A0A2K6D880_MACNE Loading...

Transmembrane protein 63B

AlphaFold DB , UniProt , Accession A0A2K6D880, Species MACNE (Macaca nemestrina, Pig-tailed macaque), Gene TMEM63B, Length 832 aa.

						>A0A2K6D880_MACNE|A0A2K6D880|TMEM63B
MLPFLLATLGTTALNNSNPKDYCYSARIRSTVLQGLPFGGVPTVLALDFMCFLALLFLFSILRKVAWDYGRLALVTDADRLRRQERDRVEQEYVASAMHGDSHDRYERLTSVSSSVDFDQRDNGFCSWLTAIFRIKDDEIRDKCGGDAVHYLSFQRHIIGLLVVVGVLSVGIVLPVNFSGDLLENNAYSFGRTTIANLKSGNNLLWLHTSFAFLYLLLTVYSMRRHTSKMRYKEDDLVKRTLFINGISKYAESEKIKKHFEEAYPNCTVLEARPCYNVARLMFLDAERKKAERGKLYFTNLQSKENVPTMINPKPCGHLCCCVVRGCEQVEAIEYYTKLEQKLKEDYKREKEKVNEKPLGMAFVTFHNETITAIILKDFNVCKCQGCTCRGEPRPSSCSESLHISNWTVSYAPDPQNIYWEHLSIRGFIWWLRCLVINVVLFILLFFLTTPAIIITTMDKFNVTKPVEYLNNPIITQFFPTLLLWCFSALLPTIVYYSAFFEAHWTRSGENRTTMHKCYTFLIFMVLLLPSLGLSSLDLFFRWLFDKKFLAEAAIRFECVFLPDNGAFFVNYVIASAFIGNAMDLLRIPGLLMYMIRLCLARSAAERRNVKRHQAYEFQFGAAYAWMMCVFTVVMTYSITCPIIVPFGLMYMLLKHLVDRYNLYYAYLPAKLDKKIHSGAVNQVVAAPILCLFWLLFFSTMRTGFLAPTSMFTFVVLVITIVICLCHVCFGHFKYLSAHNYKIEHTETDTVDPRSNGRPSTAAAVPKSAKYIAQVLQDSEVDGDGDGAPGSSGDEPPSSSSQDEELLMPPDGLTDTDFQSCEDSLIENEIHQ
					

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(Predicted Aligned Error values between residue pairs)

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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	32.8	Very low	35.8	Very low	196 Å²	196	89.9 Å²	89.9	97%	0.966	52%	0.519	S	S	*	.				0	-52.2	0	-86.6	-168.2	-167.8	0	0	113	F4 L5	M1-F4 WeakPolarHBondContact O-CB 3.46Å; M1-F4 PolarHBondContact O-N 3.42Å; M1-L5 PolarHBondContact O-N 2.89Å
2	L	34.1	Very low	35.4	Very low	115 Å²	115	92.3 Å²	92.3	60%	0.602	54%	0.536	S	S	*	.	H	α-helix	trans	-51.1	-46.6	178.9	-142.9	85.8	0	0	0	115.2	F4 L5 L6	L2-F4 VanDerWaalsContact C-N 3.32Å; L2-F4 PolarHBondContact O-N 3.13Å; L2-L5 PolarHBondContact O-N 3.44Å; L2-L6 WeakPolarHBondContact O-CG 3.26Å; L2-L6 PolarHBondContact O-N 2.97Å; L2-L6 VanDerWaalsContact O-N 3.1Å
3	P	35.1	Very low	35.2	Very low	41 Å²	41	93.5 Å²	93.5	27%	0.266	56%	0.563	S	S	.	*	H	α-helix	trans	-70.9	-26.8	178.5	21.7	-26.8	0	0	0	113.4	A7	P3-A7 WeakPolarHBondContact O-CB 3.24Å; P3-A7 PolarHBondContact O-N 3.17Å; P3-A7 VanDerWaalsContact O-N 3.14Å
4	F	36.6	Very low	35.8	Very low	143 Å²	143	98.4 Å²	98.4	63%	0.627	58%	0.584	S	S	*	*	H	α-helix	trans	-74	-38.6	176.9	-158.3	-94.2	0	0	0	111.3	M1 L2 A7 T8	M1-F4 WeakPolarHBondContact O-CB 3.46Å; M1-F4 PolarHBondContact O-N 3.42Å; L2-F4 VanDerWaalsContact C-N 3.32Å; L2-F4 PolarHBondContact O-N 3.13Å; F4-A7 PolarHBondContact O-N 2.75Å; F4-T8 PolarHBondContact O-N 3.08Å; F4-T8 PolarHBondContact O-OG1 2.73Å
5	L	38.6	Very low	35.8	Very low	78 Å²	78	102.1 Å²	102.1	41%	0.408	60%	0.6	S	S	.	*	H	α-helix	trans	-66.9	-40.9	175.1	-115.5	133.1	0	0	0	112	M1 L2 T8 L9 L550	M1-L5 PolarHBondContact O-N 2.89Å; L2-L5 PolarHBondContact O-N 3.44Å; L5-T8 PolarHBondContact O-N 3.39Å; L5-T8 PolarHBondContact O-OG1 3.03Å; L5-L9 HydrophobicContact CD2-CD1 4.38Å; L5-L9 WeakPolarHBondContact O-CD1 3.29Å; L5-L9 PolarHBondContact O-N 3.42Å; L5-L550 HydrophobicContact CD2-CD1 4.05Å
6	L	41.8	Very low	35.8	Very low	26 Å²	26	106.4 Å²	106.4	14%	0.136	62%	0.619	C	S	.	*	H	α-helix	trans	-66.7	-38.3	176.2	-75.9	162.4	0	0	0	112.2	L2 T8 L9 G10 A554 F557	L2-L6 WeakPolarHBondContact O-CG 3.26Å; L2-L6 PolarHBondContact O-N 2.97Å; L2-L6 VanDerWaalsContact O-N 3.1Å; L6-T8 VanDerWaalsContact C-N 3.33Å; L6-T8 PolarHBondContact O-N 3.29Å; L6-L9 PolarHBondContact O-N 3.38Å; L6-G10 PolarHBondContact O-N 2.82Å; L6-A554 HydrophobicContact CD2-CB 4.44Å; L6-F557 HydrophobicContact CD1-CD2 4.01Å; L6-F557 HydrophobicContact CD1-CE2 4.15Å; L6-F557 HydrophobicContact CD2-CD2 3.74Å; L6-F557 HydrophobicContact CD2-CE2 4.05Å
7	A	38.3	Very low	36	Very low	43 Å²	43	105 Å²	105	36%	0.355	62%	0.617	S	S	.	*	H	α-helix	trans	-66.1	-31.5	177.9	0	0	0	0	0	113.3	P3 F4 F705	P3-A7 WeakPolarHBondContact O-CB 3.24Å; P3-A7 PolarHBondContact O-N 3.17Å; P3-A7 VanDerWaalsContact O-N 3.14Å; F4-A7 PolarHBondContact O-N 2.75Å; A7-F705 HydrophobicContact CB-CB 4.17Å
8	T	36.1	Very low	36.3	Very low	91 Å²	91	105.2 Å²	105.2	56%	0.558	62%	0.615	S	S	*	*	H	α-helix	trans	-78.8	-17.8	177.1	46.9	0	0	0	0	114.2	F4 L5 L6	F4-T8 PolarHBondContact O-N 3.08Å; F4-T8 PolarHBondContact O-OG1 2.73Å; L5-T8 PolarHBondContact O-N 3.39Å; L5-T8 PolarHBondContact O-OG1 3.03Å; L6-T8 VanDerWaalsContact C-N 3.33Å; L6-T8 PolarHBondContact O-N 3.29Å
9	L	35.8	Very low	37	Very low	66 Å²	66	103.1 Å²	103.1	35%	0.346	61%	0.605	S	S	.	*	H	α-helix	trans	-97.2	-10.9	-178.3	-79.6	157.5	0	0	0	113.4	L5 L6 T11 L550	L5-L9 HydrophobicContact CD2-CD1 4.38Å; L5-L9 WeakPolarHBondContact O-CD1 3.29Å; L5-L9 PolarHBondContact O-N 3.42Å; L6-L9 PolarHBondContact O-N 3.38Å; L9-T11 PolarHBondContact O-N 3.17Å; L9-T11 VanDerWaalsContact O-N 3.15Å; L9-L550 HydrophobicContact CD1-CB 3.92Å; L9-L550 HydrophobicContact CD1-CD1 4.35Å
10	G	33.3	Very low	37.5	Very low	66 Å²	66	105.2 Å²	105.2	68%	0.68	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	6.6	-174.4	0	0	0	0	0	116.6	L6	L6-G10 PolarHBondContact O-N 2.82Å
11	T	31.7	Very low	37.9	Very low	124 Å²	124	105 Å²	105	76%	0.761	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	9.9	-173.9	44.4	0	0	0	0	115.6	L9	L9-T11 PolarHBondContact O-N 3.17Å; L9-T11 VanDerWaalsContact O-N 3.15Å
12	T	30.4	Very low	38.8	Very low	119 Å²	119	101.5 Å²	101.5	73%	0.73	58%	0.58	S	S	*	*	S	Bend	trans	-129.5	108.7	-179.4	50.3	0	0	0	0	115
13	A	33.5	Very low	39.6	Very low	107 Å²	107	96.6 Å²	96.6	88%	0.884	56%	0.555	S	S	*	*			trans	78.7	123.2	148.6	0	0	0	0	0	121.6
14	L	42.9	Very low	40	Very low	163 Å²	163	99.7 Å²	99.7	85%	0.853	56%	0.562	S	S	*	*			trans	-72.1	152.1	167.8	-82	106.2	0	0	0	113.3
15	N	35.9	Very low	40	Very low	154 Å²	154	96.9 Å²	96.9	82%	0.824	56%	0.56	S	S	*	*			trans	-157.2	107.3	140.2	-111	-11.3	0	0	0	114	S17	N15-S17 PolarHBondContact O-N 2.97Å
16	N	36.5	Very low	40	Very low	171 Å²	171	96.3 Å²	96.3	91%	0.914	57%	0.567	S	S	*	*	S	Bend	trans	30.8	34.2	140	-98.7	7.4	0	0	0	124.1
17	S	38.3	Very low	40	Very low	82 Å²	82	98 Å²	98	57%	0.573	57%	0.571	S	S	*	*	S	Bend	trans	-123.1	138.3	149.3	56.8	0	0	0	0	108.3	N15 P19	N15-S17 PolarHBondContact O-N 2.97Å; S17-P19 WeakPolarHBondContact O-CD 3.34Å
18	N	41.8	Very low	39.9	Very low	108 Å²	108	101 Å²	101	58%	0.578	58%	0.58	S	S	*	*			trans	-53.8	114.9	178.8	-109.2	-17.3	0	0	0	107.9	K20 D21 Y22	N18-K20 PolarHBondContact O-N 3.16Å; N18-D21 HydrophobicContact CB-CB 4.34Å; N18-D21 VanDerWaalsContact CB-OD2 3.28Å; N18-D21 WeakPolarHBondContact CB-OD2 3.39Å; N18-D21 PolarHBondContact O-N 3.24Å; N18-Y22 PolarHBondContact O-N 3.15Å
19	P	48.9	Very low	39.9	Very low	66 Å²	66	108 Å²	108	43%	0.429	60%	0.596	S	S	.	*	H	α-helix	trans	-59.6	-25.6	-175.5	19.7	-30.4	0	0	0	111.8	S17 Y22 C23	S17-P19 WeakPolarHBondContact O-CD 3.34Å; P19-Y22 PolarHBondContact O-N 3.43Å; P19-C23 WeakPolarHBondContact O-CB 3.29Å; P19-C23 PolarHBondContact O-N 3.49Å; P19-C23 PolarHBondContact O-SG 3.23Å; P19-C23 VanDerWaalsContact O-SG 3.35Å
20	K	48	Very low	40.1	Very low	145 Å²	145	109.3 Å²	109.3	63%	0.63	61%	0.611	S	S	*	*	H	α-helix	trans	-57.8	-48.8	170.2	-69.6	-177.3	177.4	178.8	0	112.4	N18 Y22 C23 Y24	N18-K20 PolarHBondContact O-N 3.16Å; K20-Y22 VanDerWaalsContact C-N 3.33Å; K20-Y22 PolarHBondContact O-N 3.45Å; K20-C23 PolarHBondContact O-N 2.95Å; K20-Y24 WeakPolarHBondContact O-CD2 3.1Å; K20-Y24 PolarHBondContact O-N 3.39Å
21	D	44.5	Very low	40.4	Very low	102 Å²	102	109.7 Å²	109.7	55%	0.545	60%	0.601	S	S	.	*	H	α-helix	trans	-69.1	-33.6	-176.6	-63.9	-30.9	0	0	0	111.5	N18 S25	N18-D21 HydrophobicContact CB-CB 4.34Å; N18-D21 VanDerWaalsContact CB-OD2 3.28Å; N18-D21 WeakPolarHBondContact CB-OD2 3.39Å; N18-D21 PolarHBondContact O-N 3.24Å; D21-S25 WeakPolarHBondContact O-CB 3.26Å; D21-S25 PolarHBondContact O-N 3Å
22	Y	52.8	Low	40.6	Very low	121 Å²	121	110.5 Å²	110.5	48%	0.475	61%	0.605	S	S	.	*	H	α-helix	trans	-67.6	-43.9	172.3	-171.5	-94.9	0	0	0	112	N18 P19 K20 Y24 S25 A26 I555	N18-Y22 PolarHBondContact O-N 3.15Å; P19-Y22 PolarHBondContact O-N 3.43Å; K20-Y22 VanDerWaalsContact C-N 3.33Å; K20-Y22 PolarHBondContact O-N 3.45Å; Y22-Y24 PolarHBondContact O-N 2.71Å; Y22-S25 PolarHBondContact O-N 3.05Å; Y22-A26 VanDerWaalsContact O-CB 3.23Å; Y22-A26 WeakPolarHBondContact O-CB 3.08Å; Y22-A26 PolarHBondContact O-N 3.07Å; Y22-I555 HydrophobicContact CD1-CG2 3.99Å; Y22-I555 HydrophobicContact CE1-CG2 4.14Å
23	C	50.6	Low	41	Very low	13 Å²	13	108.7 Å²	108.7	9%	0.088	59%	0.591	C	S	.	*	H	α-helix	trans	-63.2	-38.7	176.3	-76.2	0	0	0	0	113.3	P19 K20 C559 L562	P19-C23 WeakPolarHBondContact O-CB 3.29Å; P19-C23 PolarHBondContact O-N 3.49Å; P19-C23 PolarHBondContact O-SG 3.23Å; P19-C23 VanDerWaalsContact O-SG 3.35Å; K20-C23 PolarHBondContact O-N 2.95Å; C23-C559 WeakPolarHBondContact CA-SG 3.33Å; C23-C559 HydrophobicContact CB-CB 3.7Å; C23-C559 WeakPolarHBondContact CB-SG 3.24Å; C23-C559 WeakPolarHBondContact SG-CB 3.42Å; C23-C559 CovalentContact SG-SG 2.03Å; C23-C559 PolarHBondContact SG-SG 3.35Å; C23-L562 HydrophobicContact CB-CD1 4.31Å
24	Y	43.7	Very low	41.4	Very low	106 Å²	106	107.7 Å²	107.7	42%	0.416	57%	0.567	S	S	.	*	H	α-helix	trans	-71.8	-50.6	174.2	-82.5	-74.6	0	0	0	110.8	K20 Y22 A26 R27 I28 L562	K20-Y24 WeakPolarHBondContact O-CD2 3.1Å; K20-Y24 PolarHBondContact O-N 3.39Å; Y22-Y24 PolarHBondContact O-N 2.71Å; Y24-A26 PolarHBondContact O-N 2.77Å; Y24-R27 PolarHBondContact O-N 3.27Å; Y24-I28 VanDerWaalsContact O-CD1 3.28Å; Y24-I28 WeakPolarHBondContact O-CD1 3.47Å; Y24-I28 WeakPolarHBondContact O-CG1 3.07Å; Y24-I28 PolarHBondContact O-N 3.46Å; Y24-I28 VanDerWaalsContact O-N 3.08Å; Y24-L562 HydrophobicContact CE1-CD2 4.44Å; Y24-L562 HydrophobicContact CE2-CD2 4.4Å
25	S	36.5	Very low	41.9	Very low	83 Å²	83	103.8 Å²	103.8	58%	0.58	57%	0.567	S	S	*	*	H	α-helix	trans	-66.7	-34.5	-174.3	-159.8	0	0	0	0	114.3	D21 Y22 R27	D21-S25 WeakPolarHBondContact O-CB 3.26Å; D21-S25 PolarHBondContact O-N 3Å; Y22-S25 PolarHBondContact O-N 3.05Å; S25-R27 PolarHBondContact O-N 2.98Å
