.5	Confident	79 Å²	79	49.7 Å²	49.7	41%	0.414	23%	0.234	S	C	.	.	H	α-helix	trans	-70.8	-37.9	176.1	-175.9	63.2	0	0	0	114	P897 R994 N995 L996 N1001 L1002	P897-L998 HydrophobicContact CG-CD2 4.35Å; R994-L998 VanDerWaalsContact O-CB 3.29Å; R994-L998 WeakPolarHBondContact O-CB 3.31Å; R994-L998 PolarHBondContact O-N 3.22Å; N995-L998 PolarHBondContact O-N 3.12Å; L996-L998 VanDerWaalsContact C-N 3.29Å; L996-L998 PolarHBondContact O-N 3.18Å; L998-N1001 CarbonylContact O-C 3.53Å; L998-N1001 PolarHBondContact O-N 3.1Å; L998-L1002 HydrophobicContact CD1-CD1 3.91Å; L998-L1002 HydrophobicContact CD1-CG 4.06Å; L998-L1002 HydrophobicContact CG-CD1 4.06Å; L998-L1002 WeakPolarHBondContact O-CG 3.38Å; L998-L1002 PolarHBondContact O-N 3.28Å
999	T	82.6	Confident	79.3	Confident	4 Å²	4	44.5 Å²	44.5	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-67.2	-44.1	179.2	-55.4	0	0	0	0	110.1	P897 I900 L901 N995 L996 G1003	P897-T999 WeakPolarHBondContact CA-OG1 3.41Å; P897-T999 WeakPolarHBondContact CB-OG1 3.26Å; I900-T999 HydrophobicContact CB-CG2 3.97Å; I900-T999 HydrophobicContact CG2-CG2 3.78Å; L901-T999 HydrophobicContact CD2-CG2 4.45Å; L901-T999 HydrophobicContact CG-CG2 4.41Å; N995-T999 VanDerWaalsContact O-CB 3.26Å; N995-T999 WeakPolarHBondContact O-CB 3.42Å; N995-T999 PolarHBondContact O-N 3.26Å; N995-T999 PolarHBondContact O-OG1 3.43Å; L996-T999 PolarHBondContact O-N 3.15Å; T999-G1003 PolarHBondContact O-N 3.11Å
1000	L	84.3	Confident	79.9	Confident	31 Å²	31	44.9 Å²	44.9	16%	0.162	22%	0.22	C	C	.	.	H	α-helix	trans	-57.7	-58.6	166.9	-63.4	174.1	0	0	0	108.8	L996 L1002 G1003 S1004 S1045 V1239 F1240	L996-L1000 HydrophobicContact CD1-CD1 4.28Å; L996-L1000 HydrophobicContact CD1-CG 4.38Å; L996-L1000 HydrophobicContact CG-CD1 4.26Å; L996-L1000 WeakPolarHBondContact O-CB 3.06Å; L996-L1000 VanDerWaalsContact O-CG 3.32Å; L996-L1000 WeakPolarHBondContact O-CG 3.08Å; L996-L1000 PolarHBondContact O-N 2.91Å; L1000-L1002 PolarHBondContact O-N 3.4Å; L1000-G1003 CarbonylContact O-C 3.52Å; L1000-G1003 WeakPolarHBondContact O-CA 3.23Å; L1000-G1003 PolarHBondContact O-N 3.24Å; L1000-S1004 PolarHBondContact O-N 3.01Å; L1000-S1045 WeakPolarHBondContact CD2-OG 3.44Å; L1000-V1239 HydrophobicContact CD2-CB 4.21Å; L1000-V1239 HydrophobicContact CD2-CG1 4.5Å; L1000-F1240 WeakPolarHBondContact O-CE1 3.47Å; L1000-F1240 WeakPolarHBondContact O-CZ 3.47Å
1001	N	82.8	Confident	80.4	Confident	101 Å²	101	43.9 Å²	43.9	54%	0.54	22%	0.215	S	C	.	.	H	α-helix	trans	-64.4	5.6	-176.4	-67.9	14.3	0	0	0	116.8	K997 L998 F1240	K997-N1001 WeakPolarHBondContact O-CA 2.23Å; K997-N1001 WeakPolarHBondContact O-CB 2.22Å; K997-N1001 PolarHBondContact O-N 3.38Å; K997-N1001 PolarHBondContact O-OD1 2.91Å; L998-N1001 CarbonylContact O-C 3.53Å; L998-N1001 PolarHBondContact O-N 3.1Å; N1001-F1240 HydrophobicContact CB-CE1 4.36Å; N1001-F1240 HydrophobicContact CB-CZ 4.43Å; N1001-F1240 WeakPolarHBondContact O-CZ 2.82Å
1002	L	81	Confident	80.8	Confident	51 Å²	51	46.9 Å²	46.9	27%	0.267	23%	0.23	S	C	.	.	H	α-helix	trans	-120.2	-35.1	163.6	-69.1	173.2	0	0	0	111.9	L901 L998 L1000 S1004 E1005 L1006	L901-L1002 HydrophobicContact CD1-CB 3.71Å; L901-L1002 HydrophobicContact CD1-CD1 4.05Å; L901-L1002 HydrophobicContact CD2-CB 4.34Å; L998-L1002 HydrophobicContact CD1-CD1 3.91Å; L998-L1002 HydrophobicContact CD1-CG 4.06Å; L998-L1002 HydrophobicContact CG-CD1 4.06Å; L998-L1002 WeakPolarHBondContact O-CG 3.38Å; L998-L1002 PolarHBondContact O-N 3.28Å; L1000-L1002 PolarHBondContact O-N 3.4Å; L1002-S1004 PolarHBondContact O-N 2.85Å; L1002-E1005 PolarHBondContact O-N 3.18Å; L1002-L1006 PolarHBondContact O-N 3.08Å
1003	G	82.9	Confident	80.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-30.8	172.1	0	0	0	0	0	112.5	T999 L1000 E1005 T1007	T999-G1003 PolarHBondContact O-N 3.11Å; L1000-G1003 CarbonylContact O-C 3.52Å; L1000-G1003 WeakPolarHBondContact O-CA 3.23Å; L1000-G1003 PolarHBondContact O-N 3.24Å; G1003-E1005 VanDerWaalsContact C-N 3.34Å; G1003-E1005 PolarHBondContact O-N 2.85Å; G1003-T1007 WeakPolarHBondContact O-CB 3.2Å; G1003-T1007 WeakPolarHBondContact O-CG2 3.24Å; G1003-T1007 PolarHBondContact O-N 3.46Å; G1003-T1007 PolarHBondContact O-OG1 3.09Å
1004	S	84	Confident	81.1	Confident	24 Å²	24	49.5 Å²	49.5	17%	0.168	24%	0.236	C	C	.	.	H	α-helix	trans	-62.9	-35.9	178.2	86.4	0	0	0	0	114	L1000 L1002 T1007 K1008 V1239 F1240	L1000-S1004 PolarHBondContact O-N 3.01Å; L1002-S1004 PolarHBondContact O-N 2.85Å; S1004-T1007 PolarHBondContact O-OG1 2.99Å; S1004-T1007 VanDerWaalsContact O-OG1 3.09Å; S1004-K1008 VanDerWaalsContact O-CB 3.24Å; S1004-K1008 WeakPolarHBondContact O-CB 3.41Å; S1004-K1008 PolarHBondContact O-N 2.7Å; S1004-V1239 VanDerWaalsContact CB-O 3.32Å; S1004-V1239 WeakPolarHBondContact CB-O 3.38Å; S1004-F1240 VanDerWaalsContact CA-CE1 3.48Å; S1004-F1240 WeakPolarHBondContact O-CD2 3.36Å; S1004-F1240 WeakPolarHBondContact O-CE2 3.21Å; S1004-F1240 WeakPolarHBondContact OG-CD1 3.4Å; S1004-F1240 WeakPolarHBondContact OG-CD2 3.38Å; S1004-F1240 WeakPolarHBondContact OG-CE1 3.21Å; S1004-F1240 WeakPolarHBondContact OG-CE2 2.98Å; S1004-F1240 WeakPolarHBondContact OG-CG 3.26Å; S1004-F1240 WeakPolarHBondContact OG-CZ 2.9Å
1005	E	80.6	Confident	81.3	Confident	40 Å²	40	39.4 Å²	39.4	19%	0.187	20%	0.198	C	C	.	.	H	α-helix	trans	-90.4	-34.7	-175.9	-86.7	-39.1	132.1	0	0	110	L1002 G1003 T1007 K1008 C1009 F1240	L1002-E1005 PolarHBondContact O-N 3.18Å; G1003-E1005 VanDerWaalsContact C-N 3.34Å; G1003-E1005 PolarHBondContact O-N 2.85Å; E1005-T1007 VanDerWaalsContact C-N 3.32Å; E1005-T1007 PolarHBondContact O-N 3.14Å; E1005-K1008 IonicContact OE1-NZ 3.79Å; E1005-K1008 PolarHBondContact OE1-NZ 3.23Å; E1005-K1008 IonicContact OE2-NZ 3.7Å; E1005-K1008 PolarHBondContact OE2-NZ 3.37Å; E1005-C1009 WeakPolarHBondContact O-CB 3.39Å; E1005-C1009 PolarHBondContact O-N 2.71Å; E1005-C1009 PolarHBondContact O-SG 3Å; E1005-F1240 HydrophobicContact CB-CE2 4.02Å; E1005-F1240 HydrophobicContact CG-CE2 3.73Å
1006	L	81.6	Confident	81.4	Confident	18 Å²	18	38.8 Å²	38.8	9%	0.094	20%	0.195	C	C	.	.	H	α-helix	trans	-58.7	-45.4	171.5	-170.3	151.2	0	0	0	110.7	L904 L908 L1002 F1010 F1080 I1084	L904-L1006 HydrophobicContact CG-CD2 4.42Å; L908-L1006 HydrophobicContact CD1-CD2 3.46Å; L908-L1006 VanDerWaalsContact CD1-CD2 3.46Å; L1002-L1006 PolarHBondContact O-N 3.08Å; L1006-F1010 WeakPolarHBondContact O-CB 3.48Å; L1006-F1010 PolarHBondContact O-N 3.15Å; L1006-F1080 HydrophobicContact CD1-CE1 4.31Å; L1006-F1080 HydrophobicContact CD1-CZ 3.69Å; L1006-I1084 HydrophobicContact CD1-CD1 4Å; L1006-I1084 HydrophobicContact CD1-CG1 4.14Å
1007	T	84.2	Confident	81.2	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-69	-43.8	179.7	54.5	0	0	0	0	112.9	L904 L908 G1003 S1004 E1005 Y1011 L1043 C1044	L904-T1007 HydrophobicContact CD1-CG2 3.86Å; L904-T1007 HydrophobicContact CD2-CG2 3.78Å; L904-T1007 HydrophobicContact CG-CG2 4.05Å; L908-T1007 HydrophobicContact CD1-CG2 3.75Å; L908-T1007 HydrophobicContact CD2-CG2 4.14Å; L908-T1007 HydrophobicContact CG-CG2 4.4Å; G1003-T1007 WeakPolarHBondContact O-CB 3.2Å; G1003-T1007 WeakPolarHBondContact O-CG2 3.24Å; G1003-T1007 PolarHBondContact O-N 3.46Å; G1003-T1007 PolarHBondContact O-OG1 3.09Å; S1004-T1007 PolarHBondContact O-OG1 2.99Å; S1004-T1007 VanDerWaalsContact O-OG1 3.09Å; E1005-T1007 VanDerWaalsContact C-N 3.32Å; E1005-T1007 PolarHBondContact O-N 3.14Å; T1007-Y1011 VanDerWaalsContact O-CB 3.27Å; T1007-Y1011 WeakPolarHBondContact O-CB 3.42Å; T1007-Y1011 PolarHBondContact O-N 3.29Å; T1007-L1043 HydrophobicContact CG2-CB 4.41Å; T1007-L1043 WeakPolarHBondContact CG2-O 3.32Å; T1007-C1044 HydrophobicContact CG2-CB 3.96Å
1008	K	83.3	Confident	81	Confident	36 Å²	36	34.8 Å²	34.8	16%	0.157	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-48.8	174.3	169.8	165	153.7	-105.1	0	112.7	S1004 E1005 Y1011 E1012 F1040	S1004-K1008 VanDerWaalsContact O-CB 3.24Å; S1004-K1008 WeakPolarHBondContact O-CB 3.41Å; S1004-K1008 PolarHBondContact O-N 2.7Å; E1005-K1008 IonicContact OE1-NZ 3.79Å; E1005-K1008 PolarHBondContact OE1-NZ 3.23Å; E1005-K1008 IonicContact OE2-NZ 3.7Å; E1005-K1008 PolarHBondContact OE2-NZ 3.37Å; K1008-Y1011 PolarHBondContact O-N 2.83Å; K1008-E1012 WeakPolarHBondContact O-CG 3.22Å; K1008-E1012 PolarHBondContact O-N 2.94Å; K1008-F1040 HydrophobicContact CB-CD1 4.15Å; K1008-F1040 HydrophobicContact CB-CD2 4.1Å; K1008-F1040 HydrophobicContact CB-CE1 4.19Å; K1008-F1040 HydrophobicContact CB-CE2 4.13Å; K1008-F1040 HydrophobicContact CB-CG 4.13Å; K1008-F1040 HydrophobicContact CB-CZ 4.19Å; K1008-F1040 HydrophobicContact CD-CD2 4.07Å; K1008-F1040 HydrophobicContact CD-CE2 3.76Å; K1008-F1040 HydrophobicContact CD-CZ 4.34Å; K1008-F1040 HydrophobicContact CG-CD2 4.28Å; K1008-F1040 HydrophobicContact CG-CE1 4.4Å; K1008-F1040 HydrophobicContact CG-CE2 3.86Å; K1008-F1040 HydrophobicContact CG-CZ 3.93Å
1009	C	78.6	Confident	80.9	Confident	26 Å²	26	31 Å²	31	18%	0.176	16%	0.161	C	C	.	.	H	α-helix	trans	-65.8	-40.8	178.6	-69.4	0	0	0	0	111.9	E1005 Y1011 L1013	E1005-C1009 WeakPolarHBondContact O-CB 3.39Å; E1005-C1009 PolarHBondContact O-N 2.71Å; E1005-C1009 PolarHBondContact O-SG 3Å; C1009-Y1011 VanDerWaalsContact C-N 3.34Å; C1009-L1013 VanDerWaalsContact O-CB 3.22Å; C1009-L1013 WeakPolarHBondContact O-CB 3.41Å; C1009-L1013 WeakPolarHBondContact O-CD1 3.49Å; C1009-L1013 WeakPolarHBondContact O-CG 3.43Å; C1009-L1013 PolarHBondContact O-N 2.89Å
1010	F	81.1	Confident	80.7	Confident	9 Å²	9	36.2 Å²	36.2	4%	0.039	18%	0.184	C	C	.	.	H	α-helix	trans	-65.3	-38.7	174.7	-162.7	-77.2	0	0	0	111.4	F75 L908 E909 E912 L1006 R1014 I1015	F75-F1010 HydrophobicContact CB-CE2 4.2Å; F75-F1010 HydrophobicContact CD2-CD2 4.33Å; F75-F1010 HydrophobicContact CD2-CE2 4.21Å; F75-F1010 HydrophobicContact CG-CE2 4.34Å; L908-F1010 HydrophobicContact CB-CD1 3.7Å; L908-F1010 HydrophobicContact CB-CD2 4.36Å; L908-F1010 HydrophobicContact CB-CE1 3.8Å; L908-F1010 HydrophobicContact CB-CE2 4.44Å; L908-F1010 HydrophobicContact CB-CG 4.01Å; L908-F1010 HydrophobicContact CB-CZ 4.18Å; L908-F1010 HydrophobicContact CD1-CB 4.05Å; L908-F1010 HydrophobicContact CD1-CG 4.17Å; E909-F1010 HydrophobicContact CB-CZ 4.38Å; E912-F1010 HydrophobicContact CB-CE1 4.2Å; L1006-F1010 WeakPolarHBondContact O-CB 3.48Å; L1006-F1010 PolarHBondContact O-N 3.15Å; F1010-R1014 HydrophobicContact CD1-CB 4.27Å; F1010-R1014 HydrophobicContact CE1-CB 4.12Å; F1010-R1014 WeakPolarHBondContact O-CB 3.34Å; F1010-R1014 PolarHBondContact O-N 2.84Å; F1010-I1015 HydrophobicContact CD1-CD1 4.01Å; F1010-I1015 HydrophobicContact CD1-CG1 4.04Å; F1010-I1015 HydrophobicContact CE1-CD1 4.39Å; F1010-I1015 HydrophobicContact CE1-CG1 4.25Å; F1010-I1015 PolarHBondContact O-N 3.36Å
1011	Y	82.8	Confident	80	Confident	1 Å²	1	38.4 Å²	38.4	0%	0.004	20%	0.196	C	C	.	.	I	π-helix	trans	-62.1	-55.6	175.2	177.3	-90.8	0	0	0	111.7	T1007 K1008 C1009 L1013 I1015 L1016 I1019 I1026 W1029 W1030 F1040	T1007-Y1011 VanDerWaalsContact O-CB 3.27Å; T1007-Y1011 WeakPolarHBondContact O-CB 3.42Å; T1007-Y1011 PolarHBondContact O-N 3.29Å; K1008-Y1011 PolarHBondContact O-N 2.83Å; C1009-Y1011 VanDerWaalsContact C-N 3.34Å; Y1011-L1013 VanDerWaalsContact C-N 3.33Å; Y1011-L1013 PolarHBondContact O-N 3.15Å; Y1011-I1015 HydrophobicContact CD2-CB 3.88Å; Y1011-I1015 HydrophobicContact CD2-CD1 4.32Å; Y1011-I1015 HydrophobicContact CD2-CG2 3.74Å; Y1011-I1015 HydrophobicContact CE2-CB 4.48Å; Y1011-I1015 HydrophobicContact CE2-CG2 3.95Å; Y1011-I1015 HydrophobicContact CG-CB 4.38Å; Y1011-I1015 PolarHBondContact O-N 2.83Å; Y1011-L1016 HydrophobicContact CD1-CB 4.25Å; Y1011-L1016 HydrophobicContact CE1-CB 3.94Å; Y1011-L1016 HydrophobicContact CE1-CD1 4.09Å; Y1011-L1016 HydrophobicContact CE1-CD2 4.31Å; Y1011-L1016 HydrophobicContact CE1-CG 4.35Å; Y1011-L1016 WeakPolarHBondContact O-CB 3.39Å; Y1011-L1016 PolarHBondContact O-N 3.47Å; Y1011-I1019 HydrophobicContact CE2-CD1 4.19Å; Y1011-I1026 WeakPolarHBondContact OH-CG2 3.47Å; Y1011-W1029 HydrophobicContact CD2-CH2 4.09Å; Y1011-W1029 AromaticContact CD2-CZ3 3.97Å; Y1011-W1029 HydrophobicContact CD2-CZ3 3.97Å; Y1011-W1029 AromaticContact CE2-CE3 3.97Å; Y1011-W1029 HydrophobicContact CE2-CE3 3.97Å; Y1011-W1029 HydrophobicContact CE2-CH2 4.12Å; Y1011-W1029 AromaticContact CE2-CZ3 3.63Å; Y1011-W1029 HydrophobicContact CE2-CZ3 3.63Å; Y1011-W1030 HydrophobicContact CD2-CH2 4.49Å; Y1011-W1030 HydrophobicContact CD2-CZ2 4.05Å; Y1011-W1030 HydrophobicContact CE1-CZ2 4.2Å; Y1011-W1030 HydrophobicContact CE2-CH2 4.39Å; Y1011-W1030 AromaticContact CE2-CZ2 3.57Å; Y1011-W1030 HydrophobicContact CE2-CZ2 3.57Å; Y1011-W1030 AromaticContact CZ-CZ2 3.65Å; Y1011-W1030 AromaticContact CZ-NE1 3.91Å; Y1011-W1030 PolarHBondContact OH-NE1 3.46Å; Y1011-F1040 AromaticContact CD1-CE1 3.64Å; Y1011-F1040 HydrophobicContact CD1-CE1 3.64Å; Y1011-F1040 HydrophobicContact CD1-CZ 4.22Å; Y1011-F1040 HydrophobicContact CE1-CE1 4.28Å; Y1011-F1040 AromaticContact CG-CE1 3.82Å; Y1011-F1040 HydrophobicContact CG-CE1 3.82Å
1012	E	80.2	Confident	79.4	Confident	65 Å²	65	34.5 Å²	34.5	30%	0.304	18%	0.175	S	C	.	.	I	π-helix	trans	-64.9	-34.2	-176	-68	180	157.7	0	0	112.4	K1008 R1243	K1008-E1012 WeakPolarHBondContact O-CG 3.22Å; K1008-E1012 PolarHBondContact O-N 2.94Å; E1012-R1243 IonicContact OE1-CZ 2.73Å; E1012-R1243 IonicContact OE1-NE 2.72Å; E1012-R1243 IonicContact OE1-NH2 3.43Å; E1012-R1243 PolarHBondContact OE1-NH2 3.32Å
1013	L	76.2	Confident	78.9	Confident	116 Å²	116	41.6 Å²	41.6	61%	0.607	20%	0.203	S	C	*	.	I	π-helix	trans	-86.3	-31.6	-179.1	-65.6	172.3	0	0	0	115.1	C1009 Y1011	C1009-L1013 VanDerWaalsContact O-CB 3.22Å; C1009-L1013 WeakPolarHBondContact O-CB 3.41Å; C1009-L1013 WeakPolarHBondContact O-CD1 3.49Å; C1009-L1013 WeakPolarHBondContact O-CG 3.43Å; C1009-L1013 PolarHBondContact O-N 2.89Å; Y1011-L1013 VanDerWaalsContact C-N 3.33Å; Y1011-L1013 PolarHBondContact O-N 3.15Å
1014	R	77.8	Confident	78.3	Confident	47 Å²	47	44.8 Å²	44.8	18%	0.177	22%	0.22	C	C	.	.	I	π-helix	trans	-126.9	-33.8	-168.2	-60.1	-179.8	65.1	139.7	3	114.8	K73 E912 F1010	K73-R1014 PolarHBondContact O-NH1 2.92Å; K73-R1014 PolarHBondContact O-NH2 3.09Å; E912-R1014 IonicContact OE1-NE 3.93Å; E912-R1014 IonicContact OE1-NH2 3.72Å; E912-R1014 IonicContact OE2-CZ 3.98Å; E912-R1014 IonicContact OE2-NE 2.7Å; E912-R1014 PolarHBondContact OE2-NE 3.36Å; E912-R1014 IonicContact OE2-NH2 3.14Å; E912-R1014 PolarHBondContact OE2-NH2 3.39Å; F1010-R1014 HydrophobicContact CD1-CB 4.27Å; F1010-R1014 HydrophobicContact CE1-CB 4.12Å; F1010-R1014 WeakPolarHBondContact O-CB 3.34Å; F1010-R1014 PolarHBondContact O-N 2.84Å
1015	I	80.9	Confident	77.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.24	C	C	.	.	I	π-helix	trans	-88.5	-53.5	-175.9	-58.7	-178.2	0	0	0	110.6	L915 F1010 Y1011 R1018 I1019 W1029	L915-I1015 HydrophobicContact CD1-CG2 3.6Å; F1010-I1015 HydrophobicContact CD1-CD1 4.01Å; F1010-I1015 HydrophobicContact CD1-CG1 4.04Å; F1010-I1015 HydrophobicContact CE1-CD1 4.39Å; F1010-I1015 HydrophobicContact CE1-CG1 4.25Å; F1010-I1015 PolarHBondContact O-N 3.36Å; Y1011-I1015 HydrophobicContact CD2-CB 3.88Å; Y1011-I1015 HydrophobicContact CD2-CD1 4.32Å; Y1011-I1015 HydrophobicContact CD2-CG2 3.74Å; Y1011-I1015 HydrophobicContact CE2-CB 4.48Å; Y1011-I1015 HydrophobicContact CE2-CG2 3.95Å; Y1011-I1015 HydrophobicContact CG-CB 4.38Å; Y1011-I1015 PolarHBondContact O-N 2.83Å; I1015-R1018 WeakPolarHBondContact O-CB 3.36Å; I1015-R1018 PolarHBondContact O-N 3.17Å; I1015-I1019 HydrophobicContact CG2-CD1 3.77Å; I1015-I1019 HydrophobicContact CG2-CG1 4.3Å; I1015-I1019 PolarHBondContact O-N 2.87Å; I1015-W1029 HydrophobicContact CD1-CH2 4.41Å; I1015-W1029 HydrophobicContact CD1-CZ2 4.43Å; I1015-W1029 HydrophobicContact CG2-CH2 4.13Å; I1015-W1029 HydrophobicContact CG2-CZ2 3.74Å
1016	L	81.6	Confident	77.6	Confident	35 Å²	35	49.7 Å²	49.7	18%	0.183	24%	0.241	C	C	.	.	H	α-helix	trans	-56.4	-43	-176.9	-177.1	65.2	0	0	0	113.4	Y1011 R1018 I1019 H1020 I1026	Y1011-L1016 HydrophobicContact CD1-CB 4.25Å; Y1011-L1016 HydrophobicContact CE1-CB 3.94Å; Y1011-L1016 HydrophobicContact CE1-CD1 4.09Å; Y1011-L1016 HydrophobicContact CE1-CD2 4.31Å; Y1011-L1016 HydrophobicContact CE1-CG 4.35Å; Y1011-L1016 WeakPolarHBondContact O-CB 3.39Å; Y1011-L1016 PolarHBondContact O-N 3.47Å; L1016-R1018 VanDerWaalsContact C-N 3.28Å; L1016-R1018 PolarHBondContact O-N 3.12Å; L1016-I1019 PolarHBondContact O-N 3.24Å; L1016-H1020 WeakPolarHBondContact CD1-NE2 3.44Å; L1016-H1020 PolarHBondContact O-N 2.97Å; L1016-I1026 HydrophobicContact CD1-CD1 4.13Å
1017	P	76.9	Confident	77.3	Confident	38 Å²	38	52.6 Å²	52.6	25%	0.247	26%	0.257	C	S	.	.	H	α-helix	trans	-60	-35.4	174.7	-24.5	35.7	0	0	0	113.2	C21 L1021	C21-P1017 HydrophobicContact CB-CB 4.49Å; P1017-L1021 WeakPolarHBondContact O-CB 3.21Å; P1017-L1021 VanDerWaalsContact O-CG 3.25Å; P1017-L1021 WeakPolarHBondContact O-CG 3.17Å; P1017-L1021 PolarHBondContact O-N 2.76Å
1018	R	76	Confident	76.9	Confident	9 Å²	9	56.7 Å²	56.7	3%	0.034	28%	0.279	C	S	.	.	H	α-helix	trans	-73.5	-36.4	177.7	-64.4	-171.2	-172.3	-70.9	-2.9	112.4	E912 L915 I1015 L1016 L1021 L1022	E912-R1018 VanDerWaalsContact CG-NE 3.33Å; E912-R1018 IonicContact OE1-CZ 2.68Å; E912-R1018 VanDerWaalsContact OE1-CZ 3.24Å; E912-R1018 IonicContact OE1-NE 2.61Å; E912-R1018 PolarHBondContact OE1-NE 3.23Å; E912-R1018 IonicContact OE1-NH2 3.38Å; E912-R1018 PolarHBondContact OE1-NH2 2.82Å; L915-R1018 HydrophobicContact CB-CB 4.28Å; I1015-R1018 WeakPolarHBondContact O-CB 3.36Å; I1015-R1018 PolarHBondContact O-N 3.17Å; L1016-R1018 VanDerWaalsContact C-N 3.28Å; L1016-R1018 PolarHBondContact O-N 3.12Å; R1018-L1021 PolarHBondContact O-N 3.43Å; R1018-L1022 WeakPolarHBondContact O-CB 3.41Å; R1018-L1022 WeakPolarHBondContact O-CG 3.32Å; R1018-L1022 PolarHBondContact O-N 3.12Å
1019	I	80	Confident	76.8	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.4	-47.8	174	-65.1	174.2	0	0	0	110.1	L915 Y1011 I1015 L1016 L1021 L1022 K1023 L1024 I1026 W1029	L915-I1019 HydrophobicContact CD1-CG1 4.07Å; L915-I1019 HydrophobicContact CD2-CG1 4.5Å; Y1011-I1019 HydrophobicContact CE2-CD1 4.19Å; I1015-I1019 HydrophobicContact CG2-CD1 3.77Å; I1015-I1019 HydrophobicContact CG2-CG1 4.3Å; I1015-I1019 PolarHBondContact O-N 2.87Å; L1016-I1019 PolarHBondContact O-N 3.24Å; I1019-L1021 PolarHBondContact O-N 3.3Å; I1019-L1022 PolarHBondContact O-N 2.7Å; I1019-L1022 VanDerWaalsContact O-N 3.14Å; I1019-K1023 PolarHBondContact O-N 2.69Å; I1019-L1024 HydrophobicContact CG2-CB 4.24Å; I1019-I1026 HydrophobicContact CG2-CG1 4.3Å; I1019-W1029 HydrophobicContact CD1-CB 4.03Å; I1019-W1029 HydrophobicContact CD1-CD2 3.74Å; I1019-W1029 HydrophobicContact CD1-CE3 4.29Å; I1019-W1029 HydrophobicContact CD1-CG 3.59Å; I1019-W1029 HydrophobicContact CG1-CG 4.41Å
1020	H	77.5	Confident	77	Confident	113 Å²	113	54.3 Å²	54.3	52%	0.523	27%	0.265	S	S	.	.	H	α-helix	trans	-59.8	-44.8	175.9	-71.4	-179.5	0	0	0	112.5	L1016 L1022 K1023	L1016-H1020 WeakPolarHBondContact CD1-NE2 3.44Å; L1016-H1020 PolarHBondContact O-N 2.97Å; H1020-L1022 PolarHBondContact O-N 3.2Å; H1020-K1023 PolarHBondContact O-N 2.73Å; H1020-K1023 VanDerWaalsContact O-N 3.15Å
1021	L	70.9	Confident	76.8	Confident	78 Å²	78	57.1 Å²	57.1	41%	0.408	29%	0.286	S	S	.	.	H	α-helix	trans	-64	-27.5	176.5	-73.7	169.1	0	0	0	113.3	P1017 R1018 I1019	P1017-L1021 WeakPolarHBondContact O-CB 3.21Å; P1017-L1021 VanDerWaalsContact O-CG 3.25Å; P1017-L1021 WeakPolarHBondContact O-CG 3.17Å; P1017-L1021 PolarHBondContact O-N 2.76Å; R1018-L1021 PolarHBondContact O-N 3.43Å; I1019-L1021 PolarHBondContact O-N 3.3Å
1022	L	69.6	Low	76.7	Confident	19 Å²	19	63.6 Å²	63.6	10%	0.099	31%	0.314	C	S	.	.	H	α-helix	trans	-81	-11.2	175.8	-84.5	167.7	0	0	0	114.3	L915 Q919 L922 R1018 I1019 H1020 L1024	L915-L1022 HydrophobicContact CB-CD1 4.5Å; L915-L1022 HydrophobicContact CD2-CD1 4.01Å; Q919-L1022 HydrophobicContact CB-CD2 4.29Å; Q919-L1022 HydrophobicContact CB-CG 4.36Å; L922-L1022 HydrophobicContact CD1-CD2 4.12Å; R1018-L1022 WeakPolarHBondContact O-CB 3.41Å; R1018-L1022 WeakPolarHBondContact O-CG 3.32Å; R1018-L1022 PolarHBondContact O-N 3.12Å; I1019-L1022 PolarHBondContact O-N 2.7Å; I1019-L1022 VanDerWaalsContact O-N 3.14Å; H1020-L1022 PolarHBondContact O-N 3.2Å; L1022-L1024 HydrophobicContact CB-CD1 4.02Å; L1022-L1024 HydrophobicContact CB-CG 4.17Å; L1022-L1024 HydrophobicContact CD1-CD1 4.04Å; L1022-L1024 PolarHBondContact O-N 2.65Å
1023	K	71	Confident	76.5	Confident	199 Å²	199	62.2 Å²	62.2	87%	0.865	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	29.1	-171.6	-55	-175.4	178.1	-175.6	0	114.3	I1019 H1020	I1019-K1023 PolarHBondContact O-N 2.69Å; H1020-K1023 PolarHBondContact O-N 2.73Å; H1020-K1023 VanDerWaalsContact O-N 3.15Å
1024	L	70.1	Confident	76.6	Confident	68 Å²	68	64.8 Å²	64.8	36%	0.356	32%	0.316	S	S	.	.			trans	-77.1	145.4	169.4	-74.7	164.1	0	0	0	109.4	I1019 L1022	I1019-L1024 HydrophobicContact CG2-CB 4.24Å; L1022-L1024 HydrophobicContact CB-CD1 4.02Å; L1022-L1024 HydrophobicContact CB-CG 4.17Å; L1022-L1024 HydrophobicContact CD1-CD1 4.04Å; L1022-L1024 PolarHBondContact O-N 2.65Å
1025	H	73.4	Confident	76.8	Confident	125 Å²	125	63.6 Å²	63.6	58%	0.579	31%	0.313	S	S	*	.			trans	-64.8	148.9	166.1	-130.5	-95.8	0	0	0	109.2	D1027 D1028	H1025-D1027 IonicContact CE1-OD2 3.76Å; H1025-D1027 PolarHBondContact CE1-OD2 3.2Å; H1025-D1027 IonicContact CG-OD2 2.66Å; H1025-D1027 IonicContact ND1-OD2 3.07Å; H1025-D1027 PolarHBondContact ND1-OD2 2.93Å; H1025-D1028 HydrophobicContact CB-CB 4.14Å; H1025-D1028 WeakPolarHBondContact CB-OD2 3.36Å; H1025-D1028 PolarHBondContact O-N 3.35Å
1026	I	75.6	Confident	76.5	Confident	42 Å²	42	69.8 Å²	69.8	22%	0.215	35%	0.346	C	S	.	.	S	Bend	trans	-74.8	-40.2	-176.8	-59.5	171.3	0	0	0	109	Y1011 L1016 I1019 D1028 W1029 W1030 E1037	Y1011-I1026 WeakPolarHBondContact OH-CG2 3.47Å; L1016-I1026 HydrophobicContact CD1-CD1 4.13Å; I1019-I1026 HydrophobicContact CG2-CG1 4.3Å; I1026-D1028 VanDerWaalsContact C-N 3.29Å; I1026-D1028 PolarHBondContact O-N 3.44Å; I1026-W1029 WeakPolarHBondContact O-CB 3.5Å; I1026-W1029 PolarHBondContact O-N 2.62Å; I1026-W1030 VanDerWaalsContact O-CD1 3.26Å; I1026-W1030 PolarHBondContact O-N 2.77Å; I1026-E1037 WeakPolarHBondContact CB-OE1 3.34Å; I1026-E1037 WeakPolarHBondContact CG2-OE1 3.49Å
1027	D	75	Confident	76.1	Confident	78 Å²	78	72 Å²	72	42%	0.417	36%	0.356	S	S	.	.	H	α-helix	trans	-51.5	-42.7	168.5	-47.2	-97.3	0	0	0	113.2	H1025 W1029 W1030 S1031 E1037	H1025-D1027 IonicContact CE1-OD2 3.76Å; H1025-D1027 PolarHBondContact CE1-OD2 3.2Å; H1025-D1027 IonicContact CG-OD2 2.66Å; H1025-D1027 IonicContact ND1-OD2 3.07Å; H1025-D1027 PolarHBondContact ND1-OD2 2.93Å; D1027-W1029 PolarHBondContact O-N 2.98Å; D1027-W1029 VanDerWaalsContact O-N 3.12Å; D1027-W1030 PolarHBondContact O-N 2.79Å; D1027-S1031 VanDerWaalsContact O-CB 3.23Å; D1027-S1031 WeakPolarHBondContact O-CB 3.39Å; D1027-S1031 PolarHBondContact O-N 2.96Å; D1027-S1031 PolarHBondContact O-OG 3.06Å; D1027-E1037 PolarHBondContact N-OE1 2.95Å; D1027-E1037 VanDerWaalsContact N-OE1 3.09Å
1028	D	77	Confident	76.2	Confident	86 Å²	86	71.8 Å²	71.8	46%	0.46	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-15.9	178.9	-77.8	-25.1	0	0	0	112.7	H1025 I1026 K1032	H1025-D1028 HydrophobicContact CB-CB 4.14Å; H1025-D1028 WeakPolarHBondContact CB-OD2 3.36Å; H1025-D1028 PolarHBondContact O-N 3.35Å; I1026-D1028 VanDerWaalsContact C-N 3.29Å; I1026-D1028 PolarHBondContact O-N 3.44Å; D1028-K1032 WeakPolarHBondContact O-CG 3.44Å; D1028-K1032 PolarHBondContact O-NZ 3.36Å
1029	W	81	Confident	76.6	Confident	12 Å²	12	72.6 Å²	72.6	5%	0.045	36%	0.357	C	S	.	.	H	α-helix	trans	-92.6	-42.8	174.7	-169.7	88.5	0	0	0	111.8	L911 Y1011 I1015 I1019 I1026 D1027 F1033 L1043	L911-W1029 HydrophobicContact CD1-CZ2 4.42Å; Y1011-W1029 HydrophobicContact CD2-CH2 4.09Å; Y1011-W1029 AromaticContact CD2-CZ3 3.97Å; Y1011-W1029 HydrophobicContact CD2-CZ3 3.97Å; Y1011-W1029 AromaticContact CE2-CE3 3.97Å; Y1011-W1029 HydrophobicContact CE2-CE3 3.97Å; Y1011-W1029 HydrophobicContact CE2-CH2 4.12Å; Y1011-W1029 AromaticContact CE2-CZ3 3.63Å; Y1011-W1029 HydrophobicContact CE2-CZ3 3.63Å; I1015-W1029 HydrophobicContact CD1-CH2 4.41Å; I1015-W1029 HydrophobicContact CD1-CZ2 4.43Å; I1015-W1029 HydrophobicContact CG2-CH2 4.13Å; I1015-W1029 HydrophobicContact CG2-CZ2 3.74Å; I1019-W1029 HydrophobicContact CD1-CB 4.03Å; I1019-W1029 HydrophobicContact CD1-CD2 3.74Å; I1019-W1029 HydrophobicContact CD1-CE3 4.29Å; I1019-W1029 HydrophobicContact CD1-CG 3.59Å; I1019-W1029 HydrophobicContact CG1-CG 4.41Å; I1026-W1029 WeakPolarHBondContact O-CB 3.5Å; I1026-W1029 PolarHBondContact O-N 2.62Å; D1027-W1029 PolarHBondContact O-N 2.98Å; D1027-W1029 VanDerWaalsContact O-N 3.12Å; W1029-F1033 HydrophobicContact CD2-CE2 4.27Å; W1029-F1033 HydrophobicContact CE3-CE2 4.31Å; W1029-F1033 HydrophobicContact CH2-CE2 4.02Å; W1029-F1033 AromaticContact CZ2-CE2 3.96Å; W1029-F1033 HydrophobicContact CZ2-CE2 3.96Å; W1029-F1033 HydrophobicContact CZ3-CE2 4.19Å; W1029-L1043 HydrophobicContact CH2-CD1 3.92Å; W1029-L1043 HydrophobicContact CZ3-CD1 4.04Å
1030	W	82	Confident	76.8	Confident	1 Å²	1	72.8 Å²	72.8	0%	0.004	36%	0.358	C	S	.	.	H	α-helix	trans	-69.4	-42.4	177.6	-69.1	103.2	0	0	0	113	Y1011 I1026 D1027 K1032 F1033 L1035 D1039 F1040 L1043	Y1011-W1030 HydrophobicContact CD2-CH2 4.49Å; Y1011-W1030 HydrophobicContact CD2-CZ2 4.05Å; Y1011-W1030 HydrophobicContact CE1-CZ2 4.2Å; Y1011-W1030 HydrophobicContact CE2-CH2 4.39Å; Y1011-W1030 AromaticContact CE2-CZ2 3.57Å; Y1011-W1030 HydrophobicContact CE2-CZ2 3.57Å; Y1011-W1030 AromaticContact CZ-CZ2 3.65Å; Y1011-W1030 AromaticContact CZ-NE1 3.91Å; Y1011-W1030 PolarHBondContact OH-NE1 3.46Å; I1026-W1030 VanDerWaalsContact O-CD1 3.26Å; I1026-W1030 PolarHBondContact O-N 2.77Å; D1027-W1030 PolarHBondContact O-N 2.79Å; W1030-K1032 PolarHBondContact O-N 2.98Å; W1030-K1032 VanDerWaalsContact O-N 3.16Å; W1030-F1033 PolarHBondContact O-N 3.48Å; W1030-L1035 CarbonylContact C-O 3.58Å; W1030-L1035 HydrophobicContact CE3-CB 4.15Å; W1030-L1035 HydrophobicContact CE3-CD1 3.94Å; W1030-L1035 HydrophobicContact CZ3-CD1 4.21Å; W1030-L1035 PolarHBondContact O-N 3.2Å; W1030-D1039 VanDerWaalsContact CZ3-C 3.48Å; W1030-D1039 WeakPolarHBondContact CZ3-O 3.42Å; W1030-F1040 AromaticContact CH2-CD1 3.67Å; W1030-F1040 HydrophobicContact CH2-CD1 3.67Å; W1030-F1040 AromaticContact CH2-CE1 4Å; W1030-F1040 HydrophobicContact CH2-CE1 4Å; W1030-F1040 HydrophobicContact CH2-CG 4.37Å; W1030-F1040 HydrophobicContact CZ2-CD1 4.26Å; W1030-F1040 HydrophobicContact CZ2-CE1 4.12Å; W1030-L1043 HydrophobicContact CH2-CD1 3.95Å; W1030-L1043 HydrophobicContact CH2-CD2 4.34Å; W1030-L1043 HydrophobicContact CZ3-CD1 3.6Å
1031	S	78.5	Confident	77.2	Confident	67 Å²	67	69.9 Å²	69.9	47%	0.469	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-59.4	-27.7	179.4	56	0	0	0	0	114	D1027 F1033 Q1034	D1027-S1031 VanDerWaalsContact O-CB 3.23Å; D1027-S1031 WeakPolarHBondContact O-CB 3.39Å; D1027-S1031 PolarHBondContact O-N 2.96Å; D1027-S1031 PolarHBondContact O-OG 3.06Å; S1031-F1033 PolarHBondContact O-N 2.93Å; S1031-F1033 VanDerWaalsContact O-N 3.09Å; S1031-Q1034 PolarHBondContact O-N 2.68Å
1032	K	79.3	Confident	77.8	Confident	137 Å²	137	66.1 Å²	66.1	60%	0.596	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-60.2	-18.7	174.1	-71.6	180	176.3	98	0	113.7	D1028 W1030	D1028-K1032 WeakPolarHBondContact O-CG 3.44Å; D1028-K1032 PolarHBondContact O-NZ 3.36Å; W1030-K1032 PolarHBondContact O-N 2.98Å; W1030-K1032 VanDerWaalsContact O-N 3.16Å
1033	F	76.4	Confident	78.5	Confident	36 Å²	36	65.2 Å²	65.2	16%	0.158	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-109.9	2.1	178.1	-55.9	-57.7	0	0	0	112.9	L911 W1029 W1030 S1031 L1035 Y1046 L1237	L911-F1033 HydrophobicContact CD2-CZ 3.97Å; W1029-F1033 HydrophobicContact CD2-CE2 4.27Å; W1029-F1033 HydrophobicContact CE3-CE2 4.31Å; W1029-F1033 HydrophobicContact CH2-CE2 4.02Å; W1029-F1033 AromaticContact CZ2-CE2 3.96Å; W1029-F1033 HydrophobicContact CZ2-CE2 3.96Å; W1029-F1033 HydrophobicContact CZ3-CE2 4.19Å; W1030-F1033 PolarHBondContact O-N 3.48Å; S1031-F1033 PolarHBondContact O-N 2.93Å; S1031-F1033 VanDerWaalsContact O-N 3.09Å; F1033-L1035 HydrophobicContact CB-CD1 3.46Å; F1033-L1035 VanDerWaalsContact CB-CD1 3.46Å; F1033-L1035 HydrophobicContact CB-CG 3.72Å; F1033-L1035 HydrophobicContact CD2-CD1 4.34Å; F1033-L1035 HydrophobicContact CG-CD1 4.29Å; F1033-Y1046 VanDerWaalsContact O-CE1 3.26Å; F1033-Y1046 WeakPolarHBondContact O-CE1 3.16Å; F1033-Y1046 PolarHBondContact O-OH 3.02Å; F1033-L1237 HydrophobicContact CB-CD1 4.01Å; F1033-L1237 HydrophobicContact CD1-CD1 3.26Å; F1033-L1237 HydrophobicContact CD2-CD1 4.08Å; F1033-L1237 HydrophobicContact CE1-CD1 3.62Å; F1033-L1237 HydrophobicContact CE2-CD1 4.37Å; F1033-L1237 HydrophobicContact CG-CD1 3.51Å; F1033-L1237 HydrophobicContact CZ-CD1 4.15Å
1034	Q	78.6	Confident	79.3	Confident	170 Å²	170	55.8 Å²	55.8	79%	0.794	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	48.6	-172.9	-54.9	176.5	-22.3	0	0	113	S1031	S1031-Q1034 PolarHBondContact O-N 2.68Å
1035	L	81.4	Confident	80	Confident	22 Å²	22	52.7 Å²	52.7	12%	0.115	27%	0.267	C	S	.	.			trans	-130.8	155.9	-174.9	-52.9	170.5	0	0	0	111.5	W1030 F1033 D1039 G1042 Y1046	W1030-L1035 CarbonylContact C-O 3.58Å; W1030-L1035 HydrophobicContact CE3-CB 4.15Å; W1030-L1035 HydrophobicContact CE3-CD1 3.94Å; W1030-L1035 HydrophobicContact CZ3-CD1 4.21Å; W1030-L1035 PolarHBondContact O-N 3.2Å; F1033-L1035 HydrophobicContact CB-CD1 3.46Å; F1033-L1035 VanDerWaalsContact CB-CD1 3.46Å; F1033-L1035 HydrophobicContact CB-CG 3.72Å; F1033-L1035 HydrophobicContact CD2-CD1 4.34Å; F1033-L1035 HydrophobicContact CG-CD1 4.29Å; L1035-D1039 HydrophobicContact CB-CB 4.38Å; L1035-G1042 WeakPolarHBondContact CD1-O 3.38Å; L1035-Y1046 HydrophobicContact CD2-CD1 4.34Å; L1035-Y1046 HydrophobicContact CD2-CE1 4.33Å