26	A	38.8	Very low	43	Very low	66 Å²	66	99.9 Å²	99.9	55%	0.545	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-16	177.5	0	0	0	0	0	114.1	Y22 Y24	Y22-A26 VanDerWaalsContact O-CB 3.23Å; Y22-A26 WeakPolarHBondContact O-CB 3.08Å; Y22-A26 PolarHBondContact O-N 3.07Å; Y24-A26 PolarHBondContact O-N 2.77Å
27	R	42.8	Very low	44.6	Very low	61 Å²	61	95.2 Å²	95.2	23%	0.23	52%	0.524	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-13.6	-175.8	-148.8	177.4	-155.2	162.5	3.4	114.7	Y24 S25 R29 P530 N565	Y24-R27 PolarHBondContact O-N 3.27Å; S25-R27 PolarHBondContact O-N 2.98Å; R27-R29 PolarHBondContact O-N 3.26Å; R27-P530 PolarHBondContact NH2-O 3.24Å; R27-N565 PolarHBondContact NH1-ND2 3.14Å; R27-N565 PolarHBondContact NH1-OD1 2.75Å; R27-N565 PolarHBondContact NH2-ND2 2.89Å; R27-N565 PolarHBondContact NH2-OD1 3.21Å; R27-N565 VanDerWaalsContact NH2-OD1 3.15Å
28	I	36.2	Very low	46.4	Very low	106 Å²	106	93.6 Å²	93.6	54%	0.544	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-8.9	177.2	-81.3	162.8	0	0	0	113.8	Y24	Y24-I28 VanDerWaalsContact O-CD1 3.28Å; Y24-I28 WeakPolarHBondContact O-CD1 3.47Å; Y24-I28 WeakPolarHBondContact O-CG1 3.07Å; Y24-I28 PolarHBondContact O-N 3.46Å; Y24-I28 VanDerWaalsContact O-N 3.08Å
29	R	35.3	Very low	47.8	Very low	238 Å²	238	89.6 Å²	89.6	90%	0.898	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	1.5	-174	-86.5	-174.1	178.3	-177.9	-0.2	117.4	R27	R27-R29 PolarHBondContact O-N 3.26Å
30	S	39.2	Very low	49	Very low	94 Å²	94	86.5 Å²	86.5	66%	0.657	47%	0.471	S	S	*	.	S	Bend	trans	-146.5	22.6	-166.2	68.8	0	0	0	0	120.3
31	T	40.3	Very low	50.7	Low	75 Å²	75	79.9 Å²	79.9	46%	0.46	44%	0.443	S	S	.	.			trans	-137.8	126.7	167.3	59.9	0	0	0	0	113.3	L33 Q34	T31-L33 PolarHBondContact O-N 3Å; T31-Q34 PolarHBondContact O-N 3.1Å; T31-Q34 WeakPolarHBondContact OG1-CG 3.48Å; T31-Q34 PolarHBondContact OG1-OE1 3.44Å
32	V	36.8	Very low	52.8	Low	141 Å²	141	78.5 Å²	78.5	86%	0.855	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-11.4	179.9	176.1	0	0	0	0	113.2
33	L	38.5	Very low	54.2	Low	81 Å²	81	75.6 Å²	75.6	42%	0.424	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-2.2	-176.4	-65.2	168.7	0	0	0	114.1	T31 G35 L36 V44	T31-L33 PolarHBondContact O-N 3Å; L33-G35 PolarHBondContact O-N 3.46Å; L33-L36 HydrophobicContact CD2-CD1 4.28Å; L33-V44 HydrophobicContact CD1-CG2 4.44Å; L33-V44 HydrophobicContact CD2-CG2 4.47Å
34	Q	42.2	Very low	55.7	Low	85 Å²	85	75.9 Å²	75.9	40%	0.397	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	116	178.5	-93.7	171.3	-27.6	0	0	110.7	T31	T31-Q34 PolarHBondContact O-N 3.1Å; T31-Q34 WeakPolarHBondContact OG1-CG 3.48Å; T31-Q34 PolarHBondContact OG1-OE1 3.44Å
35	G	52.8	Low	57.8	Low	81 Å²	81	73.4 Å²	73.4	84%	0.835	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	132.5	-12.5	-180	0	0	0	0	0	114.5	L33	L33-G35 PolarHBondContact O-N 3.46Å
36	L	58.4	Low	60.2	Low	72 Å²	72	72.2 Å²	72.2	38%	0.377	42%	0.424	S	S	.	.	S	Bend	trans	-84.2	142.4	176.9	-68.7	170.5	0	0	0	111.8	L33 G39 T43	L33-L36 HydrophobicContact CD2-CD1 4.28Å; L36-G39 PolarHBondContact O-N 3.03Å; L36-T43 HydrophobicContact CD1-CG2 4.44Å
37	P	69.4	Low	62.5	Low	73 Å²	73	74.5 Å²	74.5	47%	0.474	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-58.1	144.2	177.1	24.9	-33.5	0	0	0	110.8	G39 G40 Y188	P37-G39 VanDerWaalsContact C-N 3.27Å; P37-G39 PolarHBondContact O-N 2.87Å; P37-G40 PolarHBondContact O-N 2.72Å; P37-Y188 HydrophobicContact CB-CD1 3.87Å; P37-Y188 HydrophobicContact CB-CG 4.34Å
38	F	76.8	Confident	64.6	Low	49 Å²	49	72.5 Å²	72.5	22%	0.215	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	56.6	35	177.7	-157.3	-100.8	0	0	0	114.3	G40 V41 Y188 F190 T193 I643	F38-G40 PolarHBondContact O-N 3.28Å; F38-V41 HydrophobicContact CD1-CB 4.14Å; F38-V41 HydrophobicContact CD1-CG2 4.42Å; F38-V41 PolarHBondContact O-N 3.4Å; F38-Y188 VanDerWaalsContact CA-O 3.27Å; F38-Y188 WeakPolarHBondContact CA-O 3.48Å; F38-Y188 PolarHBondContact N-O 3.27Å; F38-F190 AromaticContact CD1-CD2 3.88Å; F38-F190 HydrophobicContact CD1-CD2 3.88Å; F38-F190 HydrophobicContact CD2-CB 4.33Å; F38-F190 HydrophobicContact CD2-CD2 4.43Å; F38-F190 AromaticContact CE1-CD2 3.63Å; F38-F190 HydrophobicContact CE1-CD2 3.63Å; F38-F190 HydrophobicContact CE1-CE2 4.06Å; F38-F190 HydrophobicContact CE2-CD2 4.22Å; F38-F190 HydrophobicContact CG-CB 4.5Å; F38-F190 HydrophobicContact CG-CD2 4.28Å; F38-F190 AromaticContact CZ-CD2 3.83Å; F38-F190 HydrophobicContact CZ-CD2 3.83Å; F38-F190 HydrophobicContact CZ-CE2 4.36Å; F38-T193 HydrophobicContact CE2-CG2 3.87Å; F38-T193 HydrophobicContact CZ-CG2 3.85Å; F38-I643 HydrophobicContact CE1-CD1 4.48Å; F38-I643 HydrophobicContact CZ-CD1 3.89Å
39	G	70.8	Confident	67.3	Low	24 Å²	24	71.8 Å²	71.8	25%	0.247	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	67.1	19.1	177.5	0	0	0	0	0	114.3	L36 P37 V41 N571	L36-G39 PolarHBondContact O-N 3.03Å; P37-G39 VanDerWaalsContact C-N 3.27Å; P37-G39 PolarHBondContact O-N 2.87Å; G39-V41 VanDerWaalsContact C-N 3.26Å; G39-V41 PolarHBondContact O-N 3.16Å; G39-N571 PolarHBondContact O-ND2 3.24Å; G39-N571 VanDerWaalsContact O-ND2 3.08Å
40	G	75	Confident	70	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	76.9	1.8	178.1	0	0	0	0	0	115.5	P37 F38 T43 V44	P37-G40 PolarHBondContact O-N 2.72Å; F38-G40 PolarHBondContact O-N 3.28Å; G40-T43 PolarHBondContact O-N 3.16Å; G40-T43 VanDerWaalsContact O-N 3.17Å; G40-V44 WeakPolarHBondContact O-CG2 2.8Å; G40-V44 PolarHBondContact O-N 2.69Å
41	V	84	Confident	72.3	Confident	6 Å²	6	64.4 Å²	64.4	4%	0.036	39%	0.386	C	S	.	.	H	α-helix	trans	-55.1	-48.5	-174.4	177.5	0	0	0	0	113.5	F38 G39 T43 V44 L45 F190 V570 N571 I574 F647	F38-V41 HydrophobicContact CD1-CB 4.14Å; F38-V41 HydrophobicContact CD1-CG2 4.42Å; F38-V41 PolarHBondContact O-N 3.4Å; G39-V41 VanDerWaalsContact C-N 3.26Å; G39-V41 PolarHBondContact O-N 3.16Å; V41-T43 VanDerWaalsContact C-N 3.33Å; V41-T43 PolarHBondContact O-N 2.71Å; V41-V44 PolarHBondContact O-N 3.26Å; V41-L45 VanDerWaalsContact O-CB 3.28Å; V41-L45 WeakPolarHBondContact O-CB 3.22Å; V41-L45 PolarHBondContact O-N 2.69Å; V41-F190 HydrophobicContact CG2-CD2 4.41Å; V41-F190 HydrophobicContact CG2-CE2 4.13Å; V41-V570 HydrophobicContact CG1-CG1 3.79Å; V41-V570 HydrophobicContact CG2-CB 4.39Å; V41-V570 HydrophobicContact CG2-CG1 3.93Å; V41-N571 VanDerWaalsContact CA-OD1 3.29Å; V41-N571 WeakPolarHBondContact CA-OD1 3.45Å; V41-N571 WeakPolarHBondContact CG2-OD1 3.11Å; V41-I574 HydrophobicContact CG1-CD1 3.7Å; V41-F647 HydrophobicContact CG1-CE2 4.37Å; V41-F647 HydrophobicContact CG1-CZ 4.45Å
42	P	87.8	Confident	74.8	Confident	74 Å²	74	61.9 Å²	61.9	48%	0.481	37%	0.368	S	S	.	.	H	α-helix	trans	-64.9	-37.6	179.9	-21.5	35	0	0	0	112.8	A46	P42-A46 WeakPolarHBondContact O-CB 3.43Å; P42-A46 PolarHBondContact O-N 2.95Å
43	T	81.9	Confident	77.4	Confident	60 Å²	60	58.8 Å²	58.8	37%	0.368	35%	0.347	S	S	.	.	H	α-helix	trans	-67.2	-47.3	178.7	-51.2	0	0	0	0	111	L36 G40 V41 A46 L47	L36-T43 HydrophobicContact CD1-CG2 4.44Å; G40-T43 PolarHBondContact O-N 3.16Å; G40-T43 VanDerWaalsContact O-N 3.17Å; V41-T43 VanDerWaalsContact C-N 3.33Å; V41-T43 PolarHBondContact O-N 2.71Å; T43-A46 PolarHBondContact O-N 3.04Å; T43-L47 HydrophobicContact CG2-CD1 4.18Å; T43-L47 WeakPolarHBondContact O-CG 3.47Å; T43-L47 PolarHBondContact O-N 2.9Å
44	V	81.7	Confident	80	Confident	18 Å²	18	57.7 Å²	57.7	11%	0.109	35%	0.35	C	S	.	.	H	α-helix	trans	-61.3	-45.7	177.1	172.1	0	0	0	0	110.3	L33 G40 V41 A46 L47 D48 N571 I574	L33-V44 HydrophobicContact CD1-CG2 4.44Å; L33-V44 HydrophobicContact CD2-CG2 4.47Å; G40-V44 WeakPolarHBondContact O-CG2 2.8Å; G40-V44 PolarHBondContact O-N 2.69Å; V41-V44 PolarHBondContact O-N 3.26Å; V44-A46 PolarHBondContact O-N 2.78Å; V44-L47 PolarHBondContact O-N 2.82Å; V44-D48 VanDerWaalsContact CG1-OD2 3.26Å; V44-D48 WeakPolarHBondContact CG1-OD2 3.37Å; V44-D48 VanDerWaalsContact O-CB 3.31Å; V44-D48 WeakPolarHBondContact O-CB 3.41Å; V44-D48 VanDerWaalsContact O-CG 3.27Å; V44-D48 PolarHBondContact O-N 3.05Å; V44-N571 HydrophobicContact CG1-CB 4.19Å; V44-I574 HydrophobicContact CG1-CG2 4.38Å
45	L	88.1	Confident	82.3	Confident	55 Å²	55	55 Å²	55	29%	0.288	34%	0.338	S	S	.	.	H	α-helix	trans	-56	-47.1	176.1	-179.9	64.1	0	0	0	112.6	V41 F49 I574 F578 F647	V41-L45 VanDerWaalsContact O-CB 3.28Å; V41-L45 WeakPolarHBondContact O-CB 3.22Å; V41-L45 PolarHBondContact O-N 2.69Å; L45-F49 WeakPolarHBondContact O-CB 3.34Å; L45-F49 PolarHBondContact O-N 3.22Å; L45-I574 HydrophobicContact CB-CD1 4.41Å; L45-I574 HydrophobicContact CB-CG2 4.29Å; L45-I574 HydrophobicContact CD1-CG2 3.81Å; L45-F578 HydrophobicContact CD1-CD2 4.45Å; L45-F578 HydrophobicContact CD1-CE2 3.58Å; L45-F578 HydrophobicContact CD1-CZ 4.29Å; L45-F647 HydrophobicContact CD1-CE1 3.99Å; L45-F647 HydrophobicContact CD2-CE1 4.04Å; L45-F647 HydrophobicContact CD2-CZ 4.36Å
46	A	88	Confident	84	Confident	57 Å²	57	52.7 Å²	52.7	47%	0.471	31%	0.306	S	S	.	.	H	α-helix	trans	-64.7	-45.5	179.3	0	0	0	0	0	111.7	P42 T43 V44 F49 M50	P42-A46 WeakPolarHBondContact O-CB 3.43Å; P42-A46 PolarHBondContact O-N 2.95Å; T43-A46 PolarHBondContact O-N 3.04Å; V44-A46 PolarHBondContact O-N 2.78Å; A46-F49 PolarHBondContact O-N 2.82Å; A46-M50 VanDerWaalsContact O-CG 3.25Å; A46-M50 WeakPolarHBondContact O-CG 3.49Å; A46-M50 PolarHBondContact O-N 3.33Å
47	L	86.2	Confident	85.5	Confident	114 Å²	114	55 Å²	55	60%	0.597	31%	0.313	S	S	*	.	H	α-helix	trans	-63.7	-46.4	178.7	-71.2	175.1	0	0	0	112	T43 V44 F49 M50 C51	T43-L47 HydrophobicContact CG2-CD1 4.18Å; T43-L47 WeakPolarHBondContact O-CG 3.47Å; T43-L47 PolarHBondContact O-N 2.9Å; V44-L47 PolarHBondContact O-N 2.82Å; L47-F49 VanDerWaalsContact C-N 3.34Å; L47-F49 PolarHBondContact O-N 3.34Å; L47-M50 PolarHBondContact O-N 3.34Å; L47-C51 WeakPolarHBondContact O-CB 3.3Å; L47-C51 PolarHBondContact O-N 2.92Å
48	D	88.3	Confident	86.4	Confident	19 Å²	19	55 Å²	55	10%	0.102	31%	0.309	C	S	.	.	H	α-helix	trans	-65.9	-38	-179.8	-71.7	-16.2	0	0	0	111.4	V44 C51 F52 I574 A575 F578 I579	V44-D48 VanDerWaalsContact CG1-OD2 3.26Å; V44-D48 WeakPolarHBondContact CG1-OD2 3.37Å; V44-D48 VanDerWaalsContact O-CB 3.31Å; V44-D48 WeakPolarHBondContact O-CB 3.41Å; V44-D48 VanDerWaalsContact O-CG 3.27Å; V44-D48 PolarHBondContact O-N 3.05Å; D48-C51 PolarHBondContact O-N 3.24Å; D48-F52 VanDerWaalsContact O-CB 3.24Å; D48-F52 WeakPolarHBondContact O-CB 3.43Å; D48-F52 PolarHBondContact O-N 3.09Å; D48-I574 HydrophobicContact CB-CG2 4.26Å; D48-A575 WeakPolarHBondContact OD2-CA 3.36Å; D48-A575 WeakPolarHBondContact OD2-CB 3.44Å; D48-A575 PolarHBondContact OD2-N 3.41Å; D48-F578 HydrophobicContact CB-CB 4.13Å; D48-F578 HydrophobicContact CB-CD2 4.24Å; D48-I579 VanDerWaalsContact OD1-CD1 3.26Å; D48-I579 WeakPolarHBondContact OD1-CD1 3.25Å
49	F	92.4	Very high	86.8	Confident	92 Å²	92	53.4 Å²	53.4	40%	0.404	30%	0.302	S	S	.	.	H	α-helix	trans	-65.5	-43.4	174.2	-178	-104.2	0	0	0	112.2	L45 A46 L47 F52 L53 F578	L45-F49 WeakPolarHBondContact O-CB 3.34Å; L45-F49 PolarHBondContact O-N 3.22Å; A46-F49 PolarHBondContact O-N 2.82Å; L47-F49 VanDerWaalsContact C-N 3.34Å; L47-F49 PolarHBondContact O-N 3.34Å; F49-F52 WeakPolarHBondContact O-CB 3.48Å; F49-F52 PolarHBondContact O-N 3.35Å; F49-L53 HydrophobicContact CD1-CD1 4.13Å; F49-L53 HydrophobicContact CE1-CD1 3.6Å; F49-L53 HydrophobicContact CE1-CG 4.21Å; F49-L53 HydrophobicContact CZ-CD1 4.01Å; F49-L53 HydrophobicContact CZ-CD2 4.32Å; F49-L53 HydrophobicContact CZ-CG 4.26Å; F49-L53 WeakPolarHBondContact O-CG 3.47Å; F49-L53 PolarHBondContact O-N 3.46Å; F49-F578 HydrophobicContact CD2-CD1 4.39Å; F49-F578 AromaticContact CD2-CE1 3.86Å; F49-F578 HydrophobicContact CD2-CE1 3.86Å; F49-F578 HydrophobicContact CD2-CZ 4.24Å
50	M	91.5	Very high	87.5	Confident	124 Å²	124	52.7 Å²	52.7	61%	0.611	29%	0.293	S	S	*	.	H	α-helix	trans	-64.2	-42.4	175.6	-70.5	-60.2	-66.6	0	0	111.8	A46 L47 F52 L53 A54	A46-M50 VanDerWaalsContact O-CG 3.25Å; A46-M50 WeakPolarHBondContact O-CG 3.49Å; A46-M50 PolarHBondContact O-N 3.33Å; L47-M50 PolarHBondContact O-N 3.34Å; M50-F52 VanDerWaalsContact C-N 3.33Å; M50-F52 PolarHBondContact O-N 3.34Å; M50-L53 PolarHBondContact O-N 3.05Å; M50-L53 HydrophobicContact SD-CD1 4.49Å; M50-A54 PolarHBondContact O-N 3.27Å; M50-A54 VanDerWaalsContact O-N 3.08Å
51	C	88.4	Confident	87.9	Confident	52 Å²	52	55.7 Å²	55.7	35%	0.351	31%	0.309	S	S	.	.	H	α-helix	trans	-61.3	-42.5	174.1	-173.6	0	0	0	0	111.3	L47 D48 L53 A54 L55	L47-C51 WeakPolarHBondContact O-CB 3.3Å; L47-C51 PolarHBondContact O-N 2.92Å; D48-C51 PolarHBondContact O-N 3.24Å; C51-L53 PolarHBondContact O-N 3.38Å; C51-A54 WeakPolarHBondContact O-CB 3.43Å; C51-A54 PolarHBondContact O-N 3.06Å; C51-L55 WeakPolarHBondContact O-CG 3.38Å; C51-L55 PolarHBondContact O-N 2.9Å
52	F	92.1	Very high	87.7	Confident	22 Å²	22	58.6 Å²	58.6	10%	0.096	32%	0.324	C	S	.	.	H	α-helix	trans	-58.1	-46.7	175.3	176.2	-106.2	0	0	0	112.4	D48 F49 M50 A54 L55 L56 F578 A582 L654	D48-F52 VanDerWaalsContact O-CB 3.24Å; D48-F52 WeakPolarHBondContact O-CB 3.43Å; D48-F52 PolarHBondContact O-N 3.09Å; F49-F52 WeakPolarHBondContact O-CB 3.48Å; F49-F52 PolarHBondContact O-N 3.35Å; M50-F52 VanDerWaalsContact C-N 3.33Å; M50-F52 PolarHBondContact O-N 3.34Å; F52-A54 VanDerWaalsContact C-N 3.32Å; F52-A54 PolarHBondContact O-N 3.05Å; F52-L55 PolarHBondContact O-N 2.87Å; F52-L56 HydrophobicContact CD1-CD1 3.93Å; F52-L56 HydrophobicContact CD1-CG 4.39Å; F52-L56 HydrophobicContact CD2-CG 4.49Å; F52-L56 HydrophobicContact CE1-CD1 3.33Å; F52-L56 HydrophobicContact CE1-CG 4.06Å; F52-L56 HydrophobicContact CE2-CD1 4.23Å; F52-L56 HydrophobicContact CE2-CD2 4.21Å; F52-L56 HydrophobicContact CE2-CG 4.15Å; F52-L56 HydrophobicContact CZ-CD1 3.5Å; F52-L56 HydrophobicContact CZ-CD2 4.13Å; F52-L56 HydrophobicContact CZ-CG 3.93Å; F52-L56 WeakPolarHBondContact O-CG 3.31Å; F52-L56 PolarHBondContact O-N 3.26Å; F52-F578 HydrophobicContact CB-CB 3.97Å; F52-F578 HydrophobicContact CB-CD1 4.06Å; F52-F578 HydrophobicContact CB-CG 4.39Å; F52-F578 AromaticContact CD1-CD1 4Å; F52-F578 HydrophobicContact CD1-CD1 4Å; F52-F578 HydrophobicContact CD2-CB 4.35Å; F52-F578 HydrophobicContact CD2-CD1 4.24Å; F52-F578 VanDerWaalsContact CD2-O 3.3Å; F52-F578 WeakPolarHBondContact CD2-O 3.28Å; F52-F578 HydrophobicContact CG-CB 4.32Å; F52-F578 AromaticContact CG-CD1 3.85Å; F52-F578 HydrophobicContact CG-CD1 3.85Å; F52-A582 HydrophobicContact CD2-CB 3.72Å; F52-A582 HydrophobicContact CE2-CB 4.06Å; F52-L654 HydrophobicContact CZ-CD2 4.28Å
53	L	92.3	Very high	87.1	Confident	76 Å²	76	56.4 Å²	56.4	40%	0.398	31%	0.306	S	S	.	.	H	α-helix	trans	-60.9	-41.6	175.7	-68.1	177.4	0	0	0	112	F49 M50 C51 L56 F57	F49-L53 HydrophobicContact CD1-CD1 4.13Å; F49-L53 HydrophobicContact CE1-CD1 3.6Å; F49-L53 HydrophobicContact CE1-CG 4.21Å; F49-L53 HydrophobicContact CZ-CD1 4.01Å; F49-L53 HydrophobicContact CZ-CD2 4.32Å; F49-L53 HydrophobicContact CZ-CG 4.26Å; F49-L53 WeakPolarHBondContact O-CG 3.47Å; F49-L53 PolarHBondContact O-N 3.46Å; M50-L53 PolarHBondContact O-N 3.05Å; M50-L53 HydrophobicContact SD-CD1 4.49Å; C51-L53 PolarHBondContact O-N 3.38Å; L53-L56 PolarHBondContact O-N 2.88Å; L53-F57 WeakPolarHBondContact O-CB 3.24Å; L53-F57 PolarHBondContact O-N 3.42Å
54	A	92.2	Very high	86.8	Confident	59 Å²	59	61 Å²	61	49%	0.488	32%	0.321	S	S	.	.	H	α-helix	trans	-63.1	-41.4	175.8	0	0	0	0	0	112.1	M50 C51 F52 F57 L58	M50-A54 PolarHBondContact O-N 3.27Å; M50-A54 VanDerWaalsContact O-N 3.08Å; C51-A54 WeakPolarHBondContact O-CB 3.43Å; C51-A54 PolarHBondContact O-N 3.06Å; F52-A54 VanDerWaalsContact C-N 3.32Å; F52-A54 PolarHBondContact O-N 3.05Å; A54-F57 PolarHBondContact O-N 3.41Å; A54-L58 WeakPolarHBondContact O-CB 3.47Å; A54-L58 PolarHBondContact O-N 3.41Å
55	L	89.9	Confident	86.2	Confident	27 Å²	27	64.7 Å²	64.7	14%	0.141	34%	0.343	C	S	.	.	H	α-helix	trans	-67.8	-37.4	176.1	-70.4	174.3	0	0	0	112.4	C51 F52 F57 L58 F59 A582 L586	C51-L55 WeakPolarHBondContact O-CG 3.38Å; C51-L55 PolarHBondContact O-N 2.9Å; F52-L55 PolarHBondContact O-N 2.87Å; L55-F57 VanDerWaalsContact C-N 3.35Å; L55-L58 HydrophobicContact CD2-CD2 4.5Å; L55-L58 PolarHBondContact O-N 3.3Å; L55-F59 WeakPolarHBondContact O-CB 3.26Å; L55-F59 PolarHBondContact O-N 3.17Å; L55-A582 HydrophobicContact CB-CB 3.81Å; L55-A582 HydrophobicContact CD1-CB 3.65Å; L55-A582 HydrophobicContact CG-CB 4.39Å; L55-L586 HydrophobicContact CB-CD1 3.95Å; L55-L586 HydrophobicContact CD2-CD1 3.79Å; L55-L586 HydrophobicContact CG-CD1 4.37Å
56	L	89.7	Confident	85	Confident	34 Å²	34	64 Å²	64	18%	0.178	35%	0.345	C	S	.	.	H	α-helix	trans	-66.1	-37.5	173.2	-72.1	-174	0	0	0	112.2	F52 L53 F59 S60 W128 L585	F52-L56 HydrophobicContact CD1-CD1 3.93Å; F52-L56 HydrophobicContact CD1-CG 4.39Å; F52-L56 HydrophobicContact CD2-CG 4.49Å; F52-L56 HydrophobicContact CE1-CD1 3.33Å; F52-L56 HydrophobicContact CE1-CG 4.06Å; F52-L56 HydrophobicContact CE2-CD1 4.23Å; F52-L56 HydrophobicContact CE2-CD2 4.21Å; F52-L56 HydrophobicContact CE2-CG 4.15Å; F52-L56 HydrophobicContact CZ-CD1 3.5Å; F52-L56 HydrophobicContact CZ-CD2 4.13Å; F52-L56 HydrophobicContact CZ-CG 3.93Å; F52-L56 WeakPolarHBondContact O-CG 3.31Å; F52-L56 PolarHBondContact O-N 3.26Å; L53-L56 PolarHBondContact O-N 2.88Å; L56-F59 PolarHBondContact O-N 3.03Å; L56-S60 PolarHBondContact O-N 3.46Å; L56-S60 PolarHBondContact O-OG 3.01Å; L56-W128 HydrophobicContact CD2-CH2 3.81Å; L56-W128 HydrophobicContact CD2-CZ2 4.05Å; L56-L585 HydrophobicContact CD2-CD2 3.63Å
57	F	89	Confident	83.5	Confident	119 Å²	119	64.7 Å²	64.7	52%	0.522	34%	0.336	S	S	.	.	H	α-helix	trans	-64.8	-47.2	173.4	-177.7	-102.9	0	0	0	110.9	L53 A54 L55 F59 S60 I61 F125	L53-F57 WeakPolarHBondContact O-CB 3.24Å; L53-F57 PolarHBondContact O-N 3.42Å; A54-F57 PolarHBondContact O-N 3.41Å; L55-F57 VanDerWaalsContact C-N 3.35Å; F57-F59 VanDerWaalsContact C-N 3.31Å; F57-F59 PolarHBondContact O-N 3.42Å; F57-S60 WeakPolarHBondContact O-CB 3.35Å; F57-S60 PolarHBondContact O-N 3.44Å; F57-S60 VanDerWaalsContact O-N 3.11Å; F57-I61 HydrophobicContact CD1-CD1 3.86Å; F57-I61 HydrophobicContact CE1-CD1 3.39Å; F57-I61 HydrophobicContact CE1-CG1 4.31Å; F57-I61 HydrophobicContact CZ-CD1 3.88Å; F57-I61 HydrophobicContact CZ-CG1 4.47Å; F57-I61 PolarHBondContact O-N 3.25Å; F57-F125 AromaticContact CD2-CE1 3.6Å; F57-F125 HydrophobicContact CD2-CE1 3.6Å; F57-F125 HydrophobicContact CD2-CZ 4.19Å; F57-F125 AromaticContact CE2-CE1 3.49Å; F57-F125 HydrophobicContact CE2-CE1 3.49Å; F57-F125 VanDerWaalsContact CE2-CE1 3.49Å; F57-F125 AromaticContact CE2-CZ 3.72Å; F57-F125 HydrophobicContact CE2-CZ 3.72Å; F57-F125 HydrophobicContact CZ-CE1 4.38Å; F57-F125 HydrophobicContact CZ-CZ 4.18Å
58	L	87.8	Confident	81.9	Confident	73 Å²	73	64.3 Å²	64.3	38%	0.382	33%	0.334	S	S	.	.	H	α-helix	trans	-58	-43.7	173.6	178.5	63.7	0	0	0	111.6	A54 L55 S60 I61 L62 L586	A54-L58 WeakPolarHBondContact O-CB 3.47Å; A54-L58 PolarHBondContact O-N 3.41Å; L55-L58 HydrophobicContact CD2-CD2 4.5Å; L55-L58 PolarHBondContact O-N 3.3Å; L58-S60 VanDerWaalsContact C-N 3.3Å; L58-S60 PolarHBondContact O-N 2.91Å; L58-I61 PolarHBondContact O-N 2.77Å; L58-L62 HydrophobicContact CD1-CD1 4.12Å; L58-L62 HydrophobicContact CD1-CG 4.09Å; L58-L62 HydrophobicContact CD2-CD1 4.42Å; L58-L62 HydrophobicContact CG-CD1 3.88Å; L58-L62 HydrophobicContact CG-CG 4.27Å; L58-L62 WeakPolarHBondContact O-CB 3.31Å; L58-L62 WeakPolarHBondContact O-CG 3.28Å; L58-L62 PolarHBondContact O-N 3.17Å; L58-L586 HydrophobicContact CG-CD2 4.47Å