1036	D	74.3	Confident	80.5	Confident	131 Å²	131	49.5 Å²	49.5	70%	0.701	25%	0.25	S	S	*	.			trans	-82.7	168.7	173.9	-63.9	-39.7	0	0	0	112.7	N1038 D1039	D1036-N1038 PolarHBondContact O-N 3.49Å; D1036-D1039 HydrophobicContact CB-CB 4.05Å; D1036-D1039 WeakPolarHBondContact O-CB 3.35Å; D1036-D1039 PolarHBondContact O-N 3.1Å; D1036-D1039 VanDerWaalsContact O-N 3.1Å
1037	E	74.5	Confident	80.9	Confident	82 Å²	82	48.9 Å²	48.9	38%	0.383	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	130.2	-179.9	-76.9	-135.5	131.9	0	0	113.9	I1026 D1027 D1039	I1026-E1037 WeakPolarHBondContact CB-OE1 3.34Å; I1026-E1037 WeakPolarHBondContact CG2-OE1 3.49Å; D1027-E1037 PolarHBondContact N-OE1 2.95Å; D1027-E1037 VanDerWaalsContact N-OE1 3.09Å; E1037-D1039 PolarHBondContact O-N 2.88Å; E1037-D1039 VanDerWaalsContact O-N 3.1Å
1038	N	79.2	Confident	81.2	Confident	33 Å²	33	45.4 Å²	45.4	18%	0.176	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	16.8	-173.1	-41.2	-88.1	0	0	0	112.3	D1036 F1040 R1243	D1036-N1038 PolarHBondContact O-N 3.49Å; N1038-F1040 HydrophobicContact CB-CE2 4.14Å; N1038-F1040 HydrophobicContact CB-CZ 4.3Å; N1038-F1040 VanDerWaalsContact O-CD2 3.32Å; N1038-F1040 WeakPolarHBondContact O-CD2 3.34Å; N1038-F1040 PolarHBondContact O-N 2.95Å; N1038-R1243 PolarHBondContact OD1-NH1 2.94Å
1039	D	83.1	Confident	81.5	Confident	26 Å²	26	46.2 Å²	46.2	14%	0.139	23%	0.225	C	C	.	.			trans	-70.5	70.5	159.5	-164.7	50.8	0	0	0	108	W1030 L1035 D1036 E1037 T1041 G1042	W1030-D1039 VanDerWaalsContact CZ3-C 3.48Å; W1030-D1039 WeakPolarHBondContact CZ3-O 3.42Å; L1035-D1039 HydrophobicContact CB-CB 4.38Å; D1036-D1039 HydrophobicContact CB-CB 4.05Å; D1036-D1039 WeakPolarHBondContact O-CB 3.35Å; D1036-D1039 PolarHBondContact O-N 3.1Å; D1036-D1039 VanDerWaalsContact O-N 3.1Å; E1037-D1039 PolarHBondContact O-N 2.88Å; E1037-D1039 VanDerWaalsContact O-N 3.1Å; D1039-T1041 PolarHBondContact O-N 3.17Å; D1039-T1041 WeakPolarHBondContact OD1-CA 3.11Å; D1039-T1041 WeakPolarHBondContact OD1-CB 3.27Å; D1039-T1041 PolarHBondContact OD1-N 2.83Å; D1039-T1041 VanDerWaalsContact OD1-N 3.15Å; D1039-T1041 PolarHBondContact OD1-OG1 2.89Å; D1039-T1041 WeakPolarHBondContact OD2-CA 3.39Å; D1039-G1042 VanDerWaalsContact O-CA 3.25Å; D1039-G1042 WeakPolarHBondContact O-CA 3.4Å; D1039-G1042 PolarHBondContact O-N 2.77Å; D1039-G1042 PolarHBondContact OD2-N 2.92Å
1040	F	85	Confident	81.4	Confident	3 Å²	3	50.4 Å²	50.4	1%	0.013	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-58.1	-7.2	150.8	-24.7	-87	0	0	0	109.1	K1008 Y1011 W1030 N1038 G1042 L1043 V1239 F1240	K1008-F1040 HydrophobicContact CB-CD1 4.15Å; K1008-F1040 HydrophobicContact CB-CD2 4.1Å; K1008-F1040 HydrophobicContact CB-CE1 4.19Å; K1008-F1040 HydrophobicContact CB-CE2 4.13Å; K1008-F1040 HydrophobicContact CB-CG 4.13Å; K1008-F1040 HydrophobicContact CB-CZ 4.19Å; K1008-F1040 HydrophobicContact CD-CD2 4.07Å; K1008-F1040 HydrophobicContact CD-CE2 3.76Å; K1008-F1040 HydrophobicContact CD-CZ 4.34Å; K1008-F1040 HydrophobicContact CG-CD2 4.28Å; K1008-F1040 HydrophobicContact CG-CE1 4.4Å; K1008-F1040 HydrophobicContact CG-CE2 3.86Å; K1008-F1040 HydrophobicContact CG-CZ 3.93Å; Y1011-F1040 AromaticContact CD1-CE1 3.64Å; Y1011-F1040 HydrophobicContact CD1-CE1 3.64Å; Y1011-F1040 HydrophobicContact CD1-CZ 4.22Å; Y1011-F1040 HydrophobicContact CE1-CE1 4.28Å; Y1011-F1040 AromaticContact CG-CE1 3.82Å; Y1011-F1040 HydrophobicContact CG-CE1 3.82Å; W1030-F1040 AromaticContact CH2-CD1 3.67Å; W1030-F1040 HydrophobicContact CH2-CD1 3.67Å; W1030-F1040 AromaticContact CH2-CE1 4Å; W1030-F1040 HydrophobicContact CH2-CE1 4Å; W1030-F1040 HydrophobicContact CH2-CG 4.37Å; W1030-F1040 HydrophobicContact CZ2-CD1 4.26Å; W1030-F1040 HydrophobicContact CZ2-CE1 4.12Å; N1038-F1040 HydrophobicContact CB-CE2 4.14Å; N1038-F1040 HydrophobicContact CB-CZ 4.3Å; N1038-F1040 VanDerWaalsContact O-CD2 3.32Å; N1038-F1040 WeakPolarHBondContact O-CD2 3.34Å; N1038-F1040 PolarHBondContact O-N 2.95Å; F1040-G1042 CarbonylContact O-C 3.57Å; F1040-G1042 PolarHBondContact O-N 3.48Å; F1040-L1043 HydrophobicContact CB-CB 4.01Å; F1040-L1043 HydrophobicContact CD1-CD2 4.3Å; F1040-L1043 PolarHBondContact O-N 3.44Å; F1040-V1239 CarbonylContact O-C 2.94Å; F1040-V1239 WeakPolarHBondContact O-CA 3.24Å; F1040-V1239 PolarHBondContact O-N 3.13Å; F1040-F1240 CarbonylContact C-O 2.98Å; F1040-F1240 WeakPolarHBondContact CA-O 3.49Å; F1040-F1240 WeakPolarHBondContact CB-O 3.47Å; F1040-F1240 WeakPolarHBondContact CD2-O 3.3Å; F1040-F1240 PolarHBondContact N-O 2.79Å; F1040-F1240 PolarHBondContact O-N 3.28Å
1041	T	84.9	Confident	80.8	Confident	52 Å²	52	51.5 Å²	51.5	32%	0.319	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-62.2	-3.2	164.5	4.7	0	0	0	0	112.7	D1039 S1238 V1239 F1240 A1241	D1039-T1041 PolarHBondContact O-N 3.17Å; D1039-T1041 WeakPolarHBondContact OD1-CA 3.11Å; D1039-T1041 WeakPolarHBondContact OD1-CB 3.27Å; D1039-T1041 PolarHBondContact OD1-N 2.83Å; D1039-T1041 VanDerWaalsContact OD1-N 3.15Å; D1039-T1041 PolarHBondContact OD1-OG1 2.89Å; D1039-T1041 WeakPolarHBondContact OD2-CA 3.39Å; T1041-S1238 WeakPolarHBondContact O-CB 3.22Å; T1041-S1238 PolarHBondContact O-OG 3.21Å; T1041-V1239 HydrophobicContact CG2-CB 4.08Å; T1041-V1239 HydrophobicContact CG2-CG1 3.75Å; T1041-V1239 HydrophobicContact CG2-CG2 4.31Å; T1041-V1239 WeakPolarHBondContact O-CA 3.31Å; T1041-V1239 PolarHBondContact O-N 3.35Å; T1041-F1240 VanDerWaalsContact CA-C 3.41Å; T1041-F1240 VanDerWaalsContact CA-N 3.3Å; T1041-F1240 PolarHBondContact N-O 3Å; T1041-A1241 VanDerWaalsContact CB-N 3.28Å; T1041-A1241 WeakPolarHBondContact OG1-CA 3.28Å; T1041-A1241 WeakPolarHBondContact OG1-CB 3.24Å; T1041-A1241 PolarHBondContact OG1-N 3.2Å
1042	G	83.5	Confident	80.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-104.6	-3.6	164.7	0	0	0	0	0	119.6	L1035 D1039 F1040 L1237 S1238	L1035-G1042 WeakPolarHBondContact CD1-O 3.38Å; D1039-G1042 VanDerWaalsContact O-CA 3.25Å; D1039-G1042 WeakPolarHBondContact O-CA 3.4Å; D1039-G1042 PolarHBondContact O-N 2.77Å; D1039-G1042 PolarHBondContact OD2-N 2.92Å; F1040-G1042 CarbonylContact O-C 3.57Å; F1040-G1042 PolarHBondContact O-N 3.48Å; G1042-L1237 CarbonylContact O-C 3.59Å; G1042-L1237 WeakPolarHBondContact O-CB 3.38Å; G1042-S1238 WeakPolarHBondContact O-CA 3.26Å; G1042-S1238 WeakPolarHBondContact O-CB 3.48Å; G1042-S1238 PolarHBondContact O-N 2.94Å
1043	L	85.2	Confident	79.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-7.6	-165.3	-132	81.3	0	0	0	123.4	L908 T1007 W1029 W1030 F1040 L1237 S1238	L908-L1043 HydrophobicContact CD2-CD2 4.07Å; L908-L1043 HydrophobicContact CD2-CG 4.39Å; T1007-L1043 HydrophobicContact CG2-CB 4.41Å; T1007-L1043 WeakPolarHBondContact CG2-O 3.32Å; W1029-L1043 HydrophobicContact CH2-CD1 3.92Å; W1029-L1043 HydrophobicContact CZ3-CD1 4.04Å; W1030-L1043 HydrophobicContact CH2-CD1 3.95Å; W1030-L1043 HydrophobicContact CH2-CD2 4.34Å; W1030-L1043 HydrophobicContact CZ3-CD1 3.6Å; F1040-L1043 HydrophobicContact CB-CB 4.01Å; F1040-L1043 HydrophobicContact CD1-CD2 4.3Å; F1040-L1043 PolarHBondContact O-N 3.44Å; L1043-L1237 VanDerWaalsContact C-CA 3.45Å; L1043-L1237 HydrophobicContact CD1-CD2 3.51Å; L1043-L1237 HydrophobicContact CG-CD2 3.91Å; L1043-L1237 VanDerWaalsContact O-CA 3.24Å; L1043-L1237 WeakPolarHBondContact O-CA 3.42Å; L1043-S1238 VanDerWaalsContact N-CA 3.29Å
1044	C	87.1	Confident	79.6	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	-97.9	-46.3	166.1	152	0	0	0	0	121.3	L904 T1007 L1048 L1237 S1238	L904-C1044 WeakPolarHBondContact CD1-O 3.29Å; L904-C1044 HydrophobicContact CD2-CB 3.58Å; T1007-C1044 HydrophobicContact CG2-CB 3.96Å; C1044-L1048 VanDerWaalsContact O-CD1 3.28Å; C1044-L1048 WeakPolarHBondContact O-CD1 3.49Å; C1044-L1048 VanDerWaalsContact O-CG 3.24Å; C1044-L1048 WeakPolarHBondContact O-CG 3Å; C1044-L1237 CarbonylContact C-O 3.49Å; C1044-S1238 CarbonylContact C-O 3.2Å; C1044-S1238 WeakPolarHBondContact CA-O 3.44Å; C1044-S1238 WeakPolarHBondContact CB-O 3.42Å; C1044-S1238 PolarHBondContact N-O 3.12Å
1045	S	84.1	Confident	79	Confident	4 Å²	4	43.4 Å²	43.4	3%	0.028	22%	0.219	C	C	.	.	S	Bend	trans	-120.5	-27.9	-168.7	61.9	0	0	0	0	126.7	L1000 L1047 L1048 R1049 F1057 L1237 S1238 V1239	L1000-S1045 WeakPolarHBondContact CD2-OG 3.44Å; S1045-L1047 VanDerWaalsContact C-N 3.29Å; S1045-L1047 PolarHBondContact O-N 3.41Å; S1045-L1048 VanDerWaalsContact C-N 3.34Å; S1045-L1048 CarbonylContact O-C 3.6Å; S1045-L1048 VanDerWaalsContact O-CA 3.24Å; S1045-L1048 WeakPolarHBondContact O-CA 3.39Å; S1045-L1048 VanDerWaalsContact O-CB 3.26Å; S1045-L1048 WeakPolarHBondContact O-CB 3.37Å; S1045-L1048 PolarHBondContact O-N 3Å; S1045-R1049 PolarHBondContact O-N 3.41Å; S1045-F1057 WeakPolarHBondContact O-CZ 3.2Å; S1045-L1237 CarbonylContact C-O 3.58Å; S1045-L1237 WeakPolarHBondContact CA-O 3.49Å; S1045-L1237 PolarHBondContact N-O 3.13Å; S1045-S1238 PolarHBondContact N-O 2.67Å; S1045-S1238 PolarHBondContact OG-O 2.71Å; S1045-V1239 VanDerWaalsContact OG-CG2 3.31Å; S1045-V1239 WeakPolarHBondContact OG-CG2 3.23Å
1046	Y	85.6	Confident	78.6	Confident	58 Å²	58	42.5 Å²	42.5	23%	0.227	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-39.9	-45.5	164.5	176.1	144.7	0	0	0	115.1	F1033 L1035 R1049 L1237 S1238	F1033-Y1046 VanDerWaalsContact O-CE1 3.26Å; F1033-Y1046 WeakPolarHBondContact O-CE1 3.16Å; F1033-Y1046 PolarHBondContact O-OH 3.02Å; L1035-Y1046 HydrophobicContact CD2-CD1 4.34Å; L1035-Y1046 HydrophobicContact CD2-CE1 4.33Å; Y1046-R1049 VanDerWaalsContact CG-NH2 3.26Å; Y1046-R1049 WeakPolarHBondContact O-CB 3.2Å; Y1046-R1049 VanDerWaalsContact O-CG 3.28Å; Y1046-R1049 WeakPolarHBondContact O-CG 2.92Å; Y1046-R1049 PolarHBondContact O-N 3.41Å; Y1046-R1049 PolarHBondContact O-NE 3.03Å; Y1046-L1237 CarbonylContact C-O 3.5Å; Y1046-L1237 WeakPolarHBondContact CA-O 3.41Å; Y1046-L1237 PolarHBondContact N-O 3.01Å; Y1046-S1238 WeakPolarHBondContact CB-OG 3.46Å; Y1046-S1238 VanDerWaalsContact N-CB 3.32Å; Y1046-S1238 PolarHBondContact N-OG 2.91Å
1047	L	82.3	Confident	78.4	Confident	29 Å²	29	39.6 Å²	39.6	15%	0.152	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-5.5	170.5	-65	-170.8	0	0	0	111.8	S1045 R1049 N1050 A1051 F1235 P1236 L1237	S1045-L1047 VanDerWaalsContact C-N 3.29Å; S1045-L1047 PolarHBondContact O-N 3.41Å; L1047-R1049 PolarHBondContact O-N 2.86Å; L1047-N1050 VanDerWaalsContact CA-CB 3.46Å; L1047-N1050 HydrophobicContact CB-CB 3.55Å; L1047-N1050 HydrophobicContact CD2-CB 3.46Å; L1047-N1050 VanDerWaalsContact CD2-CB 3.46Å; L1047-N1050 HydrophobicContact CG-CB 3.96Å; L1047-N1050 CarbonylContact O-C 3.54Å; L1047-N1050 WeakPolarHBondContact O-CA 3.02Å; L1047-N1050 WeakPolarHBondContact O-CB 3.45Å; L1047-N1050 PolarHBondContact O-N 3.07Å; L1047-A1051 PolarHBondContact O-N 3.29Å; L1047-F1235 HydrophobicContact CD1-CD1 3.96Å; L1047-P1236 VanDerWaalsContact CB-CA 3.42Å; L1047-P1236 HydrophobicContact CB-CB 3.47Å; L1047-P1236 VanDerWaalsContact CB-CB 3.47Å; L1047-P1236 WeakPolarHBondContact O-CB 3.29Å; L1047-L1237 HydrophobicContact CB-CB 3.94Å; L1047-L1237 HydrophobicContact CB-CG 4.33Å; L1047-L1237 HydrophobicContact CD1-CB 4.16Å; L1047-L1237 HydrophobicContact CD1-CD1 3.74Å; L1047-L1237 HydrophobicContact CD1-CG 3.65Å; L1047-L1237 HydrophobicContact CG-CB 3.87Å; L1047-L1237 HydrophobicContact CG-CD1 3.99Å; L1047-L1237 HydrophobicContact CG-CG 3.92Å; L1047-L1237 PolarHBondContact N-O 3.21Å
1048	L	83.1	Confident	78	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-29.1	156.1	-70	169.7	0	0	0	107.5	I900 I903 C1044 S1045 N1050 A1051 F1052 G1053 F1057 P1236	I900-L1048 HydrophobicContact CG2-CD1 3.89Å; I900-L1048 HydrophobicContact CG2-CD2 3.9Å; I903-L1048 HydrophobicContact CG2-CD2 4.14Å; C1044-L1048 VanDerWaalsContact O-CD1 3.28Å; C1044-L1048 WeakPolarHBondContact O-CD1 3.49Å; C1044-L1048 VanDerWaalsContact O-CG 3.24Å; C1044-L1048 WeakPolarHBondContact O-CG 3Å; S1045-L1048 VanDerWaalsContact C-N 3.34Å; S1045-L1048 CarbonylContact O-C 3.6Å; S1045-L1048 VanDerWaalsContact O-CA 3.24Å; S1045-L1048 WeakPolarHBondContact O-CA 3.39Å; S1045-L1048 VanDerWaalsContact O-CB 3.26Å; S1045-L1048 WeakPolarHBondContact O-CB 3.37Å; S1045-L1048 PolarHBondContact O-N 3Å; L1048-N1050 PolarHBondContact O-N 3.46Å; L1048-A1051 PolarHBondContact O-N 3.06Å; L1048-F1052 HydrophobicContact CB-CD2 4.08Å; L1048-F1052 HydrophobicContact CD2-CD2 3.63Å; L1048-F1052 HydrophobicContact CD2-CE2 3.37Å; L1048-F1052 HydrophobicContact CG-CD2 4.46Å; L1048-F1052 WeakPolarHBondContact O-CA 3.34Å; L1048-F1052 VanDerWaalsContact O-CB 3.27Å; L1048-F1052 WeakPolarHBondContact O-CB 3.48Å; L1048-F1052 PolarHBondContact O-N 2.91Å; L1048-G1053 PolarHBondContact O-N 3.22Å; L1048-F1057 HydrophobicContact CB-CZ 4.22Å; L1048-P1236 HydrophobicContact CD2-CB 4.34Å; L1048-P1236 HydrophobicContact CD2-CG 3.49Å; L1048-P1236 VanDerWaalsContact CD2-CG 3.49Å; L1048-P1236 HydrophobicContact CG-CB 4.27Å; L1048-P1236 HydrophobicContact CG-CG 3.77Å
1049	R	81.9	Confident	77.4	Confident	103 Å²	103	39.4 Å²	39.4	39%	0.389	21%	0.205	S	C	.	.	H	α-helix	trans	-62.5	-23.9	160.4	143.5	-172.8	89.1	162.9	5.5	114.2	S1045 Y1046 L1047 G1053 E1054 F1057	S1045-R1049 PolarHBondContact O-N 3.41Å; Y1046-R1049 VanDerWaalsContact CG-NH2 3.26Å; Y1046-R1049 WeakPolarHBondContact O-CB 3.2Å; Y1046-R1049 VanDerWaalsContact O-CG 3.28Å; Y1046-R1049 WeakPolarHBondContact O-CG 2.92Å; Y1046-R1049 PolarHBondContact O-N 3.41Å; Y1046-R1049 PolarHBondContact O-NE 3.03Å; L1047-R1049 PolarHBondContact O-N 2.86Å; R1049-G1053 WeakPolarHBondContact O-CA 3.42Å; R1049-G1053 PolarHBondContact O-N 3.34Å; R1049-G1053 VanDerWaalsContact O-N 3.07Å; R1049-E1054 HydrophobicContact CB-CG 4.34Å; R1049-E1054 HydrophobicContact CG-CG 3.84Å; R1049-F1057 HydrophobicContact CB-CE2 3.88Å
1050	N	78.6	Confident	76.5	Confident	100 Å²	100	40.3 Å²	40.3	54%	0.535	21%	0.209	S	C	.	.	H	α-helix	trans	-82.4	-26.5	171	-173.7	69.8	0	0	0	114.3	L1047 L1048	L1047-N1050 VanDerWaalsContact CA-CB 3.46Å; L1047-N1050 HydrophobicContact CB-CB 3.55Å; L1047-N1050 HydrophobicContact CD2-CB 3.46Å; L1047-N1050 VanDerWaalsContact CD2-CB 3.46Å; L1047-N1050 HydrophobicContact CG-CB 3.96Å; L1047-N1050 CarbonylContact O-C 3.54Å; L1047-N1050 WeakPolarHBondContact O-CA 3.02Å; L1047-N1050 WeakPolarHBondContact O-CB 3.45Å; L1047-N1050 PolarHBondContact O-N 3.07Å; L1048-N1050 PolarHBondContact O-N 3.46Å
1051	A	70.9	Confident	75.4	Confident	24 Å²	24	44.2 Å²	44.2	20%	0.198	23%	0.234	C	C	.	.	H	α-helix	trans	-91.3	-49.2	172.9	0	0	0	0	0	112.6	L1047 L1048	L1047-A1051 PolarHBondContact O-N 3.29Å; L1048-A1051 PolarHBondContact O-N 3.06Å
1052	F	70	Confident	73.9	Confident	3 Å²	3	51 Å²	51	1%	0.013	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-19.7	-173.5	-61.6	-94.7	0	0	0	114.7	I900 I903 F986 R987 I989 L1048 V1056	I900-F1052 HydrophobicContact CG1-CZ 4.12Å; I900-F1052 HydrophobicContact CG2-CE2 4.22Å; I900-F1052 HydrophobicContact CG2-CZ 4.28Å; I903-F1052 HydrophobicContact CB-CE2 4.47Å; I903-F1052 HydrophobicContact CB-CZ 4.47Å; I903-F1052 HydrophobicContact CD1-CE1 4.33Å; I903-F1052 HydrophobicContact CD1-CE2 4.09Å; I903-F1052 HydrophobicContact CD1-CZ 3.52Å; I903-F1052 HydrophobicContact CG2-CE2 3.85Å; I903-F1052 HydrophobicContact CG2-CZ 4.31Å; F986-F1052 CarbonylContact C-O 3.58Å; F986-F1052 HydrophobicContact CB-CD1 4.23Å; F986-F1052 AromaticContact CD1-CD1 3.8Å; F986-F1052 HydrophobicContact CD1-CD1 3.8Å; F986-F1052 AromaticContact CD1-CE1 3.79Å; F986-F1052 HydrophobicContact CD1-CE1 3.79Å; F986-F1052 HydrophobicContact CE1-CE1 4.34Å; F986-F1052 HydrophobicContact CG-CD1 4.5Å; R987-F1052 WeakPolarHBondContact CA-O 3.39Å; R987-F1052 PolarHBondContact N-O 3.13Å; I989-F1052 HydrophobicContact CB-CD1 4.32Å; I989-F1052 HydrophobicContact CD1-CD1 3.93Å; I989-F1052 HydrophobicContact CD1-CE1 3.84Å; I989-F1052 HydrophobicContact CG2-CD1 4.46Å; L1048-F1052 HydrophobicContact CB-CD2 4.08Å; L1048-F1052 HydrophobicContact CD2-CD2 3.63Å; L1048-F1052 HydrophobicContact CD2-CE2 3.37Å; L1048-F1052 HydrophobicContact CG-CD2 4.46Å; L1048-F1052 WeakPolarHBondContact O-CA 3.34Å; L1048-F1052 VanDerWaalsContact O-CB 3.27Å; L1048-F1052 WeakPolarHBondContact O-CB 3.48Å; L1048-F1052 PolarHBondContact O-N 2.91Å; F1052-V1056 HydrophobicContact CB-CB 4.28Å; F1052-V1056 HydrophobicContact CB-CG2 3.46Å; F1052-V1056 VanDerWaalsContact CB-CG2 3.46Å; F1052-V1056 HydrophobicContact CD1-CG2 3.95Å; F1052-V1056 HydrophobicContact CG-CG2 3.83Å
1053	G	68.8	Low	72.1	Confident	15 Å²	15	58.6 Å²	58.6	16%	0.155	30%	0.295	C	S	.	.			trans	82	176	-166.4	0	0	0	0	0	112.5	L1048 R1049 Q1055	L1048-G1053 PolarHBondContact O-N 3.22Å; R1049-G1053 WeakPolarHBondContact O-CA 3.42Å; R1049-G1053 PolarHBondContact O-N 3.34Å; R1049-G1053 VanDerWaalsContact O-N 3.07Å; G1053-Q1055 PolarHBondContact O-N 2.84Å
1054	E	70.1	Confident	70.6	Confident	133 Å²	133	59.7 Å²	59.7	62%	0.621	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-69.9	-18.1	-174.7	-64.5	169.5	151.4	0	0	113.5	R1049 V1056 F1057	R1049-E1054 HydrophobicContact CB-CG 4.34Å; R1049-E1054 HydrophobicContact CG-CG 3.84Å; E1054-V1056 PolarHBondContact O-N 3.16Å; E1054-F1057 WeakPolarHBondContact O-CD2 3.3Å; E1054-F1057 PolarHBondContact O-N 3.47Å; E1054-F1057 VanDerWaalsContact O-N 3.15Å
1055	Q	65.2	Low	69	Low	90 Å²	90	61 Å²	61	42%	0.421	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-67.7	-18	-173.8	-59.7	-159.5	25.3	0	0	114.4	R987 G1053 F1057 C1058	R987-Q1055 WeakPolarHBondContact O-CB 3.08Å; R987-Q1055 PolarHBondContact O-OE1 3.25Å; R987-Q1055 VanDerWaalsContact O-OE1 3.08Å; G1053-Q1055 PolarHBondContact O-N 2.84Å; Q1055-F1057 PolarHBondContact O-N 3.23Å; Q1055-C1058 WeakPolarHBondContact O-CB 3.45Å; Q1055-C1058 PolarHBondContact O-N 2.83Å; Q1055-C1058 VanDerWaalsContact O-N 3.1Å
1056	V	72.2	Confident	67.7	Low	2 Å²	2	64 Å²	64	1%	0.012	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-65	-24.6	174.3	161.3	0	0	0	0	112.6	I989 L991 F1052 E1054	I989-V1056 HydrophobicContact CB-CG2 4.26Å; I989-V1056 HydrophobicContact CG2-CG2 4.21Å; I989-V1056 WeakPolarHBondContact O-CG2 2.98Å; L991-V1056 HydrophobicContact CD1-CG1 4.06Å; F1052-V1056 HydrophobicContact CB-CB 4.28Å; F1052-V1056 HydrophobicContact CB-CG2 3.46Å; F1052-V1056 VanDerWaalsContact CB-CG2 3.46Å; F1052-V1056 HydrophobicContact CD1-CG2 3.95Å; F1052-V1056 HydrophobicContact CG-CG2 3.83Å; E1054-V1056 PolarHBondContact O-N 3.16Å
1057	F	71.4	Confident	66.4	Low	70 Å²	70	62.5 Å²	62.5	31%	0.307	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-84.3	-11.9	175.6	-52.5	-65.2	0	0	0	113.1	L996 S1045 L1048 R1049 E1054 Q1055 C1059	L996-F1057 HydrophobicContact CD1-CD1 4.14Å; L996-F1057 HydrophobicContact CD1-CE1 4.46Å; S1045-F1057 WeakPolarHBondContact O-CZ 3.2Å; L1048-F1057 HydrophobicContact CB-CZ 4.22Å; R1049-F1057 HydrophobicContact CB-CE2 3.88Å; E1054-F1057 WeakPolarHBondContact O-CD2 3.3Å; E1054-F1057 PolarHBondContact O-N 3.47Å; E1054-F1057 VanDerWaalsContact O-N 3.15Å; Q1055-F1057 PolarHBondContact O-N 3.23Å; F1057-C1059 PolarHBondContact O-N 3.48Å; F1057-C1059 VanDerWaalsContact O-N 3.16Å
1058	C	66	Low	65.4	Low	68 Å²	68	65 Å²	65	46%	0.459	34%	0.339	S	S	.	.	S	Bend	trans	-79	97.5	173.4	-57.8	0	0	0	0	109.7	Q1055	Q1055-C1058 WeakPolarHBondContact O-CB 3.45Å; Q1055-C1058 PolarHBondContact O-N 2.83Å; Q1055-C1058 VanDerWaalsContact O-N 3.1Å
1059	C	66.3	Low	64.4	Low	44 Å²	44	65.8 Å²	65.8	30%	0.297	34%	0.343	S	S	.	.			trans	-50.2	142.2	173.7	-70	0	0	0	0	112.2	F1057 T1061	F1057-C1059 PolarHBondContact O-N 3.48Å; F1057-C1059 VanDerWaalsContact O-N 3.16Å; C1059-T1061 PolarHBondContact O-N 3.08Å; C1059-T1061 VanDerWaalsContact O-N 3.1Å
1060	I	64.3	Low	63.1	Low	44 Å²	44	66.9 Å²	66.9	23%	0.226	35%	0.353	C	S	.	.			trans	-63.2	111.7	175.3	-65.2	161.4	0	0	0	109.7	L894 K990 L991 N1064 T1066	L894-I1060 HydrophobicContact CD1-CD1 3.82Å; K990-I1060 HydrophobicContact CB-CD1 4.37Å; K990-I1060 HydrophobicContact CB-CG1 3.79Å; L991-I1060 WeakPolarHBondContact O-CG1 3.25Å; L991-I1060 PolarHBondContact O-N 3.28Å; L991-I1060 VanDerWaalsContact O-N 3.11Å; I1060-N1064 HydrophobicContact CG2-CB 4.38Å; I1060-T1066 HydrophobicContact CD1-CG2 3.86Å; I1060-T1066 HydrophobicContact CG1-CG2 4.35Å; I1060-T1066 HydrophobicContact CG2-CG2 3.83Å
1061	T	61.1	Low	62	Low	86 Å²	86	63.1 Å²	63.1	53%	0.528	33%	0.333	S	S	.	.			trans	-85	158.8	167.6	62	0	0	0	0	110.8	C1059 K1063 N1064	C1059-T1061 PolarHBondContact O-N 3.08Å; C1059-T1061 VanDerWaalsContact O-N 3.1Å; T1061-K1063 PolarHBondContact O-N 2.87Å; T1061-N1064 PolarHBondContact N-ND2 2.81Å; T1061-N1064 VanDerWaalsContact N-ND2 3.18Å; T1061-N1064 PolarHBondContact O-N 3.23Å; T1061-N1064 VanDerWaalsContact O-N 3.12Å; T1061-N1064 PolarHBondContact O-ND2 3.09Å; T1061-N1064 PolarHBondContact OG1-ND2 3Å
1062	E	53.7	Low	61.1	Low	195 Å²	195	69 Å²	69	91%	0.911	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-11.9	-178.6	-57.2	177.2	157.6	0	0	114.8
1063	K	46.4	Very low	60.5	Low	158 Å²	158	73.1 Å²	73.1	69%	0.687	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	12.2	179.8	-59.6	177.4	-176.6	172.9	0	113.3	R889 T1061	R889-K1063 VanDerWaalsContact CA-O 3.29Å; R889-K1063 WeakPolarHBondContact CA-O 3.23Å; R889-K1063 WeakPolarHBondContact CB-O 3.49Å; R889-K1063 VanDerWaalsContact CG-O 3.32Å; R889-K1063 WeakPolarHBondContact CG-O 3.2Å; T1061-K1063 PolarHBondContact O-N 2.87Å
1064	N	53.7	Low	60	Low	24 Å²	24	76 Å²	76	13%	0.128	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	142	179.5	-55.3	-79.7	0	0	0	111.7	S890 I1060 T1061	S890-N1064 WeakPolarHBondContact O-CA 3.2Å; S890-N1064 WeakPolarHBondContact O-CB 3.47Å; S890-N1064 PolarHBondContact OG-OD1 3.46Å; I1060-N1064 HydrophobicContact CG2-CB 4.38Å; T1061-N1064 PolarHBondContact N-ND2 2.81Å; T1061-N1064 VanDerWaalsContact N-ND2 3.18Å; T1061-N1064 PolarHBondContact O-N 3.23Å; T1061-N1064 VanDerWaalsContact O-N 3.12Å; T1061-N1064 PolarHBondContact O-ND2 3.09Å; T1061-N1064 PolarHBondContact OG1-ND2 3Å
1065	I	53.6	Low	59.5	Low	27 Å²	27	72.6 Å²	72.6	14%	0.138	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	128.3	172.1	-62.2	169.9	0	0	0	107.5	F133 R889 S890 I891 C892	F133-I1065 HydrophobicContact CD2-CD1 4.11Å; F133-I1065 HydrophobicContact CE1-CD1 4.39Å; F133-I1065 HydrophobicContact CE1-CG2 3.99Å; F133-I1065 HydrophobicContact CE2-CD1 3.93Å; F133-I1065 HydrophobicContact CE2-CG2 4.49Å; F133-I1065 HydrophobicContact CG-CD1 4.44Å; F133-I1065 HydrophobicContact CZ-CD1 4.08Å; F133-I1065 HydrophobicContact CZ-CG2 3.7Å; R889-I1065 HydrophobicContact CB-CD1 4.26Å; R889-I1065 HydrophobicContact CB-CG1 4.23Å; S890-I1065 PolarHBondContact O-N 3.47Å; I891-I1065 WeakPolarHBondContact CA-O 3.42Å; I891-I1065 HydrophobicContact CG1-CB 4.41Å; C892-I1065 PolarHBondContact N-O 3.3Å
1066	T	56.1	Low	59.2	Low	66 Å²	66	70.1 Å²	70.1	41%	0.405	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	136.4	-174.2	49.6	0	0	0	0	112.4	C892 I1060	C892-T1066 WeakPolarHBondContact O-CA 3.3Å; I1060-T1066 HydrophobicContact CD1-CG2 3.86Å; I1060-T1066 HydrophobicContact CG1-CG2 4.35Å; I1060-T1066 HydrophobicContact CG2-CG2 3.83Å
1067	I	58.6	Low	58.6	Low	27 Å²	27	70.4 Å²	70.4	14%	0.138	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.6	174.4	-60.4	174.8	0	0	0	108.4	C98 I891 C892 L893 L894	C98-I1067 HydrophobicContact CB-CD1 4.1Å; I891-I1067 HydrophobicContact CG2-CD1 3.64Å; I891-I1067 HydrophobicContact CG2-CG1 4.22Å; C892-I1067 PolarHBondContact O-N 2.81Å; L893-I1067 HydrophobicContact CD2-CB 4.17Å; L893-I1067 HydrophobicContact CD2-CG2 4.32Å; L894-I1067 PolarHBondContact N-O 3.48Å
1068	P	61.8	Low	58.1	Low	83 Å²	83	73 Å²	73	54%	0.539	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	134.8	-179.2	29.1	-34	0	0	0	112.1	L894	L894-P1068 WeakPolarHBondContact O-CA 3.42Å
1069	L	61.4	Low	57.7	Low	20 Å²	20	76.8 Å²	76.8	11%	0.105	40%	0.396	C	S	.	.			trans	-69.2	143.3	171.3	-127.1	76	0	0	0	110.6	F90 L893 L894 A895 F985 I989	F90-L1069 HydrophobicContact CD1-CD2 3.65Å; F90-L1069 HydrophobicContact CE1-CD2 3.87Å; L893-L1069 HydrophobicContact CB-CD1 3.98Å; L893-L1069 HydrophobicContact CD1-CD1 4.27Å; L893-L1069 HydrophobicContact CD2-CD1 4.02Å; L893-L1069 HydrophobicContact CG-CD1 4.32Å; L894-L1069 PolarHBondContact O-N 3.4Å; A895-L1069 HydrophobicContact CB-CD2 4.29Å; F985-L1069 HydrophobicContact CZ-CD1 4.11Å; I989-L1069 HydrophobicContact CD1-CD2 4.45Å
1070	Q	55.3	Low	57.6	Low	126 Å²	126	75.1 Å²	75.1	59%	0.589	38%	0.383	S	S	*	.			trans	-119.9	118.4	174.1	-72.5	-178.9	-25.5	0	0	109.6	N94	N94-Q1070 VanDerWaalsContact ND2-CD 3.34Å; N94-Q1070 PolarHBondContact ND2-OE1 3.3Å
1071	I	54.9	Low	57.5	Low	21 Å²	21	79.8 Å²	79.8	11%	0.108	40%	0.398	C	S	.	.	B	Isolated β-bridge	trans	-77.7	144.3	169	-70.8	-170.1	0	0	0	109.4	V89 D899 D1073	V89-I1071 HydrophobicContact CG1-CD1 4Å; V89-I1071 HydrophobicContact CG1-CG1 4.41Å; V89-I1071 HydrophobicContact CG1-CG2 4.26Å; D899-I1071 HydrophobicContact CB-CD1 3.85Å; D899-I1071 WeakPolarHBondContact OD1-CD1 3.35Å; I1071-D1073 WeakPolarHBondContact CG2-O 3.46Å
1072	R	51.6	Low	57.7	Low	146 Å²	146	80.6 Å²	80.6	55%	0.551	40%	0.396	S	S	*	.	S	Bend	trans	-62.7	-42.8	-179.2	-163.4	173.2	-177.5	175.9	-5.7	113.3	D88	D88-R1072 IonicContact OD2-CZ 3.55Å; D88-R1072 IonicContact OD2-NH1 2.76Å; D88-R1072 PolarHBondContact OD2-NH1 2.88Å
1073	D	58.3	Low	58.2	Low	91 Å²	91	73 Å²	73	49%	0.487	36%	0.362	S	S	.	.			trans	-117.2	108.1	177.4	-75.4	-59.4	0	0	0	112.5	I1071 S1075 L1076	I1071-D1073 WeakPolarHBondContact CG2-O 3.46Å; D1073-S1075 PolarHBondContact O-N 3.31Å; D1073-L1076 PolarHBondContact O-N 3.35Å
1074	A	57.5	Low	58.9	Low	75 Å²	75	66.7 Å²	66.7	62%	0.62	34%	0.335	S	S	*	.	H	α-helix	trans	-66.2	-25.9	176.9	0	0	0	0	0	113.4	L1076 G1077 Q1078	A1074-L1076 VanDerWaalsContact C-N 3.31Å; A1074-L1076 PolarHBondContact O-N 3.02Å; A1074-G1077 PolarHBondContact O-N 3.49Å; A1074-Q1078 PolarHBondContact O-N 3.31Å
1075	S	60.9	Low	59.1	Low	62 Å²	62	70.9 Å²	70.9	43%	0.434	36%	0.357	S	S	.	.	H	α-helix	trans	-64	-32.3	179.5	55.9	0	0	0	0	113.2	D1073 Q1078 R1079	D1073-S1075 PolarHBondContact O-N 3.31Å; S1075-Q1078 PolarHBondContact O-N 3Å; S1075-R1079 WeakPolarHBondContact O-CG 3.34Å; S1075-R1079 PolarHBondContact O-N 3.38Å
1076	L	57.5	Low	59.5	Low	37 Å²	37	71.9 Å²	71.9	19%	0.194	37%	0.366	C	S	.	.	H	α-helix	trans	-63.3	-48.5	177.2	-170.9	74.3	0	0	0	110.8	V89 I902 D1073 A1074 Q1078 R1079 F1080	V89-L1076 HydrophobicContact CG1-CD2 4.33Å; V89-L1076 HydrophobicContact CG2-CD2 4Å; I902-L1076 HydrophobicContact CD1-CD2 4.35Å; I902-L1076 HydrophobicContact CD1-CG 4.39Å; I902-L1076 HydrophobicContact CG2-CD2 4.48Å; D1073-L1076 PolarHBondContact O-N 3.35Å; A1074-L1076 VanDerWaalsContact C-N 3.31Å; A1074-L1076 PolarHBondContact O-N 3.02Å; L1076-Q1078 VanDerWaalsContact C-N 3.34Å; L1076-Q1078 PolarHBondContact O-N 3.36Å; L1076-R1079 PolarHBondContact O-N 3.24Å; L1076-F1080 VanDerWaalsContact O-CB 3.28Å; L1076-F1080 WeakPolarHBondContact O-CB 3.15Å; L1076-F1080 PolarHBondContact O-N 3.42Å
1077	G	60	Low	59.5	Low	9 Å²	9	71 Å²	71	9%	0.093	36%	0.359	C	S	.	.	H	α-helix	trans	-61	-40.3	176.7	0	0	0	0	0	113.1	A1074 R1081	A1074-G1077 PolarHBondContact O-N 3.49Å; G1077-R1081 WeakPolarHBondContact O-CB 3.37Å; G1077-R1081 PolarHBondContact O-N 3.24Å
1078	Q	60.8	Low	59.1	Low	125 Å²	125	73.2 Å²	73.2	58%	0.584	37%	0.371	S	S	*	.	H	α-helix	trans	-68.9	-46	179.1	-172.2	167	-21.2	0	0	112.5	A1074 S1075 L1076 F1080 R1081 E1082	A1074-Q1078 PolarHBondContact O-N 3.31Å; S1075-Q1078 PolarHBondContact O-N 3Å; L1076-Q1078 VanDerWaalsContact C-N 3.34Å; L1076-Q1078 PolarHBondContact O-N 3.36Å; Q1078-F1080 VanDerWaalsContact C-N 3.33Å; Q1078-F1080 PolarHBondContact O-N 3.32Å; Q1078-R1081 VanDerWaalsContact O-CB 3.29Å; Q1078-R1081 WeakPolarHBondContact O-CB 2.22Å; Q1078-R1081 PolarHBondContact O-N 3.05Å; Q1078-R1081 VanDerWaalsContact O-N 3.15Å; Q1078-E1082 WeakPolarHBondContact O-CG 3.46Å; Q1078-E1082 PolarHBondContact O-N 3.19Å
1079	R	59	Low	58.6	Low	147 Å²	147	71.9 Å²	71.9	56%	0.555	36%	0.363	S	S	*	.	H	α-helix	trans	-62.6	-38.6	175	-71.9	176.9	179.3	-176.2	1	112.4	S1075 L1076 R1081 E1082 L1083	S1075-R1079 WeakPolarHBondContact O-CG 3.34Å; S1075-R1079 PolarHBondContact O-N 3.38Å; L1076-R1079 PolarHBondContact O-N 3.24Å; R1079-R1081 VanDerWaalsContact C-N 3.32Å; R1079-R1081 PolarHBondContact O-N 3.44Å; R1079-E1082 WeakPolarHBondContact O-CB 3.27Å; R1079-E1082 PolarHBondContact O-N 3.31Å; R1079-L1083 PolarHBondContact O-N 3.44Å
1080	F	62.4	Low	58.1	Low	8 Å²	8	77.1 Å²	77.1	4%	0.035	39%	0.386	C	S	.	.	H	α-helix	trans	-64.6	-37	175.2	-173.5	-91.1	0	0	0	111.9	F75 L76 L901 I902 L1006 L1076 Q1078 L1083 I1084	F75-F1080 HydrophobicContact CD1-CE2 4.37Å; F75-F1080 HydrophobicContact CE1-CD2 4.29Å; F75-F1080 AromaticContact CE1-CE2 3.76Å; F75-F1080 HydrophobicContact CE1-CE2 3.76Å; L76-F1080 HydrophobicContact CD2-CD2 4.28Å; L901-F1080 VanDerWaalsContact C-CZ 3.43Å; L901-F1080 HydrophobicContact CB-CE1 3.6Å; L901-F1080 HydrophobicContact CB-CZ 4.03Å; L901-F1080 VanDerWaalsContact O-CZ 3.23Å; L901-F1080 WeakPolarHBondContact O-CZ 3.33Å; I902-F1080 HydrophobicContact CD1-CB 4.36Å; I902-F1080 HydrophobicContact CD1-CG 4.39Å; I902-F1080 HydrophobicContact CG1-CB 4.08Å; I902-F1080 HydrophobicContact CG1-CD1 3.78Å; I902-F1080 HydrophobicContact CG1-CD2 3.75Å; I902-F1080 HydrophobicContact CG1-CE1 4.09Å; I902-F1080 HydrophobicContact CG1-CE2 4.06Å; I902-F1080 HydrophobicContact CG1-CG 3.6Å; I902-F1080 HydrophobicContact CG1-CZ 4.23Å; L1006-F1080 HydrophobicContact CD1-CE1 4.31Å; L1006-F1080 HydrophobicContact CD1-CZ 3.69Å; L1076-F1080 VanDerWaalsContact O-CB 3.28Å; L1076-F1080 WeakPolarHBondContact O-CB 3.15Å; L1076-F1080 PolarHBondContact O-N 3.42Å; Q1078-F1080 VanDerWaalsContact C-N 3.33Å; Q1078-F1080 PolarHBondContact O-N 3.32Å; F1080-L1083 PolarHBondContact O-N 3.04Å; F1080-I1084 HydrophobicContact CD1-CD1 3.97Å; F1080-I1084 HydrophobicContact CD1-CG1 4.45Å; F1080-I1084 HydrophobicContact CE1-CD1 3.45Å; F1080-I1084 VanDerWaalsContact CE1-CD1 3.45Å; F1080-I1084 HydrophobicContact CE1-CG1 4.15Å; F1080-I1084 HydrophobicContact CZ-CD1 4.22Å; F1080-I1084 PolarHBondContact O-N 2.82Å