59	F	86.7	Confident	80.2	Confident	17 Å²	17	68.4 Å²	68.4	8%	0.075	35%	0.349	C	S	.	.	H	α-helix	trans	-59.4	-41.7	175.6	173.1	-101.3	0	0	0	111.7	L55 L56 F57 I61 L62 R63 W128 L585 L586 Y661	L55-F59 WeakPolarHBondContact O-CB 3.26Å; L55-F59 PolarHBondContact O-N 3.17Å; L56-F59 PolarHBondContact O-N 3.03Å; F57-F59 VanDerWaalsContact C-N 3.31Å; F57-F59 PolarHBondContact O-N 3.42Å; F59-I61 PolarHBondContact O-N 2.82Å; F59-L62 PolarHBondContact O-N 3.24Å; F59-R63 WeakPolarHBondContact O-CB 3.46Å; F59-R63 PolarHBondContact O-N 2.6Å; F59-W128 HydrophobicContact CD1-CD2 4.33Å; F59-W128 AromaticContact CD1-CE2 3.87Å; F59-W128 HydrophobicContact CD1-CH2 4.32Å; F59-W128 AromaticContact CD1-CZ2 3.88Å; F59-W128 HydrophobicContact CD1-CZ2 3.88Å; F59-W128 AromaticContact CE1-CD2 3.78Å; F59-W128 HydrophobicContact CE1-CD2 3.78Å; F59-W128 AromaticContact CE1-CE2 3.81Å; F59-W128 AromaticContact CE1-CE3 3.99Å; F59-W128 HydrophobicContact CE1-CE3 3.99Å; F59-W128 HydrophobicContact CE1-CG 4.26Å; F59-W128 HydrophobicContact CE1-CH2 4.32Å; F59-W128 HydrophobicContact CE1-CZ2 4.1Å; F59-W128 HydrophobicContact CE1-CZ3 4.25Å; F59-L585 HydrophobicContact CD1-CD2 3.85Å; F59-L585 HydrophobicContact CD1-CG 4.3Å; F59-L585 HydrophobicContact CD2-CD2 4.27Å; F59-L585 HydrophobicContact CD2-CG 3.95Å; F59-L585 HydrophobicContact CE1-CD1 4.4Å; F59-L585 HydrophobicContact CE1-CD2 4.02Å; F59-L585 HydrophobicContact CE1-CG 4.19Å; F59-L585 HydrophobicContact CE2-CD1 4.24Å; F59-L585 HydrophobicContact CE2-CD2 4.43Å; F59-L585 HydrophobicContact CE2-CG 3.83Å; F59-L585 HydrophobicContact CG-CD2 3.98Å; F59-L585 HydrophobicContact CG-CG 4.17Å; F59-L585 HydrophobicContact CZ-CD1 4.02Å; F59-L585 HydrophobicContact CZ-CD2 4.3Å; F59-L585 HydrophobicContact CZ-CG 3.96Å; F59-L586 HydrophobicContact CB-CD2 3.69Å; F59-L586 HydrophobicContact CB-CG 4.09Å; F59-L586 HydrophobicContact CD2-CD2 4.07Å; F59-L586 HydrophobicContact CD2-CG 4.31Å; F59-L586 HydrophobicContact CG-CD2 4.4Å; F59-Y661 HydrophobicContact CE1-CE1 4.48Å; F59-Y661 AromaticContact CZ-CE1 3.67Å; F59-Y661 HydrophobicContact CZ-CE1 3.67Å; F59-Y661 AromaticContact CZ-CZ 3.9Å
60	S	84.7	Confident	78.3	Confident	9 Å²	9	65.1 Å²	65.1	6%	0.063	34%	0.341	C	S	.	.	H	α-helix	trans	-66	-38.1	179	-56.1	0	0	0	0	111.7	L56 F57 L58 K64 F125 W128	L56-S60 PolarHBondContact O-N 3.46Å; L56-S60 PolarHBondContact O-OG 3.01Å; F57-S60 WeakPolarHBondContact O-CB 3.35Å; F57-S60 PolarHBondContact O-N 3.44Å; F57-S60 VanDerWaalsContact O-N 3.11Å; L58-S60 VanDerWaalsContact C-N 3.3Å; L58-S60 PolarHBondContact O-N 2.91Å; S60-K64 PolarHBondContact O-N 2.74Å; S60-K64 VanDerWaalsContact O-N 3.12Å; S60-F125 VanDerWaalsContact CB-CE1 3.44Å; S60-F125 WeakPolarHBondContact CB-O 3.32Å; S60-F125 PolarHBondContact OG-O 2.76Å; S60-W128 PolarHBondContact OG-NE1 3.28Å; S60-W128 VanDerWaalsContact OG-NE1 3.13Å
61	I	83.6	Confident	76.6	Confident	63 Å²	63	64.1 Å²	64.1	32%	0.323	33%	0.33	S	S	.	.	H	α-helix	trans	-65	-53.8	171.8	-64.1	173.7	0	0	0	110.8	F57 L58 F59 R63 K64 V65 F125	F57-I61 HydrophobicContact CD1-CD1 3.86Å; F57-I61 HydrophobicContact CE1-CD1 3.39Å; F57-I61 HydrophobicContact CE1-CG1 4.31Å; F57-I61 HydrophobicContact CZ-CD1 3.88Å; F57-I61 HydrophobicContact CZ-CG1 4.47Å; F57-I61 PolarHBondContact O-N 3.25Å; L58-I61 PolarHBondContact O-N 2.77Å; F59-I61 PolarHBondContact O-N 2.82Å; I61-R63 PolarHBondContact O-N 2.96Å; I61-K64 PolarHBondContact O-N 3.2Å; I61-V65 HydrophobicContact CG2-CG2 4.23Å; I61-V65 WeakPolarHBondContact O-CG2 3.17Å; I61-V65 PolarHBondContact O-N 3.26Å; I61-F125 HydrophobicContact CD1-CZ 4.48Å; I61-F125 HydrophobicContact CG1-CE1 4.47Å; I61-F125 HydrophobicContact CG1-CE2 4.22Å; I61-F125 HydrophobicContact CG1-CZ 3.54Å
62	L	78.7	Confident	74.7	Confident	67 Å²	67	65.6 Å²	65.6	35%	0.351	33%	0.334	S	S	.	.	H	α-helix	trans	-61	-36.8	-177.9	-73.8	176.1	0	0	0	111.2	L58 F59 V65 A66 L586	L58-L62 HydrophobicContact CD1-CD1 4.12Å; L58-L62 HydrophobicContact CD1-CG 4.09Å; L58-L62 HydrophobicContact CD2-CD1 4.42Å; L58-L62 HydrophobicContact CG-CD1 3.88Å; L58-L62 HydrophobicContact CG-CG 4.27Å; L58-L62 WeakPolarHBondContact O-CB 3.31Å; L58-L62 WeakPolarHBondContact O-CG 3.28Å; L58-L62 PolarHBondContact O-N 3.17Å; F59-L62 PolarHBondContact O-N 3.24Å; L62-V65 PolarHBondContact O-N 3.16Å; L62-A66 WeakPolarHBondContact O-CA 3.34Å; L62-A66 WeakPolarHBondContact O-CB 3.39Å; L62-A66 PolarHBondContact O-N 3.29Å; L62-L586 HydrophobicContact CD1-CD2 3.76Å
63	R	76.9	Confident	72.7	Confident	28 Å²	28	64.7 Å²	64.7	11%	0.106	33%	0.331	C	S	.	.	H	α-helix	trans	-59.6	-55	171.3	-175.4	174.6	167.3	163.9	-9	109.2	F59 I61 V65 A66 W67 D122 Y661	F59-R63 WeakPolarHBondContact O-CB 3.46Å; F59-R63 PolarHBondContact O-N 2.6Å; I61-R63 PolarHBondContact O-N 2.96Å; R63-V65 VanDerWaalsContact C-N 3.27Å; R63-V65 PolarHBondContact O-N 2.88Å; R63-A66 PolarHBondContact O-N 3.34Å; R63-W67 HydrophobicContact CG-CB 4.07Å; R63-W67 HydrophobicContact CG-CD2 3.97Å; R63-W67 HydrophobicContact CG-CE3 3.67Å; R63-W67 HydrophobicContact CG-CG 4.2Å; R63-W67 HydrophobicContact CG-CZ3 4.24Å; R63-W67 WeakPolarHBondContact O-CA 3.25Å; R63-W67 WeakPolarHBondContact O-CB 3.37Å; R63-W67 PolarHBondContact O-N 3.34Å; R63-D122 IonicContact CZ-OD2 3.12Å; R63-D122 IonicContact NH2-OD2 3.01Å; R63-D122 PolarHBondContact NH2-OD2 2.94Å; R63-Y661 PolarHBondContact NH1-OH 3.24Å
64	K	74.8	Confident	70.9	Confident	156 Å²	156	63.4 Å²	63.4	68%	0.678	32%	0.324	S	S	*	.	H	α-helix	trans	-59.9	-35.1	-178.6	-166.9	171.7	-179.6	175.8	0	114.1	S60 I61	S60-K64 PolarHBondContact O-N 2.74Å; S60-K64 VanDerWaalsContact O-N 3.12Å; I61-K64 PolarHBondContact O-N 3.2Å
65	V	70.3	Confident	68.9	Low	96 Å²	96	62.8 Å²	62.8	58%	0.582	31%	0.314	S	S	*	.	H	α-helix	trans	-86.4	-31.1	-177.2	177	0	0	0	0	112.9	I61 L62 R63 Y69	I61-V65 HydrophobicContact CG2-CG2 4.23Å; I61-V65 WeakPolarHBondContact O-CG2 3.17Å; I61-V65 PolarHBondContact O-N 3.26Å; L62-V65 PolarHBondContact O-N 3.16Å; R63-V65 VanDerWaalsContact C-N 3.27Å; R63-V65 PolarHBondContact O-N 2.88Å; V65-Y69 WeakPolarHBondContact O-CE2 3.26Å
66	A	62.3	Low	67	Low	40 Å²	40	63 Å²	63	33%	0.331	32%	0.316	S	S	.	.	H	α-helix	trans	-119.6	-2.1	-169.5	0	0	0	0	0	115.3	L62 R63 D68 Y69 G70	L62-A66 WeakPolarHBondContact O-CA 3.34Å; L62-A66 WeakPolarHBondContact O-CB 3.39Å; L62-A66 PolarHBondContact O-N 3.29Å; R63-A66 PolarHBondContact O-N 3.34Å; A66-D68 VanDerWaalsContact C-N 3.32Å; A66-D68 PolarHBondContact O-N 3.48Å; A66-Y69 VanDerWaalsContact CA-CD2 3.44Å; A66-Y69 HydrophobicContact CB-CD2 3.85Å; A66-Y69 HydrophobicContact CB-CE2 4.28Å; A66-Y69 WeakPolarHBondContact O-CB 3.14Å; A66-Y69 WeakPolarHBondContact O-CD2 3.33Å; A66-Y69 PolarHBondContact O-N 3.2Å; A66-G70 PolarHBondContact O-N 3.29Å
67	W	56.8	Low	65.2	Low	71 Å²	71	63.5 Å²	63.5	27%	0.269	32%	0.319	S	S	.	.	H	α-helix	trans	-66.7	-31.3	-179.5	-173.3	-104.5	0	0	0	113.3	R63 Y69 G70 R71 Y661 Y665	R63-W67 HydrophobicContact CG-CB 4.07Å; R63-W67 HydrophobicContact CG-CD2 3.97Å; R63-W67 HydrophobicContact CG-CE3 3.67Å; R63-W67 HydrophobicContact CG-CG 4.2Å; R63-W67 HydrophobicContact CG-CZ3 4.24Å; R63-W67 WeakPolarHBondContact O-CA 3.25Å; R63-W67 WeakPolarHBondContact O-CB 3.37Å; R63-W67 PolarHBondContact O-N 3.34Å; W67-Y69 PolarHBondContact O-N 3.32Å; W67-G70 PolarHBondContact O-N 3.08Å; W67-R71 VanDerWaalsContact O-CB 3.31Å; W67-R71 WeakPolarHBondContact O-CB 3.3Å; W67-R71 PolarHBondContact O-N 2.71Å; W67-Y661 WeakPolarHBondContact CH2-OH 3.21Å; W67-Y661 WeakPolarHBondContact CZ3-OH 3.04Å; W67-Y665 AromaticContact CH2-CD1 3.88Å; W67-Y665 HydrophobicContact CH2-CD1 3.88Å; W67-Y665 AromaticContact CH2-CG 3.81Å; W67-Y665 HydrophobicContact CH2-CG 3.81Å; W67-Y665 AromaticContact CZ2-CD1 3.8Å; W67-Y665 HydrophobicContact CZ2-CD1 3.8Å; W67-Y665 HydrophobicContact CZ2-CE1 4.42Å; W67-Y665 HydrophobicContact CZ2-CG 4.22Å
68	D	52	Low	63.3	Low	107 Å²	107	59.8 Å²	59.8	57%	0.572	31%	0.311	S	S	*	.	H	α-helix	trans	-58.9	-32	174	-64.2	-28.9	0	0	0	111.7	A66 L72	A66-D68 VanDerWaalsContact C-N 3.32Å; A66-D68 PolarHBondContact O-N 3.48Å; D68-L72 PolarHBondContact O-N 3.27Å; D68-L72 VanDerWaalsContact O-N 3.08Å
69	Y	52.8	Low	61.5	Low	105 Å²	105	59 Å²	59	41%	0.412	31%	0.307	S	S	.	.	H	α-helix	trans	-74.3	-40.2	177.5	-50.9	-63.3	0	0	0	113.3	V65 A66 W67 A73	V65-Y69 WeakPolarHBondContact O-CE2 3.26Å; A66-Y69 VanDerWaalsContact CA-CD2 3.44Å; A66-Y69 HydrophobicContact CB-CD2 3.85Å; A66-Y69 HydrophobicContact CB-CE2 4.28Å; A66-Y69 WeakPolarHBondContact O-CB 3.14Å; A66-Y69 WeakPolarHBondContact O-CD2 3.33Å; A66-Y69 PolarHBondContact O-N 3.2Å; W67-Y69 PolarHBondContact O-N 3.32Å; Y69-A73 PolarHBondContact O-N 2.8Å
70	G	52.1	Low	59.7	Low	22 Å²	22	64.8 Å²	64.8	23%	0.227	33%	0.328	C	S	.	.	H	α-helix	trans	-70.7	-36.5	176.2	0	0	0	0	0	112.5	A66 W67 L74	A66-G70 PolarHBondContact O-N 3.29Å; W67-G70 PolarHBondContact O-N 3.08Å; G70-L74 WeakPolarHBondContact O-CG 3.29Å; G70-L74 PolarHBondContact O-N 3.04Å
71	R	54.8	Low	57.9	Low	104 Å²	104	67.8 Å²	67.8	39%	0.392	34%	0.343	S	S	.	.	H	α-helix	trans	-61.5	-48	173.3	179.8	-176.4	172.2	158.6	7.6	111	W67 A73 L74 V75 D119	W67-R71 VanDerWaalsContact O-CB 3.31Å; W67-R71 WeakPolarHBondContact O-CB 3.3Å; W67-R71 PolarHBondContact O-N 2.71Å; R71-A73 VanDerWaalsContact C-N 3.3Å; R71-A73 PolarHBondContact O-N 3.19Å; R71-L74 PolarHBondContact O-N 3.44Å; R71-L74 VanDerWaalsContact O-N 3.16Å; R71-V75 HydrophobicContact CG-CG2 3.65Å; R71-V75 VanDerWaalsContact O-CB 3.28Å; R71-V75 WeakPolarHBondContact O-CB 3.36Å; R71-V75 VanDerWaalsContact O-CG2 3.23Å; R71-V75 WeakPolarHBondContact O-CG2 3.11Å; R71-V75 PolarHBondContact O-N 2.79Å; R71-D119 IonicContact CZ-OD1 3.27Å; R71-D119 IonicContact CZ-OD2 3.89Å; R71-D119 IonicContact NH1-OD1 3.94Å; R71-D119 PolarHBondContact NH1-OD1 3.15Å; R71-D119 IonicContact NH1-OD2 3.55Å; R71-D119 VanDerWaalsContact NH2-CG 3.33Å; R71-D119 IonicContact NH2-OD1 3.96Å; R71-D119 PolarHBondContact NH2-OD1 3.11Å; R71-D119 IonicContact NH2-OD2 2.77Å; R71-D119 PolarHBondContact NH2-OD2 3.38Å
72	L	49.7	Very low	56.2	Low	83 Å²	83	70.7 Å²	70.7	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-56.8	-44.8	-179.6	-162.1	77	0	0	0	111.6	D68 L74 T76	D68-L72 PolarHBondContact O-N 3.27Å; D68-L72 VanDerWaalsContact O-N 3.08Å; L72-L74 PolarHBondContact O-N 2.89Å; L72-T76 WeakPolarHBondContact O-CB 3.25Å; L72-T76 PolarHBondContact O-N 3.39Å; L72-T76 PolarHBondContact O-OG1 3.44Å
73	A	50.2	Low	54.7	Low	3 Å²	3	73.2 Å²	73.2	3%	0.025	36%	0.355	C	S	.	.	H	α-helix	trans	-64.8	-38.7	178.9	0	0	0	0	0	113.1	Y69 R71 D77 Q614 A615	Y69-A73 PolarHBondContact O-N 2.8Å; R71-A73 VanDerWaalsContact C-N 3.3Å; R71-A73 PolarHBondContact O-N 3.19Å; A73-D77 PolarHBondContact O-N 3.2Å; A73-Q614 HydrophobicContact CB-CB 4.44Å; A73-A615 HydrophobicContact CB-CB 4.2Å
74	L	53.3	Low	53.2	Low	48 Å²	48	75.8 Å²	75.8	25%	0.251	37%	0.368	S	S	.	.	H	α-helix	trans	-79.8	-39.2	-179.3	-70.3	166.9	0	0	0	113.3	G70 R71 L72 D77 A78 A615 Y665	G70-L74 WeakPolarHBondContact O-CG 3.29Å; G70-L74 PolarHBondContact O-N 3.04Å; R71-L74 PolarHBondContact O-N 3.44Å; R71-L74 VanDerWaalsContact O-N 3.16Å; L72-L74 PolarHBondContact O-N 2.89Å; L74-D77 PolarHBondContact O-N 2.88Å; L74-A78 WeakPolarHBondContact O-CB 3.43Å; L74-A78 PolarHBondContact O-N 3.29Å; L74-A615 HydrophobicContact CD2-CB 4.33Å; L74-Y665 WeakPolarHBondContact CD1-O 3.46Å
75	V	51.8	Low	51.7	Low	47 Å²	47	74.3 Å²	74.3	29%	0.285	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-44.3	176.1	170.3	0	0	0	0	109.5	R71 D77 A78 D79	R71-V75 HydrophobicContact CG-CG2 3.65Å; R71-V75 VanDerWaalsContact O-CB 3.28Å; R71-V75 WeakPolarHBondContact O-CB 3.36Å; R71-V75 VanDerWaalsContact O-CG2 3.23Å; R71-V75 WeakPolarHBondContact O-CG2 3.11Å; R71-V75 PolarHBondContact O-N 2.79Å; V75-D77 VanDerWaalsContact C-N 3.31Å; V75-D77 PolarHBondContact O-N 2.94Å; V75-A78 PolarHBondContact O-N 2.6Å; V75-D79 WeakPolarHBondContact CG1-OD2 3.38Å; V75-D79 WeakPolarHBondContact O-CB 3.37Å; V75-D79 PolarHBondContact O-N 3.42Å
76	T	50	Low	50.2	Low	30 Å²	30	77.7 Å²	77.7	18%	0.184	37%	0.366	C	S	.	.	H	α-helix	trans	-63.9	-35.9	-179.6	-46.4	0	0	0	0	113.3	L72 R80 R612	L72-T76 WeakPolarHBondContact O-CB 3.25Å; L72-T76 PolarHBondContact O-N 3.39Å; L72-T76 PolarHBondContact O-OG1 3.44Å; T76-R80 WeakPolarHBondContact O-CB 3.4Å; T76-R80 PolarHBondContact O-N 3.21Å; T76-R612 HydrophobicContact CG2-CG 4.21Å
77	D	51.6	Low	49.2	Very low	45 Å²	45	79.8 Å²	79.8	24%	0.241	37%	0.372	C	S	.	.	H	α-helix	trans	-83.6	-30.1	179.4	-146.5	48.5	0	0	0	112	A73 L74 V75 D79 R80 L81 L668	A73-D77 PolarHBondContact O-N 3.2Å; L74-D77 PolarHBondContact O-N 2.88Å; V75-D77 VanDerWaalsContact C-N 3.31Å; V75-D77 PolarHBondContact O-N 2.94Å; D77-D79 VanDerWaalsContact C-N 3.33Å; D77-R80 WeakPolarHBondContact O-CB 3.46Å; D77-R80 PolarHBondContact O-N 3.39Å; D77-R80 WeakPolarHBondContact OD1-CD 3.41Å; D77-R80 IonicContact OD1-NH1 3.9Å; D77-L81 WeakPolarHBondContact O-CB 3.21Å; D77-L81 WeakPolarHBondContact O-CG 3.33Å; D77-L81 PolarHBondContact O-N 3Å; D77-L668 WeakPolarHBondContact OD2-CD2 3.06Å
78	A	49.3	Very low	48.5	Very low	41 Å²	41	82.2 Å²	82.2	34%	0.339	38%	0.381	S	S	.	.	H	α-helix	trans	-63.5	-39.6	166.1	0	0	0	0	0	111.5	L74 V75 R80 L81 R82	L74-A78 WeakPolarHBondContact O-CB 3.43Å; L74-A78 PolarHBondContact O-N 3.29Å; V75-A78 PolarHBondContact O-N 2.6Å; A78-R80 VanDerWaalsContact C-N 3.34Å; A78-L81 PolarHBondContact O-N 2.82Å; A78-R82 VanDerWaalsContact O-CB 3.3Å; A78-R82 WeakPolarHBondContact O-CB 3.37Å; A78-R82 VanDerWaalsContact O-CG 3.25Å; A78-R82 WeakPolarHBondContact O-CG 3.32Å; A78-R82 PolarHBondContact O-N 3.13Å
79	D	49.4	Very low	48.1	Very low	58 Å²	58	80.5 Å²	80.5	31%	0.31	37%	0.374	S	S	.	.	H	α-helix	trans	-69	-34.1	173.5	-69.3	-26.3	0	0	0	111.1	V75 D77 R82 R83	V75-D79 WeakPolarHBondContact CG1-OD2 3.38Å; V75-D79 WeakPolarHBondContact O-CB 3.37Å; V75-D79 PolarHBondContact O-N 3.42Å; D77-D79 VanDerWaalsContact C-N 3.33Å; D79-R82 PolarHBondContact O-N 3.13Å; D79-R82 IonicContact OD1-NH1 3.41Å; D79-R83 WeakPolarHBondContact O-CB 3.46Å; D79-R83 VanDerWaalsContact O-CG 3.25Å; D79-R83 WeakPolarHBondContact O-CG 3.42Å; D79-R83 PolarHBondContact O-N 3.38Å
80	R	48.8	Very low	47.6	Very low	138 Å²	138	80.9 Å²	80.9	52%	0.521	38%	0.38	S	S	.	.	H	α-helix	trans	-65.2	-43.8	171.1	-170.9	-176.3	-178.6	-164.7	-2	112.2	T76 D77 A78 R83 Q84	T76-R80 WeakPolarHBondContact O-CB 3.4Å; T76-R80 PolarHBondContact O-N 3.21Å; D77-R80 WeakPolarHBondContact O-CB 3.46Å; D77-R80 PolarHBondContact O-N 3.39Å; D77-R80 WeakPolarHBondContact OD1-CD 3.41Å; D77-R80 IonicContact OD1-NH1 3.9Å; A78-R80 VanDerWaalsContact C-N 3.34Å; R80-R83 PolarHBondContact O-N 3.09Å; R80-Q84 WeakPolarHBondContact O-CB 3.34Å; R80-Q84 PolarHBondContact O-N 2.85Å
81	L	46.5	Very low	47.1	Very low	72 Å²	72	85.6 Å²	85.6	38%	0.377	40%	0.396	S	S	.	.	H	α-helix	trans	-65	-42.3	174.9	-81.8	160.1	0	0	0	111.1	D77 A78 Q84 E85	D77-L81 WeakPolarHBondContact O-CB 3.21Å; D77-L81 WeakPolarHBondContact O-CG 3.33Å; D77-L81 PolarHBondContact O-N 3Å; A78-L81 PolarHBondContact O-N 2.82Å; L81-Q84 CarbonylContact O-C 3.58Å; L81-Q84 PolarHBondContact O-N 3.04Å; L81-E85 VanDerWaalsContact O-CB 3.29Å; L81-E85 WeakPolarHBondContact O-CB 3.48Å; L81-E85 PolarHBondContact O-N 2.76Å
82	R	47.9	Very low	46.5	Very low	123 Å²	123	85.8 Å²	85.8	46%	0.464	40%	0.401	S	S	.	.	H	α-helix	trans	-65.4	-36.6	173.9	-78.4	173.3	177.3	178.6	-5.8	112.6	A78 D79 E85 R86	A78-R82 VanDerWaalsContact O-CB 3.3Å; A78-R82 WeakPolarHBondContact O-CB 3.37Å; A78-R82 VanDerWaalsContact O-CG 3.25Å; A78-R82 WeakPolarHBondContact O-CG 3.32Å; A78-R82 PolarHBondContact O-N 3.13Å; D79-R82 PolarHBondContact O-N 3.13Å; D79-R82 IonicContact OD1-NH1 3.41Å; R82-E85 PolarHBondContact O-N 3.35Å; R82-R86 WeakPolarHBondContact O-CA 3.34Å; R82-R86 WeakPolarHBondContact O-CB 3.31Å; R82-R86 PolarHBondContact O-N 2.82Å
83	R	47.8	Very low	46.2	Very low	121 Å²	121	89.2 Å²	89.2	46%	0.457	41%	0.409	S	S	.	.	H	α-helix	trans	-63.4	-49.9	170.6	-78.4	178.2	-168.9	-158.6	1.1	109.6	D79 R80 E85 R86 D87	D79-R83 WeakPolarHBondContact O-CB 3.46Å; D79-R83 VanDerWaalsContact O-CG 3.25Å; D79-R83 WeakPolarHBondContact O-CG 3.42Å; D79-R83 PolarHBondContact O-N 3.38Å; R80-R83 PolarHBondContact O-N 3.09Å; R83-E85 PolarHBondContact O-N 2.97Å; R83-R86 CarbonylContact O-C 3.57Å; R83-R86 PolarHBondContact O-N 2.81Å; R83-R86 VanDerWaalsContact O-N 3.08Å; R83-D87 WeakPolarHBondContact O-CB 3.49Å; R83-D87 PolarHBondContact O-N 2.78Å
84	Q	45.2	Very low	46.2	Very low	82 Å²	82	94.1 Å²	94.1	38%	0.383	44%	0.439	S	S	.	.	H	α-helix	trans	-59.9	-33.2	177.1	-167.1	175.1	9.4	0	0	113	R80 L81 R88	R80-Q84 WeakPolarHBondContact O-CB 3.34Å; R80-Q84 PolarHBondContact O-N 2.85Å; L81-Q84 CarbonylContact O-C 3.58Å; L81-Q84 PolarHBondContact O-N 3.04Å; Q84-R88 WeakPolarHBondContact O-CB 3.4Å; Q84-R88 WeakPolarHBondContact O-CD 3.41Å; Q84-R88 WeakPolarHBondContact O-CG 3.46Å; Q84-R88 PolarHBondContact O-N 2.61Å; Q84-R88 VanDerWaalsContact O-N 3.16Å
85	E	42.2	Very low	45.8	Very low	125 Å²	125	94.7 Å²	94.7	58%	0.584	45%	0.45	S	S	*	.	H	α-helix	trans	-80.1	-35.3	175.9	-165	154.5	-151.6	0	0	112.3	L81 R82 R83 R88 V89	L81-E85 VanDerWaalsContact O-CB 3.29Å; L81-E85 WeakPolarHBondContact O-CB 3.48Å; L81-E85 PolarHBondContact O-N 2.76Å; R82-E85 PolarHBondContact O-N 3.35Å; R83-E85 PolarHBondContact O-N 2.97Å; E85-R88 WeakPolarHBondContact O-CB 3.46Å; E85-R88 PolarHBondContact O-N 3.27Å; E85-V89 WeakPolarHBondContact O-CB 3.44Å; E85-V89 WeakPolarHBondContact O-CG2 3.41Å; E85-V89 PolarHBondContact O-N 2.97Å
86	R	38.9	Very low	45.4	Very low	166 Å²	166	96 Å²	96	63%	0.626	46%	0.462	S	S	*	.	H	α-helix	trans	-64.3	-50.8	171.3	-173.4	-175	-61.3	-151.6	1.4	110.2	R82 R83 R88 V89 E90	R82-R86 WeakPolarHBondContact O-CA 3.34Å; R82-R86 WeakPolarHBondContact O-CB 3.31Å; R82-R86 PolarHBondContact O-N 2.82Å; R83-R86 CarbonylContact O-C 3.57Å; R83-R86 PolarHBondContact O-N 2.81Å; R83-R86 VanDerWaalsContact O-N 3.08Å; R86-R88 PolarHBondContact O-N 2.88Å; R86-V89 CarbonylContact O-C 3.57Å; R86-V89 PolarHBondContact O-N 2.97Å; R86-E90 WeakPolarHBondContact O-CB 3.26Å; R86-E90 PolarHBondContact O-N 2.92Å
87	D	41.2	Very low	45.1	Very low	85 Å²	85	98.3 Å²	98.3	46%	0.455	48%	0.484	S	S	.	.	H	α-helix	trans	-58	-38.2	176	-58.4	-18.7	0	0	0	111	R83 Q91	R83-D87 WeakPolarHBondContact O-CB 3.49Å; R83-D87 PolarHBondContact O-N 2.78Å; D87-Q91 VanDerWaalsContact O-CB 3.29Å; D87-Q91 WeakPolarHBondContact O-CB 3.12Å; D87-Q91 WeakPolarHBondContact O-CG 3.46Å; D87-Q91 PolarHBondContact O-N 3.06Å
88	R	43.1	Very low	44.9	Very low	122 Å²	122	103.9 Å²	103.9	46%	0.46	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-49.3	172.5	-84.3	171.3	174.1	-169.8	-0.6	111.9	Q84 E85 R86 Q91 E92	Q84-R88 WeakPolarHBondContact O-CB 3.4Å; Q84-R88 WeakPolarHBondContact O-CD 3.41Å; Q84-R88 WeakPolarHBondContact O-CG 3.46Å; Q84-R88 PolarHBondContact O-N 2.61Å; Q84-R88 VanDerWaalsContact O-N 3.16Å; E85-R88 WeakPolarHBondContact O-CB 3.46Å; E85-R88 PolarHBondContact O-N 3.27Å; R86-R88 PolarHBondContact O-N 2.88Å; R88-Q91 PolarHBondContact O-N 3.28Å; R88-E92 WeakPolarHBondContact O-CB 3.16Å; R88-E92 PolarHBondContact O-N 2.99Å
89	V	44	Very low	44.3	Very low	71 Å²	71	110.1 Å²	110.1	43%	0.43	53%	0.532	S	S	.	.	H	α-helix	trans	-70.2	-37.8	-178.2	171.9	0	0	0	0	111.1	E85 R86 E92 Y93	E85-V89 WeakPolarHBondContact O-CB 3.44Å; E85-V89 WeakPolarHBondContact O-CG2 3.41Å; E85-V89 PolarHBondContact O-N 2.97Å; R86-V89 CarbonylContact O-C 3.57Å; R86-V89 PolarHBondContact O-N 2.97Å; V89-E92 CarbonylContact O-C 3.57Å; V89-E92 PolarHBondContact O-N 3.38Å; V89-Y93 HydrophobicContact CG1-CD2 4.3Å; V89-Y93 WeakPolarHBondContact O-CB 3.36Å; V89-Y93 PolarHBondContact O-N 3.42Å
90	E	42.2	Very low	43.5	Very low	113 Å²	113	110.6 Å²	110.6	53%	0.528	55%	0.55	S	S	.	*	H	α-helix	trans	-64.9	-44.1	174	-110.5	173.8	145.5	0	0	111.1	R86 E92 Y93 V94	R86-E90 WeakPolarHBondContact O-CB 3.26Å; R86-E90 PolarHBondContact O-N 2.92Å; E90-E92 VanDerWaalsContact C-N 3.27Å; E90-E92 PolarHBondContact O-N 3.12Å; E90-Y93 PolarHBondContact O-N 3.22Å; E90-V94 WeakPolarHBondContact O-CB 3.5Å; E90-V94 VanDerWaalsContact O-CG2 3.26Å; E90-V94 WeakPolarHBondContact O-CG2 3.47Å; E90-V94 PolarHBondContact O-N 3.32Å
91	Q	41.5	Very low	42.9	Very low	121 Å²	121	111.8 Å²	111.8	57%	0.565	57%	0.567	S	S	*	*	H	α-helix	trans	-65.5	-30.9	173.6	-85.1	177.6	-40.4	0	0	113	D87 R88 A95	D87-Q91 VanDerWaalsContact O-CB 3.29Å; D87-Q91 WeakPolarHBondContact O-CB 3.12Å; D87-Q91 WeakPolarHBondContact O-CG 3.46Å; D87-Q91 PolarHBondContact O-N 3.06Å; R88-Q91 PolarHBondContact O-N 3.28Å; Q91-A95 VanDerWaalsContact O-CB 3.26Å; Q91-A95 WeakPolarHBondContact O-CB 3.45Å; Q91-A95 PolarHBondContact O-N 3.37Å; Q91-A95 VanDerWaalsContact O-N 3.17Å