1081	R	62.7	Low	57.6	Low	143 Å²	143	74.4 Å²	74.4	54%	0.54	37%	0.373	S	S	.	.	H	α-helix	trans	-63.4	-42.3	173	-154.3	-175.7	-131	-141.4	4.9	112	E898 G1077 Q1078 R1079 L1083 I1084 L1085	E898-R1081 IonicContact OE1-CZ 3.79Å; E898-R1081 VanDerWaalsContact OE1-CZ 3.23Å; E898-R1081 IonicContact OE1-NE 2.69Å; E898-R1081 PolarHBondContact OE1-NE 3.37Å; E898-R1081 IonicContact OE1-NH2 2.63Å; E898-R1081 PolarHBondContact OE1-NH2 3.02Å; G1077-R1081 WeakPolarHBondContact O-CB 3.37Å; G1077-R1081 PolarHBondContact O-N 3.24Å; Q1078-R1081 VanDerWaalsContact O-CB 3.29Å; Q1078-R1081 WeakPolarHBondContact O-CB 2.22Å; Q1078-R1081 PolarHBondContact O-N 3.05Å; Q1078-R1081 VanDerWaalsContact O-N 3.15Å; R1079-R1081 VanDerWaalsContact C-N 3.32Å; R1079-R1081 PolarHBondContact O-N 3.44Å; R1081-L1083 VanDerWaalsContact C-N 3.33Å; R1081-I1084 PolarHBondContact O-N 2.65Å; R1081-L1085 WeakPolarHBondContact O-CB 3.49Å; R1081-L1085 VanDerWaalsContact O-CG 3.28Å; R1081-L1085 WeakPolarHBondContact O-CG 2.21Å; R1081-L1085 PolarHBondContact O-N 3.06Å
1082	E	66.4	Low	56.7	Low	102 Å²	102	79.2 Å²	79.2	48%	0.477	40%	0.397	S	S	.	.	H	α-helix	trans	-63.4	-36.5	173.3	-68.9	160.4	-170.3	0	0	111.9	Q1078 R1079 L1085 S1086	Q1078-E1082 WeakPolarHBondContact O-CG 3.46Å; Q1078-E1082 PolarHBondContact O-N 3.19Å; R1079-E1082 WeakPolarHBondContact O-CB 3.27Å; R1079-E1082 PolarHBondContact O-N 3.31Å; E1082-L1085 PolarHBondContact O-N 3.07Å; E1082-S1086 VanDerWaalsContact O-CB 3.31Å; E1082-S1086 WeakPolarHBondContact O-CB 3.49Å; E1082-S1086 PolarHBondContact O-N 3Å; E1082-S1086 PolarHBondContact O-OG 2.86Å
1083	L	62.6	Low	56	Low	37 Å²	37	76.3 Å²	76.3	19%	0.194	40%	0.398	C	S	.	.	H	α-helix	trans	-69.5	-39.1	176	-135.6	172.7	0	0	0	112.2	F75 R1079 F1080 R1081 S1086 N1087	F75-L1083 HydrophobicContact CE1-CD1 4.36Å; F75-L1083 HydrophobicContact CE2-CD2 3.96Å; F75-L1083 HydrophobicContact CZ-CD1 4.24Å; F75-L1083 HydrophobicContact CZ-CD2 3.84Å; R1079-L1083 PolarHBondContact O-N 3.44Å; F1080-L1083 PolarHBondContact O-N 3.04Å; R1081-L1083 VanDerWaalsContact C-N 3.33Å; L1083-S1086 WeakPolarHBondContact CA-OG 2.22Å; L1083-S1086 PolarHBondContact O-OG 2.9Å; L1083-N1087 VanDerWaalsContact CD2-ND2 3.34Å; L1083-N1087 WeakPolarHBondContact CD2-ND2 2.22Å; L1083-N1087 PolarHBondContact O-N 3.38Å; L1083-N1087 PolarHBondContact O-ND2 3.26Å
1084	I	61.7	Low	55	Low	24 Å²	24	75.9 Å²	75.9	12%	0.123	40%	0.399	C	S	.	.	H	α-helix	trans	-63	-50.6	170.7	-75.4	-178.7	0	0	0	110.6	L901 L1006 F1080 R1081 S1086 N1087 L1088	L901-I1084 HydrophobicContact CD1-CD1 4.16Å; L1006-I1084 HydrophobicContact CD1-CD1 4Å; L1006-I1084 HydrophobicContact CD1-CG1 4.14Å; F1080-I1084 HydrophobicContact CD1-CD1 3.97Å; F1080-I1084 HydrophobicContact CD1-CG1 4.45Å; F1080-I1084 HydrophobicContact CE1-CD1 3.45Å; F1080-I1084 VanDerWaalsContact CE1-CD1 3.45Å; F1080-I1084 HydrophobicContact CE1-CG1 4.15Å; F1080-I1084 HydrophobicContact CZ-CD1 4.22Å; F1080-I1084 PolarHBondContact O-N 2.82Å; R1081-I1084 PolarHBondContact O-N 2.65Å; I1084-S1086 VanDerWaalsContact C-N 3.32Å; I1084-S1086 PolarHBondContact O-N 2.77Å; I1084-N1087 PolarHBondContact O-N 2.89Å; I1084-L1088 HydrophobicContact CG2-CD1 3.73Å; I1084-L1088 VanDerWaalsContact O-CD1 3.27Å; I1084-L1088 WeakPolarHBondContact O-CD1 3.46Å; I1084-L1088 PolarHBondContact O-N 3.36Å
1085	L	59.1	Low	53.9	Low	113 Å²	113	76.8 Å²	76.8	59%	0.592	40%	0.401	S	S	*	.	H	α-helix	trans	-61.4	-38.6	-178.2	-72.9	166.7	0	0	0	112.6	R1081 E1082 S1089	R1081-L1085 WeakPolarHBondContact O-CB 3.49Å; R1081-L1085 VanDerWaalsContact O-CG 3.28Å; R1081-L1085 WeakPolarHBondContact O-CG 2.21Å; R1081-L1085 PolarHBondContact O-N 3.06Å; E1082-L1085 PolarHBondContact O-N 3.07Å; L1085-S1089 WeakPolarHBondContact O-CB 3.46Å; L1085-S1089 PolarHBondContact O-N 3.27Å; L1085-S1089 PolarHBondContact O-OG 2.89Å
1086	S	61.2	Low	52.7	Low	48 Å²	48	77.9 Å²	77.9	34%	0.336	41%	0.409	S	S	.	.	H	α-helix	trans	-77.9	-15.8	178.6	57.4	0	0	0	0	114.7	E1082 L1083 I1084 S1089 K1090	E1082-S1086 VanDerWaalsContact O-CB 3.31Å; E1082-S1086 WeakPolarHBondContact O-CB 3.49Å; E1082-S1086 PolarHBondContact O-N 3Å; E1082-S1086 PolarHBondContact O-OG 2.86Å; L1083-S1086 WeakPolarHBondContact CA-OG 2.22Å; L1083-S1086 PolarHBondContact O-OG 2.9Å; I1084-S1086 VanDerWaalsContact C-N 3.32Å; I1084-S1086 PolarHBondContact O-N 2.77Å; S1086-S1089 PolarHBondContact O-OG 3.2Å; S1086-K1090 WeakPolarHBondContact O-CD 3.47Å; S1086-K1090 WeakPolarHBondContact O-CG 3.24Å
1087	N	56.6	Low	51.3	Low	48 Å²	48	79.4 Å²	79.4	26%	0.257	43%	0.426	S	S	.	.	H	α-helix	trans	-85.7	-40.3	168.2	-74.6	-29.1	0	0	0	111.9	L1083 I1084 K1090	L1083-N1087 VanDerWaalsContact CD2-ND2 3.34Å; L1083-N1087 WeakPolarHBondContact CD2-ND2 2.22Å; L1083-N1087 PolarHBondContact O-N 3.38Å; L1083-N1087 PolarHBondContact O-ND2 3.26Å; I1084-N1087 PolarHBondContact O-N 2.89Å; N1087-K1090 PolarHBondContact O-N 2.94Å
1088	L	49.2	Very low	49.8	Very low	72 Å²	72	87.8 Å²	87.8	38%	0.377	46%	0.463	S	S	.	.	H	α-helix	trans	-63.5	-41	172.8	-89.3	89.8	0	0	0	112.3	I1084 K1090 Q1091 I1092	I1084-L1088 HydrophobicContact CG2-CD1 3.73Å; I1084-L1088 VanDerWaalsContact O-CD1 3.27Å; I1084-L1088 WeakPolarHBondContact O-CD1 3.46Å; I1084-L1088 PolarHBondContact O-N 3.36Å; L1088-K1090 VanDerWaalsContact C-N 3.29Å; L1088-K1090 PolarHBondContact O-N 2.9Å; L1088-Q1091 WeakPolarHBondContact O-CB 3.48Å; L1088-Q1091 PolarHBondContact O-N 3.21Å; L1088-I1092 PolarHBondContact O-N 3.21Å
1089	S	52.2	Low	48.2	Very low	55 Å²	55	86.8 Å²	86.8	39%	0.385	47%	0.47	S	S	.	.	H	α-helix	trans	-62	-34.9	-179	66.8	0	0	0	0	113	L1085 S1086 Q1091 I1092 C1093	L1085-S1089 WeakPolarHBondContact O-CB 3.46Å; L1085-S1089 PolarHBondContact O-N 3.27Å; L1085-S1089 PolarHBondContact O-OG 2.89Å; S1086-S1089 PolarHBondContact O-OG 3.2Å; S1089-Q1091 VanDerWaalsContact C-N 3.32Å; S1089-Q1091 PolarHBondContact O-N 2.84Å; S1089-I1092 WeakPolarHBondContact O-CB 3.42Å; S1089-I1092 PolarHBondContact O-N 3.39Å; S1089-C1093 PolarHBondContact O-N 2.96Å; S1089-C1093 PolarHBondContact O-SG 3.4Å; S1089-C1093 VanDerWaalsContact O-SG 3.4Å
1090	K	50.5	Low	46.7	Very low	131 Å²	131	85.9 Å²	85.9	57%	0.57	48%	0.48	S	S	*	.	H	α-helix	trans	-63.4	-35.4	173.8	-71.3	170.5	-174.9	167.9	0	112.7	S1086 N1087 L1088 I1092 C1093 T1094	S1086-K1090 WeakPolarHBondContact O-CD 3.47Å; S1086-K1090 WeakPolarHBondContact O-CG 3.24Å; N1087-K1090 PolarHBondContact O-N 2.94Å; L1088-K1090 VanDerWaalsContact C-N 3.29Å; L1088-K1090 PolarHBondContact O-N 2.9Å; K1090-I1092 VanDerWaalsContact C-N 3.34Å; K1090-C1093 PolarHBondContact O-N 2.92Å; K1090-T1094 WeakPolarHBondContact O-CG2 3.38Å; K1090-T1094 PolarHBondContact O-N 3.31Å; K1090-T1094 PolarHBondContact O-OG1 2.71Å
1091	Q	43.6	Very low	45	Very low	68 Å²	68	95.1 Å²	95.1	32%	0.318	52%	0.523	S	S	.	.	H	α-helix	trans	-68.5	-34.6	175.9	-129.7	-177.3	42.2	0	0	111.6	L1088 S1089 T1094 S1095	L1088-Q1091 WeakPolarHBondContact O-CB 3.48Å; L1088-Q1091 PolarHBondContact O-N 3.21Å; S1089-Q1091 VanDerWaalsContact C-N 3.32Å; S1089-Q1091 PolarHBondContact O-N 2.84Å; Q1091-T1094 WeakPolarHBondContact CA-OG1 3.49Å; Q1091-T1094 PolarHBondContact O-OG1 2.8Å; Q1091-S1095 WeakPolarHBondContact O-CB 3.42Å; Q1091-S1095 PolarHBondContact O-N 2.82Å; Q1091-S1095 VanDerWaalsContact O-N 3.09Å; Q1091-S1095 PolarHBondContact O-OG 2.75Å
1092	I	37.2	Very low	43.4	Very low	122 Å²	122	91.8 Å²	91.8	63%	0.626	53%	0.533	S	S	*	.	H	α-helix	trans	-66	-48.6	173	-60.9	171.5	0	0	0	110.3	L1088 S1089 K1090 T1094 S1095 S1096	L1088-I1092 PolarHBondContact O-N 3.21Å; S1089-I1092 WeakPolarHBondContact O-CB 3.42Å; S1089-I1092 PolarHBondContact O-N 3.39Å; K1090-I1092 VanDerWaalsContact C-N 3.34Å; I1092-T1094 PolarHBondContact O-N 3.18Å; I1092-S1095 WeakPolarHBondContact O-CB 3.47Å; I1092-S1095 PolarHBondContact O-N 3.04Å; I1092-S1096 PolarHBondContact O-N 2.99Å; I1092-S1096 PolarHBondContact O-OG 2.93Å
1093	C	36.7	Very low	41.5	Very low	85 Å²	85	95.3 Å²	95.3	57%	0.574	56%	0.555	S	S	*	*	H	α-helix	trans	-66.3	-33	-179.5	-65.2	0	0	0	0	114.1	S1089 K1090 S1096	S1089-C1093 PolarHBondContact O-N 2.96Å; S1089-C1093 PolarHBondContact O-SG 3.4Å; S1089-C1093 VanDerWaalsContact O-SG 3.4Å; K1090-C1093 PolarHBondContact O-N 2.92Å; C1093-S1096 PolarHBondContact O-OG 3.2Å
1094	T	37.2	Very low	39.8	Very low	82 Å²	82	97.2 Å²	97.2	50%	0.503	58%	0.584	S	S	.	*	H	α-helix	trans	-74.6	-31.5	173.8	45.6	0	0	0	0	112.2	K1090 Q1091 I1092 S1096 A1097	K1090-T1094 WeakPolarHBondContact O-CG2 3.38Å; K1090-T1094 PolarHBondContact O-N 3.31Å; K1090-T1094 PolarHBondContact O-OG1 2.71Å; Q1091-T1094 WeakPolarHBondContact CA-OG1 3.49Å; Q1091-T1094 PolarHBondContact O-OG1 2.8Å; I1092-T1094 PolarHBondContact O-N 3.18Å; T1094-S1096 VanDerWaalsContact C-N 3.27Å; T1094-S1096 PolarHBondContact O-N 3.34Å; T1094-A1097 PolarHBondContact O-N 3.2Å
1095	S	34.1	Very low	38	Very low	94 Å²	94	103 Å²	103	66%	0.657	62%	0.621	S	S	*	*	H	α-helix	trans	-65.8	-26.3	173.8	-61.4	0	0	0	0	113.4	Q1091 I1092	Q1091-S1095 WeakPolarHBondContact O-CB 3.42Å; Q1091-S1095 PolarHBondContact O-N 2.82Å; Q1091-S1095 VanDerWaalsContact O-N 3.09Å; Q1091-S1095 PolarHBondContact O-OG 2.75Å; I1092-S1095 WeakPolarHBondContact O-CB 3.47Å; I1092-S1095 PolarHBondContact O-N 3.04Å
1096	S	35	Very low	36.6	Very low	86 Å²	86	106.2 Å²	106.2	60%	0.601	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-3.7	178.6	48.9	0	0	0	0	115.5	I1092 C1093 T1094	I1092-S1096 PolarHBondContact O-N 2.99Å; I1092-S1096 PolarHBondContact O-OG 2.93Å; C1093-S1096 PolarHBondContact O-OG 3.2Å; T1094-S1096 VanDerWaalsContact C-N 3.27Å; T1094-S1096 PolarHBondContact O-N 3.34Å
1097	A	29.6	Very low	34.8	Very low	68 Å²	68	108.4 Å²	108.4	56%	0.562	65%	0.648	S	S	*	*	S	Bend	trans	-92.9	-12.5	-171	0	0	0	0	0	115.3	T1094	T1094-A1097 PolarHBondContact O-N 3.2Å
1098	H	27.6	Very low	33.2	Very low	186 Å²	186	112 Å²	112	86%	0.861	67%	0.671	S	S	*	*	S	Bend	trans	-117.9	49	-173.3	-86.7	-44.5	0	0	0	114.7
1099	S	28.5	Very low	32.1	Very low	104 Å²	104	114.4 Å²	114.4	73%	0.727	69%	0.689	S	S	*	*			trans	-157.9	89.3	157.4	60.7	0	0	0	0	112.3
1100	V	27.3	Very low	30.8	Very low	127 Å²	127	119.1 Å²	119.1	77%	0.77	72%	0.715	S	S	*	*			trans	-134.4	82.1	173.1	-174.6	0	0	0	0	110.7
1101	H	26.9	Very low	29.6	Very low	203 Å²	203	115.7 Å²	115.7	94%	0.94	72%	0.717	S	S	*	*			trans	-165.1	124.8	153.1	-113.1	64.1	0	0	0	109.3
1102	G	27.8	Very low	28.6	Very low	73 Å²	73	117.5 Å²	117.5	75%	0.753	74%	0.737	S	S	*	*			trans	143.5	93.9	-177.2	0	0	0	0	0	112.2
1103	N	26.4	Very low	28.1	Very low	175 Å²	175	118.9 Å²	118.9	94%	0.936	75%	0.751	S	S	*	*			trans	-76.3	150.3	-179.2	-59.8	-32.1	0	0	0	111.6
1104	G	27.3	Very low	27.4	Very low	78 Å²	78	120.3 Å²	120.3	80%	0.804	75%	0.753	S	S	*	*			trans	164.8	61.8	171.1	0	0	0	0	0	116.3	Q1106	G1104-Q1106 PolarHBondContact O-N 3.44Å
1105	V	24.5	Very low	26.7	Very low	146 Å²	146	123.8 Å²	123.8	89%	0.885	76%	0.763	S	S	*	*			trans	-79.3	115.7	170	174.8	0	0	0	0	109.8
1106	Q	28.9	Very low	26.3	Very low	180 Å²	180	127 Å²	127	84%	0.841	77%	0.772	S	S	*	*			trans	-149.6	102.9	158.8	-115.7	172.4	12.9	0	0	112.9	G1104	G1104-Q1106 PolarHBondContact O-N 3.44Å
1107	S	24	Very low	25.8	Very low	94 Å²	94	129.4 Å²	129.4	66%	0.657	77%	0.774	S	S	*	*				-6.8	150	125.7	61.1	0	0	0	0	117.2
1108	V	23.6	Very low	25.5	Very low	123 Å²	123	134.8 Å²	134.8	75%	0.745	79%	0.787	S	S	*	*			cis	-172	170.3	7	114.1	0	0	0	0	110.4
1109	T	24.6	Very low	25.4	Very low	122 Å²	122	134.5 Å²	134.5	75%	0.748	79%	0.786	S	S	*	*			trans	52.9	121	167.8	42.4	0	0	0	0	120.2
1110	V	26.3	Very low	25.1	Very low	155 Å²	155	133.8 Å²	133.8	94%	0.939	78%	0.781	S	S	*	*				-126.9	140.6	97.8	178.5	0	0	0	0	107.4
1111	G	24.3	Very low	24.9	Very low	59 Å²	59	132.7 Å²	132.7	61%	0.608	78%	0.778	S	S	*	*			trans	-155	158.6	176.4	0	0	0	0	0	110.8
1112	S	23.6	Very low	24.8	Very low	105 Å²	105	129 Å²	129	73%	0.734	77%	0.765	S	S	*	*			trans	34.5	111.2	179.1	-73.2	0	0	0	0	118.7
1113	V	25.7	Very low	24.6	Very low	152 Å²	152	132.7 Å²	132.7	92%	0.921	77%	0.767	S	S	*	*			trans	-130.4	124.8	130.4	178.7	0	0	0	0	106.9
1114	D	22.4	Very low	24.6	Very low	115 Å²	115	131.2 Å²	131.2	62%	0.615	76%	0.758	S	S	*	*			trans	-90	-177.8	178.9	-60.3	-87.7	0	0	0	111.4
1115	H	23	Very low	24.4	Very low	154 Å²	154	135.7 Å²	135.7	71%	0.713	76%	0.758	S	S	*	*			trans	67.7	88.6	170.6	-59.7	-86	0	0	0	118.5	E1117	H1115-E1117 HydrophobicContact CB-CG 4.43Å
1116	L	26	Very low	24.5	Very low	162 Å²	162	135.6 Å²	135.6	85%	0.848	75%	0.751	S	S	*	*				-135.6	108.9	106	-81.1	171	0	0	0	104.9
1117	E	24	Very low	24.3	Very low	136 Å²	136	132.5 Å²	132.5	64%	0.636	74%	0.74	S	S	*	*				78.2	134.7	62.5	-66.5	-175	153.3	0	0	114.1	H1115	H1115-E1117 HydrophobicContact CB-CG 4.43Å
1118	E	23.9	Very low	24.4	Very low	182 Å²	182	135.5 Å²	135.5	85%	0.85	75%	0.749	S	S	*	*			trans	28.4	97.6	153	-55.2	-172.5	140.9	0	0	118.9
1119	E	24.5	Very low	24.6	Very low	180 Å²	180	137.5 Å²	137.5	84%	0.841	75%	0.75	S	S	*	*				-173.4	118.4	100.6	-88.5	-173.1	149	0	0	105.9
1120	S	21.8	Very low	24.8	Very low	88 Å²	88	138.2 Å²	138.2	62%	0.615	75%	0.749	S	S	*	*				66.4	151.2	67.7	83	0	0	0	0	113.3
1121	C	23.6	Very low	24.9	Very low	104 Å²	104	139.1 Å²	139.1	70%	0.703	74%	0.744	S	S	*	*			trans	68.8	142.9	167.6	-61.5	0	0	0	0	117.4
1122	D	24.5	Very low	25.1	Very low	127 Å²	127	140.9 Å²	140.9	68%	0.679	75%	0.746	S	S	*	*			cis	-160.5	178	-19.2	-124	-34.9	0	0	0	112.7	I1124	D1122-I1124 PolarHBondContact O-N 3.26Å
1123	L	22.9	Very low	25.2	Very low	150 Å²	150	143.8 Å²	143.8	79%	0.785	75%	0.753	S	S	*	*			trans	-61.8	123.8	152.3	-71.4	85.8	0	0	0	109.8
1124	I	27.6	Very low	25.2	Very low	144 Å²	144	140.6 Å²	140.6	74%	0.738	74%	0.737	S	S	*	*			trans	-131.9	79.8	150.3	-53	-177.2	0	0	0	108.3	D1122 L1126	D1122-I1124 PolarHBondContact O-N 3.26Å; I1124-L1126 HydrophobicContact CG2-CB 4.05Å
1125	E	23.4	Very low	25.5	Very low	172 Å²	172	143.5 Å²	143.5	80%	0.804	75%	0.752	S	S	*	*			trans	-77.6	121.2	132	-80	-177.6	142.1	0	0	106.3
1126	L	26.1	Very low	25.7	Very low	144 Å²	144	139.1 Å²	139.1	75%	0.754	75%	0.748	S	S	*	*			trans	-177	79.7	165.5	-101.8	175	0	0	0	104.1	I1124	I1124-L1126 HydrophobicContact CG2-CB 4.05Å
1127	D	24	Very low	25.7	Very low	114 Å²	114	136.7 Å²	136.7	61%	0.61	75%	0.745	S	S	*	*				69.2	117.8	74.7	-61.4	-38.9	0	0	0	113.5
1128	N	26.1	Very low	25.7	Very low	157 Å²	157	137.7 Å²	137.7	84%	0.84	76%	0.755	S	S	*	*	S	Bend	trans	-164.9	104.1	145.8	-80.4	-67.5	0	0	0	103.3
1129	E	27.9	Very low	25.7	Very low	165 Å²	165	134 Å²	134	77%	0.771	75%	0.749	S	S	*	*	S	Bend	cis	-146.3	150.6	9.3	-62.8	173.7	138.9	0	0	111.3
1130	D	29.1	Very low	25.6	Very low	137 Å²	137	131.5 Å²	131.5	73%	0.733	75%	0.75	S	S	*	*			trans	78.9	109.2	146.7	-59.2	-9.7	0	0	0	125.8
1131	E	29	Very low	25.7	Very low	175 Å²	175	132.2 Å²	132.2	82%	0.818	76%	0.761	S	S	*	*				87.5	85.9	129.7	-64.7	-161.5	152.2	0	0	124.9
1132	S	28.4	Very low	25.5	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	77%	0.765	S	S	*	*				96.7	120.9	108.1	77.9	0	0	0	0	124.6
1133	L	25.7	Very low	25.4	Very low	166 Å²	166	137.5 Å²	137.5	87%	0.869	77%	0.774	S	S	*	*			trans	60.4	148.7	130.9	-57.6	172.5	0	0	0	122.8
1134	S	25.7	Very low	25.4	Very low	85 Å²	85	141.5 Å²	141.5	59%	0.594	78%	0.779	S	S	*	*			cis	-172.5	164.6	-20.1	65.2	0	0	0	0	113.6
1135	L	28.8	Very low	25.2	Very low	176 Å²	176	141.2 Å²	141.2	92%	0.921	77%	0.774	S	S	*	*			trans	64.4	149.1	157.6	-62.7	161.9	0	0	0	120.6
1136	G	26.9	Very low	25.2	Very low	62 Å²	62	141.9 Å²	141.9	64%	0.639	77%	0.769	S	S	*	*			cis	171.7	142.1	-11.2	0	0	0	0	0	116.3
1137	S	25	Very low	25	Very low	111 Å²	111	142.6 Å²	142.6	78%	0.776	77%	0.773	S	S	*	*			trans	53.7	123.1	152.7	63.5	0	0	0	0	125.4
1138	D	23.6	Very low	25	Very low	158 Å²	158	140.5 Å²	140.5	85%	0.845	77%	0.767	S	S	*	*				43.7	148.6	116.8	-58.9	-16.1	0	0	0	123.3
1139	S	24.4	Very low	25	Very low	105 Å²	105	140.3 Å²	140.3	73%	0.734	76%	0.762	S	S	*	*			cis	-164.5	166	-6.3	54.5	0	0	0	0	114
1140	C	23.7	Very low	24.8	Very low	126 Å²	126	143.8 Å²	143.8	85%	0.851	77%	0.768	S	S	*	*			trans	37.8	115.9	152.5	-67.9	0	0	0	0	124.1
1141	A	22.7	Very low	24.5	Very low	104 Å²	104	141.3 Å²	141.3	86%	0.86	76%	0.76	S	S	*	*				178.3	131.1	121.7	0	0	0	0	0	117.2
1142	S	20.5	Very low	24.4	Very low	111 Å²	111	139.9 Å²	139.9	78%	0.776	76%	0.763	S	S	*	*			trans	30.3	138	146.5	-149.5	0	0	0	0	125.9
1143	R	22.5	Very low	24.1	Very low	231 Å²	231	140.3 Å²	140.3	87%	0.872	76%	0.762	S	S	*	*			trans	63.5	101.5	150.4	-83.6	-175	178.8	-172.7	1.4	121.7
1144	R	22.7	Very low	24	Very low	234 Å²	234	139.2 Å²	139.2	88%	0.883	76%	0.755	S	S	*	*				33.5	106.6	113.7	-177.1	-160.9	-84.8	-171.3	-4.7	116.7
1145	E	23.2	Very low	24.1	Very low	137 Å²	137	139.5 Å²	139.5	64%	0.64	76%	0.763	S	S	*	*				-148.1	157.2	107.2	-109.9	-159.1	-173.1	0	0	113.5
1146	R	23.8	Very low	23.8	Very low	187 Å²	187	136.9 Å²	136.9	71%	0.706	75%	0.754	S	S	*	*			trans	18.8	135.1	152.1	-61.5	-177	175.6	113.6	4.2	118.9
1147	L	22	Very low	24	Very low	158 Å²	158	139.2 Å²	139.2	83%	0.827	76%	0.76	S	S	*	*				41.2	121.7	81.9	-75.5	165.9	0	0	0	111.6
1148	S	22.8	Very low	24.3	Very low	71 Å²	71	138.7 Å²	138.7	50%	0.497	76%	0.757	S	S	.	*			cis	-173.6	169.3	19.4	-156.5	0	0	0	0	108
1149	Q	25.4	Very low	24.4	Very low	153 Å²	153	140.2 Å²	140.2	72%	0.715	76%	0.756	S	S	*	*			trans	53.8	133	148.6	-65.1	152.8	8.8	0	0	118
1150	R	24.3	Very low	24.7	Very low	238 Å²	238	142.7 Å²	142.7	90%	0.898	75%	0.753	S	S	*	*				-144.8	134.2	59.1	-83.1	176.5	165	147.9	-4.2	110.1
1151	C	23.2	Very low	24.9	Very low	85 Å²	85	141.4 Å²	141.4	57%	0.574	74%	0.738	S	S	*	*				61.9	103.7	63.4	-60.8	0	0	0	0	113.1
1152	T	26.4	Very low	25.2	Very low	144 Å²	144	144 Å²	144	88%	0.883	73%	0.732	S	S	*	*				-146.6	154.3	117.7	31.8	0	0	0	0	108.6
1153	V	23.4	Very low	25.5	Very low	104 Å²	104	142.4 Å²	142.4	63%	0.63	72%	0.721	S	S	*	*			cis	157.8	140	-33	146.2	0	0	0	0	106.1
1154	I	23	Very low	25.7	Very low	144 Å²	144	137.3 Å²	137.3	74%	0.738	71%	0.711	S	S	*	*			trans	69.5	144.1	179.1	-65.9	157.8	0	0	0	113.1	V1156	I1154-V1156 HydrophobicContact CB-CG2 4.35Å; I1154-V1156 HydrophobicContact CG1-CG2 3.84Å; I1154-V1156 HydrophobicContact CG2-CG2 4.38Å
1155	A	27.3	Very low	26	Very low	91 Å²	91	132.1 Å²	132.1	75%	0.752	70%	0.701	S	S	*	*			cis	-102.8	144.6	2.2	0	0	0	0	0	112
1156	V	23.8	Very low	26.2	Very low	120 Å²	120	131 Å²	131	73%	0.727	70%	0.7	S	S	*	*			cis	72.4	98.4	37	-177.4	0	0	0	0	114.1	I1154	I1154-V1156 HydrophobicContact CB-CG2 4.35Å; I1154-V1156 HydrophobicContact CG1-CG2 3.84Å; I1154-V1156 HydrophobicContact CG2-CG2 4.38Å
1157	S	29.6	Very low	26.3	Very low	112 Å²	112	128.2 Å²	128.2	78%	0.783	70%	0.697	S	S	*	*			trans	173.6	131.3	135.1	-170.4	0	0	0	0	108
1158	S	32.8	Very low	26.4	Very low	100 Å²	100	127.2 Å²	127.2	70%	0.699	69%	0.692	S	S	*	*			cis	-146.6	150.5	-6.7	43.8	0	0	0	0	107.9
1159	K	25.7	Very low	26.8	Very low	189 Å²	189	130.2 Å²	130.2	82%	0.822	70%	0.703	S	S	*	*				51	121.2	70.2	-107.9	-178.1	178.9	179.3	0	109.6
1160	K	29	Very low	26.8	Very low	157 Å²	157	127.2 Å²	127.2	68%	0.683	70%	0.698	S	S	*	*			cis	-161.2	172	37.1	-95	179	142.6	-79.2	0	107.3
1161	D	29.7	Very low	27.1	Very low	100 Å²	100	122.4 Å²	122.4	54%	0.535	69%	0.69	S	S	.	*			cis	-151.9	146.5	4.5	-109.2	-19.2	0	0	0	107.7
1162	H	27.9	Very low	27.2	Very low	157 Å²	157	125.3 Å²	125.3	73%	0.727	70%	0.7	S	S	*	*				50.1	107.4	106.9	-80.9	-78.6	0	0	0	114.9
1163	S	26	Very low	27.3	Very low	79 Å²	79	125.2 Å²	125.2	55%	0.552	70%	0.699	S	S	*	*				83.1	158.9	80.1	75.5	0	0	0	0	111.8
1164	D	28.6	Very low	27.3	Very low	124 Å²	124	127.6 Å²	127.6	66%	0.663	71%	0.708	S	S	*	*			cis	-146.4	161.8	18	-76.8	-76.9	0	0	0	110.9
1165	N	27.9	Very low	27.9	Very low	125 Å²	125	125.9 Å²	125.9	67%	0.668	71%	0.706	S	S	*	*			trans	58	159.7	137.2	-67.2	28.1	0	0	0	121.3
1166	D	27.2	Very low	27.8	Very low	114 Å²	114	126.4 Å²	126.4	61%	0.61	71%	0.705	S	S	*	*			cis	-156.1	152.2	-10.1	-115.7	-21.2	0	0	0	113.3
1167	I	25.5	Very low	27.8	Very low	128 Å²	128	125.7 Å²	125.7	66%	0.656	71%	0.705	S	S	*	*			trans	31.7	127.6	132.9	-63.3	169.1	0	0	0	120.9
1168	N	25.4	Very low	27.7	Very low	136 Å²	136	126.7 Å²	126.7	73%	0.727	70%	0.701	S	S	*	*			trans	67.4	163.1	159.4	-65.3	-9.1	0	0	0	117.4
1169	N	29.8	Very low	27.3	Very low	134 Å²	134	130.9 Å²	130.9	72%	0.717	71%	0.707	S	S	*	*			cis	-138.1	129.1	4.2	-119.2	-4.8	0	0	0	106.8
1170	C	26.9	Very low	27.7	Very low	90 Å²	90	127 Å²	127	61%	0.608	70%	0.701	S	S	*	*				89.8	137.5	68.9	-76.4	0	0	0	0	116.3
1171	N	29.7	Very low	27.7	Very low	138 Å²	138	126.3 Å²	126.3	74%	0.738	71%	0.71	S	S	*	*			trans	78.9	120.3	162.1	-54.3	-29.5	0	0	0	118
1172	N	25.4	Very low	27.4	Very low	146 Å²	146	128.5 Å²	128.5	78%	0.781	72%	0.722	S	S	*	*			cis	91.8	114.7	34.1	-69.4	-33.5	0	0	0	114.1
1173	V	28.9	Very low	27.7	Very low	142 Å²	142	125.5 Å²	125.5	86%	0.861	72%	0.716	S	S	*	*			trans	-144	139	134.8	-176.4	0	0	0	0	109.5
1174	N	24.2	Very low	27.8	Very low	154 Å²	154	132.4 Å²	132.4	82%	0.824	73%	0.73	S	S	*	*			trans	-156.9	175	172.3	-101.9	-17.6	0	0	0	105
1175	P	35.7	Very low	27.6	Very low	107 Å²	107	133.7 Å²	133.7	70%	0.695	74%	0.737	S	S	*	*			cis	-137.4	-172	-6.9	32.4	-8.2	0	0	0	115.5
1176	S	23.7	Very low	27.7	Very low	103 Å²	103	134 Å²	134	72%	0.72	75%	0.749	S	S	*	*			trans	55.8	124.3	139.9	63.2	0	0	0	0	124.9
1177	S	24.9	Very low	27.5	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	76%	0.757	S	S	*	*				173.1	137.9	113.5	60.4	0	0	0	0	115.8
1178	D	27.4	Very low	27.7	Very low	133 Å²	133	133.2 Å²	133.2	71%	0.711	76%	0.764	S	S	*	*			trans	59.8	116.3	145	-56.2	-17.3	0	0	0	126.3
1179	F	24.5	Very low	27.6	Very low	187 Å²	187	134.7 Å²	134.7	82%	0.82	77%	0.767	S	S	*	*				50	162.3	123.7	-66.4	-72.1	0	0	0	123.8
1180	P	33.1	Very low	27.3	Very low	108 Å²	108	134.4 Å²	134.4	70%	0.701	77%	0.77	S	S	*	*				-138.9	-160.1	-68.7	37	-14.3	0	0	0	115.1
1181	V	29.6	Very low	27.2	Very low	143 Å²	143	135.3 Å²	135.3	87%	0.867	78%	0.778	S	S	*	*			trans	105.5	140.2	157.5	-166.4	0	0	0	0	119.5
1182	D	23.5	Very low	26.9	Very low	146 Å²	146	134 Å²	134	78%	0.781	78%	0.778	S	S	*	*			trans	-91.6	-173.5	-179	-111.6	-40.8	0	0	0	113.1
1183	P	35	Very low	26.8	Very low	94 Å²	94	134.5 Å²	134.5	61%	0.61	78%	0.781	S	S	*	*			cis	-138.9	177.7	-30.1	39	-21.8	0	0	0	115.2
1184	R	26.3	Very low	27	Very low	224 Å²	224	132.6 Å²	132.6	85%	0.845	77%	0.771	S	S	*	*			trans	69.1	119.8	149.8	-78.4	172	-175.8	171.3	2.8	123.2
1185	N	26.1	Very low	27.1	Very low	150 Å²	150	132.6 Å²	132.6	80%	0.802	77%	0.771	S	S	*	*			trans	59.1	110.2	131	-59.9	13.2	0	0	0	122.3
1186	S	28.3	Very low	26.5	Very low	133 Å²	133	132.1 Å²	132.1	93%	0.93	77%	0.771	S	S	*	*				-165.9	172.8	114.1	39.1	0	0	0	0	109.9
1187	A	24.1	Very low	26.6	Very low	94 Å²	94	133.5 Å²	133.5	78%	0.777	77%	0.774	S	S	*	*			trans	-126.1	153.6	-161.7	0	0	0	0	0	114.5
1188	T	29.5	Very low	26.5	Very low	131 Å²	131	138.7 Å²	138.7	80%	0.804	78%	0.779	S	S	*	*			trans	-159.5	121.9	148.5	-1.2	0	0	0	0	112.8
1189	E	24.2	Very low	26.4	Very low	166 Å²	166	138.8 Å²	138.8	78%	0.776	79%	0.785	S	S	*	*			trans	47.9	115.1	138.1	-67.8	-178.6	179.1	0	0	124.1
1190	T	22.9	Very low	26.5	Very low	128 Å²	128	134.9 Å²	134.9	79%	0.785	78%	0.78	S	S	*	*			trans	89.2	132.8	130.4	60.8	0	0	0	0	123.8
1191	S	23.5	Very low	26.2	Very low	110 Å²	110	135.3 Å²	135.3	77%	0.769	78%	0.783	S	S	*	*			trans	92.9	123.4	147.2	76.3	0	0	0	0	121.5
1192	C	24.2	Very low	26	Very low	111 Å²	111	135.7 Å²	135.7	75%	0.75	78%	0.779	S	S	*	*			trans	63.4	123.2	141	-60.8	0	0	0	0	123.7
1193	D	23.9	Very low	26.1	Very low	155 Å²	155	135.3 Å²	135.3	83%	0.829	78%	0.781	S	S	*	*			trans	77.4	158.9	134.7	-76	-10.9	0	0	0	121.3
1194	P	32.9	Very low	25.6	Very low	102 Å²	102	139.1 Å²	139.1	66%	0.662	79%	0.791	S	S	*	*			trans	-120.4	-166.9	-135.4	45.3	-38.2	0	0	0	116.5
1195	N	26.2	Very low	25.5	Very low	154 Å²	154	134.3 Å²	134.3	82%	0.824	79%	0.791	S	S	*	*			trans	90.5	150.2	179.1	-51.3	-56.9	0	0	0	114.3
1196	S	23.2	Very low	25.5	Very low	98 Å²	98	132.3 Å²	132.3	69%	0.685	79%	0.789	S	S	*	*			cis	-175.5	163.6	-23.5	56.6	0	0	0	0	110.4
1197	V	25.6	Very low	25.6	Very low	131 Å²	131	132.1 Å²	132.1	79%	0.794	78%	0.782	S	S	*	*			trans	81.4	130.2	161.2	-175.9	0	0	0	0	119.7
1198	Y	23	Very low	25.6	Very low	214 Å²	214	135.5 Å²	135.5	84%	0.839	78%	0.782	S	S	*	*			trans	-22.9	149.8	160.6	-72.4	-105.4	0	0	0	120.6
1199	V	24.3	Very low	25.9	Very low	136 Å²	136	135.3 Å²	135.3	82%	0.824	78%	0.782	S	S	*	*				176.6	153.2	98.3	158.3	0	0	0	0	110.1
1200	S	26.1	Very low	26.1	Very low	105 Å²	105	130.8 Å²	130.8	73%	0.734	78%	0.78	S	S	*	*			trans	-120.5	156.6	176.5	55.1	0	0	0	0	112.8
1201	P	28.6	Very low	26.3	Very low	117 Å²	117	128.3 Å²	128.3	76%	0.76	78%	0.781	S	S	*	*				-156.7	135.7	127.6	35.7	-15.8	0	0	0	119.5
1202	I	25.3	Very low	26.5	Very low	151 Å²	151	134.7 Å²	134.7	77%	0.774	79%	0.79	S	S	*	*				28.5	134.4	125.1	-41.3	175.2	0	0	0	122
1203	V	24.9	Very low	26.5	Very low	138 Å²	138	135.2 Å²	135.2	84%	0.836	78%	0.781	S	S	*	*				176.1	155.9	124.8	152	0	0	0	0	113.9
1204	H	24.6	Very low	26.8	Very low	173 Å²	173	132.9 Å²	132.9	80%	0.801	77%	0.774	S	S	*	*			trans	-100.7	171	-169.2	-65.6	-109.1	0	0	0	116.3
1205	S	24.5	Very low	26.5	Very low	123 Å²	123	134.6 Å²	134.6	86%	0.86	78%	0.778	S	S	*	*				-174.5	-174.8	119.8	52.7	0	0	0	0	114.4
1206	S	24.9	Very low	26.7	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	77%	0.773	S	S	*	*			trans	-154.5	-118.2	-144	61.6	0	0	0	0	117.1
1207	V	30.8	Very low	26.8	Very low	128 Å²	128	135.1 Å²	135.1	78%	0.776	77%	0.77	S	S	*	*			trans	74.4	124.4	-167	-171.2	0	0	0	0	113.2
1208	H	25.4	Very low	26.7	Very low	166 Å²	166	135.7 Å²	135.7	77%	0.769	76%	0.761	S	S	*	*			cis	80.3	107.2	4.6	-91	83.6	0	0	0	119.8
1209	P	34.1	Very low	26.8	Very low	126 Å²	126	130.7 Å²	130.7	82%	0.818	76%	0.755	S	S	*	*				-139.4	157.8	111.9	39.3	-28.1	0	0	0	114.9
1210	G	29.4	Very low	26.8	Very low	71 Å²	71	129.5 Å²	129.5	73%	0.732	75%	0.753	S	S	*	*			cis	107.5	151	5.2	0	0	0	0	0	113
1211	G	26.4	Very low	26.6	Very low	77 Å²	77	131.3 Å²	131.3	79%	0.794	75%	0.753	S	S	*	*			cis	-101.6	-137	-3.8	0	0	0	0	0	113.4
1212	Y	28.5	Very low	26.3	Very low	244 Å²	244	132.8 Å²	132.8	96%	0.957	75%	0.753	S	S	*	*			cis	-105.8	151.3	-0.9	-99	-90.7	0	0	0	113
1213	E	24.5	Very low	26.1	Very low	121 Å²	121	132.4 Å²	132.4	57%	0.565	75%	0.753	S	S	*	*			trans	-111	168.9	-176	-124.3	-179.7	175.9	0	0	109.8	L1216	E1213-L1216 WeakPolarHBondContact OE1-CD1 3.45Å
1214	P	30.1	Very low	26.2	Very low	107 Å²	107	131.4 Å²	131.4	70%	0.695	75%	0.749	S	S	*	*				-142.1	146.8	55.9	36.4	-16	0	0	0	118.3
1215	N	27.2	Very low	26	Very low	138 Å²	138	132.2 Å²	132.2	74%	0.738	76%	0.755	S	S	*	*	S	Bend	trans	69.9	115.3	151.1	-52.3	-21.9	0	0	0	119.9
1216	L	29.3	Very low	25.8	Very low	139 Å²	139	131 Å²	131	73%	0.728	75%	0.747	S	S	*	*			cis	-152.9	151.3	-24.3	-149.7	71.4	0	0	0	110.4	E1213	E1213-L1216 WeakPolarHBondContact OE1-CD1 3.45Å
1217	M	24.7	Very low	25.6	Very low	123 Å²	123	132.6 Å²	132.6	61%	0.606	75%	0.746	S	S	*	*			trans	-65.5	173.3	-176.4	-63.3	-173	177.4	0	0	115.1
1218	K	23.4	Very low	25.2	Very low	143 Å²	143	130.3 Å²	130.3	62%	0.622	73%	0.729	S	S	*	*			cis	-163.3	159.3	9.5	-135.5	154.1	-169.9	162.5	0	111.5
1219	P	25.2	Very low	24.9	Very low	109 Å²	109	127.8 Å²	127.8	71%	0.708	72%	0.717	S	S	*	*			trans	-111.1	174.4	165.5	39.1	-32	0	0	0	114.6
1220	S	25.7	Very low	24.3	Very low	112 Å²	112	125.9 Å²	125.9	78%	0.783	70%	0.699	S	S	*	*			trans	76.1	147.9	168.5	80.5	0	0	0	0	116.5
1221	I	22.1	Very low	23.9	Very low	142 Å²	142	123.8 Å²	123.8	73%	0.728	67%	0.671	S	S	*	*			cis	-146.6	148.1	19.5	-71.1	178.9	0	0	0	111.8
1222	I	22.1	Very low	23.8	Very low	148 Å²	148	120.4 Å²	120.4	76%	0.759	64%	0.635	S	S	*	*			trans	68.5	127.8	161.6	-73.3	163	0	0	0	121.7
1223	D	21.1	Very low	23.6	Very low	144 Å²	144	108.9 Å²	108.9	77%	0.77	59%	0.59	S	S	*	*			trans	7.8	165.4	146.1	-49.7	-7.8	0	0	0	122.5
1224	P	26.3	Very low	23.6	Very low	117 Å²	117	104.9 Å²	104.9	76%	0.76	57%	0.573	S	S	*	*			cis	-139	179.1	9.6	42.9	-24.7	0	0	0	118.4
1225	M	20	Very low	23.3	Very low	189 Å²	189	102.3 Å²	102.3	93%	0.931	55%	0.551	S	S	*	*			trans	57.4	107	149.8	-87.5	-170.8	164	0	0	122.9
1226	S	21.2	Very low	23.2	Very low	99 Å²	99	95.8 Å²	95.8	69%	0.692	52%	0.515	S	S	*	.			trans	-156.2	116.9	130	60.5	0	0	0	0	108.8
1227	L	20.6	Very low	22.9	Very low	141 Å²	141	89.1 Å²	89.1	74%	0.738	48%	0.481	S	S	*	.				68.8	108.7	84.4	-156.7	88.1	0	0	0	113.4
1228	I	21.2	Very low	22.8	Very low	81 Å²	81	84 Å²	84	42%	0.415	46%	0.457	S	S	.	.				174.2	86.2	95.2	-63.8	157.8	0	0	0	109.1	E82 D83	E82-I1228 CarbonylContact C-O 3.51Å; E82-I1228 VanDerWaalsContact CB-O 3.28Å; E82-I1228 WeakPolarHBondContact CB-O 3.46Å; E82-I1228 WeakPolarHBondContact OE2-CA 3.25Å; E82-I1228 PolarHBondContact OE2-N 3.16Å; D83-I1228 WeakPolarHBondContact CA-O 3.32Å; D83-I1228 HydrophobicContact CB-CB 4.32Å; D83-I1228 HydrophobicContact CB-CG2 4.38Å; D83-I1228 WeakPolarHBondContact CB-O 3.42Å; D83-I1228 PolarHBondContact N-O 2.76Å; D83-I1228 VanDerWaalsContact OD2-CG2 3.26Å; D83-I1228 WeakPolarHBondContact OD2-CG2 3.5Å
1229	H	20.4	Very low	22.8	Very low	112 Å²	112	79.5 Å²	79.5	52%	0.519	44%	0.441	S	S	.	.			trans	37.6	131.8	133.1	-160.3	-123.1	0	0	0	122.6	E82	E82-H1229 CarbonylContact O-C 3.01Å; E82-H1229 PolarHBondContact OE2-N 3.38Å; E82-H1229 VanDerWaalsContact OE2-N 3.08Å
1230	I	21.5	Very low	22.8	Very low	87 Å²	87	75 Å²	75	45%	0.446	41%	0.411	S	S	.	.			trans	98.8	146.6	159.8	-61.3	155.4	0	0	0	118.3	E82 A976	E82-I1230 PolarHBondContact O-N 3.4Å; E82-I1230 VanDerWaalsContact O-O 3.06Å; A976-I1230 HydrophobicContact CB-CG2 4Å