92	E	42.8	Very low	42.1	Very low	107 Å²	107	113.8 Å²	113.8	50%	0.5	59%	0.587	S	S	.	*	H	α-helix	trans	-74.9	-34.2	174.7	-153.1	165.2	-148.1	0	0	111.4	R88 V89 E90 S96	R88-E92 WeakPolarHBondContact O-CB 3.16Å; R88-E92 PolarHBondContact O-N 2.99Å; V89-E92 CarbonylContact O-C 3.57Å; V89-E92 PolarHBondContact O-N 3.38Å; E90-E92 VanDerWaalsContact C-N 3.27Å; E90-E92 PolarHBondContact O-N 3.12Å; E92-S96 VanDerWaalsContact O-CB 3.29Å; E92-S96 WeakPolarHBondContact O-CB 3.33Å; E92-S96 PolarHBondContact O-N 3.1Å; E92-S96 PolarHBondContact O-OG 2.79Å
93	Y	42.5	Very low	41.3	Very low	155 Å²	155	115.9 Å²	115.9	61%	0.608	60%	0.602	S	S	*	*	H	α-helix	trans	-69.1	-47.6	173.4	-120.6	-93.1	0	0	0	112.1	V89 E90 A95 S96 A97	V89-Y93 HydrophobicContact CG1-CD2 4.3Å; V89-Y93 WeakPolarHBondContact O-CB 3.36Å; V89-Y93 PolarHBondContact O-N 3.42Å; E90-Y93 PolarHBondContact O-N 3.22Å; Y93-A95 VanDerWaalsContact C-N 3.27Å; Y93-A95 PolarHBondContact O-N 2.95Å; Y93-S96 CarbonylContact O-C 3.56Å; Y93-S96 PolarHBondContact O-N 2.86Å; Y93-S96 VanDerWaalsContact O-N 3.08Å; Y93-A97 VanDerWaalsContact O-CB 3.24Å; Y93-A97 WeakPolarHBondContact O-CB 3.25Å; Y93-A97 PolarHBondContact O-N 3.47Å
94	V	50.1	Low	40.6	Very low	106 Å²	106	117.2 Å²	117.2	64%	0.642	62%	0.618	S	S	*	*	H	α-helix	trans	-64.7	-34.2	177.8	174.2	0	0	0	0	110.9	E90	E90-V94 WeakPolarHBondContact O-CB 3.5Å; E90-V94 VanDerWaalsContact O-CG2 3.26Å; E90-V94 WeakPolarHBondContact O-CG2 3.47Å; E90-V94 PolarHBondContact O-N 3.32Å
95	A	44.2	Very low	39.8	Very low	60 Å²	60	124.1 Å²	124.1	50%	0.496	64%	0.641	S	S	.	*	H	α-helix	trans	-70.7	-30.5	172.8	0	0	0	0	0	113.2	Q91 Y93	Q91-A95 VanDerWaalsContact O-CB 3.26Å; Q91-A95 WeakPolarHBondContact O-CB 3.45Å; Q91-A95 PolarHBondContact O-N 3.37Å; Q91-A95 VanDerWaalsContact O-N 3.17Å; Y93-A95 VanDerWaalsContact C-N 3.27Å; Y93-A95 PolarHBondContact O-N 2.95Å
96	S	43.8	Very low	39.3	Very low	75 Å²	75	126 Å²	126	52%	0.524	64%	0.643	S	S	.	*	H	α-helix	trans	-89.7	-26.6	-178.9	-57.5	0	0	0	0	113.4	E92 Y93 M98 H99	E92-S96 VanDerWaalsContact O-CB 3.29Å; E92-S96 WeakPolarHBondContact O-CB 3.33Å; E92-S96 PolarHBondContact O-N 3.1Å; E92-S96 PolarHBondContact O-OG 2.79Å; Y93-S96 CarbonylContact O-C 3.56Å; Y93-S96 PolarHBondContact O-N 2.86Å; Y93-S96 VanDerWaalsContact O-N 3.08Å; S96-M98 PolarHBondContact O-N 3.07Å; S96-H99 PolarHBondContact O-N 3.48Å
97	A	44.8	Very low	38.7	Very low	79 Å²	79	126.4 Å²	126.4	65%	0.653	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-8.6	178.8	0	0	0	0	0	113.8	Y93 H99	Y93-A97 VanDerWaalsContact O-CB 3.24Å; Y93-A97 WeakPolarHBondContact O-CB 3.25Å; Y93-A97 PolarHBondContact O-N 3.47Å; A97-H99 PolarHBondContact O-N 3.31Å
98	M	46.6	Very low	38	Very low	161 Å²	161	132.8 Å²	132.8	79%	0.793	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-7.2	166.5	-76.9	-87.8	-164.2	0	0	113.1	S96	S96-M98 PolarHBondContact O-N 3.07Å
99	H	37	Very low	37.3	Very low	173 Å²	173	132.8 Å²	132.8	80%	0.801	68%	0.679	S	S	*	*	S	Bend	trans	-134.8	89.5	176.5	-74.1	-29.7	0	0	0	112.6	S96 A97	S96-H99 PolarHBondContact O-N 3.48Å; A97-H99 PolarHBondContact O-N 3.31Å
100	G	31.4	Very low	36.6	Very low	67 Å²	67	135.3 Å²	135.3	69%	0.691	70%	0.695	S	S	*	*			trans	71.9	97.9	143	0	0	0	0	0	118.7
101	D	36.8	Very low	36	Very low	163 Å²	163	134.1 Å²	134.1	87%	0.872	70%	0.699	S	S	*	*			trans	21.6	102.6	141.9	-148.2	15.1	0	0	0	118.8
102	S	29.3	Very low	35.4	Very low	114 Å²	114	134.4 Å²	134.4	80%	0.797	71%	0.709	S	S	*	*			trans	-165.2	72	152.3	32.8	0	0	0	0	110.8
103	H	32.4	Very low	34.7	Very low	167 Å²	167	133.6 Å²	133.6	77%	0.773	71%	0.714	S	S	*	*			trans	-66.2	150.7	161	-132.1	-92.8	0	0	0	108.9
104	D	32.3	Very low	34.2	Very low	150 Å²	150	128.9 Å²	128.9	80%	0.802	70%	0.704	S	S	*	*	S	Bend	trans	105.4	3.1	167.2	-52.9	-15.5	0	0	0	119.7
105	R	29.1	Very low	33.7	Very low	226 Å²	226	126.9 Å²	126.9	85%	0.853	70%	0.695	S	S	*	*	S	Bend	trans	-109.1	-9.4	174.3	-155.9	172.2	-71.5	-178	0.9	116.3
106	Y	30.3	Very low	33.3	Very low	164 Å²	164	129.3 Å²	129.3	64%	0.643	70%	0.703	S	S	*	*	S	Bend	trans	-109.9	0.7	-169.3	-104.3	-90.8	0	0	0	117.3	R108 L109	Y106-R108 PolarHBondContact O-N 2.88Å; Y106-R108 VanDerWaalsContact O-N 3.15Å; Y106-L109 HydrophobicContact CD1-CB 4.43Å; Y106-L109 HydrophobicContact CD1-CD1 4.08Å; Y106-L109 HydrophobicContact CE1-CD1 3.57Å
107	E	27.6	Very low	32.8	Very low	175 Å²	175	130.6 Å²	130.6	82%	0.818	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-3.5	173.3	-79.9	-169.6	149.4	0	0	114.4	T110	E107-T110 PolarHBondContact O-OG1 3.47Å
108	R	27	Very low	32.8	Very low	220 Å²	220	131.4 Å²	131.4	83%	0.83	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	2.1	-178.1	-148.4	177.7	-88.8	175	-6.1	114.6	Y106	Y106-R108 PolarHBondContact O-N 2.88Å; Y106-R108 VanDerWaalsContact O-N 3.15Å
109	L	27.8	Very low	32.7	Very low	121 Å²	121	127.9 Å²	127.9	63%	0.634	68%	0.678	S	S	*	*	S	Bend	trans	-109.9	-3.5	175.8	-76.1	165.3	0	0	0	113.8	Y106 S111	Y106-L109 HydrophobicContact CD1-CB 4.43Å; Y106-L109 HydrophobicContact CD1-CD1 4.08Å; Y106-L109 HydrophobicContact CE1-CD1 3.57Å; L109-S111 VanDerWaalsContact C-N 3.33Å
110	T	28.4	Very low	32.9	Very low	125 Å²	125	128.1 Å²	128.1	77%	0.767	68%	0.679	S	S	*	*	S	Bend	trans	-88.5	5.6	174.1	43.7	0	0	0	0	113.7	E107	E107-T110 PolarHBondContact O-OG1 3.47Å
111	S	29.8	Very low	33.7	Very low	88 Å²	88	132.2 Å²	132.2	62%	0.615	67%	0.674	S	S	*	*			trans	-117.3	18.9	-173.5	75.1	0	0	0	0	115.6	L109	L109-S111 VanDerWaalsContact C-N 3.33Å
112	V	29	Very low	34.4	Very low	127 Å²	127	127.1 Å²	127.1	77%	0.77	65%	0.647	S	S	*	*	S	Bend	trans	-113.2	107.3	173.3	-172.4	0	0	0	0	110.3
113	S	29.1	Very low	35.7	Very low	89 Å²	89	128.7 Å²	128.7	62%	0.622	65%	0.646	S	S	*	*			trans	85.3	63.8	176.8	-145.2	0	0	0	0	115.2	S115	S113-S115 PolarHBondContact O-N 3.28Å
114	S	32.3	Very low	37.2	Very low	56 Å²	56	122.8 Å²	122.8	39%	0.392	63%	0.63	S	S	.	*			trans	-46.3	122	150.7	49.3	0	0	0	0	110	V116 D117	S114-V116 PolarHBondContact O-N 3.33Å; S114-D117 PolarHBondContact O-N 3.02Å
115	S	38.8	Very low	38.7	Very low	65 Å²	65	119.9 Å²	119.9	46%	0.455	61%	0.61	S	S	.	*	G	3₁₀ helix	trans	-58.2	-8.1	161.4	38.8	0	0	0	0	112.8	S113	S113-S115 PolarHBondContact O-N 3.28Å
116	V	36.5	Very low	40.6	Very low	110 Å²	110	112.9 Å²	112.9	67%	0.667	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-76.7	-23.4	176.6	-166.7	0	0	0	0	112.5	S114 F118	S114-V116 PolarHBondContact O-N 3.33Å; V116-F118 PolarHBondContact O-N 3.18Å
117	D	32.7	Very low	42.6	Very low	102 Å²	102	106.1 Å²	106.1	55%	0.545	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-83.7	-6.6	-179.6	-99.2	-8.4	0	0	0	114.6	S114	S114-D117 PolarHBondContact O-N 3.02Å
118	F	45.1	Very low	45	Very low	97 Å²	97	98.6 Å²	98.6	43%	0.425	54%	0.536	S	S	.	.	S	Bend	trans	-90.6	-25.6	177.6	-81.5	-86.2	0	0	0	113.1	V116 Q120	V116-F118 PolarHBondContact O-N 3.18Å; F118-Q120 VanDerWaalsContact C-N 3.31Å; F118-Q120 PolarHBondContact O-N 2.8Å
119	D	43.7	Very low	47.3	Very low	87 Å²	87	92.3 Å²	92.3	47%	0.465	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-17.7	-170.4	-87.5	-34.8	0	0	0	114.1	R71	R71-D119 IonicContact CZ-OD1 3.27Å; R71-D119 IonicContact CZ-OD2 3.89Å; R71-D119 IonicContact NH1-OD1 3.94Å; R71-D119 PolarHBondContact NH1-OD1 3.15Å; R71-D119 IonicContact NH1-OD2 3.55Å; R71-D119 VanDerWaalsContact NH2-CG 3.33Å; R71-D119 IonicContact NH2-OD1 3.96Å; R71-D119 PolarHBondContact NH2-OD1 3.11Å; R71-D119 IonicContact NH2-OD2 2.77Å; R71-D119 PolarHBondContact NH2-OD2 3.38Å
120	Q	41.3	Very low	49.7	Very low	178 Å²	178	91.4 Å²	91.4	83%	0.832	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	0	-177.3	-145.4	155.3	20.2	0	0	114.7	F118	F118-Q120 VanDerWaalsContact C-N 3.31Å; F118-Q120 PolarHBondContact O-N 2.8Å
121	R	47.4	Very low	51.9	Low	152 Å²	152	86 Å²	86	57%	0.574	49%	0.487	S	S	*	.	S	Bend	trans	-103.6	-4.2	-168.4	-77.9	-178.7	178.1	160.6	6.9	116.6
122	D	53.2	Low	54.3	Low	57 Å²	57	82.1 Å²	82.1	31%	0.305	46%	0.459	S	S	.	.			trans	-127.7	39.4	-164.5	-105.3	1.4	0	0	0	115	R63 S127	R63-D122 IonicContact CZ-OD2 3.12Å; R63-D122 IonicContact NH2-OD2 3.01Å; R63-D122 PolarHBondContact NH2-OD2 2.94Å; D122-S127 WeakPolarHBondContact OD1-CB 3.36Å; D122-S127 PolarHBondContact OD1-OG 3.39Å
123	N	55.8	Low	56.8	Low	147 Å²	147	83 Å²	83	79%	0.786	45%	0.453	S	S	*	.			trans	-85.6	-6.4	-179.8	-72.2	-8.2	0	0	0	114.8
124	G	63.4	Low	59.2	Low	42 Å²	42	87.1 Å²	87.1	43%	0.433	46%	0.455	S	S	.	.	S	Bend	trans	-91.8	141.2	-176	0	0	0	0	0	113.5	C126 S127	G124-C126 PolarHBondContact O-N 3.28Å; G124-S127 PolarHBondContact O-N 3.48Å; G124-S127 VanDerWaalsContact O-N 3.12Å; G124-S127 PolarHBondContact O-OG 2.77Å
125	F	64.8	Low	61.6	Low	89 Å²	89	84.9 Å²	84.9	39%	0.39	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-25.8	-178.7	-151.6	-95.7	0	0	0	114.1	F57 S60 I61	F57-F125 AromaticContact CD2-CE1 3.6Å; F57-F125 HydrophobicContact CD2-CE1 3.6Å; F57-F125 HydrophobicContact CD2-CZ 4.19Å; F57-F125 AromaticContact CE2-CE1 3.49Å; F57-F125 HydrophobicContact CE2-CE1 3.49Å; F57-F125 VanDerWaalsContact CE2-CE1 3.49Å; F57-F125 AromaticContact CE2-CZ 3.72Å; F57-F125 HydrophobicContact CE2-CZ 3.72Å; F57-F125 HydrophobicContact CZ-CE1 4.38Å; F57-F125 HydrophobicContact CZ-CZ 4.18Å; S60-F125 VanDerWaalsContact CB-CE1 3.44Å; S60-F125 WeakPolarHBondContact CB-O 3.32Å; S60-F125 PolarHBondContact OG-O 2.76Å; I61-F125 HydrophobicContact CD1-CZ 4.48Å; I61-F125 HydrophobicContact CG1-CE1 4.47Å; I61-F125 HydrophobicContact CG1-CE2 4.22Å; I61-F125 HydrophobicContact CG1-CZ 3.54Å
126	C	68.6	Low	63.8	Low	79 Å²	79	88 Å²	88	53%	0.534	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	15	178.2	-59.5	0	0	0	0	113.8	G124 W128 L129	G124-C126 PolarHBondContact O-N 3.28Å; C126-W128 PolarHBondContact O-N 3.35Å; C126-L129 WeakPolarHBondContact O-CB 3.34Å; C126-L129 PolarHBondContact O-N 3.38Å; C126-L129 VanDerWaalsContact O-N 3.13Å
127	S	72.8	Confident	66.2	Low	23 Å²	23	84.8 Å²	84.8	16%	0.161	42%	0.422	C	S	.	.	H	α-helix	trans	-60.2	-31.6	-179.7	73.8	0	0	0	0	111.6	D122 G124 L129 T130 A131	D122-S127 WeakPolarHBondContact OD1-CB 3.36Å; D122-S127 PolarHBondContact OD1-OG 3.39Å; G124-S127 PolarHBondContact O-N 3.48Å; G124-S127 VanDerWaalsContact O-N 3.12Å; G124-S127 PolarHBondContact O-OG 2.77Å; S127-L129 PolarHBondContact O-N 3.09Å; S127-L129 VanDerWaalsContact O-N 3.14Å; S127-T130 PolarHBondContact O-N 3.01Å; S127-T130 PolarHBondContact O-OG1 2.83Å; S127-A131 PolarHBondContact O-N 2.72Å; S127-A131 VanDerWaalsContact O-N 3.12Å