1231	D	21.7	Very low	22.7	Very low	27 Å²	27	72 Å²	72	14%	0.144	39%	0.392	C	S	.	.				-148.1	-175.8	-75.9	-101.4	-39.5	0	0	0	106.2	R972 R973 A976 L977	R972-D1231 WeakPolarHBondContact O-CB 3.12Å; R972-D1231 VanDerWaalsContact O-OD2 3.11Å; R973-D1231 VanDerWaalsContact CD-OD1 3.31Å; R973-D1231 WeakPolarHBondContact CD-OD1 3.31Å; R973-D1231 IonicContact CZ-OD1 3.75Å; R973-D1231 PolarHBondContact N-OD2 3.27Å; R973-D1231 IonicContact NE-OD1 2.71Å; R973-D1231 IonicContact NH1-OD1 2.63Å; R973-D1231 PolarHBondContact NH1-OD1 3.41Å; A976-D1231 CarbonylContact C-O 3.58Å; A976-D1231 VanDerWaalsContact CB-C 3.48Å; A976-D1231 HydrophobicContact CB-CB 4.4Å; A976-D1231 WeakPolarHBondContact CB-O 2.98Å; L977-D1231 PolarHBondContact N-O 3.43Å
1232	L	23.3	Very low	22.8	Very low	5 Å²	5	70 Å²	70	3%	0.026	39%	0.389	C	S	.	.			cis	79	124.2	36.1	-66.5	82	0	0	0	118	E909 R973 A974 K975 A976 L977	E909-L1232 HydrophobicContact CG-CD2 3.88Å; E909-L1232 WeakPolarHBondContact OE1-CD2 3.34Å; R973-L1232 HydrophobicContact CB-CB 4.27Å; R973-L1232 HydrophobicContact CG-CB 3.76Å; R973-L1232 HydrophobicContact CG-CD1 4.24Å; R973-L1232 HydrophobicContact CG-CD2 3.43Å; R973-L1232 VanDerWaalsContact CG-CD2 3.43Å; R973-L1232 HydrophobicContact CG-CG 3.87Å; R973-L1232 VanDerWaalsContact NH1-CD1 3.25Å; R973-L1232 WeakPolarHBondContact O-CB 3.41Å; A974-L1232 CarbonylContact C-O 2.99Å; A974-L1232 WeakPolarHBondContact CA-O 3.07Å; A974-L1232 PolarHBondContact N-O 3.14Å; K975-L1232 CarbonylContact C-O 3.21Å; K975-L1232 WeakPolarHBondContact CA-O 3.08Å; K975-L1232 PolarHBondContact N-O 3.32Å; A976-L1232 PolarHBondContact N-O 3.14Å; L977-L1232 HydrophobicContact CD1-CB 4.04Å; L977-L1232 HydrophobicContact CD1-CD1 4.23Å; L977-L1232 HydrophobicContact CD1-CD2 3.87Å; L977-L1232 HydrophobicContact CD1-CG 3.41Å; L977-L1232 VanDerWaalsContact CD1-CG 3.41Å; L977-L1232 HydrophobicContact CG-CB 4.11Å; L977-L1232 HydrophobicContact CG-CD1 4.12Å; L977-L1232 HydrophobicContact CG-CG 3.7Å; L977-L1232 VanDerWaalsContact CG-N 3.34Å; L977-L1232 VanDerWaalsContact N-CA 3.27Å; L977-L1232 PolarHBondContact N-O 2.89Å
1233	P	25.1	Very low	22.8	Very low	2 Å²	2	68.7 Å²	68.7	1%	0.013	37%	0.374	C	S	.	.			cis	-135.8	-162.6	38.9	42.2	-21.9	0	0	0	118.8	Y910 A974 L977 E978	Y910-P1233 HydrophobicContact CD2-CB 3.18Å; Y910-P1233 HydrophobicContact CE2-CB 3.28Å; Y910-P1233 HydrophobicContact CE2-CG 4.27Å; Y910-P1233 HydrophobicContact CG-CB 3.99Å; A974-P1233 VanDerWaalsContact C-CG 3.44Å; A974-P1233 HydrophobicContact CB-CB 3.71Å; A974-P1233 HydrophobicContact CB-CG 3.72Å; L977-P1233 CarbonylContact C-O 3.21Å; L977-P1233 WeakPolarHBondContact CB-O 3.43Å; E978-P1233 HydrophobicContact CB-CG 4.39Å; E978-P1233 HydrophobicContact CG-CG 4.3Å; E978-P1233 PolarHBondContact N-O 3.15Å; E978-P1233 VanDerWaalsContact N-O 3.08Å
1234	N	23.2	Very low	23	Very low	38 Å²	38	66.8 Å²	66.8	20%	0.203	37%	0.368	C	S	.	.			trans	94	169.8	152	-72.2	-18.5	0	0	0	120.8	Q907 Y910	Q907-N1234 WeakPolarHBondContact CA-O 3.49Å; Q907-N1234 WeakPolarHBondContact CB-O 3.37Å; Q907-N1234 VanDerWaalsContact CD-C 3.4Å; Q907-N1234 WeakPolarHBondContact CG-O 3.47Å; Q907-N1234 PolarHBondContact OE1-O 2.71Å; Y910-N1234 VanDerWaalsContact CB-N 3.34Å; Y910-N1234 WeakPolarHBondContact CD1-OD1 3.47Å; Y910-N1234 WeakPolarHBondContact CE1-OD1 3.49Å; Y910-N1234 VanDerWaalsContact CZ-OD1 3.25Å
1235	F	23.3	Very low	22.9	Very low	53 Å²	53	65.4 Å²	65.4	23%	0.232	36%	0.357	C	S	.	.			trans	-88.4	136.8	-137.4	-74.7	-72.3	0	0	0	126.1	Q907 Y910 L911 L1047	Q907-F1235 VanDerWaalsContact CB-CA 3.4Å; Q907-F1235 VanDerWaalsContact OE1-CA 3.29Å; Q907-F1235 PolarHBondContact OE1-O 3.26Å; Y910-F1235 HydrophobicContact CD1-CD2 4.16Å; Y910-F1235 HydrophobicContact CD1-CE1 4.01Å; Y910-F1235 AromaticContact CD1-CE2 3.48Å; Y910-F1235 HydrophobicContact CD1-CE2 3.48Å; Y910-F1235 VanDerWaalsContact CD1-CE2 3.48Å; Y910-F1235 AromaticContact CD1-CZ 3.4Å; Y910-F1235 HydrophobicContact CD1-CZ 3.4Å; Y910-F1235 HydrophobicContact CE1-CD2 4.28Å; Y910-F1235 HydrophobicContact CE1-CE1 4.41Å; Y910-F1235 AromaticContact CE1-CE2 3.29Å; Y910-F1235 HydrophobicContact CE1-CE2 3.29Å; Y910-F1235 AromaticContact CE1-CZ 3.39Å; Y910-F1235 HydrophobicContact CE1-CZ 3.39Å; L911-F1235 HydrophobicContact CD2-CE1 3.82Å; L911-F1235 HydrophobicContact CG-CE1 4.47Å; L1047-F1235 HydrophobicContact CD1-CD1 3.96Å
1236	P	26.6	Very low	23.1	Very low	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.351	C	S	.	.				-152.8	-156.9	94.4	44.8	-25.4	0	0	0	122	L904 L1047 L1048	L904-P1236 HydrophobicContact CD1-CG 4.05Å; L1047-P1236 VanDerWaalsContact CB-CA 3.42Å; L1047-P1236 HydrophobicContact CB-CB 3.47Å; L1047-P1236 VanDerWaalsContact CB-CB 3.47Å; L1047-P1236 WeakPolarHBondContact O-CB 3.29Å; L1048-P1236 HydrophobicContact CD2-CB 4.34Å; L1048-P1236 HydrophobicContact CD2-CG 3.49Å; L1048-P1236 VanDerWaalsContact CD2-CG 3.49Å; L1048-P1236 HydrophobicContact CG-CB 4.27Å; L1048-P1236 HydrophobicContact CG-CG 3.77Å
1237	L	22.5	Very low	23.4	Very low	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.352	C	S	.	.			trans	-159.7	165.9	-165.7	-65.5	-173	0	0	0	111.6	L911 F1033 G1042 L1043 C1044 S1045 Y1046 L1047	L911-L1237 HydrophobicContact CD1-CD2 3.49Å; L911-L1237 VanDerWaalsContact CD1-CD2 3.49Å; F1033-L1237 HydrophobicContact CB-CD1 4.01Å; F1033-L1237 HydrophobicContact CD1-CD1 3.26Å; F1033-L1237 HydrophobicContact CD2-CD1 4.08Å; F1033-L1237 HydrophobicContact CE1-CD1 3.62Å; F1033-L1237 HydrophobicContact CE2-CD1 4.37Å; F1033-L1237 HydrophobicContact CG-CD1 3.51Å; F1033-L1237 HydrophobicContact CZ-CD1 4.15Å; G1042-L1237 CarbonylContact O-C 3.59Å; G1042-L1237 WeakPolarHBondContact O-CB 3.38Å; L1043-L1237 VanDerWaalsContact C-CA 3.45Å; L1043-L1237 HydrophobicContact CD1-CD2 3.51Å; L1043-L1237 HydrophobicContact CG-CD2 3.91Å; L1043-L1237 VanDerWaalsContact O-CA 3.24Å; L1043-L1237 WeakPolarHBondContact O-CA 3.42Å; C1044-L1237 CarbonylContact C-O 3.49Å; S1045-L1237 CarbonylContact C-O 3.58Å; S1045-L1237 WeakPolarHBondContact CA-O 3.49Å; S1045-L1237 PolarHBondContact N-O 3.13Å; Y1046-L1237 CarbonylContact C-O 3.5Å; Y1046-L1237 WeakPolarHBondContact CA-O 3.41Å; Y1046-L1237 PolarHBondContact N-O 3.01Å; L1047-L1237 HydrophobicContact CB-CB 3.94Å; L1047-L1237 HydrophobicContact CB-CG 4.33Å; L1047-L1237 HydrophobicContact CD1-CB 4.16Å; L1047-L1237 HydrophobicContact CD1-CD1 3.74Å; L1047-L1237 HydrophobicContact CD1-CG 3.65Å; L1047-L1237 HydrophobicContact CG-CB 3.87Å; L1047-L1237 HydrophobicContact CG-CD1 3.99Å; L1047-L1237 HydrophobicContact CG-CG 3.92Å; L1047-L1237 PolarHBondContact N-O 3.21Å
1238	S	22.1	Very low	23.5	Very low	16 Å²	16	68.2 Å²	68.2	11%	0.112	36%	0.356	C	S	.	.			trans	119.5	118.8	179.7	138.6	0	0	0	0	125.4	T1041 G1042 L1043 C1044 S1045 Y1046	T1041-S1238 WeakPolarHBondContact O-CB 3.22Å; T1041-S1238 PolarHBondContact O-OG 3.21Å; G1042-S1238 WeakPolarHBondContact O-CA 3.26Å; G1042-S1238 WeakPolarHBondContact O-CB 3.48Å; G1042-S1238 PolarHBondContact O-N 2.94Å; L1043-S1238 VanDerWaalsContact N-CA 3.29Å; C1044-S1238 CarbonylContact C-O 3.2Å; C1044-S1238 WeakPolarHBondContact CA-O 3.44Å; C1044-S1238 WeakPolarHBondContact CB-O 3.42Å; C1044-S1238 PolarHBondContact N-O 3.12Å; S1045-S1238 PolarHBondContact N-O 2.67Å; S1045-S1238 PolarHBondContact OG-O 2.71Å; Y1046-S1238 WeakPolarHBondContact CB-OG 3.46Å; Y1046-S1238 VanDerWaalsContact N-CB 3.32Å; Y1046-S1238 PolarHBondContact N-OG 2.91Å
1239	V	24.2	Very low	23.7	Very low	47 Å²	47	69.8 Å²	69.8	29%	0.285	37%	0.372	S	S	.	.			trans	85.7	73.8	154.7	-163.6	0	0	0	0	122.6	L1000 S1004 F1040 T1041 S1045	L1000-V1239 HydrophobicContact CD2-CB 4.21Å; L1000-V1239 HydrophobicContact CD2-CG1 4.5Å; S1004-V1239 VanDerWaalsContact CB-O 3.32Å; S1004-V1239 WeakPolarHBondContact CB-O 3.38Å; F1040-V1239 CarbonylContact O-C 2.94Å; F1040-V1239 WeakPolarHBondContact O-CA 3.24Å; F1040-V1239 PolarHBondContact O-N 3.13Å; T1041-V1239 HydrophobicContact CG2-CB 4.08Å; T1041-V1239 HydrophobicContact CG2-CG1 3.75Å; T1041-V1239 HydrophobicContact CG2-CG2 4.31Å; T1041-V1239 WeakPolarHBondContact O-CA 3.31Å; T1041-V1239 PolarHBondContact O-N 3.35Å; S1045-V1239 VanDerWaalsContact OG-CG2 3.31Å; S1045-V1239 WeakPolarHBondContact OG-CG2 3.23Å
1240	F	24	Very low	23.7	Very low	16 Å²	16	70.1 Å²	70.1	7%	0.07	39%	0.387	C	S	.	.				-151	118	113.4	-67	-1.9	0	0	0	114.1	L1000 N1001 S1004 E1005 F1040 T1041	L1000-F1240 WeakPolarHBondContact O-CE1 3.47Å; L1000-F1240 WeakPolarHBondContact O-CZ 3.47Å; N1001-F1240 HydrophobicContact CB-CE1 4.36Å; N1001-F1240 HydrophobicContact CB-CZ 4.43Å; N1001-F1240 WeakPolarHBondContact O-CZ 2.82Å; S1004-F1240 VanDerWaalsContact CA-CE1 3.48Å; S1004-F1240 WeakPolarHBondContact O-CD2 3.36Å; S1004-F1240 WeakPolarHBondContact O-CE2 3.21Å; S1004-F1240 WeakPolarHBondContact OG-CD1 3.4Å; S1004-F1240 WeakPolarHBondContact OG-CD2 3.38Å; S1004-F1240 WeakPolarHBondContact OG-CE1 3.21Å; S1004-F1240 WeakPolarHBondContact OG-CE2 2.98Å; S1004-F1240 WeakPolarHBondContact OG-CG 3.26Å; S1004-F1240 WeakPolarHBondContact OG-CZ 2.9Å; E1005-F1240 HydrophobicContact CB-CE2 4.02Å; E1005-F1240 HydrophobicContact CG-CE2 3.73Å; F1040-F1240 CarbonylContact C-O 2.98Å; F1040-F1240 WeakPolarHBondContact CA-O 3.49Å; F1040-F1240 WeakPolarHBondContact CB-O 3.47Å; F1040-F1240 WeakPolarHBondContact CD2-O 3.3Å; F1040-F1240 PolarHBondContact N-O 2.79Å; F1040-F1240 PolarHBondContact O-N 3.28Å; T1041-F1240 VanDerWaalsContact CA-C 3.41Å; T1041-F1240 VanDerWaalsContact CA-N 3.3Å; T1041-F1240 PolarHBondContact N-O 3Å
1241	A	25.1	Very low	23.9	Very low	48 Å²	48	71.4 Å²	71.4	40%	0.397	40%	0.401	S	S	.	.				-77.4	151.2	120.9	0	0	0	0	0	104.3	T1041	T1041-A1241 VanDerWaalsContact CB-N 3.28Å; T1041-A1241 WeakPolarHBondContact OG1-CA 3.28Å; T1041-A1241 WeakPolarHBondContact OG1-CB 3.24Å; T1041-A1241 PolarHBondContact OG1-N 3.2Å
1242	P	22.7	Very low	24	Very low	100 Å²	100	78 Å²	78	65%	0.649	44%	0.435	S	S	*	.			cis	-132.6	140.8	31	26.4	-4.3	0	0	0	115.8
1243	R	23.1	Very low	24	Very low	120 Å²	120	87.2 Å²	87.2	45%	0.453	48%	0.475	S	S	.	.			trans	-75.4	125.8	131.5	-76.7	-175.8	177.6	176.9	0.8	108.1	E1012 N1038	E1012-R1243 IonicContact OE1-CZ 2.73Å; E1012-R1243 IonicContact OE1-NE 2.72Å; E1012-R1243 IonicContact OE1-NH2 3.43Å; E1012-R1243 PolarHBondContact OE1-NH2 3.32Å; N1038-R1243 PolarHBondContact OD1-NH1 2.94Å
1244	T	25	Very low	23.8	Very low	104 Å²	104	92.1 Å²	92.1	64%	0.638	51%	0.509	S	S	*	.			cis	-166.5	166.8	-15.2	-5.8	0	0	0	0	108.5
1245	V	24.3	Very low	23.7	Very low	88 Å²	88	96.5 Å²	96.5	53%	0.533	54%	0.542	S	S	.	.			trans	71.3	108.6	142.6	165	0	0	0	0	119.8
1246	R	25	Very low	23.6	Very low	214 Å²	214	99.1 Å²	99.1	81%	0.808	57%	0.567	S	S	*	*				57.8	153.2	123.7	-50	174.8	-162.7	122.9	-0.7	119.1
1247	T	25.8	Very low	23.3	Very low	116 Å²	116	109.9 Å²	109.9	71%	0.712	61%	0.607	S	S	*	*			cis	-135.2	143.9	6.6	26.1	0	0	0	0	109.3
1248	L	22.5	Very low	23.3	Very low	158 Å²	158	119.9 Å²	119.9	83%	0.827	65%	0.645	S	S	*	*				65.3	152.8	83.6	-98	80.7	0	0	0	115.4
1249	P	26.3	Very low	23.2	Very low	115 Å²	115	125.3 Å²	125.3	75%	0.747	67%	0.673	S	S	*	*			trans	-135.9	-175.5	-131.1	41.3	-22.2	0	0	0	115.7
1250	S	21.3	Very low	23.2	Very low	119 Å²	119	129.4 Å²	129.4	83%	0.832	70%	0.698	S	S	*	*			trans	-171.9	158.7	146.7	34.3	0	0	0	0	112.7
1251	P	25.3	Very low	23.5	Very low	114 Å²	114	133.9 Å²	133.9	74%	0.74	73%	0.729	S	S	*	*			trans	-115.3	157.6	-173.7	40.5	-31.5	0	0	0	116.5
1252	L	23	Very low	23.8	Very low	165 Å²	165	136.8 Å²	136.8	86%	0.864	74%	0.743	S	S	*	*			trans	47.1	106.7	149.9	-65.8	171.2	0	0	0	120.8
1253	K	22.8	Very low	23.7	Very low	198 Å²	198	136.4 Å²	136.4	86%	0.861	75%	0.748	S	S	*	*				-173.3	139.6	117.5	-105.8	168.5	-177.2	176.9	0	115.4
1254	S	21.3	Very low	23.7	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	76%	0.758	S	S	*	*			trans	38.7	121.9	150.8	58	0	0	0	0	123.4
1255	C	20.6	Very low	23.6	Very low	131 Å²	131	139.1 Å²	139.1	89%	0.885	76%	0.76	S	S	*	*				18.5	141.5	125.7	-64.3	0	0	0	0	120.5
1256	S	21.7	Very low	23.4	Very low	108 Å²	108	140.5 Å²	140.5	76%	0.755	77%	0.773	S	S	*	*			cis	-163.1	-176.7	8.1	67.5	0	0	0	0	113.5
1257	R	21.2	Very low	23.4	Very low	225 Å²	225	136.3 Å²	136.3	85%	0.849	77%	0.771	S	S	*	*			trans	-1.7	141.6	161.6	-71	177.7	174.3	177.7	-1.7	117.7
1258	R	21.5	Very low	23.2	Very low	210 Å²	210	135.7 Å²	135.7	79%	0.792	77%	0.771	S	S	*	*			cis	-174.3	163.1	42.2	-137.6	-177.4	-177	158.5	-2.8	111.6
1259	N	21	Very low	23.1	Very low	130 Å²	130	134.4 Å²	134.4	70%	0.695	76%	0.764	S	S	*	*			trans	63.3	124.3	162.2	-53	-10.4	0	0	0	118.2
1260	V	23.8	Very low	23	Very low	133 Å²	133	136.3 Å²	136.3	81%	0.806	76%	0.763	S	S	*	*			cis	79.6	131.8	38.2	178.7	0	0	0	0	113.4
1261	P	30.3	Very low	23	Very low	111 Å²	111	137 Å²	137	72%	0.721	76%	0.757	S	S	*	*			cis	-134.6	-127.4	-30.5	40.2	-17.7	0	0	0	110
1262	P	30.1	Very low	22.9	Very low	108 Å²	108	137.4 Å²	137.4	70%	0.701	76%	0.758	S	S	*	*			cis	-132.4	178.7	-41.1	40.4	-23.8	0	0	0	116.2
1263	A	21.6	Very low	22.8	Very low	92 Å²	92	134 Å²	134	76%	0.76	75%	0.748	S	S	*	*			trans	67.5	164.5	148.1	0	0	0	0	0	119.4
1264	D	22.5	Very low	22.7	Very low	123 Å²	123	129.7 Å²	129.7	66%	0.658	74%	0.743	S	S	*	*			cis	-157.3	165.5	1.7	-147.9	-8	0	0	0	114.2
1265	K	23.3	Very low	22.9	Very low	158 Å²	158	133.4 Å²	133.4	69%	0.687	75%	0.749	S	S	*	*			trans	57.5	116.8	156.7	-70.5	173.7	-177.7	78.5	0	123.7
1266	C	20.6	Very low	22.9	Very low	117 Å²	117	132.8 Å²	132.8	79%	0.791	74%	0.744	S	S	*	*				62.5	147.3	118.2	-51	0	0	0	0	121.6
1267	T	24.3	Very low	22.9	Very low	127 Å²	127	133 Å²	133	78%	0.779	75%	0.746	S	S	*	*			cis	-152.9	144.8	35.6	42.1	0	0	0	0	116
1268	C	21.1	Very low	22.9	Very low	103 Å²	103	127.1 Å²	127.1	70%	0.696	74%	0.738	S	S	*	*			trans	44.4	129	136.9	-54.1	0	0	0	0	126.1
1269	N	21.1	Very low	23	Very low	130 Å²	130	125.6 Å²	125.6	70%	0.695	74%	0.744	S	S	*	*			trans	69.2	156.3	131.9	-63.4	13.6	0	0	0	120.4
1270	H	24.5	Very low	23	Very low	155 Å²	155	124.4 Å²	124.4	72%	0.718	75%	0.745	S	S	*	*			cis	-134.9	146.9	-5.7	-92.6	-58.1	0	0	0	108
1271	N	21.9	Very low	23.1	Very low	133 Å²	133	125.6 Å²	125.6	71%	0.711	75%	0.746	S	S	*	*				81.5	137.2	62.9	-132.8	33.7	0	0	0	115.2
1272	T	22.1	Very low	22.8	Very low	124 Å²	124	123.4 Å²	123.4	76%	0.761	73%	0.731	S	S	*	*			trans	68.5	152.3	169.6	62.7	0	0	0	0	119.8
1273	S	21.5	Very low	22.5	Very low	93 Å²	93	126.7 Å²	126.7	65%	0.65	74%	0.735	S	S	*	*			cis	-179.7	152.1	-29.4	55.7	0	0	0	0	111.9
1274	S	21.8	Very low	22.7	Very low	107 Å²	107	127.6 Å²	127.6	75%	0.748	73%	0.727	S	S	*	*			trans	64.9	151.5	162.4	74.8	0	0	0	0	116.7
1275	Q	24.6	Very low	22.9	Very low	184 Å²	184	130.1 Å²	130.1	86%	0.86	73%	0.728	S	S	*	*			cis	-144.6	168.9	38.8	-69.6	-179.6	-27.3	0	0	114.4
1276	C	20.7	Very low	23.1	Very low	118 Å²	118	128.6 Å²	128.6	80%	0.797	73%	0.727	S	S	*	*			trans	-106.6	152.7	-177.9	-41.3	0	0	0	0	112.9
1277	S	20.9	Very low	23.3	Very low	113 Å²	113	129.1 Å²	129.1	79%	0.79	72%	0.718	S	S	*	*			trans	-174	109.8	133.6	47	0	0	0	0	110.3
1278	C	21.2	Very low	23.5	Very low	101 Å²	101	126.2 Å²	126.2	68%	0.682	70%	0.702	S	S	*	*				73.2	103.4	80.4	-69	0	0	0	0	115.1
1279	I	24.3	Very low	23.8	Very low	178 Å²	178	125.7 Å²	125.7	91%	0.913	69%	0.693	S	S	*	*			trans	-145	146	145.3	-101.3	158.6	0	0	0	108.4
1280	S	20.9	Very low	24.2	Very low	104 Å²	104	123.9 Å²	123.9	73%	0.727	68%	0.679	S	S	*	*			trans	-108.1	144	-167.2	60.2	0	0	0	0	114
1281	L	25.3	Very low	24.4	Very low	158 Å²	158	122.5 Å²	122.5	83%	0.827	67%	0.673	S	S	*	*			trans	-138.6	102.5	167.3	-105.6	148.4	0	0	0	113.3
1282	T	25.7	Very low	24.8	Very low	66 Å²	66	121.4 Å²	121.4	41%	0.405	66%	0.662	S	S	.	*			trans	24.7	115.7	154.5	50.8	0	0	0	0	120.7	N1284	T1282-N1284 PolarHBondContact O-N 3.28Å
1283	K	23.9	Very low	25.1	Very low	177 Å²	177	121.6 Å²	121.6	77%	0.77	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.8	-24.3	175.9	-168.1	173.1	178.8	179.8	0	116.7
1284	N	25	Very low	25.3	Very low	111 Å²	111	120.2 Å²	120.2	59%	0.594	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-2.2	-169.7	-71	72.2	0	0	0	116.3	T1282	T1282-N1284 PolarHBondContact O-N 3.28Å
1285	Y	25.8	Very low	25.6	Very low	175 Å²	175	117.7 Å²	117.7	69%	0.686	62%	0.624	S	S	*	*	S	Bend	trans	-94.2	-18.6	174.6	-113.4	-90.2	0	0	0	113.3	S1288	Y1285-S1288 PolarHBondContact O-OG 3.01Å
1286	L	27	Very low	25.8	Very low	126 Å²	126	113.6 Å²	113.6	66%	0.66	61%	0.605	S	S	*	*	H	α-helix	trans	-76.7	-30.6	-177.1	-89.8	162.3	0	0	0	113.3	D1289 F1290	L1286-D1289 PolarHBondContact O-N 3.43Å; L1286-F1290 VanDerWaalsContact O-CB 3.27Å; L1286-F1290 WeakPolarHBondContact O-CB 3.1Å; L1286-F1290 PolarHBondContact O-N 3.08Å
1287	E	25.7	Very low	26.1	Very low	128 Å²	128	110.9 Å²	110.9	60%	0.598	59%	0.585	S	S	*	*	H	α-helix	trans	-66.9	-38.9	-179	-70.2	169.5	143.8	0	0	112.5	F1290 H1291	E1287-F1290 PolarHBondContact O-N 3.14Å; E1287-H1291 PolarHBondContact O-N 3.49Å; E1287-H1291 VanDerWaalsContact O-N 3.09Å
1288	S	28.3	Very low	26.3	Very low	66 Å²	66	113.5 Å²	113.5	46%	0.462	58%	0.577	S	S	.	*	H	α-helix	trans	-65.1	-41.8	175.7	43.8	0	0	0	0	112.4	Y1285 K1292	Y1285-S1288 PolarHBondContact O-OG 3.01Å; S1288-K1292 WeakPolarHBondContact O-CB 3.27Å; S1288-K1292 PolarHBondContact O-N 3.17Å
1289	D	28.3	Very low	26.5	Very low	92 Å²	92	112.2 Å²	112.2	49%	0.492	57%	0.569	S	S	.	*	H	α-helix	trans	-76.2	-26.7	176.1	-74.1	-21.5	0	0	0	111.9	L1286 K1292 H1293	L1286-D1289 PolarHBondContact O-N 3.43Å; D1289-K1292 PolarHBondContact O-N 3.15Å; D1289-H1293 WeakPolarHBondContact O-CB 3.22Å; D1289-H1293 PolarHBondContact O-N 2.87Å
1290	F	29.3	Very low	26.4	Very low	93 Å²	93	110 Å²	110	41%	0.408	56%	0.559	S	S	.	*	H	α-helix	trans	-65.7	-46.7	174.4	-152.6	-107.7	0	0	0	110.9	L1286 E1287 H1293 L1294 E1736	L1286-F1290 VanDerWaalsContact O-CB 3.27Å; L1286-F1290 WeakPolarHBondContact O-CB 3.1Å; L1286-F1290 PolarHBondContact O-N 3.08Å; E1287-F1290 PolarHBondContact O-N 3.14Å; F1290-H1293 PolarHBondContact O-N 3.39Å; F1290-L1294 HydrophobicContact CD1-CD1 3.7Å; F1290-L1294 HydrophobicContact CE1-CD1 3.7Å; F1290-L1294 VanDerWaalsContact O-CB 3.28Å; F1290-L1294 WeakPolarHBondContact O-CB 3.44Å; F1290-L1294 PolarHBondContact O-N 3.25Å; F1290-E1736 WeakPolarHBondContact CD1-OE1 3.06Å
1291	H	28.7	Very low	26.5	Very low	126 Å²	126	111.4 Å²	111.4	58%	0.583	56%	0.555	S	S	*	*	H	α-helix	trans	-65.4	-38.5	172.2	-82.9	-23.1	0	0	0	112.9	E1287 A1295 E1736	E1287-H1291 PolarHBondContact O-N 3.49Å; E1287-H1291 VanDerWaalsContact O-N 3.09Å; H1291-A1295 WeakPolarHBondContact O-CB 2.78Å; H1291-A1295 PolarHBondContact O-N 3.04Å; H1291-E1736 IonicContact CE1-OE1 3.85Å
1292	K	29.6	Very low	26.4	Very low	110 Å²	110	109 Å²	109	48%	0.478	55%	0.551	S	S	.	*	H	α-helix	trans	-67.1	-40.2	177.8	-166.4	171.3	178.1	-65.8	0	112	S1288 D1289 A1295 E1296	S1288-K1292 WeakPolarHBondContact O-CB 3.27Å; S1288-K1292 PolarHBondContact O-N 3.17Å; D1289-K1292 PolarHBondContact O-N 3.15Å; K1292-A1295 PolarHBondContact O-N 2.83Å; K1292-E1296 WeakPolarHBondContact CE-OE1 3.35Å; K1292-E1296 VanDerWaalsContact NZ-CD 3.31Å; K1292-E1296 IonicContact NZ-OE1 3.57Å; K1292-E1296 PolarHBondContact NZ-OE1 2.87Å; K1292-E1296 IonicContact NZ-OE2 2.88Å; K1292-E1296 PolarHBondContact NZ-OE2 3.35Å; K1292-E1296 VanDerWaalsContact O-CB 3.32Å; K1292-E1296 WeakPolarHBondContact O-CB 3.41Å; K1292-E1296 VanDerWaalsContact O-CG 3.27Å; K1292-E1296 WeakPolarHBondContact O-CG 3.49Å; K1292-E1296 PolarHBondContact O-N 3.44Å
1293	H	28.4	Very low	26.4	Very low	128 Å²	128	115 Å²	115	59%	0.593	57%	0.572	S	S	*	*	H	α-helix	trans	-79	-27.9	179	-142.2	-0.9	0	0	0	112.5	D1289 F1290 T1297	D1289-H1293 WeakPolarHBondContact O-CB 3.22Å; D1289-H1293 PolarHBondContact O-N 2.87Å; F1290-H1293 PolarHBondContact O-N 3.39Å; H1293-T1297 WeakPolarHBondContact O-CB 3.24Å; H1293-T1297 VanDerWaalsContact O-CG2 3.31Å; H1293-T1297 WeakPolarHBondContact O-CG2 3.32Å; H1293-T1297 PolarHBondContact O-N 3.26Å; H1293-T1297 PolarHBondContact O-OG1 3.01Å
1294	L	26.7	Very low	26.3	Very low	64 Å²	64	112.5 Å²	112.5	34%	0.335	57%	0.567	S	S	.	*	H	α-helix	trans	-68.6	-40.3	166.8	-92.3	163.8	0	0	0	111.9	F1290 T1297 W1298 E1736	F1290-L1294 HydrophobicContact CD1-CD1 3.7Å; F1290-L1294 HydrophobicContact CE1-CD1 3.7Å; F1290-L1294 VanDerWaalsContact O-CB 3.28Å; F1290-L1294 WeakPolarHBondContact O-CB 3.44Å; F1290-L1294 PolarHBondContact O-N 3.25Å; L1294-T1297 PolarHBondContact O-OG1 2.83Å; L1294-W1298 WeakPolarHBondContact O-CB 3.42Å; L1294-W1298 PolarHBondContact O-N 2.75Å; L1294-E1736 WeakPolarHBondContact CD1-OE1 3.28Å
1295	A	28.1	Very low	26.3	Very low	53 Å²	53	116 Å²	116	44%	0.438	58%	0.58	S	S	.	*	H	α-helix	trans	-60.5	-59.1	170.1	0	0	0	0	0	109.9	H1291 K1292 T1297 W1298 S1299	H1291-A1295 WeakPolarHBondContact O-CB 2.78Å; H1291-A1295 PolarHBondContact O-N 3.04Å; K1292-A1295 PolarHBondContact O-N 2.83Å; A1295-T1297 PolarHBondContact O-N 3.06Å; A1295-T1297 VanDerWaalsContact O-N 3.08Å; A1295-W1298 CarbonylContact O-C 3.2Å; A1295-W1298 PolarHBondContact O-N 2.77Å; A1295-S1299 WeakPolarHBondContact O-CB 3.5Å; A1295-S1299 PolarHBondContact O-N 2.92Å; A1295-S1299 PolarHBondContact O-OG 3.23Å
1296	E	26.9	Very low	26.2	Very low	98 Å²	98	113.5 Å²	113.5	46%	0.458	58%	0.577	S	S	.	*	H	α-helix	trans	-65	-16.3	-175	-71	169.6	169.9	0	0	114.4	K1292	K1292-E1296 WeakPolarHBondContact CE-OE1 3.35Å; K1292-E1296 VanDerWaalsContact NZ-CD 3.31Å; K1292-E1296 IonicContact NZ-OE1 3.57Å; K1292-E1296 PolarHBondContact NZ-OE1 2.87Å; K1292-E1296 IonicContact NZ-OE2 2.88Å; K1292-E1296 PolarHBondContact NZ-OE2 3.35Å; K1292-E1296 VanDerWaalsContact O-CB 3.32Å; K1292-E1296 WeakPolarHBondContact O-CB 3.41Å; K1292-E1296 VanDerWaalsContact O-CG 3.27Å; K1292-E1296 WeakPolarHBondContact O-CG 3.49Å; K1292-E1296 PolarHBondContact O-N 3.44Å
1297	T	27.4	Very low	26	Very low	62 Å²	62	114.5 Å²	114.5	38%	0.38	58%	0.583	S	S	.	*	H	α-helix	trans	-91.7	-20.8	169.9	52.5	0	0	0	0	114.1	H1293 L1294 A1295	H1293-T1297 WeakPolarHBondContact O-CB 3.24Å; H1293-T1297 VanDerWaalsContact O-CG2 3.31Å; H1293-T1297 WeakPolarHBondContact O-CG2 3.32Å; H1293-T1297 PolarHBondContact O-N 3.26Å; H1293-T1297 PolarHBondContact O-OG1 3.01Å; L1294-T1297 PolarHBondContact O-OG1 2.83Å; A1295-T1297 PolarHBondContact O-N 3.06Å; A1295-T1297 VanDerWaalsContact O-N 3.08Å
1298	W	25.6	Very low	26	Very low	168 Å²	168	113 Å²	113	64%	0.636	59%	0.587	S	S	*	*	H	α-helix	trans	-115.6	-3.5	-177.7	-77.3	25.2	0	0	0	114.4	L1294 A1295	L1294-W1298 WeakPolarHBondContact O-CB 3.42Å; L1294-W1298 PolarHBondContact O-N 2.75Å; A1295-W1298 CarbonylContact O-C 3.2Å; A1295-W1298 PolarHBondContact O-N 2.77Å
1299	S	24.5	Very low	25.8	Very low	73 Å²	73	118 Å²	118	51%	0.51	61%	0.608	S	S	.	*	S	Bend	trans	-90	-36	176	60.4	0	0	0	0	114.3	A1295	A1295-S1299 WeakPolarHBondContact O-CB 3.5Å; A1295-S1299 PolarHBondContact O-N 2.92Å; A1295-S1299 PolarHBondContact O-OG 3.23Å
1300	D	22.9	Very low	25.6	Very low	132 Å²	132	122.7 Å²	122.7	71%	0.706	63%	0.627	S	S	*	*	S	Bend	trans	-127.4	13	-164.9	-67.5	-84	0	0	0	115.1
1301	Q	23.4	Very low	25.4	Very low	134 Å²	134	123.3 Å²	123.3	63%	0.626	64%	0.643	S	S	*	*	S	Bend	trans	-124.5	48.4	-177.6	-68.7	-159.4	-20.1	0	0	115.5
1302	S	23.7	Very low	25.1	Very low	107 Å²	107	124.8 Å²	124.8	75%	0.748	66%	0.655	S	S	*	*	S	Bend	trans	-152.5	8.5	161.3	61.6	0	0	0	0	117.5
1303	F	24.1	Very low	24.9	Very low	192 Å²	192	125.4 Å²	125.4	84%	0.842	67%	0.67	S	S	*	*	S	Bend	trans	-154	50.4	-178.9	-113	-66.5	0	0	0	115.9
1304	D	23.2	Very low	24.7	Very low	125 Å²	125	127.8 Å²	127.8	67%	0.668	69%	0.686	S	S	*	*	S	Bend	trans	-159.1	-17.7	157.8	-112.6	-23.2	0	0	0	117.4	L1306 N1307	D1304-L1306 PolarHBondContact O-N 3.07Å; D1304-N1307 PolarHBondContact O-N 3.28Å
1305	E	24.5	Very low	24.5	Very low	185 Å²	185	133.7 Å²	133.7	86%	0.864	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	31.3	176.1	-67.5	-168.7	127.3	0	0	115
1306	L	24.5	Very low	24.5	Very low	122 Å²	122	140.4 Å²	140.4	64%	0.639	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.3	11.8	176.2	-137.2	143.2	0	0	0	112.5	D1304 Y1328	D1304-L1306 PolarHBondContact O-N 3.07Å; L1306-Y1328 HydrophobicContact CD1-CE1 4.37Å; L1306-Y1328 HydrophobicContact CD2-CD1 3.78Å; L1306-Y1328 HydrophobicContact CD2-CE1 3.76Å
1307	N	23.2	Very low	24.3	Very low	146 Å²	146	146.6 Å²	146.6	78%	0.781	76%	0.756	S	S	*	*	S	Bend	trans	-125.1	7.2	178	-74.4	-50.9	0	0	0	114.4	D1304	D1304-N1307 PolarHBondContact O-N 3.28Å
1308	S	24.4	Very low	24.1	Very low	97 Å²	97	154.9 Å²	154.9	68%	0.678	78%	0.78	S	S	*	*	S	Bend	trans	-141.4	41.2	-169.3	68	0	0	0	0	115.2
1309	L	23.7	Very low	23.9	Very low	172 Å²	172	150.4 Å²	150.4	90%	0.901	79%	0.786	S	S	*	*	S	Bend	trans	-150.6	38.4	173	-126.7	163	0	0	0	114.6
1310	E	23.9	Very low	23.9	Very low	189 Å²	189	152.1 Å²	152.1	88%	0.883	81%	0.805	S	S	*	*			trans	-140.6	74.1	165.1	-162.1	165.3	-130.2	0	0	110.8
1311	S	26	Very low	23.9	Very low	107 Å²	107	152.6 Å²	152.6	75%	0.748	81%	0.813	S	S	*	*	S	Bend	trans	-141.3	106.1	167.8	62.7	0	0	0	0	110.1
1312	D	22.9	Very low	23.8	Very low	157 Å²	157	155.3 Å²	155.3	84%	0.84	83%	0.825	S	S	*	*			trans	60.3	106.5	171.3	-63.6	-23.9	0	0	0	119.8
1313	P	25.1	Very low	23.8	Very low	122 Å²	122	154.3 Å²	154.3	79%	0.792	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.8	165.8	158.7	35.2	-34.4	0	0	0	111.4	M1315	P1313-M1315 PolarHBondContact O-N 2.83Å
1314	L	23.7	Very low	23.7	Very low	178 Å²	178	155.6 Å²	155.6	93%	0.932	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-61.3	130.6	175.1	-78.3	169.4	0	0	0	112	Q1316	L1314-Q1316 PolarHBondContact O-N 3Å
1315	M	23.3	Very low	23.6	Very low	189 Å²	189	158.2 Å²	158.2	93%	0.931	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-61.6	129.4	175.6	-87.7	-159.3	174	0	0	112.7	P1313	P1313-M1315 PolarHBondContact O-N 2.83Å
1316	Q	27.7	Very low	23.6	Very low	194 Å²	194	156.7 Å²	156.7	91%	0.907	82%	0.82	S	S	*	*				-155.7	141.2	116.9	-114.3	173.6	-0.1	0	0	113	L1314	L1314-Q1316 PolarHBondContact O-N 3Å
1317	R	22.2	Very low	23.6	Very low	228 Å²	228	156 Å²	156	86%	0.86	82%	0.821	S	S	*	*			trans	-54.4	151	167	-72	171.7	166.4	173.3	-5.4	109.1
1318	R	22.8	Very low	23.5	Very low	235 Å²	235	158.9 Å²	158.9	89%	0.887	82%	0.822	S	S	*	*			cis	-175.9	148.7	45.1	-144.5	171.6	-164.8	178.4	3.4	109.9
1319	G	22.2	Very low	23.6	Very low	74 Å²	74	156.4 Å²	156.4	76%	0.763	81%	0.805	S	S	*	*			trans	119.1	137.9	152.5	0	0	0	0	0	118.1
1320	A	25.3	Very low	23.6	Very low	110 Å²	110	149.2 Å²	149.2	91%	0.909	77%	0.77	S	S	*	*			trans	54.8	91.9	168.3	0	0	0	0	0	117.9
1321	T	21.4	Very low	23.6	Very low	142 Å²	142	144.7 Å²	144.7	87%	0.871	76%	0.755	S	S	*	*			trans	-89.3	124.5	174.1	49.8	0	0	0	0	113
1322	Q	23	Very low	23.6	Very low	190 Å²	190	148.4 Å²	148.4	89%	0.888	76%	0.758	S	S	*	*			trans	-124.4	162.7	152.6	-85.9	-171.7	-19.9	0	0	110
1323	S	22	Very low	23.7	Very low	87 Å²	87	147.4 Å²	147.4	61%	0.608	74%	0.742	S	S	*	*			trans	-50.8	145	-178.4	49.8	0	0	0	0	114.7
1324	Y	23.8	Very low	23.7	Very low	219 Å²	219	146.8 Å²	146.8	86%	0.859	73%	0.732	S	S	*	*				-176.8	89	114.1	-90.5	-59.9	0	0	0	112.1
1325	H	20.9	Very low	23.8	Very low	179 Å²	179	146.8 Å²	146.8	83%	0.829	73%	0.732	S	S	*	*			trans	-108.6	87.4	162.3	-100.3	-48.9	0	0	0	109.4
1326	H	23.6	Very low	23.8	Very low	154 Å²	154	140.9 Å²	140.9	71%	0.713	71%	0.709	S	S	*	*			trans	176.4	109.1	156.9	-98.1	-44.7	0	0	0	111.4
1327	T	23.7	Very low	23.6	Very low	107 Å²	107	136 Å²	136	66%	0.656	70%	0.697	S	S	*	*			trans	-164	12.8	151.1	7.1	0	0	0	0	117.8
1328	Y	23	Very low	23.7	Very low	206 Å²	206	135.8 Å²	135.8	81%	0.808	70%	0.696	S	S	*	*	S	Bend	trans	-103.5	65.8	171.8	-96.8	-72.5	0	0	0	113.7	L1306	L1306-Y1328 HydrophobicContact CD1-CE1 4.37Å; L1306-Y1328 HydrophobicContact CD2-CD1 3.78Å; L1306-Y1328 HydrophobicContact CD2-CE1 3.76Å
1329	S	24.7	Very low	23.7	Very low	46 Å²	46	129.7 Å²	129.7	32%	0.322	69%	0.685	S	S	.	*			trans	-159.9	2.7	169.4	53.4	0	0	0	0	116.5	R1333	S1329-R1333 WeakPolarHBondContact O-CG 3.36Å; S1329-R1333 VanDerWaalsContact OG-CZ 3.23Å; S1329-R1333 PolarHBondContact OG-NE 3.22Å; S1329-R1333 PolarHBondContact OG-NH2 3.3Å
1330	A	24.4	Very low	23.7	Very low	21 Å²	21	133.6 Å²	133.6	17%	0.174	69%	0.687	C	S	.	*	G	3₁₀ helix	trans	-64.8	-44.2	-169.9	0	0	0	0	0	114.6	K1332 R1333	A1330-K1332 PolarHBondContact O-N 2.95Å; A1330-K1332 VanDerWaalsContact O-N 3.15Å; A1330-R1333 WeakPolarHBondContact O-CB 3.49Å; A1330-R1333 PolarHBondContact O-N 2.87Å
1331	V	24.6	Very low	23.6	Very low	93 Å²	93	137.3 Å²	137.3	56%	0.564	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-64.1	-26	-172.7	-166.2	0	0	0	0	113.1	N1470	V1331-N1470 WeakPolarHBondContact CG1-OD1 3.33Å; V1331-N1470 HydrophobicContact CG2-CB 3.74Å; V1331-N1470 VanDerWaalsContact CG2-CG 3.42Å; V1331-N1470 WeakPolarHBondContact CG2-OD1 3.22Å
1332	K	25.7	Very low	23.8	Very low	185 Å²	185	137 Å²	137	80%	0.804	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-93.2	2	177.9	-142.9	165.2	-171.7	166.8	0	113.4	A1330	A1330-K1332 PolarHBondContact O-N 2.95Å; A1330-K1332 VanDerWaalsContact O-N 3.15Å
1333	R	25.7	Very low	23.8	Very low	136 Å²	136	134.1 Å²	134.1	51%	0.513	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.1	-18	-177.6	-77.4	173.6	174.2	-170.8	-1.8	115.1	S1329 A1330 L1335 S1336	S1329-R1333 WeakPolarHBondContact O-CG 3.36Å; S1329-R1333 VanDerWaalsContact OG-CZ 3.23Å; S1329-R1333 PolarHBondContact OG-NE 3.22Å; S1329-R1333 PolarHBondContact OG-NH2 3.3Å; A1330-R1333 WeakPolarHBondContact O-CB 3.49Å; A1330-R1333 PolarHBondContact O-N 2.87Å; R1333-L1335 PolarHBondContact O-N 3.36Å; R1333-L1335 VanDerWaalsContact O-N 3.17Å; R1333-S1336 WeakPolarHBondContact CA-OG 3.17Å; R1333-S1336 PolarHBondContact O-N 3.03Å; R1333-S1336 PolarHBondContact O-OG 3.29Å