128	W	77	Confident	68.7	Low	16 Å²	16	84 Å²	84	6%	0.061	42%	0.419	C	S	.	.	H	α-helix	trans	-53.8	-34.1	176.7	73.4	-96.4	0	0	0	113.5	L56 F59 S60 C126 T130 A131 I132 L585 Y661	L56-W128 HydrophobicContact CD2-CH2 3.81Å; L56-W128 HydrophobicContact CD2-CZ2 4.05Å; F59-W128 HydrophobicContact CD1-CD2 4.33Å; F59-W128 AromaticContact CD1-CE2 3.87Å; F59-W128 HydrophobicContact CD1-CH2 4.32Å; F59-W128 AromaticContact CD1-CZ2 3.88Å; F59-W128 HydrophobicContact CD1-CZ2 3.88Å; F59-W128 AromaticContact CE1-CD2 3.78Å; F59-W128 HydrophobicContact CE1-CD2 3.78Å; F59-W128 AromaticContact CE1-CE2 3.81Å; F59-W128 AromaticContact CE1-CE3 3.99Å; F59-W128 HydrophobicContact CE1-CE3 3.99Å; F59-W128 HydrophobicContact CE1-CG 4.26Å; F59-W128 HydrophobicContact CE1-CH2 4.32Å; F59-W128 HydrophobicContact CE1-CZ2 4.1Å; F59-W128 HydrophobicContact CE1-CZ3 4.25Å; S60-W128 PolarHBondContact OG-NE1 3.28Å; S60-W128 VanDerWaalsContact OG-NE1 3.13Å; C126-W128 PolarHBondContact O-N 3.35Å; W128-T130 VanDerWaalsContact C-N 3.35Å; W128-A131 WeakPolarHBondContact O-CB 3.48Å; W128-A131 PolarHBondContact O-N 3Å; W128-I132 HydrophobicContact CE3-CD1 3.68Å; W128-I132 HydrophobicContact CE3-CG1 4.48Å; W128-I132 HydrophobicContact CZ3-CD1 3.51Å; W128-I132 WeakPolarHBondContact O-CG1 3.41Å; W128-I132 PolarHBondContact O-N 2.99Å; W128-L585 HydrophobicContact CH2-CD2 3.73Å; W128-L585 HydrophobicContact CZ2-CD2 4.48Å; W128-L585 HydrophobicContact CZ3-CD2 4Å; W128-Y661 HydrophobicContact CB-CE2 4.28Å; W128-Y661 HydrophobicContact CE3-CD2 4.48Å; W128-Y661 HydrophobicContact CE3-CE2 4.31Å
129	L	76.6	Confident	70.6	Confident	89 Å²	89	82.9 Å²	82.9	47%	0.466	42%	0.415	S	S	.	.	H	α-helix	trans	-66.8	-38.8	179.3	-172.1	68.9	0	0	0	111.3	C126 S127 F133	C126-L129 WeakPolarHBondContact O-CB 3.34Å; C126-L129 PolarHBondContact O-N 3.38Å; C126-L129 VanDerWaalsContact O-N 3.13Å; S127-L129 PolarHBondContact O-N 3.09Å; S127-L129 VanDerWaalsContact O-N 3.14Å; L129-F133 WeakPolarHBondContact O-CD2 3.44Å
130	T	76.9	Confident	72.5	Confident	101 Å²	101	78.8 Å²	78.8	62%	0.62	39%	0.392	S	S	*	.	H	α-helix	trans	-72.7	-31.2	176.4	66.8	0	0	0	0	112.1	S127 W128 I132 F133	S127-T130 PolarHBondContact O-N 3.01Å; S127-T130 PolarHBondContact O-OG1 2.83Å; W128-T130 VanDerWaalsContact C-N 3.35Å; T130-I132 VanDerWaalsContact C-N 3.29Å; T130-I132 PolarHBondContact O-N 3.49Å; T130-F133 PolarHBondContact O-N 2.72Å
131	A	75.1	Confident	74.6	Confident	13 Å²	13	76 Å²	76	11%	0.107	37%	0.374	C	S	.	.	H	α-helix	trans	-62.8	-34.8	176.8	0	0	0	0	0	112.1	S127 W128 F133 R134 I135	S127-A131 PolarHBondContact O-N 2.72Å; S127-A131 VanDerWaalsContact O-N 3.12Å; W128-A131 WeakPolarHBondContact O-CB 3.48Å; W128-A131 PolarHBondContact O-N 3Å; A131-F133 VanDerWaalsContact C-N 3.3Å; A131-F133 PolarHBondContact O-N 2.9Å; A131-R134 PolarHBondContact O-N 3.38Å; A131-R134 VanDerWaalsContact O-N 3.07Å; A131-I135 WeakPolarHBondContact O-CG1 3.45Å; A131-I135 PolarHBondContact O-N 2.6Å
132	I	80.8	Confident	76.2	Confident	6 Å²	6	74.9 Å²	74.9	3%	0.031	38%	0.38	C	S	.	.	H	α-helix	trans	-56.5	-43.4	-180	-65.9	175.9	0	0	0	112.1	W128 T130 R134 L657 Y661	W128-I132 HydrophobicContact CE3-CD1 3.68Å; W128-I132 HydrophobicContact CE3-CG1 4.48Å; W128-I132 HydrophobicContact CZ3-CD1 3.51Å; W128-I132 WeakPolarHBondContact O-CG1 3.41Å; W128-I132 PolarHBondContact O-N 2.99Å; T130-I132 VanDerWaalsContact C-N 3.29Å; T130-I132 PolarHBondContact O-N 3.49Å; I132-R134 VanDerWaalsContact C-N 3.31Å; I132-L657 HydrophobicContact CG2-CB 4.23Å; I132-L657 HydrophobicContact CG2-CD2 3.8Å; I132-Y661 HydrophobicContact CD1-CD2 4.03Å; I132-Y661 HydrophobicContact CD1-CG 4.18Å; I132-Y661 HydrophobicContact CG1-CD2 3.65Å; I132-Y661 HydrophobicContact CG1-CG 4.13Å
133	F	80.1	Confident	77.4	Confident	146 Å²	146	77.1 Å²	77.1	64%	0.64	39%	0.387	S	S	*	.	H	α-helix	trans	-79.4	-15.3	-178.3	-65.8	-73.9	0	0	0	113.3	L129 T130 A131 L657	L129-F133 WeakPolarHBondContact O-CD2 3.44Å; T130-F133 PolarHBondContact O-N 2.72Å; A131-F133 VanDerWaalsContact C-N 3.3Å; A131-F133 PolarHBondContact O-N 2.9Å; F133-L657 HydrophobicContact CD1-CD2 4.4Å; F133-L657 HydrophobicContact CE1-CD2 3.67Å; F133-L657 HydrophobicContact CZ-CD1 4.16Å; F133-L657 HydrophobicContact CZ-CD2 3.91Å
134	R	80.2	Confident	78.6	Confident	174 Å²	174	70.5 Å²	70.5	66%	0.657	35%	0.352	S	S	*	.	H	α-helix	trans	-91.7	-26.4	-176	-164	174	179.2	171	0.8	113.5	A131 I132 K136	A131-R134 PolarHBondContact O-N 3.38Å; A131-R134 VanDerWaalsContact O-N 3.07Å; I132-R134 VanDerWaalsContact C-N 3.31Å; R134-K136 PolarHBondContact O-N 3.18Å
135	I	82.3	Confident	79.5	Confident	9 Å²	9	69.7 Å²	69.7	5%	0.046	34%	0.344	C	S	.	.			trans	-60.9	129.8	179	-66	158.5	0	0	0	109.8	A131 I140 R660 Y664 Y665	A131-I135 WeakPolarHBondContact O-CG1 3.45Å; A131-I135 PolarHBondContact O-N 2.6Å; I135-I140 HydrophobicContact CG2-CD1 3.7Å; I135-I140 HydrophobicContact CG2-CG1 3.57Å; I135-R660 PolarHBondContact O-NH2 3Å; I135-Y664 HydrophobicContact CD1-CD1 3.91Å; I135-Y664 HydrophobicContact CD1-CG 4.02Å; I135-Y664 HydrophobicContact CG1-CD1 4.29Å; I135-Y664 HydrophobicContact CG1-CE1 4.43Å; I135-Y664 HydrophobicContact CG1-CG 4.44Å; I135-Y664 HydrophobicContact CG2-CD2 3.86Å; I135-Y664 HydrophobicContact CG2-CE2 4.12Å; I135-Y664 HydrophobicContact CG2-CG 4.19Å; I135-Y665 HydrophobicContact CD1-CE2 3.74Å
136	K	86.1	Confident	80.4	Confident	131 Å²	131	67 Å²	67	57%	0.57	34%	0.342	S	S	*	.			trans	-91.9	153.6	178.2	-66.3	177.6	-177.8	173	0	112.3	R134 D138 E139 I140	R134-K136 PolarHBondContact O-N 3.18Å; K136-D138 VanDerWaalsContact C-N 3.25Å; K136-D138 PolarHBondContact O-N 2.84Å; K136-E139 HydrophobicContact CB-CG 4.15Å; K136-E139 PolarHBondContact N-OE2 3.49Å; K136-E139 PolarHBondContact O-N 2.69Å; K136-I140 WeakPolarHBondContact O-CG1 3.19Å; K136-I140 PolarHBondContact O-N 3.02Å
137	D	85.9	Confident	81.3	Confident	42 Å²	42	63.6 Å²	63.6	23%	0.225	32%	0.318	C	S	.	.	H	α-helix	trans	-64.2	-31.6	178.2	-73.3	11.2	0	0	0	111.9	I140 R141 R156 R660	D137-I140 PolarHBondContact O-N 2.77Å; D137-R141 PolarHBondContact O-N 3.2Å; D137-R156 IonicContact OD2-CZ 3.53Å; D137-R156 IonicContact OD2-NH1 2.72Å; D137-R156 PolarHBondContact OD2-NH1 3.02Å; D137-R156 IonicContact OD2-NH2 2.91Å; D137-R156 PolarHBondContact OD2-NH2 2.84Å; D137-R660 IonicContact OD1-CZ 2.72Å; D137-R660 IonicContact OD1-NH1 2.6Å; D137-R660 IonicContact OD1-NH2 3.35Å; D137-R660 PolarHBondContact OD1-NH2 2.85Å
138	D	85	Confident	82	Confident	87 Å²	87	62.6 Å²	62.6	47%	0.465	31%	0.311	S	S	.	.	H	α-helix	trans	-67.3	-41.8	176.1	-61.7	-53.9	0	0	0	111.6	K136 I140 R141 D142	K136-D138 VanDerWaalsContact C-N 3.25Å; K136-D138 PolarHBondContact O-N 2.84Å; D138-I140 VanDerWaalsContact C-N 3.3Å; D138-I140 PolarHBondContact O-N 2.94Å; D138-R141 WeakPolarHBondContact O-CB 3.17Å; D138-R141 PolarHBondContact O-N 3.2Å; D138-R141 VanDerWaalsContact O-N 3.09Å; D138-R141 IonicContact OD1-CZ 3.74Å; D138-R141 IonicContact OD1-NH1 2.75Å; D138-R141 PolarHBondContact OD1-NH1 2.74Å; D138-R141 IonicContact OD1-NH2 3.45Å; D138-R141 PolarHBondContact OD1-NH2 3.49Å; D138-D142 VanDerWaalsContact O-CG 3.28Å; D138-D142 PolarHBondContact O-N 3.24Å
139	E	85.1	Confident	82.6	Confident	73 Å²	73	63.3 Å²	63.3	34%	0.341	32%	0.317	S	S	.	.	H	α-helix	trans	-62.2	-38.1	175.4	-65.6	166	-169.6	0	0	111.6	K136 K143 Y664	K136-E139 HydrophobicContact CB-CG 4.15Å; K136-E139 PolarHBondContact N-OE2 3.49Å; K136-E139 PolarHBondContact O-N 2.69Å; E139-K143 WeakPolarHBondContact O-CB 3.47Å; E139-K143 PolarHBondContact O-N 2.97Å; E139-K143 VanDerWaalsContact O-N 3.08Å; E139-Y664 HydrophobicContact CB-CE2 4.26Å
140	I	84.6	Confident	83.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-67.1	-39.6	174.4	-63.7	169.4	0	0	0	110.6	I135 K136 D137 D138 D142 C144 A148 V149 L152 R660 Y664	I135-I140 HydrophobicContact CG2-CD1 3.7Å; I135-I140 HydrophobicContact CG2-CG1 3.57Å; K136-I140 WeakPolarHBondContact O-CG1 3.19Å; K136-I140 PolarHBondContact O-N 3.02Å; D137-I140 PolarHBondContact O-N 2.77Å; D138-I140 VanDerWaalsContact C-N 3.3Å; D138-I140 PolarHBondContact O-N 2.94Å; I140-D142 VanDerWaalsContact C-N 3.33Å; I140-D142 PolarHBondContact O-N 2.91Å; I140-C144 HydrophobicContact CG2-CB 4.14Å; I140-C144 WeakPolarHBondContact O-CA 3.38Å; I140-C144 VanDerWaalsContact O-CB 3.23Å; I140-C144 WeakPolarHBondContact O-CB 3.42Å; I140-C144 PolarHBondContact O-N 3.46Å; I140-A148 HydrophobicContact CG2-CB 4.11Å; I140-V149 HydrophobicContact CG2-CG2 4.26Å; I140-L152 HydrophobicContact CD1-CD1 3.79Å; I140-L152 HydrophobicContact CG2-CD1 4.21Å; I140-R660 HydrophobicContact CD1-CG 3.89Å; I140-Y664 HydrophobicContact CG1-CD2 3.94Å
141	R	85.1	Confident	83.9	Confident	120 Å²	120	55.4 Å²	55.4	45%	0.453	27%	0.271	S	S	.	.	H	α-helix	trans	-60.7	-45.8	177.6	-173	173.8	57.6	-139.1	-12.4	111.3	D137 D138 G145 V149	D137-R141 PolarHBondContact O-N 3.2Å; D138-R141 WeakPolarHBondContact O-CB 3.17Å; D138-R141 PolarHBondContact O-N 3.2Å; D138-R141 VanDerWaalsContact O-N 3.09Å; D138-R141 IonicContact OD1-CZ 3.74Å; D138-R141 IonicContact OD1-NH1 2.75Å; D138-R141 PolarHBondContact OD1-NH1 2.74Å; D138-R141 IonicContact OD1-NH2 3.45Å; D138-R141 PolarHBondContact OD1-NH2 3.49Å; R141-G145 CarbonylContact O-C 3.55Å; R141-G145 WeakPolarHBondContact O-CA 3.44Å; R141-G145 PolarHBondContact O-N 2.91Å; R141-V149 HydrophobicContact CB-CG2 3.79Å; R141-V149 HydrophobicContact CG-CG2 4.35Å
142	D	80.3	Confident	84.7	Confident	128 Å²	128	55 Å²	55	68%	0.684	27%	0.266	S	S	*	.	H	α-helix	trans	-73.9	-35.8	-173.6	-61	-13.4	0	0	0	111	D138 I140	D138-D142 VanDerWaalsContact O-CG 3.28Å; D138-D142 PolarHBondContact O-N 3.24Å; I140-D142 VanDerWaalsContact C-N 3.33Å; I140-D142 PolarHBondContact O-N 2.91Å