1334	L	24.7	Very low	23.9	Very low	109 Å²	109	133.5 Å²	133.5	57%	0.571	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-16.3	177.8	-77.7	173.7	0	0	0	114	V1473	L1334-V1473 HydrophobicContact CD1-CG1 4.14Å
1335	L	24.5	Very low	23.9	Very low	178 Å²	178	130.4 Å²	130.4	93%	0.932	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	8	172.4	-85.5	163.7	0	0	0	114	R1333	R1333-L1335 PolarHBondContact O-N 3.36Å; R1333-L1335 VanDerWaalsContact O-N 3.17Å
1336	S	25	Very low	23.9	Very low	66 Å²	66	128.7 Å²	128.7	46%	0.462	68%	0.684	S	S	.	*			trans	-117.9	11.1	-179.1	66.7	0	0	0	0	115	R1333 W1338	R1333-S1336 WeakPolarHBondContact CA-OG 3.17Å; R1333-S1336 PolarHBondContact O-N 3.03Å; R1333-S1336 PolarHBondContact O-OG 3.29Å; S1336-W1338 PolarHBondContact O-N 3.31Å
1337	S	23.1	Very low	23.8	Very low	91 Å²	91	126.8 Å²	126.8	64%	0.636	68%	0.683	S	S	*	*			trans	-75.7	1.4	173.9	-54.4	0	0	0	0	114.2
1338	W	23	Very low	23.7	Very low	224 Å²	224	127.2 Å²	127.2	85%	0.848	69%	0.686	S	S	*	*	S	Bend	trans	-107.5	69.8	169.9	-84	47.6	0	0	0	110.5	S1336	S1336-W1338 PolarHBondContact O-N 3.31Å
1339	T	23.8	Very low	23.6	Very low	107 Å²	107	124.3 Å²	124.3	66%	0.656	68%	0.684	S	S	*	*			trans	174.3	105	146	36	0	0	0	0	108.4
1340	I	21.8	Very low	23.7	Very low	156 Å²	156	128.7 Å²	128.7	80%	0.8	71%	0.709	S	S	*	*			trans	-114	107.2	159.4	-63.3	175.3	0	0	0	106.3
1341	F	23.5	Very low	23.5	Very low	188 Å²	188	135.5 Å²	135.5	83%	0.825	74%	0.742	S	S	*	*			trans	-173.3	154.4	132.8	-114.1	-74.8	0	0	0	112.4
1342	T	26.3	Very low	23.6	Very low	136 Å²	136	134.6 Å²	134.6	83%	0.834	75%	0.752	S	S	*	*			trans	63.9	145.5	171.6	65.3	0	0	0	0	119.3
1343	S	23	Very low	23.5	Very low	129 Å²	129	132.5 Å²	132.5	90%	0.902	75%	0.754	S	S	*	*			trans	-141.9	167	-171.6	57.6	0	0	0	0	109.7
1344	G	24.3	Very low	23.4	Very low	74 Å²	74	130.6 Å²	130.6	76%	0.763	76%	0.762	S	S	*	*			trans	145.1	122.3	171.3	0	0	0	0	0	113
1345	N	21.9	Very low	23.3	Very low	154 Å²	154	131 Å²	131	82%	0.824	77%	0.769	S	S	*	*			trans	-109.1	166.6	-177.9	-87	-6.8	0	0	0	112.5
1346	N	21.6	Very low	23.3	Very low	142 Å²	142	129.6 Å²	129.6	76%	0.759	76%	0.762	S	S	*	*			trans	96.3	109.5	150	-69.2	-10.1	0	0	0	121.9
1347	V	22.1	Very low	23.2	Very low	115 Å²	115	134.8 Å²	134.8	70%	0.697	78%	0.779	S	S	*	*				88.7	130.3	118.2	175.8	0	0	0	0	120.6
1348	T	21.6	Very low	23.2	Very low	116 Å²	116	137.2 Å²	137.2	71%	0.712	79%	0.785	S	S	*	*			trans	67	125.3	163.9	44.2	0	0	0	0	122.6
1349	N	20.6	Very low	23.4	Very low	145 Å²	145	136.8 Å²	136.8	78%	0.775	79%	0.785	S	S	*	*			trans	28.4	129.5	131.4	-48.8	-5.9	0	0	0	118.4
1350	V	25.6	Very low	23.5	Very low	138 Å²	138	141 Å²	141	84%	0.836	79%	0.794	S	S	*	*				-166.3	160.6	75.4	152.1	0	0	0	0	110.2
1351	D	21.8	Very low	23.7	Very low	164 Å²	164	138.9 Å²	138.9	88%	0.877	78%	0.784	S	S	*	*			trans	-61.3	144.1	179.4	-62.8	-78.8	0	0	0	115.7
1352	G	26.5	Very low	23.9	Very low	74 Å²	74	137.8 Å²	137.8	76%	0.763	78%	0.782	S	S	*	*			trans	-158.7	146.5	169.6	0	0	0	0	0	110.3
1353	V	23.9	Very low	24.1	Very low	140 Å²	140	138.4 Å²	138.4	85%	0.848	78%	0.78	S	S	*	*			trans	-125.3	157	-163.5	176.7	0	0	0	0	112.4
1354	S	22.6	Very low	24.4	Very low	97 Å²	97	141.2 Å²	141.2	68%	0.678	77%	0.771	S	S	*	*			trans	80.8	118.3	166.8	12.7	0	0	0	0	118.9
1355	T	22.7	Very low	24.7	Very low	118 Å²	118	142.6 Å²	142.6	72%	0.724	76%	0.757	S	S	*	*				27.7	130.9	122.9	54.2	0	0	0	0	118.6
1356	D	23.6	Very low	25.1	Very low	147 Å²	147	140.1 Å²	140.1	79%	0.786	74%	0.744	S	S	*	*			cis	-148.2	154.3	11.7	-77.3	-50.1	0	0	0	111.3
1357	E	23.9	Very low	25.4	Very low	175 Å²	175	137.4 Å²	137.4	82%	0.818	73%	0.726	S	S	*	*			trans	-163.9	139.1	138.3	-122.6	174.5	-150.1	0	0	112.3
1358	N	23.6	Very low	25.8	Very low	143 Å²	143	135.6 Å²	135.6	77%	0.765	71%	0.713	S	S	*	*			trans	-87.4	175.2	159.6	-105.8	-35.2	0	0	0	109.2
1359	Y	26	Very low	26.3	Very low	214 Å²	214	134.7 Å²	134.7	84%	0.839	70%	0.699	S	S	*	*	S	Bend	trans	70	65.5	174	-63.9	-82.3	0	0	0	117.5
1360	K	26	Very low	26.8	Very low	197 Å²	197	132.1 Å²	132.1	86%	0.857	68%	0.684	S	S	*	*	S	Bend	trans	-156.6	-4.5	150.7	-113.8	145.2	-165.6	160.2	0	118.7
1361	D	25.9	Very low	26.9	Very low	110 Å²	110	132 Å²	132	59%	0.588	67%	0.669	S	S	*	*			trans	-104.6	-5.8	-164.4	-113.7	-26.6	0	0	0	117.4	N1363 R1364 E1365	D1361-N1363 VanDerWaalsContact C-N 3.29Å; D1361-N1363 PolarHBondContact O-N 3.16Å; D1361-N1363 VanDerWaalsContact O-N 3.13Å; D1361-R1364 PolarHBondContact O-N 3.48Å; D1361-E1365 PolarHBondContact O-N 3.4Å
1362	E	29.1	Very low	27.2	Very low	166 Å²	166	125.9 Å²	125.9	78%	0.776	64%	0.639	S	S	*	*	H	α-helix	trans	-57.6	-36.1	-170.9	-63.3	-164.1	128.3	0	0	114.3	L1366	E1362-L1366 PolarHBondContact O-N 3.36Å
1363	N	28.9	Very low	27.4	Very low	148 Å²	148	126.4 Å²	126.4	79%	0.791	62%	0.623	S	S	*	*	H	α-helix	trans	-77	-19.9	178.2	-79.5	-31.9	0	0	0	114.2	D1361	D1361-N1363 VanDerWaalsContact C-N 3.29Å; D1361-N1363 PolarHBondContact O-N 3.16Å; D1361-N1363 VanDerWaalsContact O-N 3.13Å
1364	R	30.6	Very low	27.5	Very low	188 Å²	188	126.9 Å²	126.9	71%	0.709	62%	0.62	S	S	*	*	H	α-helix	trans	-83.8	-44.1	169.1	-101.9	-176.9	173.2	174.1	-1.2	110.9	D1361 L1366 H1367 D1368	D1361-R1364 PolarHBondContact O-N 3.48Å; R1364-L1366 PolarHBondContact O-N 3.34Å; R1364-H1367 PolarHBondContact O-N 3.19Å; R1364-D1368 PolarHBondContact O-N 2.71Å
1365	E	29.6	Very low	27.6	Very low	103 Å²	103	131 Å²	131	48%	0.481	62%	0.621	S	S	.	*	H	α-helix	trans	-62.6	-29.9	-177.4	-146.6	-153.1	-172.2	0	0	112.2	D1361 K1369	D1361-E1365 PolarHBondContact O-N 3.4Å; E1365-K1369 HydrophobicContact CG-CD 4.24Å; E1365-K1369 WeakPolarHBondContact O-CA 3.47Å; E1365-K1369 WeakPolarHBondContact O-CB 3.37Å; E1365-K1369 WeakPolarHBondContact O-CG 3.19Å; E1365-K1369 PolarHBondContact O-N 3.15Å; E1365-K1369 WeakPolarHBondContact OE1-CE 3.36Å; E1365-K1369 IonicContact OE1-NZ 2.74Å; E1365-K1369 PolarHBondContact OE1-NZ 3.43Å; E1365-K1369 WeakPolarHBondContact OE2-CE 3.41Å; E1365-K1369 IonicContact OE2-NZ 2.61Å; E1365-K1369 PolarHBondContact OE2-NZ 3.02Å
1366	L	31.2	Very low	27.8	Very low	102 Å²	102	133.1 Å²	133.1	53%	0.534	62%	0.62	S	S	.	*	H	α-helix	trans	-67.4	-47.5	174.9	-166.9	72.4	0	0	0	112.9	E1362 R1364 K1369 I1370	E1362-L1366 PolarHBondContact O-N 3.36Å; R1364-L1366 PolarHBondContact O-N 3.34Å; L1366-K1369 PolarHBondContact O-N 3.44Å; L1366-I1370 HydrophobicContact CG-CD1 4.47Å; L1366-I1370 WeakPolarHBondContact O-CG1 3.23Å; L1366-I1370 PolarHBondContact O-N 3.39Å
1367	H	27.8	Very low	27.9	Very low	85 Å²	85	132.5 Å²	132.5	39%	0.394	61%	0.613	S	S	.	*	H	α-helix	trans	-68.7	-37.4	-179.2	-109	-74.3	0	0	0	112.1	R1364 I1370 R1371	R1364-H1367 PolarHBondContact O-N 3.19Å; H1367-I1370 PolarHBondContact O-N 3.4Å; H1367-R1371 WeakPolarHBondContact O-CB 3.48Å; H1367-R1371 PolarHBondContact O-N 3.39Å
1368	D	29.9	Very low	27.9	Very low	78 Å²	78	131.3 Å²	131.3	42%	0.417	61%	0.612	S	S	.	*	H	α-helix	trans	-80.9	-18.2	173.5	-81.4	-44.5	0	0	0	113.8	R1364 R1371 S1372	R1364-D1368 PolarHBondContact O-N 2.71Å; D1368-R1371 WeakPolarHBondContact OD1-CD 3.5Å; D1368-R1371 IonicContact OD1-CZ 3.83Å; D1368-R1371 IonicContact OD1-NE 2.82Å; D1368-R1371 IonicContact OD1-NH1 3.22Å; D1368-R1371 PolarHBondContact OD1-NH1 2.87Å; D1368-R1371 IonicContact OD2-NH1 3.89Å; D1368-S1372 WeakPolarHBondContact O-CA 3.48Å; D1368-S1372 WeakPolarHBondContact O-CB 3.22Å; D1368-S1372 PolarHBondContact O-N 3.09Å; D1368-S1372 PolarHBondContact O-OG 3.11Å
1369	K	32.3	Very low	27.8	Very low	97 Å²	97	132.9 Å²	132.9	42%	0.422	62%	0.615	S	S	.	*	H	α-helix	trans	-69.1	-40.8	162.3	-84.3	171.5	175.9	166.9	0	111.9	E1365 L1366 S1372 L1373	E1365-K1369 HydrophobicContact CG-CD 4.24Å; E1365-K1369 WeakPolarHBondContact O-CA 3.47Å; E1365-K1369 WeakPolarHBondContact O-CB 3.37Å; E1365-K1369 WeakPolarHBondContact O-CG 3.19Å; E1365-K1369 PolarHBondContact O-N 3.15Å; E1365-K1369 WeakPolarHBondContact OE1-CE 3.36Å; E1365-K1369 IonicContact OE1-NZ 2.74Å; E1365-K1369 PolarHBondContact OE1-NZ 3.43Å; E1365-K1369 WeakPolarHBondContact OE2-CE 3.41Å; E1365-K1369 IonicContact OE2-NZ 2.61Å; E1365-K1369 PolarHBondContact OE2-NZ 3.02Å; L1366-K1369 PolarHBondContact O-N 3.44Å; K1369-S1372 WeakPolarHBondContact CA-OG 3.39Å; K1369-S1372 PolarHBondContact O-N 3.33Å; K1369-S1372 PolarHBondContact O-OG 3.08Å; K1369-L1373 VanDerWaalsContact O-CB 3.29Å; K1369-L1373 WeakPolarHBondContact O-CB 3.45Å; K1369-L1373 WeakPolarHBondContact O-CD1 3.16Å; K1369-L1373 WeakPolarHBondContact O-CG 3.21Å; K1369-L1373 PolarHBondContact O-N 3.07Å
1370	I	30.9	Very low	27.6	Very low	90 Å²	90	129.1 Å²	129.1	46%	0.462	61%	0.605	S	S	.	*	H	α-helix	trans	-66.3	-44.4	173.7	-66.6	165.6	0	0	0	110.6	L1366 H1367 S1372 L1373 L1374	L1366-I1370 HydrophobicContact CG-CD1 4.47Å; L1366-I1370 WeakPolarHBondContact O-CG1 3.23Å; L1366-I1370 PolarHBondContact O-N 3.39Å; H1367-I1370 PolarHBondContact O-N 3.4Å; I1370-S1372 VanDerWaalsContact C-N 3.35Å; I1370-S1372 PolarHBondContact O-N 2.92Å; I1370-L1373 PolarHBondContact O-N 3Å; I1370-L1374 PolarHBondContact O-N 3.38Å
1371	R	27.2	Very low	27.5	Very low	137 Å²	137	126.4 Å²	126.4	52%	0.517	60%	0.6	S	S	.	*	H	α-helix	trans	-67.1	-31.6	177.3	-169	179.3	-69.5	133.7	-6	113.2	H1367 D1368	H1367-R1371 WeakPolarHBondContact O-CB 3.48Å; H1367-R1371 PolarHBondContact O-N 3.39Å; D1368-R1371 WeakPolarHBondContact OD1-CD 3.5Å; D1368-R1371 IonicContact OD1-CZ 3.83Å; D1368-R1371 IonicContact OD1-NE 2.82Å; D1368-R1371 IonicContact OD1-NH1 3.22Å; D1368-R1371 PolarHBondContact OD1-NH1 2.87Å; D1368-R1371 IonicContact OD2-NH1 3.89Å
1372	S	29.9	Very low	27.3	Very low	35 Å²	35	129.4 Å²	129.4	25%	0.245	61%	0.611	C	S	.	*	H	α-helix	trans	-84.5	-29.7	174.9	62.5	0	0	0	0	113.2	D1368 K1369 I1370 L1374 R1375 F1376	D1368-S1372 WeakPolarHBondContact O-CA 3.48Å; D1368-S1372 WeakPolarHBondContact O-CB 3.22Å; D1368-S1372 PolarHBondContact O-N 3.09Å; D1368-S1372 PolarHBondContact O-OG 3.11Å; K1369-S1372 WeakPolarHBondContact CA-OG 3.39Å; K1369-S1372 PolarHBondContact O-N 3.33Å; K1369-S1372 PolarHBondContact O-OG 3.08Å; I1370-S1372 VanDerWaalsContact C-N 3.35Å; I1370-S1372 PolarHBondContact O-N 2.92Å; S1372-L1374 PolarHBondContact O-N 2.89Å; S1372-R1375 CarbonylContact O-C 3.17Å; S1372-R1375 WeakPolarHBondContact O-CA 3.27Å; S1372-R1375 PolarHBondContact O-N 2.87Å; S1372-F1376 VanDerWaalsContact O-CB 3.32Å; S1372-F1376 WeakPolarHBondContact O-CB 3.45Å; S1372-F1376 VanDerWaalsContact O-CD2 3.28Å; S1372-F1376 WeakPolarHBondContact O-CD2 3.32Å; S1372-F1376 PolarHBondContact O-N 3.35Å
1373	L	28.9	Very low	27	Very low	84 Å²	84	131.5 Å²	131.5	44%	0.44	61%	0.611	S	S	.	*	H	α-helix	trans	-59.5	-33.9	166.8	-77.3	165.4	0	0	0	111.1	K1369 I1370 R1375	K1369-L1373 VanDerWaalsContact O-CB 3.29Å; K1369-L1373 WeakPolarHBondContact O-CB 3.45Å; K1369-L1373 WeakPolarHBondContact O-CD1 3.16Å; K1369-L1373 WeakPolarHBondContact O-CG 3.21Å; K1369-L1373 PolarHBondContact O-N 3.07Å; I1370-L1373 PolarHBondContact O-N 3Å; L1373-R1375 VanDerWaalsContact C-N 3.27Å; L1373-R1375 PolarHBondContact O-N 2.95Å
1374	L	26.7	Very low	26.5	Very low	150 Å²	150	129.4 Å²	129.4	79%	0.785	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	10.1	170	-70.6	167.3	0	0	0	114.9	I1370 S1372	I1370-L1374 PolarHBondContact O-N 3.38Å; S1372-L1374 PolarHBondContact O-N 2.89Å
1375	R	26	Very low	26.1	Very low	185 Å²	185	130.7 Å²	130.7	70%	0.698	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	-18.9	172.4	-76.1	-170.8	172	-153.4	0	114.8	S1372 L1373 E1377 N1378	S1372-R1375 CarbonylContact O-C 3.17Å; S1372-R1375 WeakPolarHBondContact O-CA 3.27Å; S1372-R1375 PolarHBondContact O-N 2.87Å; L1373-R1375 VanDerWaalsContact C-N 3.27Å; L1373-R1375 PolarHBondContact O-N 2.95Å; R1375-E1377 PolarHBondContact O-N 3.5Å; R1375-E1377 VanDerWaalsContact O-N 3.14Å; R1375-N1378 PolarHBondContact O-N 2.96Å
1376	F	24.9	Very low	25.7	Very low	161 Å²	161	131.5 Å²	131.5	71%	0.706	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-4.8	-173.9	-100.6	-63.1	0	0	0	114.4	S1372	S1372-F1376 VanDerWaalsContact O-CB 3.32Å; S1372-F1376 WeakPolarHBondContact O-CB 3.45Å; S1372-F1376 VanDerWaalsContact O-CD2 3.28Å; S1372-F1376 WeakPolarHBondContact O-CD2 3.32Å; S1372-F1376 PolarHBondContact O-N 3.35Å
1377	E	27	Very low	25.2	Very low	134 Å²	134	132.8 Å²	132.8	63%	0.626	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-7.7	167.2	-70.5	-163.4	131.5	0	0	113.9	R1375 S1399	R1375-E1377 PolarHBondContact O-N 3.5Å; R1375-E1377 VanDerWaalsContact O-N 3.14Å; E1377-S1399 WeakPolarHBondContact OE2-CB 3.18Å
1378	N	24.3	Very low	24.9	Very low	151 Å²	151	136.2 Å²	136.2	81%	0.807	67%	0.667	S	S	*	*	S	Bend	trans	-118.3	-4.1	-170.8	-88.9	-17.2	0	0	0	117.6	R1375	R1375-N1378 PolarHBondContact O-N 2.96Å
1379	E	20.8	Very low	24.5	Very low	175 Å²	175	141.3 Å²	141.3	82%	0.818	69%	0.688	S	S	*	*	S	Bend	trans	-136.3	56.8	-179.3	-72	-167.7	166.1	0	0	115.2
1380	E	21.7	Very low	24.1	Very low	135 Å²	135	141.9 Å²	141.9	63%	0.631	70%	0.703	S	S	*	*			trans	-149.4	66.5	155.1	-143	-173.1	-104.1	0	0	113.6	R159	R159-E1380 IonicContact CZ-OE2 2.8Å; R159-E1380 IonicContact NH1-OE1 3.24Å; R159-E1380 PolarHBondContact NH1-OE1 3.27Å; R159-E1380 IonicContact NH1-OE2 2.67Å; R159-E1380 PolarHBondContact NH1-OE2 3.45Å
1381	N	24.3	Very low	23.7	Very low	141 Å²	141	143.6 Å²	143.6	75%	0.754	72%	0.723	S	S	*	*			trans	-140.8	46.5	175.7	-110.3	-26.5	0	0	0	115.3	W1383	N1381-W1383 VanDerWaalsContact C-N 3.34Å; N1381-W1383 PolarHBondContact O-N 3.09Å
1382	Q	20.7	Very low	23.4	Very low	173 Å²	173	143 Å²	143	81%	0.808	74%	0.735	S	S	*	*			trans	-91.2	67	155.1	-80.9	-164.5	-3.9	0	0	110.7
1383	W	23	Very low	23.1	Very low	210 Å²	210	150.7 Å²	150.7	80%	0.795	76%	0.759	S	S	*	*			trans	-100.3	101	162.7	-81.9	91.7	0	0	0	109.2	N1381	N1381-W1383 VanDerWaalsContact C-N 3.34Å; N1381-W1383 PolarHBondContact O-N 3.09Å
1384	C	19.6	Very low	22.8	Very low	104 Å²	104	152.6 Å²	152.6	70%	0.703	78%	0.779	S	S	*	*			trans	-107.2	132.1	-173.3	-142	0	0	0	0	109.8
1385	Y	21.3	Very low	22.6	Very low	215 Å²	215	150.1 Å²	150.1	84%	0.843	78%	0.775	S	S	*	*	S	Bend	trans	72.8	150	172.6	-74.4	-103.7	0	0	0	118.7
1386	C	20.7	Very low	22.5	Very low	120 Å²	120	145.2 Å²	145.2	81%	0.811	77%	0.774	S	S	*	*			trans	81.4	57.6	173.6	-55.2	0	0	0	0	118.2
1387	C	22.4	Very low	22.5	Very low	129 Å²	129	143.2 Å²	143.2	87%	0.872	78%	0.775	S	S	*	*			trans	-164.7	86.6	140.8	-98.4	0	0	0	0	110.9	H1389	C1387-H1389 PolarHBondContact O-N 3.22Å
1388	D	20.5	Very low	22.4	Very low	157 Å²	157	142 Å²	142	84%	0.84	77%	0.771	S	S	*	*			trans	-80.7	108.5	164.4	-76	-60.1	0	0	0	109.5
1389	H	22.7	Very low	22.8	Very low	185 Å²	185	135.9 Å²	135.9	86%	0.856	74%	0.739	S	S	*	*			trans	164.9	158.5	141.1	-89.4	-61.2	0	0	0	112	C1387	C1387-H1389 PolarHBondContact O-N 3.22Å
1390	S	23.1	Very low	23.6	Very low	108 Å²	108	132 Å²	132	76%	0.755	72%	0.724	S	S	*	*			trans	64.9	86.2	177.8	65.3	0	0	0	0	117.2	T1392	S1390-T1392 PolarHBondContact O-N 2.96Å
1391	S	21.6	Very low	24.2	Very low	126 Å²	126	129 Å²	129	88%	0.881	72%	0.715	S	S	*	*			trans	-84.5	75.8	174.1	56.9	0	0	0	0	112.7
1392	T	21.8	Very low	24.7	Very low	124 Å²	124	125.3 Å²	125.3	76%	0.761	70%	0.695	S	S	*	*			trans	-137.5	50.1	176.3	52.5	0	0	0	0	113.8	S1390	S1390-T1392 PolarHBondContact O-N 2.96Å
1393	R	23.2	Very low	25.3	Very low	197 Å²	197	121.7 Å²	121.7	74%	0.743	68%	0.677	S	S	*	*			trans	-174	123.9	157.5	-110.4	162.4	178.2	-179	-2	112.2	T1725	R1393-T1725 PolarHBondContact NH2-OG1 3Å
1394	S	22.2	Very low	25.8	Very low	124 Å²	124	113.1 Å²	113.1	87%	0.867	65%	0.649	S	S	*	*			trans	-138.7	49.6	163.2	61.4	0	0	0	0	110.5
1395	S	22.8	Very low	26.5	Very low	99 Å²	99	110.4 Å²	110.4	69%	0.692	63%	0.627	S	S	*	*			trans	-119.5	31.9	-179.4	62.6	0	0	0	0	112.5
1396	A	23.7	Very low	27.1	Very low	82 Å²	82	104.6 Å²	104.6	68%	0.678	61%	0.606	S	S	*	*			trans	-148.3	133.8	161.9	0	0	0	0	0	105.9
1397	T	25.6	Very low	27.8	Very low	119 Å²	119	100.6 Å²	100.6	73%	0.73	58%	0.582	S	S	*	*			cis	-128.1	120	21.9	46.8	0	0	0	0	113.4
1398	M	24.6	Very low	28.6	Very low	109 Å²	109	95.9 Å²	95.9	54%	0.537	55%	0.547	S	S	.	.	S	Bend	trans	-113.9	150.4	151.9	-75.1	179.7	72.7	0	0	107.8	D1402 K1403 F1406	M1398-D1402 HydrophobicContact CE-CB 4.35Å; M1398-K1403 WeakPolarHBondContact O-CE 3.37Å; M1398-F1406 HydrophobicContact CE-CD2 4.29Å; M1398-F1406 HydrophobicContact CE-CE2 3.84Å
1399	S	33	Very low	29.4	Very low	22 Å²	22	92.8 Å²	92.8	15%	0.154	53%	0.527	C	S	.	.			trans	-54.9	143.4	-179.8	91.9	0	0	0	0	110.3	E1377 V1401 D1402	E1377-S1399 WeakPolarHBondContact OE2-CB 3.18Å; S1399-V1401 PolarHBondContact O-N 3.2Å; S1399-V1401 PolarHBondContact OG-N 3.11Å; S1399-D1402 WeakPolarHBondContact CB-OD2 3.42Å; S1399-D1402 PolarHBondContact O-N 3.22Å; S1399-D1402 PolarHBondContact OG-N 3.14Å; S1399-D1402 VanDerWaalsContact OG-N 3.14Å; S1399-D1402 PolarHBondContact OG-OD2 3.16Å
1400	N	38.2	Very low	30.2	Very low	94 Å²	94	86.1 Å²	86.1	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-74.7	-7.2	178.7	-71	-42	0	0	0	112.6	K418 K1403 S1404	K418-N1400 PolarHBondContact NZ-O 2.87Å; N1400-K1403 PolarHBondContact OD1-NZ 2.87Å; N1400-S1404 PolarHBondContact O-OG 2.73Å
1401	V	32.6	Very low	31	Very low	72 Å²	72	81.9 Å²	81.9	44%	0.436	47%	0.467	S	S	.	.	H	α-helix	trans	-76.9	-46.5	171.5	-179.8	0	0	0	0	109.9	S1399 K1403 S1404 I1405	S1399-V1401 PolarHBondContact O-N 3.2Å; S1399-V1401 PolarHBondContact OG-N 3.11Å; V1401-K1403 VanDerWaalsContact C-N 3.26Å; V1401-K1403 PolarHBondContact O-N 3.37Å; V1401-S1404 PolarHBondContact O-N 3.42Å; V1401-S1404 VanDerWaalsContact O-N 3.15Å; V1401-S1404 PolarHBondContact O-OG 2.88Å; V1401-I1405 HydrophobicContact CG1-CD1 4.24Å; V1401-I1405 PolarHBondContact O-N 2.66Å
1402	D	35.2	Very low	31.9	Very low	63 Å²	63	78.5 Å²	78.5	34%	0.337	44%	0.439	S	S	.	.	H	α-helix	trans	-56.6	-41	177.7	-63	-47.8	0	0	0	111.3	M1398 S1399 S1404 I1405 F1406	M1398-D1402 HydrophobicContact CE-CB 4.35Å; S1399-D1402 WeakPolarHBondContact CB-OD2 3.42Å; S1399-D1402 PolarHBondContact O-N 3.22Å; S1399-D1402 PolarHBondContact OG-N 3.14Å; S1399-D1402 VanDerWaalsContact OG-N 3.14Å; S1399-D1402 PolarHBondContact OG-OD2 3.16Å; D1402-S1404 VanDerWaalsContact C-N 3.29Å; D1402-S1404 PolarHBondContact O-N 2.93Å; D1402-I1405 CarbonylContact O-C 3.57Å; D1402-I1405 WeakPolarHBondContact O-CA 3.46Å; D1402-I1405 WeakPolarHBondContact O-CB 3.42Å; D1402-I1405 PolarHBondContact O-N 2.73Å; D1402-F1406 HydrophobicContact CB-CD2 4.2Å; D1402-F1406 HydrophobicContact CB-CE2 4.49Å; D1402-F1406 WeakPolarHBondContact O-CB 3.45Å; D1402-F1406 WeakPolarHBondContact O-CD2 3.39Å; D1402-F1406 PolarHBondContact O-N 2.94Å
1403	K	34.4	Very low	32.9	Very low	96 Å²	96	74.3 Å²	74.3	42%	0.417	41%	0.411	S	S	.	.	H	α-helix	trans	-58.7	-35.8	-179.8	-66.2	176.3	-166.2	162.8	0	113.8	M1398 N1400 V1401 A1407	M1398-K1403 WeakPolarHBondContact O-CE 3.37Å; N1400-K1403 PolarHBondContact OD1-NZ 2.87Å; V1401-K1403 VanDerWaalsContact C-N 3.26Å; V1401-K1403 PolarHBondContact O-N 3.37Å; K1403-A1407 VanDerWaalsContact O-CB 3.32Å; K1403-A1407 WeakPolarHBondContact O-CB 3.19Å; K1403-A1407 PolarHBondContact O-N 3.13Å
1404	S	33.4	Very low	34.1	Very low	31 Å²	31	66.3 Å²	66.3	22%	0.217	38%	0.382	C	S	.	.	H	α-helix	trans	-70.2	-36.8	173.5	16.2	0	0	0	0	112.1	K418 N1400 V1401 D1402 F1408	K418-S1404 PolarHBondContact NZ-OG 2.79Å; N1400-S1404 PolarHBondContact O-OG 2.73Å; V1401-S1404 PolarHBondContact O-N 3.42Å; V1401-S1404 VanDerWaalsContact O-N 3.15Å; V1401-S1404 PolarHBondContact O-OG 2.88Å; D1402-S1404 VanDerWaalsContact C-N 3.29Å; D1402-S1404 PolarHBondContact O-N 2.93Å; S1404-F1408 PolarHBondContact O-N 2.9Å
1405	I	34.3	Very low	35.3	Very low	46 Å²	46	61.8 Å²	61.8	24%	0.236	35%	0.347	C	S	.	.	H	α-helix	trans	-69.2	-42.8	176	-64.1	171.4	0	0	0	110.4	V1401 D1402 F1408 Q1409	V1401-I1405 HydrophobicContact CG1-CD1 4.24Å; V1401-I1405 PolarHBondContact O-N 2.66Å; D1402-I1405 CarbonylContact O-C 3.57Å; D1402-I1405 WeakPolarHBondContact O-CA 3.46Å; D1402-I1405 WeakPolarHBondContact O-CB 3.42Å; D1402-I1405 PolarHBondContact O-N 2.73Å; I1405-F1408 PolarHBondContact O-N 2.97Å; I1405-Q1409 VanDerWaalsContact O-CB 3.26Å; I1405-Q1409 WeakPolarHBondContact O-CB 3.33Å; I1405-Q1409 PolarHBondContact O-N 2.75Å
1406	F	34	Very low	36.5	Very low	93 Å²	93	58.7 Å²	58.7	41%	0.408	33%	0.328	S	S	.	.	H	α-helix	trans	-66.8	-37.1	174.2	-89.7	-79.4	0	0	0	112.5	M1398 D1402 F1408 Q1409 N1410	M1398-F1406 HydrophobicContact CE-CD2 4.29Å; M1398-F1406 HydrophobicContact CE-CE2 3.84Å; D1402-F1406 HydrophobicContact CB-CD2 4.2Å; D1402-F1406 HydrophobicContact CB-CE2 4.49Å; D1402-F1406 WeakPolarHBondContact O-CB 3.45Å; D1402-F1406 WeakPolarHBondContact O-CD2 3.39Å; D1402-F1406 PolarHBondContact O-N 2.94Å; F1406-F1408 VanDerWaalsContact C-N 3.35Å; F1406-F1408 PolarHBondContact O-N 3.02Å; F1406-Q1409 PolarHBondContact O-N 2.96Å; F1406-N1410 WeakPolarHBondContact O-CB 3.18Å; F1406-N1410 PolarHBondContact O-N 2.83Å; F1406-N1410 PolarHBondContact O-ND2 3.17Å
1407	A	34.4	Very low	37.9	Very low	36 Å²	36	59.9 Å²	59.9	30%	0.298	32%	0.315	S	S	.	.	H	α-helix	trans	-59.1	-46.6	172.2	0	0	0	0	0	110.9	K1403 N1410 V1411	K1403-A1407 VanDerWaalsContact O-CB 3.32Å; K1403-A1407 WeakPolarHBondContact O-CB 3.19Å; K1403-A1407 PolarHBondContact O-N 3.13Å; A1407-N1410 WeakPolarHBondContact O-CB 3.19Å; A1407-N1410 PolarHBondContact O-N 2.8Å; A1407-V1411 WeakPolarHBondContact O-CG2 3.5Å; A1407-V1411 PolarHBondContact O-N 2.93Å
1408	F	38.9	Very low	39.3	Very low	30 Å²	30	55 Å²	55	13%	0.132	29%	0.285	C	S	.	.	H	α-helix	trans	-70	-36.9	176.9	-171.1	-114.5	0	0	0	113.5	V374 K378 I429 S1404 I1405 F1406 N1410 V1411 I1412	V374-F1408 HydrophobicContact CG1-CE1 3.98Å; V374-F1408 HydrophobicContact CG1-CZ 3.93Å; K378-F1408 HydrophobicContact CB-CD1 4.27Å; K378-F1408 HydrophobicContact CB-CE1 3.85Å; K378-F1408 HydrophobicContact CD-CD1 4.03Å; K378-F1408 HydrophobicContact CD-CE1 4.23Å; K378-F1408 HydrophobicContact CG-CD1 4.01Å; K378-F1408 HydrophobicContact CG-CE1 4.11Å; I429-F1408 HydrophobicContact CB-CE2 4.45Å; I429-F1408 HydrophobicContact CD1-CD2 4.27Å; I429-F1408 HydrophobicContact CD1-CE2 4.36Å; I429-F1408 HydrophobicContact CG2-CD2 4.44Å; I429-F1408 HydrophobicContact CG2-CE2 3.54Å; I429-F1408 HydrophobicContact CG2-CZ 3.68Å; S1404-F1408 PolarHBondContact O-N 2.9Å; I1405-F1408 PolarHBondContact O-N 2.97Å; F1406-F1408 VanDerWaalsContact C-N 3.35Å; F1406-F1408 PolarHBondContact O-N 3.02Å; F1408-N1410 VanDerWaalsContact C-N 3.31Å; F1408-N1410 PolarHBondContact O-N 2.9Å; F1408-V1411 HydrophobicContact CD2-CB 4.45Å; F1408-V1411 WeakPolarHBondContact O-CB 3.35Å; F1408-V1411 PolarHBondContact O-N 2.61Å; F1408-V1411 VanDerWaalsContact O-N 3.13Å; F1408-I1412 HydrophobicContact CD1-CD1 3.9Å; F1408-I1412 HydrophobicContact CE1-CD1 3.61Å; F1408-I1412 HydrophobicContact CE1-CG1 4.25Å; F1408-I1412 HydrophobicContact CZ-CD1 4.17Å; F1408-I1412 HydrophobicContact CZ-CG1 4.36Å; F1408-I1412 WeakPolarHBondContact O-CG1 3.1Å; F1408-I1412 PolarHBondContact O-N 3.18Å
1409	Q	38	Very low	41	Very low	92 Å²	92	51.3 Å²	51.3	43%	0.43	27%	0.265	S	S	.	.	H	α-helix	trans	-67.8	-33.8	175.5	-167.4	159.4	-26.9	0	0	111.5	I1405 F1406 Q1413	I1405-Q1409 VanDerWaalsContact O-CB 3.26Å; I1405-Q1409 WeakPolarHBondContact O-CB 3.33Å; I1405-Q1409 PolarHBondContact O-N 2.75Å; F1406-Q1409 PolarHBondContact O-N 2.96Å; Q1409-Q1413 WeakPolarHBondContact O-CB 3.25Å; Q1409-Q1413 PolarHBondContact O-N 3.38Å
1410	N	39.1	Very low	42.7	Very low	46 Å²	46	51 Å²	51	25%	0.246	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-44.6	166.2	-70.7	-18.3	0	0	0	110.7	F1406 A1407 F1408 I1412 Q1413 H1414	F1406-N1410 WeakPolarHBondContact O-CB 3.18Å; F1406-N1410 PolarHBondContact O-N 2.83Å; F1406-N1410 PolarHBondContact O-ND2 3.17Å; A1407-N1410 WeakPolarHBondContact O-CB 3.19Å; A1407-N1410 PolarHBondContact O-N 2.8Å; F1408-N1410 VanDerWaalsContact C-N 3.31Å; F1408-N1410 PolarHBondContact O-N 2.9Å; N1410-I1412 VanDerWaalsContact C-N 3.34Å; N1410-I1412 PolarHBondContact O-N 2.68Å; N1410-Q1413 CarbonylContact O-C 3.43Å; N1410-Q1413 PolarHBondContact O-N 2.72Å; N1410-Q1413 VanDerWaalsContact O-N 3.12Å; N1410-H1414 WeakPolarHBondContact O-CB 3.34Å; N1410-H1414 PolarHBondContact O-CD2 2.82Å; N1410-H1414 PolarHBondContact O-N 3.09Å
1411	V	40.1	Very low	44.3	Very low	18 Å²	18	46.5 Å²	46.5	11%	0.109	24%	0.237	C	C	.	.	H	α-helix	trans	-53.1	-49.9	173.8	169.2	0	0	0	0	111.4	A1407 F1408 Q1413 H1414 M1415 L1732	A1407-V1411 WeakPolarHBondContact O-CG2 3.5Å; A1407-V1411 PolarHBondContact O-N 2.93Å; F1408-V1411 HydrophobicContact CD2-CB 4.45Å; F1408-V1411 WeakPolarHBondContact O-CB 3.35Å; F1408-V1411 PolarHBondContact O-N 2.61Å; F1408-V1411 VanDerWaalsContact O-N 3.13Å; V1411-Q1413 PolarHBondContact O-N 3.1Å; V1411-H1414 PolarHBondContact O-N 2.85Å; V1411-M1415 HydrophobicContact CG1-CG 4.44Å; V1411-M1415 HydrophobicContact CG1-SD 3.96Å; V1411-M1415 WeakPolarHBondContact O-CB 3.46Å; V1411-M1415 WeakPolarHBondContact O-CG 3.09Å; V1411-M1415 PolarHBondContact O-N 3.13Å; V1411-L1732 HydrophobicContact CB-CD2 4.46Å; V1411-L1732 HydrophobicContact CG2-CB 4.32Å; V1411-L1732 HydrophobicContact CG2-CD1 3.85Å; V1411-L1732 HydrophobicContact CG2-CD2 3.85Å; V1411-L1732 HydrophobicContact CG2-CG 4.23Å
1412	I	41.1	Very low	46.3	Very low	55 Å²	55	43.1 Å²	43.1	28%	0.282	22%	0.216	S	C	.	.	H	α-helix	trans	-60.6	-45.6	176.4	-62.6	164.2	0	0	0	110.9	V374 F1408 N1410 H1414 M1415 A1416	V374-I1412 HydrophobicContact CG1-CD1 3.53Å; V374-I1412 HydrophobicContact CG1-CG1 3.98Å; F1408-I1412 HydrophobicContact CD1-CD1 3.9Å; F1408-I1412 HydrophobicContact CE1-CD1 3.61Å; F1408-I1412 HydrophobicContact CE1-CG1 4.25Å; F1408-I1412 HydrophobicContact CZ-CD1 4.17Å; F1408-I1412 HydrophobicContact CZ-CG1 4.36Å; F1408-I1412 WeakPolarHBondContact O-CG1 3.1Å; F1408-I1412 PolarHBondContact O-N 3.18Å; N1410-I1412 VanDerWaalsContact C-N 3.34Å; N1410-I1412 PolarHBondContact O-N 2.68Å; I1412-H1414 VanDerWaalsContact C-N 3.33Å; I1412-H1414 PolarHBondContact O-N 3.21Å; I1412-M1415 PolarHBondContact O-N 3.37Å; I1412-A1416 WeakPolarHBondContact O-CB 3.45Å; I1412-A1416 PolarHBondContact O-N 2.61Å
1413	Q	42.7	Very low	48	Very low	37 Å²	37	41.8 Å²	41.8	17%	0.173	21%	0.209	C	C	.	.	H	α-helix	trans	-68.3	-30.1	179.6	-169.1	174.1	11.1	0	0	113	Q1409 N1410 V1411 R1417	Q1409-Q1413 WeakPolarHBondContact O-CB 3.25Å; Q1409-Q1413 PolarHBondContact O-N 3.38Å; N1410-Q1413 CarbonylContact O-C 3.43Å; N1410-Q1413 PolarHBondContact O-N 2.72Å; N1410-Q1413 VanDerWaalsContact O-N 3.12Å; V1411-Q1413 PolarHBondContact O-N 3.1Å; Q1413-R1417 WeakPolarHBondContact O-CD 3.27Å; Q1413-R1417 VanDerWaalsContact O-CG 3.27Å; Q1413-R1417 WeakPolarHBondContact O-CG 3.37Å; Q1413-R1417 PolarHBondContact O-N 3.19Å
1414	H	47.5	Very low	50	Low	29 Å²	29	37.3 Å²	37.3	13%	0.134	19%	0.189	C	C	.	.	H	α-helix	trans	-73	-45	172	-85.5	-91.6	0	0	0	110.2	N1410 V1411 I1412 A1416 R1417 V1418 L1732	N1410-H1414 WeakPolarHBondContact O-CB 3.34Å; N1410-H1414 PolarHBondContact O-CD2 2.82Å; N1410-H1414 PolarHBondContact O-N 3.09Å; V1411-H1414 PolarHBondContact O-N 2.85Å; I1412-H1414 VanDerWaalsContact C-N 3.33Å; I1412-H1414 PolarHBondContact O-N 3.21Å; H1414-A1416 VanDerWaalsContact C-N 3.34Å; H1414-A1416 PolarHBondContact O-N 3.47Å; H1414-R1417 CarbonylContact O-C 3.56Å; H1414-R1417 WeakPolarHBondContact O-CA 3.17Å; H1414-R1417 WeakPolarHBondContact O-CB 3.36Å; H1414-R1417 PolarHBondContact O-N 3.18Å; H1414-V1418 WeakPolarHBondContact O-CB 3.43Å; H1414-V1418 WeakPolarHBondContact O-CG2 3Å; H1414-V1418 PolarHBondContact O-N 2.86Å; H1414-L1732 HydrophobicContact CB-CD2 3.77Å
1415	M	48.1	Very low	52	Low	29 Å²	29	35.8 Å²	35.8	14%	0.143	18%	0.179	C	C	.	.	H	α-helix	trans	-57.6	-44.5	172.6	-71.8	176	111.6	0	0	111.7	I449 V1411 I1412 R1417 V1418 Y1419	I449-M1415 HydrophobicContact CG1-CE 4.08Å; V1411-M1415 HydrophobicContact CG1-CG 4.44Å; V1411-M1415 HydrophobicContact CG1-SD 3.96Å; V1411-M1415 WeakPolarHBondContact O-CB 3.46Å; V1411-M1415 WeakPolarHBondContact O-CG 3.09Å; V1411-M1415 PolarHBondContact O-N 3.13Å; I1412-M1415 PolarHBondContact O-N 3.37Å; M1415-R1417 PolarHBondContact O-N 3.37Å; M1415-V1418 WeakPolarHBondContact O-CB 3.24Å; M1415-V1418 PolarHBondContact O-N 3.48Å; M1415-Y1419 HydrophobicContact CB-CD2 4.33Å; M1415-Y1419 HydrophobicContact CB-CE2 3.92Å; M1415-Y1419 HydrophobicContact CE-CE2 4.44Å; M1415-Y1419 HydrophobicContact CG-CE2 4.37Å; M1415-Y1419 WeakPolarHBondContact O-CD2 3.23Å; M1415-Y1419 PolarHBondContact O-N 3.4Å
1416	A	47.6	Very low	53.9	Low	34 Å²	34	34.7 Å²	34.7	28%	0.281	17%	0.173	S	C	.	.	H	α-helix	trans	-63.6	-26.1	175.3	0	0	0	0	0	113.8	I1412 H1414	I1412-A1416 WeakPolarHBondContact O-CB 3.45Å; I1412-A1416 PolarHBondContact O-N 2.61Å; H1414-A1416 VanDerWaalsContact C-N 3.34Å; H1414-A1416 PolarHBondContact O-N 3.47Å
1417	R	52	Low	55.7	Low	107 Å²	107	32.6 Å²	32.6	40%	0.404	17%	0.166	S	C	.	.	H	α-helix	trans	-80.3	-43.8	170.6	-75	166.4	169.2	157.9	-4.7	112.1	Q1413 H1414 M1415 Y1419 H1420 I1423	Q1413-R1417 WeakPolarHBondContact O-CD 3.27Å; Q1413-R1417 VanDerWaalsContact O-CG 3.27Å; Q1413-R1417 WeakPolarHBondContact O-CG 3.37Å; Q1413-R1417 PolarHBondContact O-N 3.19Å; H1414-R1417 CarbonylContact O-C 3.56Å; H1414-R1417 WeakPolarHBondContact O-CA 3.17Å; H1414-R1417 WeakPolarHBondContact O-CB 3.36Å; H1414-R1417 PolarHBondContact O-N 3.18Å; M1415-R1417 PolarHBondContact O-N 3.37Å; R1417-Y1419 VanDerWaalsContact C-N 3.33Å; R1417-Y1419 PolarHBondContact O-N 3.39Å; R1417-H1420 WeakPolarHBondContact O-CB 3.36Å; R1417-H1420 PolarHBondContact O-N 3.04Å; R1417-H1420 VanDerWaalsContact O-N 3.12Å; R1417-I1423 WeakPolarHBondContact O-CD1 3.4Å
1418	V	55	Low	57.6	Low	17 Å²	17	31.1 Å²	31.1	10%	0.103	15%	0.153	C	C	.	.	H	α-helix	trans	-54.3	-49.1	177.4	168.7	0	0	0	0	110.4	L221 L224 H1414 M1415 H1420	L221-V1418 HydrophobicContact CD2-CB 3.91Å; L221-V1418 HydrophobicContact CD2-CG1 3.8Å; L221-V1418 HydrophobicContact CD2-CG2 3.49Å; L221-V1418 VanDerWaalsContact CD2-CG2 3.49Å; L224-V1418 HydrophobicContact CD1-CG1 3.88Å; H1414-V1418 WeakPolarHBondContact O-CB 3.43Å; H1414-V1418 WeakPolarHBondContact O-CG2 3Å; H1414-V1418 PolarHBondContact O-N 2.86Å; M1415-V1418 WeakPolarHBondContact O-CB 3.24Å; M1415-V1418 PolarHBondContact O-N 3.48Å; V1418-H1420 PolarHBondContact O-N 3.24Å
1419	Y	61.3	Low	59.2	Low	31 Å²	31	29.9 Å²	29.9	12%	0.122	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	11.4	-177.8	-53.7	-47.6	0	0	0	113.8	L279 L448 M1415 R1417	L279-Y1419 WeakPolarHBondContact CD1-O 3.49Å; L448-Y1419 HydrophobicContact CB-CE1 4.18Å; L448-Y1419 HydrophobicContact CD1-CD1 4.08Å; L448-Y1419 HydrophobicContact CD1-CE1 3.96Å; L448-Y1419 HydrophobicContact CD1-CG 4.47Å; L448-Y1419 HydrophobicContact CD2-CD1 4.42Å; L448-Y1419 HydrophobicContact CD2-CE1 3.94Å; L448-Y1419 HydrophobicContact CG-CE1 4.25Å; M1415-Y1419 HydrophobicContact CB-CD2 4.33Å; M1415-Y1419 HydrophobicContact CB-CE2 3.92Å; M1415-Y1419 HydrophobicContact CE-CE2 4.44Å; M1415-Y1419 HydrophobicContact CG-CE2 4.37Å; M1415-Y1419 WeakPolarHBondContact O-CD2 3.23Å; M1415-Y1419 PolarHBondContact O-N 3.4Å; R1417-Y1419 VanDerWaalsContact C-N 3.33Å; R1417-Y1419 PolarHBondContact O-N 3.39Å
1420	H	68.6	Low	60.6	Low	15 Å²	15	29 Å²	29	7%	0.069	15%	0.152	C	C	.	.			trans	-71.6	126.4	178.2	-174.4	-78.3	0	0	0	111.2	H282 R1417 V1418 C1422 I1423 I1424 I1452 T1453	H282-H1420 AromaticContact ND1-CD2 3.85Å; R1417-H1420 WeakPolarHBondContact O-CB 3.36Å; R1417-H1420 PolarHBondContact O-N 3.04Å; R1417-H1420 VanDerWaalsContact O-N 3.12Å; V1418-H1420 PolarHBondContact O-N 3.24Å; H1420-C1422 VanDerWaalsContact C-N 3.28Å; H1420-C1422 WeakPolarHBondContact ND1-CB 3.46Å; H1420-C1422 PolarHBondContact ND1-N 3.26Å; H1420-C1422 PolarHBondContact O-N 3.11Å; H1420-I1423 PolarHBondContact O-N 3.44Å; H1420-I1424 PolarHBondContact O-N 2.73Å; H1420-I1452 VanDerWaalsContact CE1-CG2 3.44Å; H1420-I1452 WeakPolarHBondContact CE1-CG2 3.23Å; H1420-T1453 HydrophobicContact CB-CG2 4.48Å
1421	P	72.2	Confident	62	Low	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-57.1	-33	-169.4	19	-32.5	0	0	0	114.9	Y267 F269 H282 I1424 T1425	Y267-P1421 HydrophobicContact CD1-CB 4.29Å; Y267-P1421 HydrophobicContact CD1-CG 3.81Å; Y267-P1421 HydrophobicContact CE1-CG 3.75Å; F269-P1421 HydrophobicContact CE2-CB 4.23Å; F269-P1421 HydrophobicContact CZ-CB 4.44Å; H282-P1421 HydrophobicContact CB-CG 4.02Å; P1421-I1424 PolarHBondContact O-N 3.31Å; P1421-T1425 PolarHBondContact O-N 3.43Å; P1421-T1425 PolarHBondContact O-OG1 3.02Å
1422	C	73.8	Confident	63.3	Low	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.5	-45.3	174.4	-176	0	0	0	0	112.9	L265 H1420 T1425 L1426 I1452	L265-C1422 HydrophobicContact CD1-CB 4.3Å; L265-C1422 HydrophobicContact CD2-CB 4.15Å; H1420-C1422 VanDerWaalsContact C-N 3.28Å; H1420-C1422 WeakPolarHBondContact ND1-CB 3.46Å; H1420-C1422 PolarHBondContact ND1-N 3.26Å; H1420-C1422 PolarHBondContact O-N 3.11Å; C1422-T1425 WeakPolarHBondContact CA-OG1 3.31Å; C1422-T1425 PolarHBondContact O-N 3.31Å; C1422-T1425 PolarHBondContact O-OG1 3.45Å; C1422-L1426 WeakPolarHBondContact O-CG 3.48Å; C1422-L1426 PolarHBondContact O-N 3.14Å; C1422-I1452 HydrophobicContact CB-CD1 4.3Å; C1422-I1452 HydrophobicContact CB-CG2 4.31Å
1423	I	72.2	Confident	64.4	Low	35 Å²	35	35.3 Å²	35.3	18%	0.179	17%	0.172	C	C	.	.	H	α-helix	trans	-68.7	-41.6	-179.2	-69.9	169.1	0	0	0	109.7	R1417 H1420 T1425 L1426 L1427 I1449 T1453	R1417-I1423 WeakPolarHBondContact O-CD1 3.4Å; H1420-I1423 PolarHBondContact O-N 3.44Å; I1423-T1425 VanDerWaalsContact C-N 3.34Å; I1423-T1425 PolarHBondContact O-N 3Å; I1423-L1426 PolarHBondContact O-N 3.41Å; I1423-L1427 HydrophobicContact CG2-CD1 3.99Å; I1423-L1427 PolarHBondContact O-N 3.16Å; I1423-I1449 HydrophobicContact CG1-CG2 4.34Å; I1423-T1453 HydrophobicContact CD1-CG2 4.22Å
1424	I	74.9	Confident	65	Low	2 Å²	2	39 Å²	39	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-55.7	-47.3	171.9	-60.9	172.5	0	0	0	110.8	I225 L228 F269 L279 H1420 P1421 L1426 L1427 M1428	I225-I1424 HydrophobicContact CD1-CG1 3.83Å; I225-I1424 HydrophobicContact CG1-CG1 4.19Å; I225-I1424 HydrophobicContact CG2-CB 4.5Å; I225-I1424 HydrophobicContact CG2-CG2 4.04Å; L228-I1424 HydrophobicContact CD1-CD1 4.39Å; L228-I1424 HydrophobicContact CD1-CG2 4.09Å; F269-I1424 HydrophobicContact CD1-CG2 3.88Å; F269-I1424 HydrophobicContact CE1-CB 4.37Å; F269-I1424 HydrophobicContact CE1-CG2 3.42Å; F269-I1424 VanDerWaalsContact CE1-CG2 3.42Å; F269-I1424 HydrophobicContact CE2-CG2 4.39Å; F269-I1424 HydrophobicContact CZ-CB 4.21Å; F269-I1424 HydrophobicContact CZ-CG2 3.72Å; L279-I1424 HydrophobicContact CD1-CD1 3.46Å; L279-I1424 VanDerWaalsContact CD1-CD1 3.46Å; H1420-I1424 PolarHBondContact O-N 2.73Å; P1421-I1424 PolarHBondContact O-N 3.31Å; I1424-L1426 VanDerWaalsContact C-N 3.34Å; I1424-L1426 PolarHBondContact O-N 3.43Å; I1424-L1427 PolarHBondContact O-N 3.35Å; I1424-M1428 HydrophobicContact CG2-SD 4.38Å; I1424-M1428 WeakPolarHBondContact O-CB 3.42Å; I1424-M1428 VanDerWaalsContact O-CG 3.31Å; I1424-M1428 WeakPolarHBondContact O-CG 3.43Å; I1424-M1428 PolarHBondContact O-N 3.19Å
1425	T	76.2	Confident	65.2	Low	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-69	-25.6	179.2	42.4	0	0	0	0	115.5	F241 W242 P266 F269 P1421 C1422 I1423 H1429	F241-T1425 VanDerWaalsContact CE1-OG1 3.27Å; F241-T1425 WeakPolarHBondContact CE1-OG1 3.37Å; W242-T1425 PolarHBondContact NE1-O 3.22Å; P266-T1425 HydrophobicContact CG-CG2 3.29Å; F269-T1425 HydrophobicContact CZ-CG2 4.37Å; P1421-T1425 PolarHBondContact O-N 3.43Å; P1421-T1425 PolarHBondContact O-OG1 3.02Å; C1422-T1425 WeakPolarHBondContact CA-OG1 3.31Å; C1422-T1425 PolarHBondContact O-N 3.31Å; C1422-T1425 PolarHBondContact O-OG1 3.45Å; I1423-T1425 VanDerWaalsContact C-N 3.34Å; I1423-T1425 PolarHBondContact O-N 3Å; T1425-H1429 PolarHBondContact O-N 3.19Å; T1425-H1429 VanDerWaalsContact O-N 3.16Å
1426	L	74.2	Confident	65.6	Low	22 Å²	22	47.1 Å²	47.1	12%	0.115	24%	0.237	C	C	.	.	H	α-helix	trans	-76.9	-42.6	175.4	-72.2	167.7	0	0	0	111	F241 C1422 I1423 I1424 M1428 H1429 S1430 L1438 I1449	F241-L1426 HydrophobicContact CE1-CD2 4.07Å; F241-L1426 HydrophobicContact CE1-CG 4.15Å; F241-L1426 HydrophobicContact CZ-CD2 4.34Å; F241-L1426 HydrophobicContact CZ-CG 4.38Å; C1422-L1426 WeakPolarHBondContact O-CG 3.48Å; C1422-L1426 PolarHBondContact O-N 3.14Å; I1423-L1426 PolarHBondContact O-N 3.41Å; I1424-L1426 VanDerWaalsContact C-N 3.34Å; I1424-L1426 PolarHBondContact O-N 3.43Å; L1426-M1428 VanDerWaalsContact C-N 3.28Å; L1426-M1428 PolarHBondContact O-N 3.47Å; L1426-H1429 WeakPolarHBondContact O-CA 3.07Å; L1426-H1429 VanDerWaalsContact O-CB 3.27Å; L1426-H1429 WeakPolarHBondContact O-CB 3.46Å; L1426-H1429 PolarHBondContact O-N 3.1Å; L1426-S1430 PolarHBondContact O-N 2.84Å; L1426-L1438 HydrophobicContact CD2-CD1 4.44Å; L1426-I1449 HydrophobicContact CD1-CD1 3.58Å; L1426-I1449 HydrophobicContact CD1-CG1 3.65Å
1427	L	71.5	Confident	65.9	Low	49 Å²	49	50.5 Å²	50.5	26%	0.257	25%	0.254	S	S	.	.	H	α-helix	trans	-67.1	-29.9	173.6	-68.3	167.6	0	0	0	112.3	L221 I225 I1423 I1424 S1430 R1431	L221-L1427 HydrophobicContact CB-CD1 4.22Å; I225-L1427 HydrophobicContact CB-CD1 4.44Å; I225-L1427 HydrophobicContact CD1-CD1 3.6Å; I225-L1427 HydrophobicContact CG2-CB 3.99Å; I225-L1427 HydrophobicContact CG2-CD1 4.43Å; I1423-L1427 HydrophobicContact CG2-CD1 3.99Å; I1423-L1427 PolarHBondContact O-N 3.16Å; I1424-L1427 PolarHBondContact O-N 3.35Å; L1427-S1430 WeakPolarHBondContact CA-OG 3.46Å; L1427-S1430 PolarHBondContact O-OG 2.85Å; L1427-R1431 PolarHBondContact O-N 2.77Å
1428	M	74.8	Confident	66.3	Low	6 Å²	6	46.4 Å²	46.4	3%	0.03	24%	0.24	C	C	.	.	H	α-helix	trans	-68.6	-29.2	167.4	-72.6	-175	76.9	0	0	113.2	V230 W242 F269 I1424 L1426 D1432	V230-M1428 HydrophobicContact CG2-CE 3.9Å; V230-M1428 HydrophobicContact CG2-SD 3.97Å; W242-M1428 HydrophobicContact CZ2-CB 4.16Å; F269-M1428 HydrophobicContact CD1-SD 4.18Å; F269-M1428 HydrophobicContact CE1-SD 3.92Å; I1424-M1428 HydrophobicContact CG2-SD 4.38Å; I1424-M1428 WeakPolarHBondContact O-CB 3.42Å; I1424-M1428 VanDerWaalsContact O-CG 3.31Å; I1424-M1428 WeakPolarHBondContact O-CG 3.43Å; I1424-M1428 PolarHBondContact O-N 3.19Å; L1426-M1428 VanDerWaalsContact C-N 3.28Å; L1426-M1428 PolarHBondContact O-N 3.47Å; M1428-D1432 VanDerWaalsContact O-CB 3.28Å; M1428-D1432 WeakPolarHBondContact O-CB 3.24Å; M1428-D1432 PolarHBondContact O-N 3.33Å
1429	H	73.5	Confident	66.7	Low	4 Å²	4	48.6 Å²	48.6	2%	0.019	25%	0.251	C	S	.	.	H	α-helix	trans	-66.3	-50.1	174.6	178.5	-86.1	0	0	0	110.8	W242 E246 T1425 L1426 R1431 D1432 R1433 T1436 L1438	W242-H1429 AromaticContact CD1-CD2 3.83Å; W242-H1429 HydrophobicContact CD2-CB 4.35Å; W242-H1429 AromaticContact CD2-CD2 3.81Å; W242-H1429 HydrophobicContact CG-CB 4.32Å; W242-H1429 AromaticContact CG-CD2 3.57Å; W242-H1429 HydrophobicContact CZ2-CB 4.4Å; E246-H1429 IonicContact OE1-CD2 3.82Å; E246-H1429 IonicContact OE1-CE1 3.52Å; E246-H1429 IonicContact OE1-NE2 2.81Å; E246-H1429 PolarHBondContact OE1-NE2 2.99Å; T1425-H1429 PolarHBondContact O-N 3.19Å; T1425-H1429 VanDerWaalsContact O-N 3.16Å; L1426-H1429 WeakPolarHBondContact O-CA 3.07Å; L1426-H1429 VanDerWaalsContact O-CB 3.27Å; L1426-H1429 WeakPolarHBondContact O-CB 3.46Å; L1426-H1429 PolarHBondContact O-N 3.1Å; H1429-R1431 PolarHBondContact O-N 3.45Å; H1429-D1432 PolarHBondContact O-N 3.38Å; H1429-D1432 VanDerWaalsContact O-N 3.09Å; H1429-R1433 WeakPolarHBondContact NE2-CD 3.46Å; H1429-R1433 PolarHBondContact O-N 3.46Å; H1429-T1436 PolarHBondContact CE1-O 2.75Å; H1429-L1438 WeakPolarHBondContact ND1-CD1 3.24Å
1430	S	66.6	Low	66.7	Low	73 Å²	73	49.5 Å²	49.5	51%	0.51	26%	0.26	S	S	.	.	H	α-helix	trans	-61.2	-27.9	-179.5	48.8	0	0	0	0	113.2	L1426 L1427	L1426-S1430 PolarHBondContact O-N 2.84Å; L1427-S1430 WeakPolarHBondContact CA-OG 3.46Å; L1427-S1430 PolarHBondContact O-OG 2.85Å
1431	R	67.6	Low	66.1	Low	93 Å²	93	52.4 Å²	52.4	35%	0.351	28%	0.276	S	S	.	.	H	α-helix	trans	-79	-39.7	172.9	-168	-164.1	66.9	-156.4	-9.8	113	C226 L228 L1427 H1429	C226-R1431 PolarHBondContact O-NH1 2.93Å; L228-R1431 PolarHBondContact O-NH1 3.48Å; L1427-R1431 PolarHBondContact O-N 2.77Å; H1429-R1431 PolarHBondContact O-N 3.45Å
1432	D	68.5	Low	65.7	Low	80 Å²	80	52.6 Å²	52.6	43%	0.428	28%	0.277	S	S	.	.	H	α-helix	trans	-95.9	-5.6	-170.9	-66.2	6.6	0	0	0	113.6	W242 M1428 H1429	W242-D1432 HydrophobicContact CH2-CB 3.52Å; W242-D1432 HydrophobicContact CZ2-CB 4.27Å; W242-D1432 HydrophobicContact CZ3-CB 4.17Å; M1428-D1432 VanDerWaalsContact O-CB 3.28Å; M1428-D1432 WeakPolarHBondContact O-CB 3.24Å; M1428-D1432 PolarHBondContact O-N 3.33Å; H1429-D1432 PolarHBondContact O-N 3.38Å; H1429-D1432 VanDerWaalsContact O-N 3.09Å
1433	R	63.7	Low	65.4	Low	78 Å²	78	55.6 Å²	55.6	29%	0.294	30%	0.296	S	S	.	.			trans	-142.7	52.3	-177.4	-69.8	-166.7	173.1	-164.3	-0.4	114.5	W242 E246 H1429 N1435 T1436	W242-R1433 HydrophobicContact CE3-CG 4.49Å; W242-R1433 HydrophobicContact CZ3-CG 4.42Å; E246-R1433 VanDerWaalsContact OE1-CD 3.27Å; E246-R1433 WeakPolarHBondContact OE1-CD 3.1Å; E246-R1433 IonicContact OE1-CZ 2.75Å; E246-R1433 IonicContact OE1-NE 2.76Å; E246-R1433 IonicContact OE1-NH1 3.18Å; E246-R1433 PolarHBondContact OE1-NH1 3.22Å; E246-R1433 IonicContact OE2-NH1 3.9Å; E246-R1433 PolarHBondContact OE2-NH1 3.44Å; H1429-R1433 WeakPolarHBondContact NE2-CD 3.46Å; H1429-R1433 PolarHBondContact O-N 3.46Å; R1433-N1435 PolarHBondContact O-N 3.39Å; R1433-T1436 PolarHBondContact O-N 3.25Å; R1433-T1436 PolarHBondContact O-OG1 2.73Å
1434	E	56.3	Low	65.2	Low	114 Å²	114	54.4 Å²	54.4	53%	0.533	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-38.8	-179.6	-59.9	176.9	141	0	0	114.6	T1436 G1746	E1434-T1436 PolarHBondContact O-N 3.02Å; E1434-G1746 WeakPolarHBondContact OE1-CA 3.36Å
1435	N	51.4	Low	65	Low	165 Å²	165	54.5 Å²	54.5	88%	0.882	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-4.7	-177.2	-70.6	-50.8	0	0	0	115.5	R1433	R1433-N1435 PolarHBondContact O-N 3.39Å
1436	T	55.5	Low	64.6	Low	65 Å²	65	58.5 Å²	58.5	40%	0.399	31%	0.309	S	S	.	.	S	Bend	trans	-137.2	69.9	-178.9	50	0	0	0	0	111	H1429 R1433 E1434 L1438	H1429-T1436 PolarHBondContact CE1-O 2.75Å; R1433-T1436 PolarHBondContact O-N 3.25Å; R1433-T1436 PolarHBondContact O-OG1 2.73Å; E1434-T1436 PolarHBondContact O-N 3.02Å; T1436-L1438 PolarHBondContact O-N 3.22Å; T1436-L1438 VanDerWaalsContact O-N 3.14Å
1437	V	55.4	Low	64.4	Low	104 Å²	104	61.9 Å²	61.9	63%	0.63	32%	0.323	S	S	*	.			trans	-56.1	116.7	178.2	-175.5	0	0	0	0	110.6
1438	L	60	Low	64.4	Low	21 Å²	21	59.6 Å²	59.6	11%	0.11	31%	0.311	C	S	.	.			trans	-73.4	124.2	169.8	-73.8	171.6	0	0	0	109.3	C245 E246 L1426 H1429 T1436 V1440 I1445	C245-L1438 HydrophobicContact CB-CD1 3.88Å; C245-L1438 HydrophobicContact CB-CD2 4.26Å; E246-L1438 HydrophobicContact CB-CD2 4.46Å; E246-L1438 HydrophobicContact CG-CD2 3.88Å; L1426-L1438 HydrophobicContact CD2-CD1 4.44Å; H1429-L1438 WeakPolarHBondContact ND1-CD1 3.24Å; T1436-L1438 PolarHBondContact O-N 3.22Å; T1436-L1438 VanDerWaalsContact O-N 3.14Å; L1438-V1440 PolarHBondContact O-N 3.33Å; L1438-I1445 HydrophobicContact CD2-CD1 4.37Å
1439	D	62.2	Low	64.1	Low	64 Å²	64	59.4 Å²	59.4	34%	0.342	31%	0.31	S	S	.	.			trans	-71.9	94.1	165.5	-178.9	22.1	0	0	0	109.8	N1441 H1442	D1439-N1441 PolarHBondContact O-N 3.12Å; D1439-N1441 WeakPolarHBondContact OD1-CB 3.49Å; D1439-N1441 PolarHBondContact OD1-N 2.71Å; D1439-N1441 VanDerWaalsContact OD1-N 3.07Å; D1439-N1441 PolarHBondContact OD1-ND2 3.08Å; D1439-H1442 WeakPolarHBondContact O-CB 3.42Å; D1439-H1442 PolarHBondContact O-N 2.9Å
1440	V	61.4	Low	63.7	Low	49 Å²	49	62.4 Å²	62.4	30%	0.297	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.8	177.5	-172.3	0	0	0	0	111.5	L1438 H1442 I1449 L1738	L1438-V1440 PolarHBondContact O-N 3.33Å; V1440-H1442 PolarHBondContact O-N 2.59Å; V1440-I1449 HydrophobicContact CG1-CD1 4.34Å; V1440-L1738 HydrophobicContact CG1-CD2 4.33Å
1441	N	56.5	Low	63.9	Low	76 Å²	76	63.4 Å²	63.4	41%	0.406	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-7.6	174.8	-45.8	-78.8	0	0	0	112.8	D1439 I1740	D1439-N1441 PolarHBondContact O-N 3.12Å; D1439-N1441 WeakPolarHBondContact OD1-CB 3.49Å; D1439-N1441 PolarHBondContact OD1-N 2.71Å; D1439-N1441 VanDerWaalsContact OD1-N 3.07Å; D1439-N1441 PolarHBondContact OD1-ND2 3.08Å; N1441-I1740 WeakPolarHBondContact OD1-CG1 3.39Å
1442	H	63.9	Low	63.8	Low	4 Å²	4	60.9 Å²	60.9	2%	0.019	31%	0.314	C	S	.	.	S	Bend	trans	-63.2	123.4	176.5	-169.2	-110.5	0	0	0	110.3	L248 L251 F253 D1439 V1440 L1444 I1445 H1446	L248-H1442 PolarHBondContact O-CE1 3.21Å; L248-H1442 PolarHBondContact O-ND1 2.76Å; L251-H1442 PolarHBondContact O-NE2 3.22Å; F253-H1442 AromaticContact CD1-CD2 3.79Å; F253-H1442 AromaticContact CE1-CD2 3.54Å; F253-H1442 AromaticContact CZ-CD2 3.89Å; D1439-H1442 WeakPolarHBondContact O-CB 3.42Å; D1439-H1442 PolarHBondContact O-N 2.9Å; V1440-H1442 PolarHBondContact O-N 2.59Å; H1442-L1444 PolarHBondContact O-N 3.04Å; H1442-I1445 HydrophobicContact CB-CD1 4.38Å; H1442-I1445 HydrophobicContact CB-CG1 4.48Å; H1442-I1445 PolarHBondContact O-N 3.36Å; H1442-H1446 PolarHBondContact O-N 3.1Å; H1442-H1446 VanDerWaalsContact O-N 3.11Å
1443	P	66.6	Low	63.4	Low	63 Å²	63	58.8 Å²	58.8	41%	0.409	30%	0.304	S	S	.	.	H	α-helix	trans	-62.8	-23.3	-167.2	22.2	-34.9	0	0	0	114.3	F253 K1447	F253-P1443 HydrophobicContact CD1-CG 4.03Å; P1443-K1447 WeakPolarHBondContact O-CB 3.17Å; P1443-K1447 PolarHBondContact O-N 3.43Å
1444	L	68.2	Low	63	Low	11 Å²	11	62 Å²	62	6%	0.058	32%	0.316	C	S	.	.	H	α-helix	trans	-73.3	-33.7	173.8	-59.5	-176.6	0	0	0	112.6	L248 L251 H1442 L1448	L248-L1444 HydrophobicContact CB-CB 4.49Å; L248-L1444 HydrophobicContact CD2-CB 4.22Å; L248-L1444 HydrophobicContact CD2-CD1 4.08Å; L251-L1444 HydrophobicContact CB-CD1 4.25Å; L251-L1444 HydrophobicContact CD1-CD1 3.65Å; H1442-L1444 PolarHBondContact O-N 3.04Å; L1444-L1448 VanDerWaalsContact O-CB 3.29Å; L1444-L1448 WeakPolarHBondContact O-CB 3.12Å; L1444-L1448 PolarHBondContact O-N 3.23Å
1445	I	71	Confident	62.7	Low	3 Å²	3	60 Å²	60	2%	0.015	31%	0.313	C	S	.	.	H	α-helix	trans	-71.8	-45.7	174.7	-64.9	178.6	0	0	0	109.4	L248 L1438 H1442 K1447 L1448 I1449	L248-I1445 HydrophobicContact CB-CG1 4.2Å; L1438-I1445 HydrophobicContact CD2-CD1 4.37Å; H1442-I1445 HydrophobicContact CB-CD1 4.38Å; H1442-I1445 HydrophobicContact CB-CG1 4.48Å; H1442-I1445 PolarHBondContact O-N 3.36Å; I1445-K1447 VanDerWaalsContact C-N 3.34Å; I1445-K1447 PolarHBondContact O-N 3.33Å; I1445-L1448 PolarHBondContact O-N 3.4Å; I1445-L1448 VanDerWaalsContact O-N 3.16Å; I1445-I1449 HydrophobicContact CG2-CD1 3.92Å; I1445-I1449 HydrophobicContact CG2-CG1 4.46Å; I1445-I1449 WeakPolarHBondContact O-CG1 2.93Å; I1445-I1449 PolarHBondContact O-N 3.14Å
1446	H	68.6	Low	62.6	Low	84 Å²	84	60.3 Å²	60.3	39%	0.389	31%	0.307	S	S	.	.	H	α-helix	trans	-56.6	-45.6	172.5	-174.3	-86.2	0	0	0	112.2	H1442 L1448 I1449 H1450	H1442-H1446 PolarHBondContact O-N 3.1Å; H1442-H1446 VanDerWaalsContact O-N 3.11Å; H1446-L1448 PolarHBondContact O-N 2.94Å; H1446-I1449 PolarHBondContact O-N 2.7Å; H1446-H1450 WeakPolarHBondContact O-CB 3.38Å; H1446-H1450 PolarHBondContact O-N 2.92Å
1447	K	69	Low	62	Low	93 Å²	93	58.2 Å²	58.2	40%	0.404	30%	0.296	S	S	.	.	H	α-helix	trans	-60.7	-42.8	175.1	-176	-176.4	175.6	-170.6	0	111.9	I259 P1443 I1445 Q1451	I259-K1447 HydrophobicContact CD1-CB 4.26Å; I259-K1447 HydrophobicContact CD1-CD 3.89Å; I259-K1447 HydrophobicContact CD1-CG 3.81Å; P1443-K1447 WeakPolarHBondContact O-CB 3.17Å; P1443-K1447 PolarHBondContact O-N 3.43Å; I1445-K1447 VanDerWaalsContact C-N 3.34Å; I1445-K1447 PolarHBondContact O-N 3.33Å; K1447-Q1451 WeakPolarHBondContact O-CB 3.36Å; K1447-Q1451 PolarHBondContact O-N 2.92Å
1448	L	70.8	Confident	61.3	Low	1 Å²	1	55.7 Å²	55.7	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-62.2	-48.1	176.4	176.5	149.5	0	0	0	111.6	F241 I244 L248 I259 I263 L1444 I1445 H1446 Q1451 I1452	F241-L1448 HydrophobicContact CE2-CD2 4.22Å; F241-L1448 HydrophobicContact CZ-CD2 4.36Å; I244-L1448 HydrophobicContact CG2-CD1 4.48Å; L248-L1448 HydrophobicContact CD1-CD1 3.59Å; I259-L1448 HydrophobicContact CD1-CB 4.13Å; I259-L1448 HydrophobicContact CG2-CD1 4.09Å; I259-L1448 HydrophobicContact CG2-CG 4.43Å; I263-L1448 HydrophobicContact CD1-CD1 4.19Å; I263-L1448 HydrophobicContact CD1-CG 4.24Å; L1444-L1448 VanDerWaalsContact O-CB 3.29Å; L1444-L1448 WeakPolarHBondContact O-CB 3.12Å; L1444-L1448 PolarHBondContact O-N 3.23Å; I1445-L1448 PolarHBondContact O-N 3.4Å; I1445-L1448 VanDerWaalsContact O-N 3.16Å; H1446-L1448 PolarHBondContact O-N 2.94Å; L1448-Q1451 PolarHBondContact O-N 3.24Å; L1448-I1452 HydrophobicContact CD2-CD1 3.57Å; L1448-I1452 HydrophobicContact CG-CD1 3.96Å; L1448-I1452 WeakPolarHBondContact O-CD1 2.99Å; L1448-I1452 VanDerWaalsContact O-CG1 3.26Å; L1448-I1452 WeakPolarHBondContact O-CG1 3.27Å; L1448-I1452 PolarHBondContact O-N 2.99Å; L1448-I1452 VanDerWaalsContact O-N 3.11Å
1449	I	69.8	Low	60.3	Low	2 Å²	2	58.7 Å²	58.7	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-50	179.6	-57.9	160.2	0	0	0	109.5	I1423 L1426 V1440 I1445 H1446 Q1451 I1452 T1453 L1738	I1423-I1449 HydrophobicContact CG1-CG2 4.34Å; L1426-I1449 HydrophobicContact CD1-CD1 3.58Å; L1426-I1449 HydrophobicContact CD1-CG1 3.65Å; V1440-I1449 HydrophobicContact CG1-CD1 4.34Å; I1445-I1449 HydrophobicContact CG2-CD1 3.92Å; I1445-I1449 HydrophobicContact CG2-CG1 4.46Å; I1445-I1449 WeakPolarHBondContact O-CG1 2.93Å; I1445-I1449 PolarHBondContact O-N 3.14Å; H1446-I1449 PolarHBondContact O-N 2.7Å; I1449-Q1451 VanDerWaalsContact C-N 3.29Å; I1449-Q1451 PolarHBondContact O-N 3.34Å; I1449-I1452 PolarHBondContact O-N 2.73Å; I1449-I1452 VanDerWaalsContact O-N 3.12Å; I1449-T1453 HydrophobicContact CG2-CG2 3.79Å; I1449-T1453 WeakPolarHBondContact O-CG2 3.25Å; I1449-T1453 PolarHBondContact O-N 3.24Å; I1449-T1453 PolarHBondContact O-OG1 3.29Å; I1449-L1738 HydrophobicContact CB-CD1 3.8Å; I1449-L1738 HydrophobicContact CD1-CD1 3.82Å; I1449-L1738 HydrophobicContact CD1-CD2 3.95Å; I1449-L1738 HydrophobicContact CG1-CD1 4.44Å; I1449-L1738 HydrophobicContact CG2-CD1 3.74Å
1450	H	65.9	Low	59.3	Low	67 Å²	67	60.5 Å²	60.5	31%	0.31	30%	0.296	S	S	.	.	H	α-helix	trans	-62.9	-30.2	178.7	175.8	-107.7	0	0	0	113.8	H1446 R1454	H1446-H1450 WeakPolarHBondContact O-CB 3.38Å; H1446-H1450 PolarHBondContact O-N 2.92Å; H1450-R1454 PolarHBondContact CE1-NE 3.21Å; H1450-R1454 WeakPolarHBondContact O-CB 3.44Å; H1450-R1454 WeakPolarHBondContact O-CG 3.19Å
1451	Q	68.7	Low	58.3	Low	94 Å²	94	59.7 Å²	59.7	44%	0.439	29%	0.29	S	S	.	.	H	α-helix	trans	-67.3	-41.3	173.6	177	170.8	-20.4	0	0	111.6	K1447 L1448 I1449	K1447-Q1451 WeakPolarHBondContact O-CB 3.36Å; K1447-Q1451 PolarHBondContact O-N 2.92Å; L1448-Q1451 PolarHBondContact O-N 3.24Å; I1449-Q1451 VanDerWaalsContact C-N 3.29Å; I1449-Q1451 PolarHBondContact O-N 3.34Å
1452	I	66.1	Low	57.6	Low	40 Å²	40	59.9 Å²	59.9	21%	0.205	29%	0.29	C	S	.	.	H	α-helix	trans	-78.9	-46.4	-179.2	-55	160.8	0	0	0	111.2	I263 L265 H1420 C1422 L1448 I1449 R1454	I263-I1452 HydrophobicContact CD1-CD1 3.74Å; I263-I1452 HydrophobicContact CD1-CG1 3.91Å; I263-I1452 HydrophobicContact CG2-CD1 4.33Å; L265-I1452 HydrophobicContact CD1-CG2 3.85Å; H1420-I1452 VanDerWaalsContact CE1-CG2 3.44Å; H1420-I1452 WeakPolarHBondContact CE1-CG2 3.23Å; C1422-I1452 HydrophobicContact CB-CD1 4.3Å; C1422-I1452 HydrophobicContact CB-CG2 4.31Å; L1448-I1452 HydrophobicContact CD2-CD1 3.57Å; L1448-I1452 HydrophobicContact CG-CD1 3.96Å; L1448-I1452 WeakPolarHBondContact O-CD1 2.99Å; L1448-I1452 VanDerWaalsContact O-CG1 3.26Å; L1448-I1452 WeakPolarHBondContact O-CG1 3.27Å; L1448-I1452 PolarHBondContact O-N 2.99Å; L1448-I1452 VanDerWaalsContact O-N 3.11Å; I1449-I1452 PolarHBondContact O-N 2.73Å; I1449-I1452 VanDerWaalsContact O-N 3.12Å; I1452-R1454 PolarHBondContact O-N 2.93Å; I1452-R1454 VanDerWaalsContact O-N 3.1Å
1453	T	60.7	Low	56.5	Low	36 Å²	36	66.5 Å²	66.5	22%	0.221	32%	0.319	C	S	.	.	S	Bend	trans	-76.9	7.4	-174.8	63.4	0	0	0	0	114	H1420 I1423 I1449 P1455	H1420-T1453 HydrophobicContact CB-CG2 4.48Å; I1423-T1453 HydrophobicContact CD1-CG2 4.22Å; I1449-T1453 HydrophobicContact CG2-CG2 3.79Å; I1449-T1453 WeakPolarHBondContact O-CG2 3.25Å; I1449-T1453 PolarHBondContact O-N 3.24Å; I1449-T1453 PolarHBondContact O-OG1 3.29Å; T1453-P1455 WeakPolarHBondContact O-CD 3.49Å
1454	R	56	Low	55.5	Low	145 Å²	145	68.4 Å²	68.4	55%	0.547	32%	0.321	S	S	.	.			trans	-71.6	115	-173.7	-127.8	173.6	175.5	-165.6	-4.2	110.2	H1450 I1452 K1456	H1450-R1454 PolarHBondContact CE1-NE 3.21Å; H1450-R1454 WeakPolarHBondContact O-CB 3.44Å; H1450-R1454 WeakPolarHBondContact O-CG 3.19Å; I1452-R1454 PolarHBondContact O-N 2.93Å; I1452-R1454 VanDerWaalsContact O-N 3.1Å; R1454-K1456 PolarHBondContact O-N 2.69Å
1455	P	50.1	Low	54.1	Low	73 Å²	73	72 Å²	72	47%	0.474	34%	0.34	S	S	.	.			trans	-80.8	55.5	-161.8	33.6	-38.5	0	0	0	114.2	T1453	T1453-P1455 WeakPolarHBondContact O-CD 3.49Å
1456	K	47.6	Very low	52.6	Low	172 Å²	172	76.6 Å²	76.6	75%	0.748	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-23.8	-179.7	-72.9	-168.8	172.3	-171.5	0	114.3	R1454	R1454-K1456 PolarHBondContact O-N 2.69Å
1457	A	42.9	Very low	51.2	Low	21 Å²	21	74.8 Å²	74.8	17%	0.174	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-50.1	-171.7	0	0	0	0	0	114.4	P284 L287 M1459 K1460 L1461	P284-A1457 HydrophobicContact CB-CB 3.84Å; L287-A1457 HydrophobicContact CD2-CB 4.06Å; A1457-M1459 PolarHBondContact O-N 2.86Å; A1457-K1460 WeakPolarHBondContact O-CA 3.27Å; A1457-K1460 WeakPolarHBondContact O-CB 3.38Å; A1457-K1460 PolarHBondContact O-N 2.81Å; A1457-L1461 PolarHBondContact O-N 3.1Å; A1457-L1461 VanDerWaalsContact O-N 3.08Å
1458	Q	41.2	Very low	49.7	Very low	50 Å²	50	73.3 Å²	73.3	23%	0.234	35%	0.354	C	S	.	.	H	α-helix	trans	-62.6	-38.1	-178.1	-73.9	175.6	-56.2	0	0	112.8	L287 K1460 L1461 I1462	L287-Q1458 HydrophobicContact CD2-CG 4.43Å; Q1458-K1460 PolarHBondContact O-N 2.69Å; Q1458-L1461 WeakPolarHBondContact O-CB 3.42Å; Q1458-L1461 PolarHBondContact O-N 3.05Å; Q1458-I1462 WeakPolarHBondContact O-CG1 3.48Å; Q1458-I1462 PolarHBondContact O-N 2.86Å
1459	M	39.2	Very low	48.1	Very low	84 Å²	84	77 Å²	77	41%	0.414	37%	0.372	S	S	.	.	H	α-helix	trans	-65.1	-25.4	173.8	-161.7	71.3	102.2	0	0	112.5	A1457 K1463	A1457-M1459 PolarHBondContact O-N 2.86Å; M1459-K1463 WeakPolarHBondContact O-CB 3.5Å; M1459-K1463 WeakPolarHBondContact O-CG 3.46Å; M1459-K1463 PolarHBondContact O-N 3.22Å
1460	K	40.7	Very low	46.7	Very low	102 Å²	102	79.5 Å²	79.5	44%	0.443	39%	0.385	S	S	.	.	H	α-helix	trans	-76.7	-36.7	176.9	-158.9	179.4	-175.5	-178.6	0	111.4	E288 A1457 Q1458 K1464	E288-K1460 IonicContact OE1-NZ 2.74Å; E288-K1460 PolarHBondContact OE1-NZ 3.11Å; A1457-K1460 WeakPolarHBondContact O-CA 3.27Å; A1457-K1460 WeakPolarHBondContact O-CB 3.38Å; A1457-K1460 PolarHBondContact O-N 2.81Å; Q1458-K1460 PolarHBondContact O-N 2.69Å; K1460-K1464 WeakPolarHBondContact O-CB 3.37Å; K1460-K1464 PolarHBondContact O-N 2.92Å
1461	L	40	Very low	45.7	Very low	33 Å²	33	79.7 Å²	79.7	17%	0.173	39%	0.388	C	S	.	.	H	α-helix	trans	-61.2	-52.5	168.4	175.6	68.8	0	0	0	110.7	L291 A1457 Q1458 K1463 K1464 I1465	L291-L1461 HydrophobicContact CD1-CB 4.44Å; L291-L1461 HydrophobicContact CD2-CD1 3.58Å; L291-L1461 HydrophobicContact CG-CD1 4.3Å; A1457-L1461 PolarHBondContact O-N 3.1Å; A1457-L1461 VanDerWaalsContact O-N 3.08Å; Q1458-L1461 WeakPolarHBondContact O-CB 3.42Å; Q1458-L1461 PolarHBondContact O-N 3.05Å; L1461-K1463 PolarHBondContact O-N 3.28Å; L1461-K1464 PolarHBondContact O-N 3.19Å; L1461-I1465 HydrophobicContact CD1-CD1 3.72Å; L1461-I1465 HydrophobicContact CD1-CG1 4.26Å; L1461-I1465 HydrophobicContact CG-CD1 3.91Å; L1461-I1465 WeakPolarHBondContact O-CG1 3.38Å; L1461-I1465 PolarHBondContact O-N 2.96Å
1462	I	42.7	Very low	44.3	Very low	79 Å²	79	75.9 Å²	75.9	41%	0.405	37%	0.371	S	S	.	.	H	α-helix	trans	-60.8	-46.9	-179.8	-65.4	165.8	0	0	0	111.4	Q1458 K1464 I1465 H1466	Q1458-I1462 WeakPolarHBondContact O-CG1 3.48Å; Q1458-I1462 PolarHBondContact O-N 2.86Å; I1462-K1464 VanDerWaalsContact C-N 3.33Å; I1462-K1464 PolarHBondContact O-N 2.74Å; I1462-I1465 PolarHBondContact O-N 3.2Å; I1462-H1466 PolarHBondContact O-N 2.94Å
1463	K	41.8	Very low	43	Very low	143 Å²	143	74.7 Å²	74.7	62%	0.622	37%	0.365	S	S	*	.	H	α-helix	trans	-61.8	-36.8	175.8	-79.1	-170.3	173.8	-169.7	0	112.6	M1459 L1461 A1467	M1459-K1463 WeakPolarHBondContact O-CB 3.5Å; M1459-K1463 WeakPolarHBondContact O-CG 3.46Å; M1459-K1463 PolarHBondContact O-N 3.22Å; L1461-K1463 PolarHBondContact O-N 3.28Å; K1463-A1467 VanDerWaalsContact O-CB 3.22Å; K1463-A1467 WeakPolarHBondContact O-CB 3.49Å; K1463-A1467 PolarHBondContact O-N 3.05Å; K1463-A1467 VanDerWaalsContact O-N 3.07Å
1464	K	43.6	Very low	42.1	Very low	103 Å²	103	73.8 Å²	73.8	45%	0.448	36%	0.36	S	S	.	.	H	α-helix	trans	-67.5	-46.9	174.2	-87	-167.4	166.9	-162.7	0	112.6	L291 K1460 L1461 I1462 A1467 H1468	L291-K1464 HydrophobicContact CD2-CD 4.32Å; K1460-K1464 WeakPolarHBondContact O-CB 3.37Å; K1460-K1464 PolarHBondContact O-N 2.92Å; L1461-K1464 PolarHBondContact O-N 3.19Å; I1462-K1464 VanDerWaalsContact C-N 3.33Å; I1462-K1464 PolarHBondContact O-N 2.74Å; K1464-A1467 PolarHBondContact O-N 2.99Å; K1464-H1468 WeakPolarHBondContact O-CB 3.49Å; K1464-H1468 PolarHBondContact O-N 3.48Å
1465	I	39.5	Very low	41.3	Very low	88 Å²	88	69.7 Å²	69.7	45%	0.451	35%	0.35	S	S	.	.	H	α-helix	trans	-62.3	-49.9	-178.8	-68.8	173	0	0	0	110.5	L1461 I1462 A1467 H1468 E1469	L1461-I1465 HydrophobicContact CD1-CD1 3.72Å; L1461-I1465 HydrophobicContact CD1-CG1 4.26Å; L1461-I1465 HydrophobicContact CG-CD1 3.91Å; L1461-I1465 WeakPolarHBondContact O-CG1 3.38Å; L1461-I1465 PolarHBondContact O-N 2.96Å; I1462-I1465 PolarHBondContact O-N 3.2Å; I1465-A1467 VanDerWaalsContact C-N 3.32Å; I1465-A1467 PolarHBondContact O-N 3.48Å; I1465-H1468 PolarHBondContact O-N 3.39Å; I1465-E1469 VanDerWaalsContact O-CB 3.31Å; I1465-E1469 WeakPolarHBondContact O-CB 3.41Å; I1465-E1469 PolarHBondContact O-N 2.99Å
1466	H	38.9	Very low	40.5	Very low	99 Å²	99	67.1 Å²	67.1	46%	0.458	33%	0.332	S	S	.	.	H	α-helix	trans	-64.2	-33.7	175.8	-91.9	-40	0	0	0	112.8	I1462 E1469 N1470	I1462-H1466 PolarHBondContact O-N 2.94Å; H1466-E1469 IonicContact CE1-OE2 2.73Å; H1466-E1469 PolarHBondContact CE1-OE2 3.25Å; H1466-E1469 IonicContact CG-OE2 2.65Å; H1466-E1469 IonicContact ND1-OE2 2.68Å; H1466-E1469 PolarHBondContact ND1-OE2 2.89Å; H1466-N1470 WeakPolarHBondContact O-CB 3.41Å; H1466-N1470 PolarHBondContact O-N 2.97Å; H1466-N1470 VanDerWaalsContact O-N 3.17Å; H1466-N1470 PolarHBondContact O-ND2 2.87Å
1467	A	40.1	Very low	40.2	Very low	46 Å²	46	61.4 Å²	61.4	38%	0.38	31%	0.311	S	S	.	.	H	α-helix	trans	-64.1	-43.8	173.1	0	0	0	0	0	111.5	K1463 K1464 I1465 N1470 I1471	K1463-A1467 VanDerWaalsContact O-CB 3.22Å; K1463-A1467 WeakPolarHBondContact O-CB 3.49Å; K1463-A1467 PolarHBondContact O-N 3.05Å; K1463-A1467 VanDerWaalsContact O-N 3.07Å; K1464-A1467 PolarHBondContact O-N 2.99Å; I1465-A1467 VanDerWaalsContact C-N 3.32Å; I1465-A1467 PolarHBondContact O-N 3.48Å; A1467-N1470 PolarHBondContact O-N 3.27Å; A1467-I1471 VanDerWaalsContact O-CG1 3.29Å; A1467-I1471 WeakPolarHBondContact O-CG1 3.19Å; A1467-I1471 PolarHBondContact O-N 3.19Å
1468	H	36.5	Very low	40.1	Very low	61 Å²	61	62.6 Å²	62.6	28%	0.282	33%	0.325	S	S	.	.	H	α-helix	trans	-74.3	-35	-178.8	-81.9	-139.9	0	0	0	113.2	E298 K1464 I1465 N1470 I1471 V1472	E298-H1468 IonicContact OE2-CE1 3.09Å; E298-H1468 IonicContact OE2-CG 2.78Å; E298-H1468 IonicContact OE2-ND1 3.21Å; E298-H1468 PolarHBondContact OE2-ND1 3.35Å; K1464-H1468 WeakPolarHBondContact O-CB 3.49Å; K1464-H1468 PolarHBondContact O-N 3.48Å; I1465-H1468 PolarHBondContact O-N 3.39Å; H1468-N1470 VanDerWaalsContact C-N 3.33Å; H1468-N1470 PolarHBondContact O-N 3.23Å; H1468-I1471 PolarHBondContact O-N 3.18Å; H1468-V1472 WeakPolarHBondContact O-CB 3.17Å; H1468-V1472 VanDerWaalsContact O-CG2 3.31Å; H1468-V1472 WeakPolarHBondContact O-CG2 3.25Å; H1468-V1472 PolarHBondContact O-N 3.06Å
1469	E	38.3	Very low	40	Very low	80 Å²	80	65.9 Å²	65.9	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-56.9	-47	169.2	179.1	179.9	-132.1	0	0	110.9	I1465 H1466 I1471 V1472 V1473	I1465-E1469 VanDerWaalsContact O-CB 3.31Å; I1465-E1469 WeakPolarHBondContact O-CB 3.41Å; I1465-E1469 PolarHBondContact O-N 2.99Å; H1466-E1469 IonicContact CE1-OE2 2.73Å; H1466-E1469 PolarHBondContact CE1-OE2 3.25Å; H1466-E1469 IonicContact CG-OE2 2.65Å; H1466-E1469 IonicContact ND1-OE2 2.68Å; H1466-E1469 PolarHBondContact ND1-OE2 2.89Å; E1469-I1471 VanDerWaalsContact C-N 3.34Å; E1469-I1471 PolarHBondContact O-N 3.36Å; E1469-V1472 PolarHBondContact O-N 3.31Å; E1469-V1473 WeakPolarHBondContact O-CB 3.08Å; E1469-V1473 WeakPolarHBondContact O-CG2 3.2Å; E1469-V1473 PolarHBondContact O-N 3.01Å
1470	N	40.8	Very low	39.8	Very low	53 Å²	53	62.6 Å²	62.6	28%	0.283	32%	0.321	S	S	.	.	H	α-helix	trans	-64.5	-35.8	176.1	-76.4	-52.3	0	0	0	113	V1331 H1466 A1467 H1468 S1474	V1331-N1470 WeakPolarHBondContact CG1-OD1 3.33Å; V1331-N1470 HydrophobicContact CG2-CB 3.74Å; V1331-N1470 VanDerWaalsContact CG2-CG 3.42Å; V1331-N1470 WeakPolarHBondContact CG2-OD1 3.22Å; H1466-N1470 WeakPolarHBondContact O-CB 3.41Å; H1466-N1470 PolarHBondContact O-N 2.97Å; H1466-N1470 VanDerWaalsContact O-N 3.17Å; H1466-N1470 PolarHBondContact O-ND2 2.87Å; A1467-N1470 PolarHBondContact O-N 3.27Å; H1468-N1470 VanDerWaalsContact C-N 3.33Å; H1468-N1470 PolarHBondContact O-N 3.23Å; N1470-S1474 WeakPolarHBondContact O-CB 3.29Å; N1470-S1474 PolarHBondContact O-N 3.43Å; N1470-S1474 PolarHBondContact O-OG 3.2Å
1471	I	43.9	Very low	39.5	Very low	71 Å²	71	62.2 Å²	62.2	36%	0.364	32%	0.323	S	S	.	.	H	α-helix	trans	-66.6	-51	173.3	-66.3	162.5	0	0	0	110.2	R302 A1467 H1468 E1469 V1473 S1474 D1475	R302-I1471 VanDerWaalsContact NH2-CG2 3.32Å; A1467-I1471 VanDerWaalsContact O-CG1 3.29Å; A1467-I1471 WeakPolarHBondContact O-CG1 3.19Å; A1467-I1471 PolarHBondContact O-N 3.19Å; H1468-I1471 PolarHBondContact O-N 3.18Å; E1469-I1471 VanDerWaalsContact C-N 3.34Å; E1469-I1471 PolarHBondContact O-N 3.36Å; I1471-V1473 PolarHBondContact O-N 3.4Å; I1471-S1474 CarbonylContact O-C 3.54Å; I1471-S1474 WeakPolarHBondContact O-CA 3.09Å; I1471-S1474 WeakPolarHBondContact O-CB 3.15Å; I1471-S1474 PolarHBondContact O-N 3.21Å; I1471-S1474 PolarHBondContact O-OG 3.21Å; I1471-D1475 WeakPolarHBondContact CG2-OD2 3.31Å; I1471-D1475 PolarHBondContact O-N 3.43Å
1472	V	38.9	Very low	39.1	Very low	15 Å²	15	64.9 Å²	64.9	9%	0.091	35%	0.345	C	S	.	.	H	α-helix	trans	-58.7	-44.9	179.3	168.4	0	0	0	0	111	H1468 E1469 S1474 D1475 L1476	H1468-V1472 WeakPolarHBondContact O-CB 3.17Å; H1468-V1472 VanDerWaalsContact O-CG2 3.31Å; H1468-V1472 WeakPolarHBondContact O-CG2 3.25Å; H1468-V1472 PolarHBondContact O-N 3.06Å; E1469-V1472 PolarHBondContact O-N 3.31Å; V1472-S1474 VanDerWaalsContact C-N 3.33Å; V1472-S1474 PolarHBondContact O-N 2.84Å; V1472-D1475 PolarHBondContact O-N 3.43Å; V1472-L1476 HydrophobicContact CG1-CD1 3.67Å; V1472-L1476 WeakPolarHBondContact O-CB 3.37Å; V1472-L1476 WeakPolarHBondContact O-CD1 3.28Å; V1472-L1476 PolarHBondContact O-N 3.03Å
1473	V	39.7	Very low	38.4	Very low	14 Å²	14	65.7 Å²	65.7	9%	0.085	36%	0.358	C	S	.	.	H	α-helix	trans	-59.8	-42.5	172.7	168	0	0	0	0	111.3	M336 L1334 E1469 I1471 T1477	M336-V1473 HydrophobicContact SD-CG2 4.06Å; L1334-V1473 HydrophobicContact CD1-CG1 4.14Å; E1469-V1473 WeakPolarHBondContact O-CB 3.08Å; E1469-V1473 WeakPolarHBondContact O-CG2 3.2Å; E1469-V1473 PolarHBondContact O-N 3.01Å; I1471-V1473 PolarHBondContact O-N 3.4Å; V1473-T1477 WeakPolarHBondContact O-CG2 3.29Å; V1473-T1477 PolarHBondContact O-N 3.36Å; V1473-T1477 PolarHBondContact O-OG1 2.99Å
1474	S	42	Very low	37.7	Very low	17 Å²	17	63.3 Å²	63.3	12%	0.119	36%	0.359	C	S	.	.	H	α-helix	trans	-64.4	-43.5	178.1	76.5	0	0	0	0	112.5	N1470 I1471 V1472 T1477 G1478	N1470-S1474 WeakPolarHBondContact O-CB 3.29Å; N1470-S1474 PolarHBondContact O-N 3.43Å; N1470-S1474 PolarHBondContact O-OG 3.2Å; I1471-S1474 CarbonylContact O-C 3.54Å; I1471-S1474 WeakPolarHBondContact O-CA 3.09Å; I1471-S1474 WeakPolarHBondContact O-CB 3.15Å; I1471-S1474 PolarHBondContact O-N 3.21Å; I1471-S1474 PolarHBondContact O-OG 3.21Å; V1472-S1474 VanDerWaalsContact C-N 3.33Å; V1472-S1474 PolarHBondContact O-N 2.84Å; S1474-T1477 PolarHBondContact O-N 3.34Å; S1474-T1477 PolarHBondContact O-OG1 3.06Å; S1474-G1478 PolarHBondContact O-N 3.44Å
1475	D	39.4	Very low	36.9	Very low	60 Å²	60	66.8 Å²	66.8	32%	0.321	38%	0.376	S	S	.	.	H	α-helix	trans	-62.2	-49.3	176.7	-65.2	-33	0	0	0	110.6	R302 I1471 V1472 T1477 G1478 Y1479	R302-D1475 IonicContact CZ-OD2 2.76Å; R302-D1475 IonicContact NH1-OD2 2.77Å; R302-D1475 PolarHBondContact NH1-OD2 3.25Å; I1471-D1475 WeakPolarHBondContact CG2-OD2 3.31Å; I1471-D1475 PolarHBondContact O-N 3.43Å; V1472-D1475 PolarHBondContact O-N 3.43Å; D1475-T1477 VanDerWaalsContact C-N 3.28Å; D1475-T1477 PolarHBondContact O-N 3.18Å; D1475-G1478 PolarHBondContact O-N 3.27Å; D1475-Y1479 WeakPolarHBondContact O-CD2 3.4Å; D1475-Y1479 PolarHBondContact O-N 3.25Å
1476	L	34.1	Very low	36.1	Very low	18 Å²	18	72.5 Å²	72.5	9%	0.094	40%	0.398	C	S	.	.	H	α-helix	trans	-58.6	-37.9	176.6	-91.3	78.3	0	0	0	112.2	F306 L332 V1472 L1480	F306-L1476 HydrophobicContact CD1-CG 4.27Å; F306-L1476 HydrophobicContact CD2-CD2 4.31Å; F306-L1476 HydrophobicContact CD2-CG 4.38Å; F306-L1476 HydrophobicContact CE1-CB 4.44Å; F306-L1476 HydrophobicContact CE1-CD2 4.25Å; F306-L1476 HydrophobicContact CE1-CG 3.71Å; F306-L1476 HydrophobicContact CE2-CD2 3.52Å; F306-L1476 HydrophobicContact CE2-CG 3.84Å; F306-L1476 HydrophobicContact CZ-CB 4.37Å; F306-L1476 HydrophobicContact CZ-CD2 3.5Å; F306-L1476 VanDerWaalsContact CZ-CD2 3.5Å; F306-L1476 HydrophobicContact CZ-CG 3.49Å; F306-L1476 VanDerWaalsContact CZ-CG 3.49Å; L332-L1476 HydrophobicContact CD1-CB 3.7Å; L332-L1476 HydrophobicContact CD1-CD2 3.76Å; L332-L1476 HydrophobicContact CD1-CG 4.38Å; L332-L1476 HydrophobicContact CG-CD2 4.42Å; V1472-L1476 HydrophobicContact CG1-CD1 3.67Å; V1472-L1476 WeakPolarHBondContact O-CB 3.37Å; V1472-L1476 WeakPolarHBondContact O-CD1 3.28Å; V1472-L1476 PolarHBondContact O-N 3.03Å; L1476-L1480 WeakPolarHBondContact O-CG 3.43Å; L1476-L1480 PolarHBondContact O-N 3.25Å
1477	T	40.1	Very low	35.5	Very low	53 Å²	53	72.7 Å²	72.7	33%	0.325	41%	0.41	S	S	.	.	H	α-helix	trans	-68.6	-39	173.9	57.3	0	0	0	0	112.6	V1473 S1474 D1475 Y1479 L1480 D1481	V1473-T1477 WeakPolarHBondContact O-CG2 3.29Å; V1473-T1477 PolarHBondContact O-N 3.36Å; V1473-T1477 PolarHBondContact O-OG1 2.99Å; S1474-T1477 PolarHBondContact O-N 3.34Å; S1474-T1477 PolarHBondContact O-OG1 3.06Å; D1475-T1477 VanDerWaalsContact C-N 3.28Å; D1475-T1477 PolarHBondContact O-N 3.18Å; T1477-Y1479 PolarHBondContact O-N 2.91Å; T1477-L1480 PolarHBondContact O-N 2.81Å; T1477-D1481 PolarHBondContact O-N 3.41Å
1478	G	41.5	Very low	34.8	Very low	45 Å²	45	78.7 Å²	78.7	46%	0.464	44%	0.436	S	S	.	.	H	α-helix	trans	-60.2	-44.7	175.4	0	0	0	0	0	112.9	S1474 D1475 L1480 D1481 S1482	S1474-G1478 PolarHBondContact O-N 3.44Å; D1475-G1478 PolarHBondContact O-N 3.27Å; G1478-L1480 PolarHBondContact O-N 3.07Å; G1478-D1481 PolarHBondContact O-N 3.49Å; G1478-S1482 PolarHBondContact O-N 2.87Å
1479	Y	38.6	Very low	34.1	Very low	119 Å²	119	79.1 Å²	79.1	47%	0.467	46%	0.456	S	S	.	.	H	α-helix	trans	-67.2	-19.2	173.9	-84.9	-89.4	0	0	0	113.9	K310 D1475 T1477 S1482	K310-Y1479 PolarHBondContact NZ-O 3.46Å; D1475-Y1479 WeakPolarHBondContact O-CD2 3.4Å; D1475-Y1479 PolarHBondContact O-N 3.25Å; T1477-Y1479 PolarHBondContact O-N 2.91Å; Y1479-S1482 PolarHBondContact O-OG 2.68Å
1480	L	34.8	Very low	33.5	Very low	16 Å²	16	83.2 Å²	83.2	8%	0.084	48%	0.476	C	S	.	.	H	α-helix	trans	-87.7	-23.7	178.8	-83.6	168.6	0	0	0	113.7	K310 K328 L1476 T1477 G1478 S1483	K310-L1480 HydrophobicContact CD-CD2 3.81Å; K310-L1480 HydrophobicContact CD-CG 4.23Å; K310-L1480 HydrophobicContact CG-CD2 4.18Å; K328-L1480 HydrophobicContact CG-CD1 4.34Å; K328-L1480 HydrophobicContact CG-CD2 4.35Å; L1476-L1480 WeakPolarHBondContact O-CG 3.43Å; L1476-L1480 PolarHBondContact O-N 3.25Å; T1477-L1480 PolarHBondContact O-N 2.81Å; G1478-L1480 PolarHBondContact O-N 3.07Å; L1480-S1483 PolarHBondContact O-OG 2.79Å
1481	D	34.5	Very low	32.7	Very low	93 Å²	93	90.6 Å²	90.6	50%	0.497	50%	0.501	S	S	.	.	H	α-helix	trans	-97.3	-15.5	-178.9	-68.9	-11.8	0	0	0	113.1	K328 T1477 G1478 S1483 S1484	K328-D1481 IonicContact NZ-OD1 3.52Å; K328-D1481 PolarHBondContact NZ-OD1 3.02Å; T1477-D1481 PolarHBondContact O-N 3.41Å; G1478-D1481 PolarHBondContact O-N 3.49Å; D1481-S1483 PolarHBondContact O-N 3.28Å; D1481-S1483 VanDerWaalsContact O-N 3.08Å; D1481-S1484 PolarHBondContact O-OG 3.46Å
1482	S	31.8	Very low	31.6	Very low	89 Å²	89	91.8 Å²	91.8	62%	0.622	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	0.3	175.3	60	0	0	0	0	115.4	G1478 Y1479	G1478-S1482 PolarHBondContact O-N 2.87Å; Y1479-S1482 PolarHBondContact O-OG 2.68Å
1483	S	27.5	Very low	30.8	Very low	97 Å²	97	97.1 Å²	97.1	68%	0.678	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	7.8	-174.4	64.6	0	0	0	0	115.6	L1480 D1481	L1480-S1483 PolarHBondContact O-OG 2.79Å; D1481-S1483 PolarHBondContact O-N 3.28Å; D1481-S1483 VanDerWaalsContact O-N 3.08Å
1484	S	27	Very low	30.2	Very low	92 Å²	92	105 Å²	105	64%	0.643	60%	0.599	S	S	*	*			trans	-110	11.3	-174.9	64.4	0	0	0	0	116.3	D1481	D1481-S1484 PolarHBondContact O-OG 3.46Å
1485	H	26.4	Very low	29.3	Very low	177 Å²	177	115.5 Å²	115.5	82%	0.819	64%	0.636	S	S	*	*			trans	-113.3	74.4	-179.9	-84.8	-71.3	0	0	0	113
1486	K	24.3	Very low	28.5	Very low	208 Å²	208	122.9 Å²	122.9	90%	0.904	66%	0.659	S	S	*	*			trans	-161.3	58.2	167.1	-123.8	171.6	-172.7	177.9	0	115.4
1487	S	24.5	Very low	28.1	Very low	102 Å²	102	130 Å²	130	71%	0.713	70%	0.697	S	S	*	*	S	Bend	trans	-156.1	118.5	161.1	56.5	0	0	0	0	111.3
1488	D	26.1	Very low	27.3	Very low	173 Å²	173	134.2 Å²	134.2	93%	0.925	72%	0.718	S	S	*	*			trans	60.6	157.6	158.5	-50	-29.3	0	0	0	120.3
1489	G	23	Very low	26.4	Very low	69 Å²	69	135.5 Å²	135.5	71%	0.711	73%	0.731	S	S	*	*			trans	-163.1	-142.8	-178.7	0	0	0	0	0	110.4
1490	Q	23.7	Very low	25.8	Very low	167 Å²	167	135.6 Å²	135.6	78%	0.78	75%	0.749	S	S	*	*			trans	77.2	132.3	-177.6	-74.1	-171	-18.9	0	0	117.8
1491	Y	24.5	Very low	25.2	Very low	208 Å²	208	142 Å²	142	82%	0.816	78%	0.784	S	S	*	*			trans	55	107.9	164.6	-55.4	-62.8	0	0	0	120.8
1492	A	20.4	Very low	24.8	Very low	95 Å²	95	146.5 Å²	146.5	79%	0.785	80%	0.804	S	S	*	*			trans	-97.9	127.4	151.1	0	0	0	0	0	109.7
1493	C	23	Very low	24.4	Very low	127 Å²	127	149.5 Å²	149.5	86%	0.858	81%	0.813	S	S	*	*			trans	165.1	118.3	143.9	-99.1	0	0	0	0	111.9
1494	L	26.6	Very low	24.2	Very low	181 Å²	181	150.2 Å²	150.2	95%	0.948	82%	0.818	S	S	*	*				-168.3	162.4	126.5	-105.4	167	0	0	0	110.7
1495	R	23.9	Very low	24.1	Very low	237 Å²	237	154 Å²	154	89%	0.894	83%	0.828	S	S	*	*			trans	-108.3	156.4	-167	-112.8	-179.2	-179.9	178.5	0.9	112.9
1496	R	22.8	Very low	24	Very low	214 Å²	214	150.7 Å²	150.7	81%	0.808	82%	0.824	S	S	*	*			trans	-21.1	148.4	162.3	-67.1	175.5	169.8	150.7	-3.5	116.7
1497	N	25.9	Very low	23.9	Very low	169 Å²	169	149 Å²	149	90%	0.904	82%	0.824	S	S	*	*				-145	161.1	114	-115	-18.4	0	0	0	111.9
1498	N	21.6	Very low	23.8	Very low	141 Å²	141	151.6 Å²	151.6	75%	0.754	83%	0.83	S	S	*	*			trans	-105.8	156.6	-167.9	-64.4	-14.3	0	0	0	113
1499	G	22.9	Very low	23.8	Very low	72 Å²	72	149.8 Å²	149.8	74%	0.742	83%	0.825	S	S	*	*				120.1	99.9	129.4	0	0	0	0	0	118.8
1500	S	26.8	Very low	23.8	Very low	121 Å²	121	155 Å²	155	85%	0.846	83%	0.833	S	S	*	*				-175.7	144.2	123.4	31.7	0	0	0	0	110.8
1501	N	22.6	Very low	23.8	Very low	151 Å²	151	154.2 Å²	154.2	81%	0.807	83%	0.834	S	S	*	*			trans	-98.1	149.7	171	-71.5	-13.9	0	0	0	109.6
1502	M	26.2	Very low	23.7	Very low	187 Å²	187	152.5 Å²	152.5	92%	0.921	84%	0.839	S	S	*	*				-164.3	146.1	121.8	-97.6	-50.8	168.8	0	0	110.3
1503	N	22.8	Very low	23.8	Very low	152 Å²	152	152.5 Å²	152.5	81%	0.813	84%	0.84	S	S	*	*			trans	-100.8	149.2	-178	-60.2	-20.4	0	0	0	111.1
1504	S	23.2	Very low	23.9	Very low	111 Å²	111	152 Å²	152	78%	0.776	84%	0.838	S	S	*	*			trans	-171.2	150.1	137.8	54.7	0	0	0	0	114.4
1505	M	24.1	Very low	23.7	Very low	173 Å²	173	149.9 Å²	149.9	85%	0.852	83%	0.827	S	S	*	*			trans	65.7	144.7	145.8	-106.2	56.2	174.9	0	0	123.8
1506	S	25.2	Very low	23.7	Very low	106 Å²	106	145.1 Å²	145.1	74%	0.741	82%	0.819	S	S	*	*			trans	50	106.3	160.5	46.2	0	0	0	0	116.9
1507	L	22.5	Very low	23.9	Very low	173 Å²	173	142.3 Å²	142.3	91%	0.906	82%	0.819	S	S	*	*			cis	58.8	80.5	45.6	-161.8	104.4	0	0	0	113.2
1508	D	22.9	Very low	23.7	Very low	157 Å²	157	141.4 Å²	141.4	84%	0.84	81%	0.813	S	S	*	*			trans	-153.7	161	153.9	-126.6	-34.6	0	0	0	110.7
1509	T	26.2	Very low	24	Very low	135 Å²	135	138.6 Å²	138.6	83%	0.828	80%	0.803	S	S	*	*			trans	64.2	69.1	175.4	-35.8	0	0	0	0	117.5
1510	M	22.7	Very low	24.2	Very low	177 Å²	177	142.2 Å²	142.2	87%	0.872	80%	0.795	S	S	*	*			trans	-147.2	94.2	153.6	-162.3	172.2	-170.2	0	0	112.3
1511	N	22.9	Very low	24.1	Very low	152 Å²	152	141.5 Å²	141.5	81%	0.813	78%	0.777	S	S	*	*			trans	172	90.9	148.2	-92.2	-23.6	0	0	0	111.3
1512	N	22.2	Very low	24.2	Very low	171 Å²	171	139.1 Å²	139.1	91%	0.914	76%	0.759	S	S	*	*			trans	-176.8	162.2	147.5	-98.9	-36.4	0	0	0	110.7
1513	A	23.8	Very low	24.1	Very low	96 Å²	96	137.9 Å²	137.9	79%	0.793	75%	0.751	S	S	*	*			trans	71.6	71.4	170.1	0	0	0	0	0	119.3
1514	S	24.3	Very low	24.4	Very low	117 Å²	117	135.6 Å²	135.6	82%	0.818	75%	0.745	S	S	*	*				-163.5	124.8	128.5	44.1	0	0	0	0	107.4
1515	N	22.5	Very low	24.5	Very low	135 Å²	135	139.6 Å²	139.6	72%	0.722	75%	0.748	S	S	*	*			cis	71.1	112.4	7.7	-96.7	64.8	0	0	0	117.6
1516	D	24.4	Very low	24.5	Very low	137 Å²	137	140.7 Å²	140.7	73%	0.733	75%	0.751	S	S	*	*			trans	88.5	153.3	143.2	-57	-44.1	0	0	0	123
1517	I	26	Very low	24.5	Very low	155 Å²	155	139.4 Å²	139.4	80%	0.795	74%	0.742	S	S	*	*			trans	78.4	76.7	165.8	-37.9	-171	0	0	0	118.2
1518	L	22	Very low	24.6	Very low	150 Å²	150	138.9 Å²	138.9	79%	0.785	74%	0.735	S	S	*	*				-88.2	137.7	123.5	-159.4	98	0	0	0	106.4
1519	P	28.9	Very low	24.6	Very low	83 Å²	83	137.6 Å²	137.6	54%	0.539	72%	0.723	S	S	.	*				-159.9	176.5	98.6	41.6	-21.9	0	0	0	117.9
1520	Y	25.9	Very low	24.6	Very low	147 Å²	147	139.2 Å²	139.2	58%	0.576	72%	0.72	S	S	*	*			trans	67.6	111.6	154.9	-66.3	-55	0	0	0	122.5	K1522	Y1520-K1522 HydrophobicContact CD1-CB 4.13Å; Y1520-K1522 HydrophobicContact CD1-CD 4.3Å; Y1520-K1522 HydrophobicContact CE1-CD 4.19Å
1521	F	25.3	Very low	24.9	Very low	107 Å²	107	137 Å²	137	47%	0.469	71%	0.71	S	S	.	*				-96.4	121.8	128.3	-114.3	-94.8	0	0	0	108.8	E326 H1549 H1550	E326-F1521 WeakPolarHBondContact OE1-CE2 3.48Å; F1521-H1549 WeakPolarHBondContact O-CB 3.34Å; F1521-H1550 PolarHBondContact O-CD2 2.87Å
1522	K	23.8	Very low	25.1	Very low	100 Å²	100	138.1 Å²	138.1	44%	0.435	71%	0.708	S	S	.	*			trans	-158.1	135.6	172.8	-162.9	177.2	171.9	-168.6	0	110.8	Y1520 H1549	Y1520-K1522 HydrophobicContact CD1-CB 4.13Å; Y1520-K1522 HydrophobicContact CD1-CD 4.3Å; Y1520-K1522 HydrophobicContact CE1-CD 4.19Å; K1522-H1549 HydrophobicContact CG-CB 4.47Å
1523	Q	24.7	Very low	25.1	Very low	162 Å²	162	134.7 Å²	134.7	76%	0.757	70%	0.697	S	S	*	*			trans	-66.4	145.2	-176.4	-64.2	177.9	-9	0	0	113.1
1524	P	28.9	Very low	25.7	Very low	104 Å²	104	135.3 Å²	135.3	68%	0.675	69%	0.693	S	S	*	*			trans	-96	128.8	161.3	34.4	-28.4	0	0	0	111.8
1525	K	24.6	Very low	25.9	Very low	194 Å²	194	136.7 Å²	136.7	84%	0.843	69%	0.69	S	S	*	*			trans	-151.5	110.4	160.7	-96	-163.2	178	-178.9	0	112.3
1526	H	25.6	Very low	26.1	Very low	196 Å²	196	135 Å²	135	91%	0.907	69%	0.689	S	S	*	*			trans	-158	143.4	152.5	-107.1	-99.6	0	0	0	104.8
1527	S	23.5	Very low	26.3	Very low	79 Å²	79	134.1 Å²	134.1	55%	0.552	69%	0.689	S	S	*	*			cis	-164.7	155.8	4	56.5	0	0	0	0	112.3
1528	Q	25	Very low	26.4	Very low	162 Å²	162	132.4 Å²	132.4	76%	0.757	69%	0.69	S	S	*	*			trans	70.6	152	158.9	-64.8	167.4	16.2	0	0	115.7
1529	Q	24.1	Very low	26.6	Very low	130 Å²	130	128.8 Å²	128.8	61%	0.607	69%	0.689	S	S	*	*			cis	-156.6	163	1.2	-132.6	164.3	26.2	0	0	111.6
1530	F	26	Very low	26.4	Very low	170 Å²	170	132.6 Å²	132.6	75%	0.746	70%	0.704	S	S	*	*			trans	68.2	141	166	-62.3	-55.1	0	0	0	117.7
1531	L	28.6	Very low	26.5	Very low	129 Å²	129	132.9 Å²	132.9	68%	0.675	71%	0.714	S	S	*	*			cis	-149.2	143.8	2.9	-106.3	155	0	0	0	111.8
1532	K	26.2	Very low	26.5	Very low	177 Å²	177	135.8 Å²	135.8	77%	0.77	73%	0.729	S	S	*	*			trans	20.9	130.2	154.5	-61.5	166.1	-168.7	173.5	0	120.9
1533	S	23.2	Very low	26.5	Very low	98 Å²	98	139.3 Å²	139.3	69%	0.685	75%	0.746	S	S	*	*			cis	81.7	153	31.1	84.7	0	0	0	0	116.2
1534	P	36.5	Very low	26.5	Very low	109 Å²	109	136.2 Å²	136.2	71%	0.708	74%	0.74	S	S	*	*			cis	-143.9	-145.4	-28.5	34.5	-9.8	0	0	0	113.4
1535	I	28.2	Very low	26.4	Very low	147 Å²	147	138.9 Å²	138.9	75%	0.754	75%	0.749	S	S	*	*			trans	96.6	87.2	163.8	-56.9	166.9	0	0	0	115.2
1536	S	26	Very low	26.3	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	74%	0.743	S	S	*	*				106.2	153.6	84.7	78.9	0	0	0	0	111.6
1537	T	28.4	Very low	26.2	Very low	118 Å²	118	131.3 Å²	131.3	72%	0.724	74%	0.737	S	S	*	*			cis	-143.4	152.5	17.9	44.5	0	0	0	0	114.5
1538	S	28.3	Very low	26.3	Very low	118 Å²	118	130.9 Å²	130.9	83%	0.825	74%	0.738	S	S	*	*			trans	53.2	119.3	145.1	63.2	0	0	0	0	122.6
1539	G	26.6	Very low	26.2	Very low	74 Å²	74	128.3 Å²	128.3	76%	0.763	73%	0.726	S	S	*	*			trans	171.5	99.3	160.8	0	0	0	0	0	111.9	I1541	G1539-I1541 PolarHBondContact O-N 2.89Å
1540	L	25.7	Very low	26.1	Very low	163 Å²	163	127.6 Å²	127.6	85%	0.853	72%	0.722	S	S	*	*			trans	-62.8	121.4	-166.1	-86.8	67.8	0	0	0	114.9
1541	I	26.9	Very low	26	Very low	154 Å²	154	130.1 Å²	130.1	79%	0.79	73%	0.727	S	S	*	*			trans	-134.4	132.6	133	-64.7	-174.4	0	0	0	107.6	G1539	G1539-I1541 PolarHBondContact O-N 2.89Å
1542	H	25.7	Very low	25.8	Very low	168 Å²	168	134.6 Å²	134.6	78%	0.778	74%	0.735	S	S	*	*			trans	-88	123.5	171.7	-102.1	-87.7	0	0	0	110.7
1543	H	22.9	Very low	25.7	Very low	173 Å²	173	135.5 Å²	135.5	80%	0.801	74%	0.735	S	S	*	*			trans	-115.6	154.2	143.7	-94.4	-68.5	0	0	0	107.7
1544	P	26.2	Very low	25.7	Very low	97 Å²	97	135 Å²	135	63%	0.63	73%	0.732	S	S	*	*				-138.3	170.2	117.7	39.8	-30.6	0	0	0	114.4
1545	D	25.6	Very low	25	Very low	160 Å²	160	137 Å²	137	86%	0.856	74%	0.737	S	S	*	*			trans	71	142.2	156.9	-58.1	-28.1	0	0	0	121
1546	S	23.1	Very low	24.7	Very low	104 Å²	104	136.2 Å²	136.2	73%	0.727	74%	0.738	S	S	*	*			trans	-118.3	144	-164.3	67.2	0	0	0	0	111.2
1547	T	23.8	Very low	24.5	Very low	128 Å²	128	139 Å²	139	79%	0.785	75%	0.745	S	S	*	*			trans	-170	154.2	134.6	13.4	0	0	0	0	113.2
1548	A	24.7	Very low	24.2	Very low	69 Å²	69	139 Å²	139	57%	0.57	75%	0.745	S	S	*	*			trans	74.5	110.7	161.9	0	0	0	0	0	119.2
1549	H	23.5	Very low	23.9	Very low	109 Å²	109	137.1 Å²	137.1	51%	0.505	73%	0.732	S	S	.	*			trans	-83	158.7	154.8	-84.1	-60.4	0	0	0	111.1	F1521 K1522	F1521-H1549 WeakPolarHBondContact O-CB 3.34Å; K1522-H1549 HydrophobicContact CG-CB 4.47Å
1550	H	22.1	Very low	23.6	Very low	114 Å²	114	143.8 Å²	143.8	53%	0.528	74%	0.74	S	S	.	*			trans	58.9	90.7	166.2	-67.1	-71.3	0	0	0	118.3	F1521	F1521-H1550 PolarHBondContact O-CD2 2.87Å
1551	R	23.3	Very low	23.5	Very low	223 Å²	223	142.9 Å²	142.9	84%	0.842	74%	0.736	S	S	*	*				-134.6	112.3	128.5	-126	178.6	-174.3	166.4	2	109.6
1552	W	24	Very low	23.2	Very low	223 Å²	223	142.5 Å²	142.5	85%	0.845	74%	0.736	S	S	*	*			trans	-89	125.2	164.3	-109.8	41.5	0	0	0	107.6
1553	Y	24.2	Very low	23.2	Very low	196 Å²	196	139.6 Å²	139.6	77%	0.769	73%	0.732	S	S	*	*	S	Bend	trans	54.5	136	167.6	-73.4	-81.3	0	0	0	120.8
1554	S	23.2	Very low	23.4	Very low	89 Å²	89	139.3 Å²	139.3	62%	0.622	73%	0.73	S	S	*	*			trans	65.8	131.2	177.5	73	0	0	0	0	116.6
1555	N	22.4	Very low	23.3	Very low	150 Å²	150	143.2 Å²	143.2	80%	0.802	74%	0.738	S	S	*	*			cis	-145.3	116.2	-7.3	-94.4	-21.5	0	0	0	111.3
1556	V	21.9	Very low	23.3	Very low	131 Å²	131	140.4 Å²	140.4	79%	0.794	74%	0.737	S	S	*	*			trans	-146.3	105	144.6	-175.3	0	0	0	0	103.5	V1558	V1556-V1558 HydrophobicContact CG1-CG2 4.16Å
1557	N	21.4	Very low	23.3	Very low	157 Å²	157	141.9 Å²	141.9	84%	0.84	74%	0.736	S	S	*	*				68.2	56.9	50.2	-155.2	32.9	0	0	0	113.7
1558	V	21.9	Very low	23.6	Very low	119 Å²	119	143.9 Å²	143.9	72%	0.721	74%	0.74	S	S	*	*			trans	-129.6	121	160.7	-176	0	0	0	0	108.6	V1556	V1556-V1558 HydrophobicContact CG1-CG2 4.16Å
1559	S	22.1	Very low	23.7	Very low	78 Å²	78	145.1 Å²	145.1	55%	0.545	75%	0.745	S	S	.	*			trans	40.7	86.9	166.7	64.3	0	0	0	0	119	N1561	S1559-N1561 VanDerWaalsContact C-N 3.25Å; S1559-N1561 WeakPolarHBondContact CB-OD1 3.47Å; S1559-N1561 PolarHBondContact O-N 3.24Å
1560	F	21.3	Very low	23.7	Very low	215 Å²	215	146.9 Å²	146.9	94%	0.943	76%	0.758	S	S	*	*				-71	90.5	128.3	-95.6	-85.8	0	0	0	107.6	N1562	F1560-N1562 VanDerWaalsContact C-N 3.32Å; F1560-N1562 PolarHBondContact O-N 3.28Å
1561	N	22.5	Very low	23.8	Very low	144 Å²	144	148.8 Å²	148.8	77%	0.77	77%	0.772	S	S	*	*			trans	-89.4	74.4	173.3	-88.7	16.9	0	0	0	110.8	S1559	S1559-N1561 VanDerWaalsContact C-N 3.25Å; S1559-N1561 WeakPolarHBondContact CB-OD1 3.47Å; S1559-N1561 PolarHBondContact O-N 3.24Å
1562	N	21.8	Very low	23.8	Very low	146 Å²	146	145 Å²	145	78%	0.781	77%	0.769	S	S	*	*			trans	-69.7	126.5	152.8	-137.8	8.7	0	0	0	107.2	F1560 H1564	F1560-N1562 VanDerWaalsContact C-N 3.32Å; F1560-N1562 PolarHBondContact O-N 3.28Å; N1562-H1564 PolarHBondContact O-N 2.69Å
1563	P	26.2	Very low	23.8	Very low	106 Å²	106	139.5 Å²	139.5	69%	0.688	76%	0.763	S	S	*	*	S	Bend	trans	-74.1	109.9	-179.3	28.2	-32.8	0	0	0	111.4
1564	H	26.4	Very low	23.7	Very low	167 Å²	167	137 Å²	137	77%	0.773	76%	0.761	S	S	*	*			trans	66.4	124.7	172	-56.8	-84.2	0	0	0	116.2	N1562	N1562-H1564 PolarHBondContact O-N 2.69Å
1565	F	23.3	Very low	23.9	Very low	180 Å²	180	139.1 Å²	139.1	79%	0.789	77%	0.766	S	S	*	*			cis	64.8	100.7	48.2	-83.9	-81.6	0	0	0	116.1
1566	A	27.3	Very low	24	Very low	101 Å²	101	139.4 Å²	139.4	84%	0.835	77%	0.767	S	S	*	*				-145.8	128.4	124.3	0	0	0	0	0	109.2
1567	N	22.5	Very low	24.1	Very low	134 Å²	134	139.5 Å²	139.5	72%	0.717	77%	0.768	S	S	*	*			trans	-88.4	159.4	170.1	-76.9	-36.9	0	0	0	109.9
1568	I	28.8	Very low	24.1	Very low	170 Å²	170	140.1 Å²	140.1	87%	0.872	77%	0.768	S	S	*	*				-166.2	145.3	119.2	-97.6	153.9	0	0	0	111.3
1569	S	28	Very low	24.2	Very low	96 Å²	96	140.8 Å²	140.8	67%	0.671	77%	0.768	S	S	*	*			trans	-41.5	138.4	-166.8	52.9	0	0	0	0	121.6
1570	N	22.8	Very low	24.2	Very low	146 Å²	146	145.4 Å²	145.4	78%	0.781	78%	0.781	S	S	*	*				19.7	127.2	123.5	-48.5	8	0	0	0	119.4
1571	N	25	Very low	24.3	Very low	153 Å²	153	139.8 Å²	139.8	82%	0.818	77%	0.768	S	S	*	*				-166	177.3	91.6	-106.4	5.7	0	0	0	111.4
1572	D	23.2	Very low	24.2	Very low	144 Å²	144	140.7 Å²	140.7	77%	0.77	77%	0.772	S	S	*	*			trans	-70.6	170.6	-162.6	-64.9	-73.2	0	0	0	118.2
1573	C	23.5	Very low	24.1	Very low	108 Å²	108	141.1 Å²	141.1	73%	0.73	77%	0.769	S	S	*	*			trans	88.6	125.2	156.7	-66	0	0	0	0	119.2
1574	I	23.1	Very low	23.9	Very low	142 Å²	142	146 Å²	146	73%	0.728	78%	0.78	S	S	*	*				53.5	115.7	124.2	-62.3	174.5	0	0	0	115.7
1575	N	26.3	Very low	23.6	Very low	134 Å²	134	145.2 Å²	145.2	72%	0.717	78%	0.776	S	S	*	*			cis	-160.8	127.8	19.4	-113.2	-8	0	0	0	111.6
1576	N	25.2	Very low	23.7	Very low	156 Å²	156	142.3 Å²	142.3	83%	0.834	78%	0.776	S	S	*	*			trans	57.9	154.1	176	-65.4	-33.6	0	0	0	116.5
1577	V	23.3	Very low	23.5	Very low	134 Å²	134	144.2 Å²	144.2	81%	0.812	77%	0.772	S	S	*	*				-168.3	124.8	123.4	140.2	0	0	0	0	107.5	N1579	V1577-N1579 WeakPolarHBondContact CG1-O 3.31Å
1578	M	21.8	Very low	23.5	Very low	169 Å²	169	149.9 Å²	149.9	83%	0.833	78%	0.783	S	S	*	*			trans	-88.3	147.9	159	-77.6	-174.2	174.9	0	0	108.3
1579	N	23.8	Very low	23.4	Very low	133 Å²	133	147.1 Å²	147.1	71%	0.711	78%	0.779	S	S	*	*			trans	71.9	155.3	166.3	-48.8	-38.2	0	0	0	114.1	V1577	V1577-N1579 WeakPolarHBondContact CG1-O 3.31Å
1580	Q	22.9	Very low	23.3	Very low	176 Å²	176	151.4 Å²	151.4	82%	0.822	79%	0.786	S	S	*	*			cis	-148.7	142.4	20.7	-151.9	163.4	22.7	0	0	112.4
1581	S	21.9	Very low	23.4	Very low	97 Å²	97	152.5 Å²	152.5	68%	0.678	79%	0.79	S	S	*	*			trans	28.5	132.1	154.6	60.6	0	0	0	0	121.8
1582	L	21.6	Very low	23.6	Very low	162 Å²	162	153.1 Å²	153.1	85%	0.848	79%	0.787	S	S	*	*				-169.1	171	111.2	-103.8	169.6	0	0	0	114.3
1583	H	20.2	Very low	23.8	Very low	155 Å²	155	151.4 Å²	151.4	72%	0.718	79%	0.787	S	S	*	*			trans	-48.9	154.8	-179.2	-86.3	-112.8	0	0	0	116.7
1584	F	21.8	Very low	23.9	Very low	210 Å²	210	150.6 Å²	150.6	92%	0.921	78%	0.782	S	S	*	*			trans	-148.5	142.6	135.1	-106.1	-73.8	0	0	0	112.8
1585	Q	20.2	Very low	24.1	Very low	149 Å²	149	151.6 Å²	151.6	70%	0.696	78%	0.783	S	S	*	*			trans	-94	148.9	163.9	-67.6	168.2	-96.9	0	0	110
1586	P	25.6	Very low	24.1	Very low	120 Å²	120	153.6 Å²	153.6	78%	0.779	79%	0.789	S	S	*	*			trans	-99.8	105.3	157.4	33.5	-24.6	0	0	0	110.5
1587	N	22.3	Very low	24.2	Very low	140 Å²	140	149.6 Å²	149.6	75%	0.749	78%	0.784	S	S	*	*			trans	-85.2	123.8	168.1	-99.4	-4.4	0	0	0	110.1
1588	W	23.3	Very low	24.2	Very low	253 Å²	253	149.4 Å²	149.4	96%	0.958	78%	0.777	S	S	*	*			trans	-87.8	109.4	158.1	-82.1	18.5	0	0	0	108.8
1589	S	25.4	Very low	24.6	Very low	113 Å²	113	150.6 Å²	150.6	79%	0.79	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-79.9	122	174.8	52.7	0	0	0	0	111.2
1590	K	26.1	Very low	24.6	Very low	185 Å²	185	150 Å²	150	80%	0.804	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-72.9	162.4	170.8	-68.4	-178.3	176.6	179.5	0	111.5
1591	I	25.6	Very low	24.7	Very low	170 Å²	170	151.2 Å²	151.2	87%	0.872	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-65.1	132.1	155.6	-65.8	173.8	0	0	0	108
1592	H	28.5	Very low	24.7	Very low	165 Å²	165	151 Å²	151	76%	0.764	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-75.1	165.5	-176.8	-75.2	-103.6	0	0	0	111.9
1593	S	27.6	Very low	24.8	Very low	109 Å²	109	151.6 Å²	151.6	76%	0.762	77%	0.77	S	S	*	*				-176.4	166.4	55	44.6	0	0	0	0	109.8
1594	S	26.1	Very low	25	Very low	90 Å²	90	148.7 Å²	148.7	63%	0.629	77%	0.767	S	S	*	*			cis	-170.3	170.7	-8.3	38.9	0	0	0	0	110.8
1595	H	27.6	Very low	25.1	Very low	163 Å²	163	146.6 Å²	146.6	76%	0.755	76%	0.76	S	S	*	*			trans	71.6	154.5	173.9	-62.6	-73.7	0	0	0	117.9
1596	E	25.2	Very low	25.1	Very low	177 Å²	177	147.2 Å²	147.2	83%	0.827	76%	0.763	S	S	*	*			cis	-174.6	149.4	-45.3	-117.7	176.2	157.2	0	0	109
1597	G	27.1	Very low	25	Very low	72 Å²	72	149.1 Å²	149.1	74%	0.742	76%	0.761	S	S	*	*			trans	144.3	75.8	168.2	0	0	0	0	0	120.3
1598	I	24.8	Very low	25	Very low	129 Å²	129	151.3 Å²	151.3	66%	0.662	76%	0.764	S	S	*	*			trans	-9.4	135.8	147	-6.8	178.9	0	0	0	116.2
1599	Y	28.8	Very low	24.9	Very low	195 Å²	195	146.6 Å²	146.6	77%	0.765	76%	0.756	S	S	*	*				-164.3	139	63	-95.3	-79.7	0	0	0	117.9
1600	D	23.2	Very low	25.6	Very low	119 Å²	119	146.3 Å²	146.3	64%	0.636	75%	0.752	S	S	*	*			trans	22.1	134.5	140.4	-57.2	-11.6	0	0	0	125
1601	F	25.4	Very low	25.5	Very low	203 Å²	203	144.7 Å²	144.7	89%	0.89	75%	0.749	S	S	*	*				-169.3	170.8	87.8	-119.8	-87.4	0	0	0	113.8
1602	S	21.6	Very low	25.4	Very low	91 Å²	91	142.7 Å²	142.7	64%	0.636	74%	0.74	S	S	*	*			trans	-152.3	-171.1	-179	69.8	0	0	0	0	114.2
1603	H	24.7	Very low	25.1	Very low	176 Å²	176	142.6 Å²	142.6	82%	0.815	74%	0.74	S	S	*	*			trans	86.3	148.4	-174.4	-70	-93.3	0	0	0	116.9
1604	S	23.8	Very low	24.9	Very low	93 Å²	93	146.4 Å²	146.4	65%	0.65	75%	0.748	S	S	*	*			cis	-164	147.2	-7.1	44.9	0	0	0	0	115.6
1605	Q	23.3	Very low	24.7	Very low	167 Å²	167	145.6 Å²	145.6	78%	0.78	75%	0.746	S	S	*	*			trans	39.6	124.3	141.1	-69.3	173.6	-38.5	0	0	124.9
1606	Q	21.5	Very low	24.7	Very low	162 Å²	162	147.2 Å²	147.2	76%	0.757	75%	0.751	S	S	*	*				30.9	134.1	125	-61.8	177.1	-28.8	0	0	122.9
1607	H	23.8	Very low	24.7	Very low	160 Å²	160	148.1 Å²	148.1	74%	0.741	75%	0.753	S	S	*	*				-173.7	134.1	114.5	-96.6	-44.3	0	0	0	116.1
1608	F	21.9	Very low	24.3	Very low	185 Å²	185	149.2 Å²	149.2	81%	0.811	75%	0.749	S	S	*	*			trans	52	168.2	148.2	-72.7	-65.4	0	0	0	125.4
1609	I	21.4	Very low	24.1	Very low	155 Å²	155	147.8 Å²	147.8	80%	0.795	75%	0.75	S	S	*	*			trans	-160.5	-177.3	-164.7	8.2	169.7	0	0	0	107.1
1610	P	40.5	Very low	23.8	Very low	106 Å²	106	146.3 Å²	146.3	69%	0.688	76%	0.756	S	S	*	*			cis	-131.8	-138.5	-28.7	39.6	-19.7	0	0	0	111.5
1611	M	22.2	Very low	23.6	Very low	151 Å²	151	148 Å²	148	74%	0.744	76%	0.764	S	S	*	*			trans	93.3	139.3	172.6	-50.3	-63.1	-89	0	0	115.3
1612	D	23.9	Very low	23.6	Very low	129 Å²	129	149 Å²	149	69%	0.69	76%	0.764	S	S	*	*			cis	-148.6	178.3	5.5	-142.3	-19.2	0	0	0	114.5
1613	E	22.5	Very low	23.5	Very low	163 Å²	163	150.8 Å²	150.8	76%	0.762	76%	0.762	S	S	*	*			trans	-66.1	158.1	-174.4	-56.8	-172.7	121.9	0	0	117
1614	M	23.7	Very low	23.5	Very low	189 Å²	189	150.6 Å²	150.6	93%	0.931	77%	0.767	S	S	*	*				-154.3	137.1	122.2	-135.4	176	-70.5	0	0	113.8
1615	A	22.5	Very low	23.4	Very low	72 Å²	72	152.9 Å²	152.9	60%	0.595	77%	0.768	S	S	*	*			trans	-125	152.9	-173	0	0	0	0	0	114.3
1616	K	26.9	Very low	23.4	Very low	197 Å²	197	153.1 Å²	153.1	86%	0.857	77%	0.773	S	S	*	*			trans	177.5	149.6	156.7	-96.5	139.7	-160.3	162.1	0	109.1
1617	K	24.2	Very low	23.3	Very low	197 Å²	197	150.9 Å²	150.9	86%	0.857	77%	0.77	S	S	*	*			cis	-151.4	159.9	3.3	-151.3	176	-177.3	-174.7	0	110.7
1618	S	20.3	Very low	23.1	Very low	94 Å²	94	149.3 Å²	149.3	66%	0.657	77%	0.771	S	S	*	*			trans	-88.9	169.2	175.1	61.5	0	0	0	0	113.9
1619	S	20.5	Very low	23	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	77%	0.768	S	S	*	*			trans	57.7	119.5	147.4	60.5	0	0	0	0	120
1620	N	22.4	Very low	22.9	Very low	164 Å²	164	146.2 Å²	146.2	88%	0.877	77%	0.769	S	S	*	*				-156	126.7	120.6	-100.7	-11.8	0	0	0	110.4
1621	N	19.5	Very low	22	Very low	153 Å²	153	145.4 Å²	145.4	82%	0.818	77%	0.766	S	S	*	*			trans	-82.3	142.3	157.3	-72.2	-20.7	0	0	0	107.8
1622	Y	23.9	Very low	21.9	Very low	225 Å²	225	144 Å²	144	88%	0.882	76%	0.762	S	S	*	*			trans	-161.3	161.8	130.5	-105.7	-65.5	0	0	0	109.7
1623	E	21	Very low	21.7	Very low	128 Å²	128	144.6 Å²	144.6	60%	0.598	77%	0.765	S	S	*	*			trans	-79.7	158.7	-166.1	-62.2	150.6	94.5	0	0	113.4	Q1625	E1623-Q1625 PolarHBondContact OE1-NE2 3.4Å; E1623-Q1625 VanDerWaalsContact OE1-NE2 3.12Å
1624	N	23.8	Very low	21.7	Very low	173 Å²	173	144 Å²	144	93%	0.925	77%	0.766	S	S	*	*				-144.8	125.3	123.5	-107.5	-41.6	0	0	0	110.8
1625	Q	21.7	Very low	21.5	Very low	141 Å²	141	141.6 Å²	141.6	66%	0.659	76%	0.757	S	S	*	*			trans	-88.1	136.7	177.8	-54.4	168	12.5	0	0	109.3	E1623	E1623-Q1625 PolarHBondContact OE1-NE2 3.4Å; E1623-Q1625 VanDerWaalsContact OE1-NE2 3.12Å
1626	I	22.4	Very low	21.5	Very low	172 Å²	172	142.8 Å²	142.8	88%	0.882	75%	0.753	S	S	*	*			trans	-138	95.5	145.5	-57.2	-175	0	0	0	109.3
1627	T	19.6	Very low	21.2	Very low	115 Å²	115	138.8 Å²	138.8	71%	0.706	76%	0.756	S	S	*	*			trans	-83.6	159.7	144.3	56.5	0	0	0	0	107.1
1628	V	20	Very low	21.2	Very low	126 Å²	126	138 Å²	138	76%	0.764	75%	0.749	S	S	*	*			cis	-146.2	166.1	16	-138	0	0	0	0	106.4
1629	T	20.5	Very low	21.3	Very low	122 Å²	122	137.8 Å²	137.8	75%	0.748	75%	0.748	S	S	*	*				-178	154.6	68.8	47.2	0	0	0	0	112.4
1630	N	19.6	Very low	21.4	Very low	153 Å²	153	144.8 Å²	144.8	82%	0.818	76%	0.761	S	S	*	*			trans	-3.8	151.9	141.1	-74.2	-16.2	0	0	0	120
1631	S	20	Very low	21.4	Very low	89 Å²	89	145.9 Å²	145.9	62%	0.622	75%	0.753	S	S	*	*			cis	-172.4	163.6	4.5	45.6	0	0	0	0	113.5
1632	N	20.6	Very low	21.6	Very low	121 Å²	121	144.6 Å²	144.6	65%	0.647	75%	0.746	S	S	*	*			trans	51.1	108.3	150.9	-60.7	-0.4	0	0	0	120.1
1633	N	21.2	Very low	21.6	Very low	143 Å²	143	136 Å²	136	77%	0.765	72%	0.718	S	S	*	*				168.9	139.1	99.5	-94.9	-19.8	0	0	0	114.9
1634	L	20.8	Very low	21.8	Very low	150 Å²	150	137 Å²	137	79%	0.785	72%	0.721	S	S	*	*			trans	65	151.5	141.6	-73.3	165.9	0	0	0	123.1
1635	L	21	Very low	21.8	Very low	139 Å²	139	131.8 Å²	131.8	73%	0.728	70%	0.697	S	S	*	*			trans	78.3	121.3	160.7	-96.1	70.6	0	0	0	121.3
1636	N	22.4	Very low	21.9	Very low	97 Å²	97	132.5 Å²	132.5	52%	0.519	70%	0.699	S	S	.	*			trans	67.8	90.9	141.9	-60.7	4.4	0	0	0	119.9	Y1638	N1636-Y1638 HydrophobicContact CB-CD2 3.78Å; N1636-Y1638 HydrophobicContact CB-CE2 3.73Å; N1636-Y1638 PolarHBondContact O-N 3.27Å
1637	A	20.1	Very low	22	Very low	112 Å²	112	130.4 Å²	130.4	93%	0.926	68%	0.679	S	S	*	*			trans	-63.3	108.3	137.6	0	0	0	0	0	108.9
1638	Y	23.9	Very low	22.3	Very low	181 Å²	181	126.4 Å²	126.4	71%	0.71	66%	0.656	S	S	*	*			trans	-79.5	143.2	173.2	-95.7	-86.4	0	0	0	111.4	N1636	N1636-Y1638 HydrophobicContact CB-CD2 3.78Å; N1636-Y1638 HydrophobicContact CB-CE2 3.73Å; N1636-Y1638 PolarHBondContact O-N 3.27Å
1639	S	22.5	Very low	22.5	Very low	90 Å²	90	124.1 Å²	124.1	63%	0.629	66%	0.658	S	S	*	*			trans	-62.3	134	176.5	57.5	0	0	0	0	112	R1641	S1639-R1641 VanDerWaalsContact C-N 3.35Å; S1639-R1641 PolarHBondContact O-N 3.02Å
1640	Y	22.3	Very low	22.7	Very low	246 Å²	246	125.6 Å²	125.6	97%	0.965	66%	0.66	S	S	*	*			trans	-65.5	95.4	159.3	-94.9	-99.1	0	0	0	109.1
1641	R	22.2	Very low	23	Very low	188 Å²	188	124.3 Å²	124.3	71%	0.709	65%	0.65	S	S	*	*			trans	-136.7	131.6	178.8	-150.7	177	-166.2	-158.6	2.9	109.5	S1639	S1639-R1641 VanDerWaalsContact C-N 3.35Å; S1639-R1641 PolarHBondContact O-N 3.02Å
1642	N	24	Very low	23.1	Very low	126 Å²	126	126.3 Å²	126.3	67%	0.674	65%	0.652	S	S	*	*			trans	56.8	85.2	175	-58.6	-16	0	0	0	115.9	K1644	N1642-K1644 PolarHBondContact O-N 3.05Å
1643	S	23.5	Very low	23.2	Very low	44 Å²	44	126.1 Å²	126.1	31%	0.308	66%	0.657	S	S	.	*			trans	-74.5	70.4	158	80.3	0	0	0	0	110.9	R804 C1645	R804-S1643 PolarHBondContact NH2-OG 3.28Å; S1643-C1645 PolarHBondContact O-N 2.76Å
1644	K	24.8	Very low	23.4	Very low	148 Å²	148	124.3 Å²	124.3	64%	0.643	65%	0.645	S	S	*	*			trans	-57.2	130.1	164	-76.5	-177.3	177.2	177.8	0	107.8	N1642 F1646	N1642-K1644 PolarHBondContact O-N 3.05Å; K1644-F1646 HydrophobicContact CB-CD2 4.46Å; K1644-F1646 HydrophobicContact CB-CE2 4.29Å; K1644-F1646 WeakPolarHBondContact O-CD2 3.28Å; K1644-F1646 PolarHBondContact O-N 3.39Å
1645	C	24.2	Very low	23.7	Very low	64 Å²	64	123.7 Å²	123.7	43%	0.432	64%	0.643	S	S	.	*			trans	-72.8	90.5	-175.8	-69.1	0	0	0	0	110.7	A795 S1643 W1647	A795-C1645 PolarHBondContact O-SG 3.41Å; S1643-C1645 PolarHBondContact O-N 2.76Å; C1645-W1647 PolarHBondContact O-N 3.08Å
1646	F	24.6	Very low	23.8	Very low	157 Å²	157	124 Å²	124	69%	0.689	65%	0.645	S	S	*	*			trans	-73.3	73.2	178	-87.4	-81.2	0	0	0	112.4	K1644	K1644-F1646 HydrophobicContact CB-CD2 4.46Å; K1644-F1646 HydrophobicContact CB-CE2 4.29Å; K1644-F1646 WeakPolarHBondContact O-CD2 3.28Å; K1644-F1646 PolarHBondContact O-N 3.39Å
1647	W	24.7	Very low	23.9	Very low	127 Å²	127	127.1 Å²	127.1	48%	0.481	66%	0.657	S	S	.	*			trans	-110.4	58.7	155.5	-85	89.1	0	0	0	110.1	W646 W793 C1645	W646-W1647 HydrophobicContact CH2-CE3 4.5Å; W646-W1647 HydrophobicContact CZ2-CB 4.33Å; W646-W1647 WeakPolarHBondContact CZ2-O 3.14Å; W646-W1647 PolarHBondContact NE1-O 3.14Å; W793-W1647 HydrophobicContact CB-CZ2 4.23Å; W793-W1647 AromaticContact CD1-CE2 3.85Å; W793-W1647 AromaticContact CD1-NE1 3.04Å; W793-W1647 HydrophobicContact CG-CZ2 4.16Å; W793-W1647 AromaticContact CG-NE1 3.84Å; W793-W1647 AromaticContact NE1-CD1 3.93Å; W793-W1647 AromaticContact NE1-NE1 3.21Å; C1645-W1647 PolarHBondContact O-N 3.08Å
1648	S	26.3	Very low	24.1	Very low	32 Å²	32	128.8 Å²	128.8	22%	0.224	65%	0.65	C	S	.	*			trans	-136.5	87.5	160.1	57.5	0	0	0	0	107.3
1649	G	23.1	Very low	24.2	Very low	77 Å²	77	124.6 Å²	124.6	79%	0.794	64%	0.64	S	S	*	*			trans	-65	149.2	-179.2	0	0	0	0	0	112.3
1650	L	24	Very low	24.2	Very low	153 Å²	153	127.5 Å²	127.5	80%	0.801	64%	0.641	S	S	*	*			trans	69	44	170.7	-139	79.7	0	0	0	117.2
1651	E	25.9	Very low	24.4	Very low	127 Å²	127	123 Å²	123	59%	0.593	63%	0.633	S	S	*	*			trans	-91.1	134.2	157.2	-69.3	-174.6	-178.3	0	0	110.4	R649	R649-E1651 IonicContact CZ-OE1 3.18Å; R649-E1651 IonicContact NH2-OE1 2.71Å; R649-E1651 PolarHBondContact NH2-OE1 3.3Å
1652	I	22.5	Very low	24.4	Very low	130 Å²	130	122.8 Å²	122.8	67%	0.667	64%	0.638	S	S	*	*			trans	-69.3	139.9	178.7	-64.2	171.7	0	0	0	108.4	M1654	I1652-M1654 PolarHBondContact O-N 2.92Å
1653	P	23.2	Very low	24.5	Very low	117 Å²	117	122 Å²	122	76%	0.76	64%	0.643	S	S	*	*			trans	-58	110.9	-176.2	22.6	-34.8	0	0	0	112
1654	M	26.3	Very low	24.6	Very low	105 Å²	105	123 Å²	123	52%	0.517	66%	0.659	S	S	.	*	P	Polyproline II helix	trans	-76.7	123.9	160.9	-70	-119.2	150.7	0	0	107.5	M678 Y694 I1652	M678-M1654 HydrophobicContact CG-CE 3.97Å; M678-M1654 HydrophobicContact SD-CE 3.52Å; M678-M1654 VanDerWaalsContact SD-CE 3.52Å; M678-M1654 HydrophobicContact SD-SD 3.87Å; Y694-M1654 HydrophobicContact CD1-CE 3.51Å; Y694-M1654 HydrophobicContact CD1-SD 4.33Å; Y694-M1654 HydrophobicContact CD2-CE 4.02Å; Y694-M1654 HydrophobicContact CD2-SD 4.38Å; Y694-M1654 HydrophobicContact CE1-CB 4.44Å; Y694-M1654 HydrophobicContact CE1-CE 3.49Å; Y694-M1654 VanDerWaalsContact CE1-CE 3.49Å; Y694-M1654 HydrophobicContact CE1-CG 4.06Å; Y694-M1654 HydrophobicContact CE1-SD 3.73Å; Y694-M1654 HydrophobicContact CE2-CE 4Å; Y694-M1654 HydrophobicContact CE2-SD 3.79Å; Y694-M1654 HydrophobicContact CG-CE 3.79Å; Y694-M1654 WeakPolarHBondContact OH-CA 3.46Å; I1652-M1654 PolarHBondContact O-N 2.92Å
1655	N	26	Very low	24.5	Very low	137 Å²	137	119.1 Å²	119.1	73%	0.733	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-89.8	140.6	-178.3	-151.4	61.3	0	0	0	109.1	Y694 H1657	Y694-N1655 PolarHBondContact OH-N 3.47Å; Y694-N1655 PolarHBondContact OH-O 3.34Å; N1655-H1657 PolarHBondContact O-N 2.96Å
1656	D	23.5	Very low	24.5	Very low	146 Å²	146	119.6 Å²	119.6	78%	0.781	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-58.3	133.6	-176.4	-69	-64	0	0	0	112.4
1657	H	24.8	Very low	24.5	Very low	163 Å²	163	117.4 Å²	117.4	76%	0.755	66%	0.664	S	S	*	*			trans	-146	140.7	158.9	-113.2	-40.3	0	0	0	108.8	N1655 D1659	N1655-H1657 PolarHBondContact O-N 2.96Å; H1657-D1659 PolarHBondContact O-N 3.44Å
1658	D	24.2	Very low	24.6	Very low	147 Å²	147	116.8 Å²	116.8	79%	0.786	68%	0.675	S	S	*	*			trans	-64.3	100.3	-161.9	-56	-104.4	0	0	0	115
1659	D	25.3	Very low	24.5	Very low	92 Å²	92	121.5 Å²	121.5	49%	0.492	70%	0.704	S	S	.	*			trans	-115.8	113.7	153.1	-93.7	-48.3	0	0	0	109.5	K683 H1657 D1661	K683-D1659 WeakPolarHBondContact CE-OD1 3.49Å; K683-D1659 IonicContact NZ-OD1 2.73Å; K683-D1659 PolarHBondContact NZ-OD1 3.15Å; H1657-D1659 PolarHBondContact O-N 3.44Å; D1659-D1661 VanDerWaalsContact C-N 3.34Å; D1659-D1661 PolarHBondContact O-N 3.01Å
1660	K	23.5	Very low	24.5	Very low	151 Å²	151	122.4 Å²	122.4	66%	0.657	70%	0.698	S	S	*	*			trans	-78.5	81.9	179	-72	176.9	179.8	169	0	109.8	F1662	K1660-F1662 HydrophobicContact CB-CD2 4.47Å; K1660-F1662 HydrophobicContact CB-CE2 4.43Å; K1660-F1662 PolarHBondContact O-N 3.49Å
1661	D	25.1	Very low	24.7	Very low	151 Å²	151	122.6 Å²	122.6	81%	0.807	70%	0.699	S	S	*	*			trans	-61.4	98.3	167.5	-84.8	-11.6	0	0	0	109.9	D1659 S1663	D1659-D1661 VanDerWaalsContact C-N 3.34Å; D1659-D1661 PolarHBondContact O-N 3.01Å; D1661-S1663 PolarHBondContact O-N 3.43Å
1662	F	24.2	Very low	24.7	Very low	185 Å²	185	126.2 Å²	126.2	81%	0.811	71%	0.709	S	S	*	*			trans	-70.4	62.2	164.5	-85.1	-93.6	0	0	0	109.9	K1660 G1664	K1660-F1662 HydrophobicContact CB-CD2 4.47Å; K1660-F1662 HydrophobicContact CB-CE2 4.43Å; K1660-F1662 PolarHBondContact O-N 3.49Å; F1662-G1664 PolarHBondContact O-N 3.02Å
1663	S	25.3	Very low	24.9	Very low	110 Å²	110	123.4 Å²	123.4	77%	0.769	71%	0.713	S	S	*	*			trans	-75.4	57.5	169	179.9	0	0	0	0	110.7	D1661 G1665	D1661-S1663 PolarHBondContact O-N 3.43Å; S1663-G1665 PolarHBondContact O-N 3.45Å
1664	G	25	Very low	25	Very low	63 Å²	63	122.5 Å²	122.5	65%	0.649	71%	0.705	S	S	*	*			trans	-63	101.9	156.2	0	0	0	0	0	107.4	F1662 T1666	F1662-G1664 PolarHBondContact O-N 3.02Å; G1664-T1666 PolarHBondContact O-N 3.45Å
1665	G	23.7	Very low	25	Very low	67 Å²	67	125.1 Å²	125.1	69%	0.691	72%	0.716	S	S	*	*			trans	-60.6	112	176	0	0	0	0	0	108.7	S1663 P1667	S1663-G1665 PolarHBondContact O-N 3.45Å; G1665-P1667 WeakPolarHBondContact O-CD 3.4Å
1666	T	23.2	Very low	24.9	Very low	75 Å²	75	125.9 Å²	125.9	46%	0.46	72%	0.72	S	S	.	*			trans	-65.4	115.1	-172.9	35.4	0	0	0	0	111.3	N501 G1664 T1668	N501-T1666 HydrophobicContact CB-CG2 3.74Å; G1664-T1666 PolarHBondContact O-N 3.45Å; T1666-T1668 PolarHBondContact O-N 3.25Å; T1666-T1668 VanDerWaalsContact O-N 3.13Å
1667	P	25.3	Very low	25	Very low	111 Å²	111	124 Å²	124	72%	0.721	72%	0.724	S	S	*	*			trans	-71.5	105.9	159.7	30.8	-29.3	0	0	0	106.3	G1665 P1669	G1665-P1667 WeakPolarHBondContact O-CD 3.4Å; P1667-P1669 VanDerWaalsContact O-CD 3.3Å; P1667-P1669 WeakPolarHBondContact O-CD 3.43Å
1668	T	25.7	Very low	25.2	Very low	114 Å²	114	120.6 Å²	120.6	70%	0.699	72%	0.724	S	S	*	*			trans	-70.4	115.6	171.6	32.5	0	0	0	0	107.9	T1666 S1670	T1666-T1668 PolarHBondContact O-N 3.25Å; T1666-T1668 VanDerWaalsContact O-N 3.13Å; T1668-S1670 PolarHBondContact O-N 2.95Å
1669	P	25	Very low	25.3	Very low	131 Å²	131	119.3 Å²	119.3	85%	0.851	72%	0.722	S	S	*	*			trans	-86	83.1	-166.1	33.5	-34.4	0	0	0	111.3	P1667	P1667-P1669 VanDerWaalsContact O-CD 3.3Å; P1667-P1669 WeakPolarHBondContact O-CD 3.43Å
1670	S	23.9	Very low	25.3	Very low	95 Å²	95	120.7 Å²	120.7	66%	0.664	73%	0.734	S	S	*	*			trans	-162.1	106.5	169.4	58.7	0	0	0	0	112.9	T1668	T1668-S1670 PolarHBondContact O-N 2.95Å
1671	L	27.2	Very low	25.6	Very low	157 Å²	157	120 Å²	120	82%	0.822	74%	0.738	S	S	*	*			trans	150.1	89.5	138.4	-100.3	64	0	0	0	111.5
1672	Y	25.2	Very low	25.8	Very low	203 Å²	203	119.6 Å²	119.6	80%	0.796	74%	0.736	S	S	*	*				-118.8	111.1	124.8	-94.8	-85.7	0	0	0	106.3	T1674	Y1672-T1674 HydrophobicContact CD1-CG2 4.41Å
1673	G	27.6	Very low	26.1	Very low	72 Å²	72	117.7 Å²	117.7	74%	0.742	73%	0.733	S	S	*	*			trans	-143.3	125.8	166.9	0	0	0	0	0	104.4
1674	T	25.1	Very low	26.4	Very low	98 Å²	98	119 Å²	119	60%	0.601	73%	0.731	S	S	*	*			trans	-114	161.3	-156.4	53.4	0	0	0	0	112.2	Y1672	Y1672-T1674 HydrophobicContact CD1-CG2 4.41Å
1675	E	25.3	Very low	26.5	Very low	159 Å²	159	124.1 Å²	124.1	74%	0.743	74%	0.738	S	S	*	*			trans	71.4	103.8	157.1	-64.7	147.6	-79.5	0	0	118.9
1676	D	24.6	Very low	26.9	Very low	154 Å²	154	128 Å²	128	82%	0.824	75%	0.749	S	S	*	*				70.7	120.8	120.7	-59.2	2.2	0	0	0	124.2
1677	A	25.7	Very low	26.9	Very low	105 Å²	105	132.9 Å²	132.9	87%	0.868	77%	0.767	S	S	*	*			trans	62.2	102.9	133.5	0	0	0	0	0	122
1678	A	28.6	Very low	27.1	Very low	92 Å²	92	134.5 Å²	134.5	76%	0.76	77%	0.769	S	S	*	*			trans	-154	98.7	145.4	0	0	0	0	0	112
1679	T	26.6	Very low	27.2	Very low	120 Å²	120	135.5 Å²	135.5	74%	0.736	77%	0.769	S	S	*	*				28.9	111.9	126.9	57.3	0	0	0	0	121.8
1680	T	26.4	Very low	27.3	Very low	121 Å²	121	136.5 Å²	136.5	74%	0.742	77%	0.766	S	S	*	*				54	172.7	127.1	66.4	0	0	0	0	122.3
1681	D	30	Very low	27.3	Very low	138 Å²	138	136.5 Å²	136.5	74%	0.738	77%	0.766	S	S	*	*			trans	76.6	132.8	169.7	-48.7	21	0	0	0	115.8
1682	D	29	Very low	27.3	Very low	142 Å²	142	137.8 Å²	137.8	76%	0.759	77%	0.77	S	S	*	*			cis	-167.1	173.2	-30.7	-124	-5.6	0	0	0	108.4
1683	L	30	Very low	27.2	Very low	144 Å²	144	132.9 Å²	132.9	75%	0.754	77%	0.766	S	S	*	*			trans	70.8	146.3	171.8	-47.8	-175.7	0	0	0	116.8
1684	D	31.6	Very low	27.1	Very low	137 Å²	137	135.5 Å²	135.5	73%	0.733	77%	0.773	S	S	*	*			cis	-151.3	169.9	-3.8	-124.2	-24.6	0	0	0	112.8
1685	E	26.6	Very low	27	Very low	172 Å²	172	135.4 Å²	135.4	80%	0.804	78%	0.776	S	S	*	*			trans	-68.3	151.3	-172.5	-55.5	175.2	152.7	0	0	115.7
1686	T	31.4	Very low	27.2	Very low	148 Å²	148	135 Å²	135	91%	0.908	78%	0.784	S	S	*	*				-168.8	130.3	122.1	11.1	0	0	0	0	111.6
1687	E	24.6	Very low	27.2	Very low	178 Å²	178	134.9 Å²	134.9	83%	0.832	78%	0.778	S	S	*	*			trans	-86.4	159.9	172.8	-55.2	-169.2	124.4	0	0	111.6
1688	D	29.4	Very low	27.1	Very low	144 Å²	144	136.2 Å²	136.2	77%	0.77	77%	0.766	S	S	*	*				-170.2	110.9	120.8	-103.6	-14.4	0	0	0	113.3
1689	I	27.2	Very low	27	Very low	136 Å²	136	136.5 Å²	136.5	70%	0.697	76%	0.762	S	S	*	*			trans	26.3	119.5	136.6	-9.7	-177.8	0	0	0	117.1
1690	L	28.2	Very low	26.9	Very low	151 Å²	151	138.7 Å²	138.7	79%	0.791	76%	0.764	S	S	*	*				-166.1	135.3	70.6	-91.1	163.7	0	0	0	115.1
1691	S	23.3	Very low	26.8	Very low	95 Å²	95	139.4 Å²	139.4	66%	0.664	76%	0.763	S	S	*	*			trans	11.1	141.3	142.9	61.8	0	0	0	0	120.3
1692	M	25.9	Very low	26.7	Very low	184 Å²	184	136.8 Å²	136.8	91%	0.906	75%	0.752	S	S	*	*			cis	-131.8	153.2	46.8	-79.6	-173.6	66.2	0	0	116.6
1693	S	23.5	Very low	26.6	Very low	101 Å²	101	137 Å²	137	71%	0.706	75%	0.753	S	S	*	*			trans	-98.5	151.7	-172	50.6	0	0	0	0	114.8
1694	S	26.1	Very low	26.5	Very low	127 Å²	127	138 Å²	138	89%	0.888	76%	0.759	S	S	*	*				-138.3	129	124.3	60.6	0	0	0	0	108.9
1695	S	23.3	Very low	26.2	Very low	95 Å²	95	137.9 Å²	137.9	66%	0.664	76%	0.758	S	S	*	*			trans	-134.5	139.7	-170.4	52.1	0	0	0	0	111.7
1696	V	28.7	Very low	26.3	Very low	152 Å²	152	135.7 Å²	135.7	92%	0.921	75%	0.751	S	S	*	*			trans	-140.3	135.5	154.8	-176.8	0	0	0	0	106.2
1697	H	24.4	Very low	26	Very low	151 Å²	151	135.1 Å²	135.1	70%	0.699	74%	0.742	S	S	*	*			trans	-116.5	160.5	-168.6	-108.9	-94.8	0	0	0	112.4
1698	H	24	Very low	26	Very low	133 Å²	133	134.1 Å²	134.1	62%	0.616	74%	0.741	S	S	*	*			trans	45.7	112.1	160.3	-66.6	-76.8	0	0	0	121.2	E1700	H1698-E1700 IonicContact CE1-OE2 3.64Å; H1698-E1700 IonicContact CG-OE2 3.85Å; H1698-E1700 IonicContact ND1-OE2 2.82Å; H1698-E1700 PolarHBondContact ND1-OE2 2.75Å
1699	S	25.9	Very low	25.8	Very low	97 Å²	97	130.9 Å²	130.9	68%	0.678	73%	0.726	S	S	*	*				-161.5	130.2	106.9	55.9	0	0	0	0	107.2
1700	E	24.7	Very low	25.8	Very low	167 Å²	167	128.3 Å²	128.3	78%	0.78	73%	0.725	S	S	*	*			cis	59.6	33.8	33.9	-68.6	-176.5	130.8	0	0	114.6	H1698	H1698-E1700 IonicContact CE1-OE2 3.64Å; H1698-E1700 IonicContact CG-OE2 3.85Å; H1698-E1700 IonicContact ND1-OE2 2.82Å; H1698-E1700 PolarHBondContact ND1-OE2 2.75Å
1701	L	25.9	Very low	25.8	Very low	135 Å²	135	129.3 Å²	129.3	71%	0.707	73%	0.726	S	S	*	*			trans	-157.1	37.9	167.6	-133.5	157.3	0	0	0	114.8
1702	V	27.9	Very low	25.9	Very low	83 Å²	83	131.9 Å²	131.9	50%	0.503	73%	0.727	S	S	.	*	S	Bend	trans	-127.3	-42.1	-177.3	-175.8	0	0	0	0	114.5	N1704 L1705 L1706	V1702-N1704 PolarHBondContact O-N 2.92Å; V1702-L1705 PolarHBondContact O-N 3.3Å; V1702-L1706 HydrophobicContact CG1-CD1 4.38Å
1703	D	25.8	Very low	26.1	Very low	148 Å²	148	129.1 Å²	129.1	79%	0.791	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-14.7	-168.8	-61.8	-55.2	0	0	0	115.3
1704	N	27.6	Very low	26.3	Very low	165 Å²	165	128.5 Å²	128.5	88%	0.882	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	4.3	174.3	-80.1	-34.1	0	0	0	114.7	V1702	V1702-N1704 PolarHBondContact O-N 2.92Å
1705	L	25.6	Very low	26.4	Very low	134 Å²	134	128.1 Å²	128.1	70%	0.702	69%	0.688	S	S	*	*	S	Bend	trans	-112	-4.5	-179.8	-91.5	166.7	0	0	0	115.2	V1702	V1702-L1705 PolarHBondContact O-N 3.3Å
1706	L	28.1	Very low	26.5	Very low	126 Å²	126	128.8 Å²	128.8	66%	0.66	68%	0.683	S	S	*	*	S	Bend	trans	-105.6	5.4	-179.9	-72.5	173.2	0	0	0	114.7	V1702 I1708	V1702-L1706 HydrophobicContact CG1-CD1 4.38Å; L1706-I1708 VanDerWaalsContact C-N 3.26Å; L1706-I1708 PolarHBondContact O-N 2.63Å
1707	N	26	Very low	26.6	Very low	136 Å²	136	126 Å²	126	73%	0.727	66%	0.663	S	S	*	*	S	Bend	trans	-85.3	14.2	-177.1	-138.8	-1.9	0	0	0	114.3
1708	I	24.5	Very low	26.7	Very low	157 Å²	157	125.2 Å²	125.2	81%	0.805	66%	0.664	S	S	*	*	S	Bend	trans	-132.6	45.9	-177.4	-38.6	-178.3	0	0	0	112.4	L1706	L1706-I1708 VanDerWaalsContact C-N 3.26Å; L1706-I1708 PolarHBondContact O-N 2.63Å
1709	T	25.9	Very low	26.9	Very low	75 Å²	75	123.3 Å²	123.3	46%	0.46	66%	0.658	S	S	.	*			trans	-139.8	6.6	160.9	48.1	0	0	0	0	113.9	Q1711 E1712	T1709-Q1711 PolarHBondContact O-N 2.71Å; T1709-E1712 PolarHBondContact O-N 3.35Å
1710	A	26.8	Very low	26.8	Very low	82 Å²	82	119.7 Å²	119.7	68%	0.678	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	4.4	-173.9	0	0	0	0	0	115.6
1711	Q	27.8	Very low	26.8	Very low	173 Å²	173	117.1 Å²	117.1	81%	0.808	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	-9.4	-178.5	-162.2	168.4	5.9	0	0	113.7	T1709	T1709-Q1711 PolarHBondContact O-N 2.71Å
1712	E	26.7	Very low	26.8	Very low	148 Å²	148	112.7 Å²	112.7	69%	0.692	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-18	178.3	-67.1	-170.9	131	0	0	113.6	T1709 I1715	T1709-E1712 PolarHBondContact O-N 3.35Å; E1712-I1715 PolarHBondContact O-N 3.37Å
1713	Q	28.6	Very low	26.6	Very low	126 Å²	126	115 Å²	115	59%	0.589	62%	0.618	S	S	*	*	H	α-helix	trans	-73.5	-24.8	-180	-71.4	-172.7	-17.1	0	0	114	I1715 L1716 N1717	Q1713-I1715 VanDerWaalsContact C-N 3.33Å; Q1713-L1716 PolarHBondContact O-N 3.34Å; Q1713-N1717 PolarHBondContact O-N 3.44Å; Q1713-N1717 PolarHBondContact O-ND2 2.71Å
1714	D	28.6	Very low	26.5	Very low	88 Å²	88	111 Å²	111	47%	0.471	61%	0.606	S	S	.	*	H	α-helix	trans	-69.4	-33	176.4	-71.8	-25.4	0	0	0	111.3
1715	I	27.9	Very low	26.4	Very low	120 Å²	120	107.2 Å²	107.2	62%	0.615	59%	0.588	S	S	*	*	H	α-helix	trans	-68.7	-34.4	175.7	-60.7	176.5	0	0	0	111.6	E1712 Q1713 I1719	E1712-I1715 PolarHBondContact O-N 3.37Å; Q1713-I1715 VanDerWaalsContact C-N 3.33Å; I1715-I1719 WeakPolarHBondContact O-CD1 3.41Å
1716	L	26.1	Very low	26.2	Very low	108 Å²	108	108.2 Å²	108.2	57%	0.565	58%	0.583	S	S	*	*	H	α-helix	trans	-79.5	-28	-179.3	-144.6	77.5	0	0	0	113	Q1713	Q1713-L1716 PolarHBondContact O-N 3.34Å
1717	N	29.3	Very low	26	Very low	93 Å²	93	107.1 Å²	107.1	50%	0.497	58%	0.583	S	S	.	*	H	α-helix	trans	-79.4	-29.3	-176.1	-81.7	-45	0	0	0	114.3	Q1713 I1719 S1720	Q1713-N1717 PolarHBondContact O-N 3.44Å; Q1713-N1717 PolarHBondContact O-ND2 2.71Å; N1717-I1719 PolarHBondContact O-N 3.43Å; N1717-S1720 PolarHBondContact O-N 3.08Å; N1717-S1720 PolarHBondContact O-OG 3.16Å
1718	D	27.8	Very low	25.9	Very low	136 Å²	136	104.4 Å²	104.4	73%	0.727	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-19.4	173.6	-116.6	-9.7	0	0	0	112.5
1719	I	28.1	Very low	25.9	Very low	92 Å²	92	104 Å²	104	47%	0.472	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.2	-21	176.5	-61.8	174.8	0	0	0	111.7	R185 V188 I1715 N1717 N1721	R185-I1719 PolarHBondContact NH1-O 2.96Å; V188-I1719 HydrophobicContact CB-CG2 4.46Å; V188-I1719 HydrophobicContact CG1-CG2 3.98Å; V188-I1719 HydrophobicContact CG2-CG2 3.58Å; I1715-I1719 WeakPolarHBondContact O-CD1 3.41Å; N1717-I1719 PolarHBondContact O-N 3.43Å; I1719-N1721 PolarHBondContact O-N 2.91Å
1720	S	24	Very low	25.8	Very low	22 Å²	22	103.6 Å²	103.6	15%	0.154	55%	0.551	C	S	.	*	S	Bend	trans	-84.5	-9.8	-164.6	73.1	0	0	0	0	116.4	R185 I192 N1717 P1722	R185-S1720 PolarHBondContact NH2-O 2.6Å; I192-S1720 WeakPolarHBondContact CD1-O 3.48Å; N1717-S1720 PolarHBondContact O-N 3.08Å; N1717-S1720 PolarHBondContact O-OG 3.16Å; S1720-P1722 WeakPolarHBondContact O-CD 3.18Å
1721	N	25	Very low	25.6	Very low	113 Å²	113	101.7 Å²	101.7	60%	0.604	53%	0.532	S	S	*	.			trans	-121	92.9	-169.2	-96.4	-60.1	0	0	0	117.3	I1719	I1719-N1721 PolarHBondContact O-N 2.91Å
1722	P	25.7	Very low	25.5	Very low	41 Å²	41	95.2 Å²	95.2	27%	0.266	50%	0.503	S	S	.	.			trans	-124.9	48.2	169.6	40.5	-27.6	0	0	0	114.1	R185 S1720 A1724	R185-P1722 VanDerWaalsContact NE-CG 3.34Å; S1720-P1722 WeakPolarHBondContact O-CD 3.18Å; P1722-A1724 VanDerWaalsContact C-N 3.3Å
1723	T	22.9	Very low	25.4	Very low	131 Å²	131	92 Å²	92	80%	0.804	50%	0.501	S	S	*	.	S	Bend	trans	-94.1	13.9	156.6	41.7	0	0	0	0	112.8
1724	A	23.8	Very low	25.2	Very low	66 Å²	66	92.6 Å²	92.6	55%	0.545	51%	0.508	S	S	.	.	S	Bend	trans	-139.6	133.4	160.5	0	0	0	0	0	109.9	P1722 R1726	P1722-A1724 VanDerWaalsContact C-N 3.3Å; A1724-R1726 PolarHBondContact O-N 3.42Å
1725	T	24.7	Very low	24.9	Very low	84 Å²	84	92.8 Å²	92.8	52%	0.515	51%	0.514	S	S	.	.			trans	-72.3	80.3	167	56	0	0	0	0	108.9	R1393 P1727	R1393-T1725 PolarHBondContact NH2-OG1 3Å; T1725-P1727 VanDerWaalsContact O-CD 3.29Å; T1725-P1727 WeakPolarHBondContact O-CD 3.3Å
1726	R	22.3	Very low	24.8	Very low	155 Å²	155	92 Å²	92	59%	0.585	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-59.9	116.5	168.5	-75.8	-179.3	171.1	177.7	-2.6	107.7	A1724	A1724-R1726 PolarHBondContact O-N 3.42Å
1727	P	23.7	Very low	24.7	Very low	103 Å²	103	90 Å²	90	67%	0.669	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-65.3	157.8	165.3	31.1	-34.1	0	0	0	108.9	T1725 R1729	T1725-P1727 VanDerWaalsContact O-CD 3.29Å; T1725-P1727 WeakPolarHBondContact O-CD 3.3Å; P1727-R1729 PolarHBondContact O-N 3.43Å
1728	L	24.4	Very low	24.5	Very low	80 Å²	80	88 Å²	88	42%	0.419	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-50.1	116.4	175	-79.8	125.4	0	0	0	110.3	Y415 A419 L1730	Y415-L1728 HydrophobicContact CE1-CD1 4.32Å; Y415-L1728 HydrophobicContact CE2-CD1 4.45Å; Y415-L1728 WeakPolarHBondContact OH-CD1 3.44Å; A419-L1728 HydrophobicContact CB-CD1 3.5Å; A419-L1728 VanDerWaalsContact CB-CD1 3.5Å; A419-L1728 HydrophobicContact CB-CD2 3.89Å; A419-L1728 HydrophobicContact CB-CG 4.35Å; L1728-L1730 PolarHBondContact O-N 2.79Å
1729	R	24.2	Very low	24.4	Very low	149 Å²	149	84.4 Å²	84.4	56%	0.562	47%	0.469	S	S	*	.			trans	-80.7	69.6	-176.5	-78	179.7	153.4	-137.6	-13.2	111.1	D213 P1727	D213-R1729 VanDerWaalsContact CG-NH1 3.32Å; D213-R1729 IonicContact OD1-CZ 2.67Å; D213-R1729 IonicContact OD1-NH1 2.79Å; D213-R1729 PolarHBondContact OD1-NH1 3.25Å; D213-R1729 IonicContact OD2-CZ 2.91Å; D213-R1729 IonicContact OD2-NH1 3.77Å; D213-R1729 PolarHBondContact OD2-NH1 3.05Å; D213-R1729 IonicContact OD2-NH2 3.86Å; D213-R1729 PolarHBondContact OD2-NH2 3.5Å; P1727-R1729 PolarHBondContact O-N 3.43Å
1730	L	22.8	Very low	24.2	Very low	65 Å²	65	85.7 Å²	85.7	34%	0.34	48%	0.476	S	S	.	.			trans	-66.8	143.3	147.2	-75.2	130.2	0	0	0	108.3	L422 K426 L1728	L422-L1730 HydrophobicContact CB-CD1 3.67Å; L422-L1730 HydrophobicContact CB-CD2 4.4Å; L422-L1730 HydrophobicContact CD1-CD1 3.99Å; L422-L1730 HydrophobicContact CG-CD1 4.44Å; L422-L1730 WeakPolarHBondContact O-CD2 3.4Å; K426-L1730 HydrophobicContact CB-CD2 4.32Å; K426-L1730 HydrophobicContact CG-CD2 4.22Å; L1728-L1730 PolarHBondContact O-N 2.79Å
1731	P	23.6	Very low	24.1	Very low	43 Å²	43	87.4 Å²	87.4	28%	0.279	49%	0.487	S	S	.	.	S	Bend	trans	-71.9	156.9	-174.9	33.4	-38	0	0	0	110.9
1732	L	25.8	Very low	24.3	Very low	36 Å²	36	85.3 Å²	85.3	19%	0.188	49%	0.486	C	S	.	.			trans	68.4	81.2	-175.9	-59	95.7	0	0	0	116.8	V1411 H1414	V1411-L1732 HydrophobicContact CB-CD2 4.46Å; V1411-L1732 HydrophobicContact CG2-CB 4.32Å; V1411-L1732 HydrophobicContact CG2-CD1 3.85Å; V1411-L1732 HydrophobicContact CG2-CD2 3.85Å; V1411-L1732 HydrophobicContact CG2-CG 4.23Å; H1414-L1732 HydrophobicContact CB-CD2 3.77Å
1733	A	23.8	Very low	24.1	Very low	80 Å²	80	88.7 Å²	88.7	66%	0.661	51%	0.506	S	S	*	.			trans	-150.2	95.4	146.8	0	0	0	0	0	111.6
1734	I	23.9	Very low	24.3	Very low	140 Å²	140	87.2 Å²	87.2	72%	0.718	50%	0.497	S	S	*	.			trans	-176.3	142	147.2	-99	152.6	0	0	0	109
1735	P	24.1	Very low	24.3	Very low	92 Å²	92	88.5 Å²	88.5	60%	0.597	51%	0.508	S	S	*	.			trans	-80.8	173.1	175.2	35.4	-36.7	0	0	0	112.6
1736	E	24.3	Very low	24.2	Very low	104 Å²	104	87.2 Å²	87.2	49%	0.486	51%	0.511	S	S	.	.			trans	70	90.8	175.3	-56.4	-172.9	-165.3	0	0	115.2	F1290 H1291 L1294	F1290-E1736 WeakPolarHBondContact CD1-OE1 3.06Å; H1291-E1736 IonicContact CE1-OE1 3.85Å; L1294-E1736 WeakPolarHBondContact CD1-OE1 3.28Å
1737	L	25.1	Very low	24.3	Very low	65 Å²	65	85.7 Å²	85.7	34%	0.34	52%	0.524	S	S	.	.			trans	-113.2	126.1	160.6	-87.7	96.5	0	0	0	110.5	L214 L217	L214-L1737 HydrophobicContact CD1-CD2 3.96Å; L214-L1737 HydrophobicContact CD1-CG 4.18Å; L217-L1737 HydrophobicContact CD2-CD1 3.69Å; L217-L1737 HydrophobicContact CD2-CD2 3.6Å; L217-L1737 HydrophobicContact CD2-CG 4.29Å; L217-L1737 HydrophobicContact CG-CD2 4.04Å
1738	L	24.2	Very low	24.4	Very low	50 Å²	50	83.9 Å²	83.9	26%	0.262	52%	0.524	S	S	.	.			trans	-168.4	72.9	134.8	-100	174.6	0	0	0	107.5	V1440 I1449	V1440-L1738 HydrophobicContact CG1-CD2 4.33Å; I1449-L1738 HydrophobicContact CB-CD1 3.8Å; I1449-L1738 HydrophobicContact CD1-CD1 3.82Å; I1449-L1738 HydrophobicContact CD1-CD2 3.95Å; I1449-L1738 HydrophobicContact CG1-CD1 4.44Å; I1449-L1738 HydrophobicContact CG2-CD1 3.74Å
1739	T	25.6	Very low	24.3	Very low	62 Å²	62	87.8 Å²	87.8	38%	0.38	55%	0.546	S	S	.	.			trans	-143.9	108.4	-172.6	47.1	0	0	0	0	112.8	L214	L214-T1739 WeakPolarHBondContact CD2-O 3.08Å
1740	I	24.1	Very low	24.4	Very low	119 Å²	119	87.6 Å²	87.6	61%	0.61	56%	0.561	S	S	*	*			trans	70.1	68.4	149.6	-38.3	172.4	0	0	0	118.4	N1441	N1441-I1740 WeakPolarHBondContact OD1-CG1 3.39Å
1741	S	23.2	Very low	24.5	Very low	57 Å²	57	93.2 Å²	93.2	40%	0.399	59%	0.586	S	S	.	*			trans	-145.3	157.6	146	66.5	0	0	0	0	110	E218	E218-S1741 WeakPolarHBondContact CB-OG 3.28Å; E218-S1741 WeakPolarHBondContact OE1-CB 3.26Å; E218-S1741 PolarHBondContact OE1-N 3.41Å; E218-S1741 PolarHBondContact OE1-OG 3.06Å; E218-S1741 WeakPolarHBondContact OE2-CB 3.49Å
1742	A	27.6	Very low	24.4	Very low	70 Å²	70	97.6 Å²	97.6	58%	0.579	61%	0.611	S	S	*	*			cis	-138.8	154.2	-5.8	0	0	0	0	0	110.2
1743	T	22.7	Very low	24.2	Very low	112 Å²	112	101.2 Å²	101.2	69%	0.687	64%	0.64	S	S	*	*	S	Bend	trans	-93	111.1	153.1	48.1	0	0	0	0	108.7
1744	T	25.6	Very low	24.3	Very low	100 Å²	100	101.1 Å²	101.1	61%	0.613	65%	0.647	S	S	*	*			trans	51.3	102.3	156.8	55.4	0	0	0	0	118.1
1745	A	23.7	Very low	24.3	Very low	93 Å²	93	104 Å²	104	77%	0.769	65%	0.654	S	S	*	*			trans	-126.8	87.4	149.6	0	0	0	0	0	108.4
1746	G	24.6	Very low	24.2	Very low	57 Å²	57	104.7 Å²	104.7	59%	0.588	66%	0.657	S	S	*	*			trans	-71.1	150.7	171.9	0	0	0	0	0	110.7	E1434	E1434-G1746 WeakPolarHBondContact OE1-CA 3.36Å
1747	S	23.3	Very low	24.1	Very low	122 Å²	122	107.5 Å²	107.5	85%	0.853	67%	0.672	S	S	*	*			trans	-128.8	133.8	-164.3	151.2	0	0	0	0	113.5
1748	G	25.8	Very low	24.1	Very low	66 Å²	66	111.9 Å²	111.9	68%	0.68	69%	0.694	S	S	*	*			trans	137.1	116.8	144	0	0	0	0	0	116.1
1749	D	22.6	Very low	24.3	Very low	162 Å²	162	117.6 Å²	117.6	87%	0.866	75%	0.748	S	S	*	*			trans	-63.2	145	170.5	-49.3	-96.4	0	0	0	112.7
1750	T	27	Very low	24.2	Very low	145 Å²	145	120.4 Å²	120.4	89%	0.89	77%	0.767	S	S	*	*			trans	-142.4	119.9	143.6	15.7	0	0	0	0	110.1
1751	Q	23.3	Very low	24.2	Very low	183 Å²	183	120.4 Å²	120.4	86%	0.855	78%	0.775	S	S	*	*			trans	-73.6	148.8	171.5	-61.5	173.8	-10.1	0	0	110.5
1752	V	22.4	Very low	24.3	Very low	134 Å²	134	123.9 Å²	123.9	81%	0.812	80%	0.796	S	S	*	*			trans	-175.9	123.3	130.6	141.8	0	0	0	0	111.4
1753	S	22.4	Very low	24.1	Very low	113 Å²	113	127.1 Å²	127.1	79%	0.79	81%	0.809	S	S	*	*			trans	30.6	121.4	161.1	66.5	0	0	0	0	121.8
1754	G	24.4	Very low	24.2	Very low	78 Å²	78	128.1 Å²	128.1	80%	0.804	82%	0.816	S	S	*	*			trans	-167.6	111.4	163.4	0	0	0	0	0	113.4
1755	F	23.9	Very low	24.1	Very low	199 Å²	199	129.9 Å²	129.9	87%	0.873	83%	0.83	S	S	*	*			trans	-56.7	133.2	-170.9	-88.5	-117.5	0	0	0	117.1
1756	T	22.4	Very low	24.1	Very low	107 Å²	107	132.6 Å²	132.6	66%	0.656	83%	0.834	S	S	*	*			trans	3.1	125.3	132.9	56.8	0	0	0	0	119.3
1757	M	22.4	Very low	24.1	Very low	163 Å²	163	138.4 Å²	138.4	80%	0.803	85%	0.853	S	S	*	*				176.2	138.1	114.9	-104.2	-168.5	-72.2	0	0	113
1758	I	24.4	Very low	24.2	Very low	158 Å²	158	139.8 Å²	139.8	81%	0.81	85%	0.853	S	S	*	*			trans	63.8	125.1	152.9	-56.1	163	0	0	0	115.6
1759	A	28.9	Very low	24	Very low	169 Å²	169	146.5 Å²	146.5	100%	1.397	87%	0.869	S	S	*	*			cis	-133.3	0	5.6	0	0	0	0	0	111.4

Retrieved 1,759 of 1,759 residues in 2520.6 ms (Link to these results)

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