143	K	80	Confident	85.2	Confident	104 Å²	104	55.6 Å²	55.6	45%	0.452	27%	0.271	S	S	.	.	H	α-helix	trans	-84.3	-44.6	179.3	-170.3	-178.9	-176.1	-175.2	0	114.4	E139 Y664	E139-K143 WeakPolarHBondContact O-CB 3.47Å; E139-K143 PolarHBondContact O-N 2.97Å; E139-K143 VanDerWaalsContact O-N 3.08Å; K143-Y664 HydrophobicContact CD-CD2 4.06Å; K143-Y664 HydrophobicContact CD-CE2 3.79Å; K143-Y664 WeakPolarHBondContact CE-O 3.4Å; K143-Y664 PolarHBondContact NZ-O 2.81Å
144	C	79.1	Confident	85.8	Confident	8 Å²	8	48.7 Å²	48.7	5%	0.054	24%	0.241	C	C	.	.	H	α-helix	trans	-106	-9.9	-169	-54	0	0	0	0	113.3	I140 A148 L663	I140-C144 HydrophobicContact CG2-CB 4.14Å; I140-C144 WeakPolarHBondContact O-CA 3.38Å; I140-C144 VanDerWaalsContact O-CB 3.23Å; I140-C144 WeakPolarHBondContact O-CB 3.42Å; I140-C144 PolarHBondContact O-N 3.46Å; C144-A148 HydrophobicContact CB-CB 3.73Å; C144-L663 PolarHBondContact SG-O 3.46Å
145	G	83.1	Confident	86.5	Confident	25 Å²	25	40.4 Å²	40.4	26%	0.258	21%	0.21	S	C	.	.			trans	89	171.2	-178	0	0	0	0	0	114.5	R141 D147	R141-G145 CarbonylContact O-C 3.55Å; R141-G145 WeakPolarHBondContact O-CA 3.44Å; R141-G145 PolarHBondContact O-N 2.91Å; G145-D147 VanDerWaalsContact C-N 3.34Å; G145-D147 PolarHBondContact O-N 3.01Å
146	G	83.3	Confident	87.1	Confident	34 Å²	34	44.6 Å²	44.6	35%	0.351	23%	0.225	S	C	.	.	H	α-helix	trans	-65	-31.3	-176.8	0	0	0	0	0	114.6	A148 V149 H150	G146-A148 VanDerWaalsContact C-N 3.34Å; G146-A148 PolarHBondContact O-N 2.81Å; G146-V149 PolarHBondContact O-N 3.23Å; G146-H150 PolarHBondContact O-N 2.99Å; G146-H150 PolarHBondContact O-ND1 3.47Å
147	D	87.3	Confident	87.5	Confident	7 Å²	7	39.7 Å²	39.7	4%	0.037	20%	0.204	C	C	.	.	H	α-helix	trans	-67.9	-33.4	-177.1	-62.2	-37.3	0	0	0	112.7	G145 H150 Y151 F620 L672 H677	G145-D147 VanDerWaalsContact C-N 3.34Å; G145-D147 PolarHBondContact O-N 3.01Å; D147-H150 PolarHBondContact O-N 3.35Å; D147-H150 IonicContact OD1-ND1 3.33Å; D147-Y151 WeakPolarHBondContact O-CB 3.11Å; D147-Y151 PolarHBondContact O-N 2.89Å; D147-F620 HydrophobicContact CB-CE1 4.47Å; D147-F620 HydrophobicContact CB-CZ 4.14Å; D147-L672 PolarHBondContact OD2-N 2.73Å; D147-H677 IonicContact OD1-CD2 2.81Å; D147-H677 IonicContact OD1-NE2 2.7Å; D147-H677 PolarHBondContact OD1-NE2 3.12Å
148	A	89	Confident	87.9	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-43.3	172.7	0	0	0	0	0	111.3	I140 C144 G146 Y151 L152 L663	I140-A148 HydrophobicContact CG2-CB 4.11Å; C144-A148 HydrophobicContact CB-CB 3.73Å; G146-A148 VanDerWaalsContact C-N 3.34Å; G146-A148 PolarHBondContact O-N 2.81Å; A148-Y151 WeakPolarHBondContact O-CB 3.49Å; A148-Y151 PolarHBondContact O-N 3.22Å; A148-L152 WeakPolarHBondContact O-CG 3.22Å; A148-L152 PolarHBondContact O-N 3.46Å; A148-L663 HydrophobicContact CB-CD1 4.49Å; A148-L663 HydrophobicContact CB-CD2 4.38Å
149	V	89.3	Confident	88.4	Confident	31 Å²	31	34.6 Å²	34.6	19%	0.188	18%	0.176	C	C	.	.	H	α-helix	trans	-67.2	-39.5	177.6	-178.5	0	0	0	0	111.2	I140 R141 G146 L152 S153	I140-V149 HydrophobicContact CG2-CG2 4.26Å; R141-V149 HydrophobicContact CB-CG2 3.79Å; R141-V149 HydrophobicContact CG-CG2 4.35Å; G146-V149 PolarHBondContact O-N 3.23Å; V149-L152 PolarHBondContact O-N 3.4Å; V149-S153 WeakPolarHBondContact O-CB 3.49Å; V149-S153 PolarHBondContact O-N 3.1Å
150	H	88.8	Confident	89	Confident	25 Å²	25	33 Å²	33	12%	0.116	18%	0.179	C	C	.	.	H	α-helix	trans	-60.8	-43.5	173.7	-71.9	142.3	0	0	0	112.1	G146 D147 S153 F154 M230	G146-H150 PolarHBondContact O-N 2.99Å; G146-H150 PolarHBondContact O-ND1 3.47Å; D147-H150 PolarHBondContact O-N 3.35Å; D147-H150 IonicContact OD1-ND1 3.33Å; H150-S153 PolarHBondContact O-N 3.12Å; H150-F154 WeakPolarHBondContact O-CB 3.41Å; H150-F154 PolarHBondContact O-N 3.01Å; H150-M230 HydrophobicContact CB-CE 3.57Å
151	Y	91.8	Very high	89.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.6	-49.4	174.5	179.5	-97.2	0	0	0	112.6	D147 A148 S153 F154 Q155 F618 F620 A623 Y624 M627 D659 L663	D147-Y151 WeakPolarHBondContact O-CB 3.11Å; D147-Y151 PolarHBondContact O-N 2.89Å; A148-Y151 WeakPolarHBondContact O-CB 3.49Å; A148-Y151 PolarHBondContact O-N 3.22Å; Y151-S153 VanDerWaalsContact C-N 3.34Å; Y151-S153 PolarHBondContact O-N 3Å; Y151-F154 WeakPolarHBondContact O-CB 3.41Å; Y151-F154 PolarHBondContact O-N 3.3Å; Y151-Q155 HydrophobicContact CE1-CG 4.47Å; Y151-Q155 PolarHBondContact O-N 3.34Å; Y151-Q155 VanDerWaalsContact O-N 3.14Å; Y151-Q155 PolarHBondContact OH-NE2 3.44Å; Y151-F618 HydrophobicContact CD1-CE1 4.27Å; Y151-F618 HydrophobicContact CE1-CE1 4.09Å; Y151-F618 HydrophobicContact CE1-CZ 4.02Å; Y151-F618 HydrophobicContact CE2-CE1 4.39Å; Y151-F620 AromaticContact CD2-CD1 3.98Å; Y151-F620 HydrophobicContact CD2-CD1 3.98Å; Y151-F620 HydrophobicContact CD2-CE1 4.48Å; Y151-F620 HydrophobicContact CG-CD1 4.11Å; Y151-F620 HydrophobicContact CG-CE1 4.14Å; Y151-A623 HydrophobicContact CE2-CB 4.2Å; Y151-Y624 WeakPolarHBondContact CA-OH 3.13Å; Y151-Y624 HydrophobicContact CD2-CD1 4.12Å; Y151-Y624 HydrophobicContact CD2-CD2 4.11Å; Y151-Y624 AromaticContact CD2-CE1 3.64Å; Y151-Y624 HydrophobicContact CD2-CE1 3.64Å; Y151-Y624 AromaticContact CD2-CE2 3.63Å; Y151-Y624 HydrophobicContact CD2-CE2 3.63Å; Y151-Y624 HydrophobicContact CD2-CG 4.32Å; Y151-Y624 AromaticContact CD2-CZ 3.38Å; Y151-Y624 AromaticContact CE2-CD1 3.93Å; Y151-Y624 HydrophobicContact CE2-CD1 3.93Å; Y151-Y624 HydrophobicContact CE2-CD2 4.23Å; Y151-Y624 AromaticContact CE2-CE1 3.9Å; Y151-Y624 HydrophobicContact CE2-CE1 3.9Å; Y151-Y624 HydrophobicContact CE2-CE2 4.21Å; Y151-Y624 HydrophobicContact CE2-CG 4.08Å; Y151-M627 HydrophobicContact CE2-CE 3.96Å; Y151-D659 HydrophobicContact CE1-CB 4.08Å; Y151-D659 PolarHBondContact OH-OD2 2.73Å; Y151-D659 VanDerWaalsContact OH-OD2 3.08Å; Y151-L663 HydrophobicContact CD1-CD1 3.99Å; Y151-L663 HydrophobicContact CE1-CD1 4.49Å
152	L	92.5	Very high	90.1	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.016	16%	0.159	C	C	.	.	H	α-helix	trans	-67	-34.4	177.8	-67.2	175.7	0	0	0	112.3	I140 A148 V149 Q155 R156 R660 L663	I140-L152 HydrophobicContact CD1-CD1 3.79Å; I140-L152 HydrophobicContact CG2-CD1 4.21Å; A148-L152 WeakPolarHBondContact O-CG 3.22Å; A148-L152 PolarHBondContact O-N 3.46Å; V149-L152 PolarHBondContact O-N 3.4Å; L152-Q155 PolarHBondContact O-N 3.29Å; L152-R156 WeakPolarHBondContact O-CG 3.21Å; L152-R156 PolarHBondContact O-N 3.43Å; L152-R660 HydrophobicContact CD1-CG 4.37Å; L152-R660 HydrophobicContact CD2-CB 4.17Å; L152-L663 HydrophobicContact CD1-CD1 4.39Å; L152-L663 HydrophobicContact CD2-CD1 4.07Å; L152-L663 HydrophobicContact CG-CD1 4.12Å
153	S	91.2	Very high	90.9	Very high	20 Å²	20	24.6 Å²	24.6	14%	0.14	15%	0.146	C	C	.	.	H	α-helix	trans	-62.9	-42.4	172.3	-178.9	0	0	0	0	111.5	V149 H150 Y151 Q155 R156 H157	V149-S153 WeakPolarHBondContact O-CB 3.49Å; V149-S153 PolarHBondContact O-N 3.1Å; H150-S153 PolarHBondContact O-N 3.12Å; Y151-S153 VanDerWaalsContact C-N 3.34Å; Y151-S153 PolarHBondContact O-N 3Å; S153-Q155 PolarHBondContact O-N 3.3Å; S153-R156 PolarHBondContact O-N 3.4Å; S153-H157 PolarHBondContact O-N 3.48Å; S153-H157 PolarHBondContact O-ND1 3.46Å
154	F	92.5	Very high	91.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.7	-46.1	176.5	176.1	-95.9	0	0	0	111.7	H150 Y151 R156 H157 I158 M223 H226 Y624 M627 M628 A680 V681 V684	H150-F154 WeakPolarHBondContact O-CB 3.41Å; H150-F154 PolarHBondContact O-N 3.01Å; Y151-F154 WeakPolarHBondContact O-CB 3.41Å; Y151-F154 PolarHBondContact O-N 3.3Å; F154-R156 VanDerWaalsContact C-N 3.34Å; F154-R156 PolarHBondContact O-N 3.36Å; F154-H157 PolarHBondContact O-N 3.5Å; F154-H157 VanDerWaalsContact O-N 3.16Å; F154-I158 HydrophobicContact CD1-CD1 3.76Å; F154-I158 HydrophobicContact CE1-CD1 3.24Å; F154-I158 HydrophobicContact CE1-CG1 4.33Å; F154-I158 HydrophobicContact CE2-CD1 4.35Å; F154-I158 HydrophobicContact CZ-CD1 3.63Å; F154-I158 PolarHBondContact O-N 2.74Å; F154-I158 VanDerWaalsContact O-N 3.11Å; F154-M223 HydrophobicContact CE2-SD 4.04Å; F154-H226 VanDerWaalsContact CA-CE1 3.42Å; F154-H226 WeakPolarHBondContact CA-CE1 3.45Å; F154-H226 AromaticContact CD2-CD2 3.84Å; F154-H226 AromaticContact CD2-NE2 3.71Å; F154-H226 PolarHBondContact N-CE1 3.46Å; F154-H226 VanDerWaalsContact N-CE1 3.31Å; F154-Y624 HydrophobicContact CB-CE1 4.43Å; F154-Y624 HydrophobicContact CD1-CD1 4.13Å; F154-Y624 AromaticContact CD1-CE1 3.54Å; F154-Y624 HydrophobicContact CD1-CE1 3.54Å; F154-Y624 AromaticContact CE1-CD1 3.82Å; F154-Y624 HydrophobicContact CE1-CD1 3.82Å; F154-Y624 AromaticContact CE1-CE1 3.65Å; F154-Y624 HydrophobicContact CE1-CE1 3.65Å; F154-Y624 AromaticContact CG-CE1 3.94Å; F154-Y624 HydrophobicContact CG-CE1 3.94Å; F154-Y624 HydrophobicContact CZ-CD1 4.34Å; F154-Y624 HydrophobicContact CZ-CE1 4.18Å; F154-M627 HydrophobicContact CD1-CE 3.67Å; F154-M627 HydrophobicContact CD1-SD 4.46Å; F154-M627 HydrophobicContact CE1-CE 3.44Å; F154-M627 VanDerWaalsContact CE1-CE 3.44Å; F154-M627 HydrophobicContact CE1-SD 4.43Å; F154-M628 HydrophobicContact CE1-CG 4.44Å; F154-M628 HydrophobicContact CZ-CG 4.36Å; F154-M628 HydrophobicContact CZ-SD 4.2Å; F154-A680 HydrophobicContact CE2-CB 4.31Å; F154-A680 HydrophobicContact CZ-CB 4.15Å; F154-V681 HydrophobicContact CD2-CG2 4.32Å; F154-V681 HydrophobicContact CE2-CG2 4.12Å; F154-V684 HydrophobicContact CE1-CG2 4.41Å; F154-V684 HydrophobicContact CE2-CG2 4.07Å; F154-V684 HydrophobicContact CZ-CG2 3.46Å; F154-V684 VanDerWaalsContact CZ-CG2 3.46Å
155	Q	95.1	Very high	92.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-55.7	-45.6	174.8	-74	-179.3	-18.4	0	0	112.6	Y151 L152 S153 H157 I158 I159 M627 H656 D659	Y151-Q155 HydrophobicContact CE1-CG 4.47Å; Y151-Q155 PolarHBondContact O-N 3.34Å; Y151-Q155 VanDerWaalsContact O-N 3.14Å; Y151-Q155 PolarHBondContact OH-NE2 3.44Å; L152-Q155 PolarHBondContact O-N 3.29Å; S153-Q155 PolarHBondContact O-N 3.3Å; Q155-H157 VanDerWaalsContact C-N 3.31Å; Q155-H157 PolarHBondContact O-N 3.11Å; Q155-I158 PolarHBondContact O-N 3.43Å; Q155-I158 VanDerWaalsContact O-N 3.16Å; Q155-I159 WeakPolarHBondContact O-CG1 3.43Å; Q155-I159 PolarHBondContact O-N 3.33Å; Q155-M627 HydrophobicContact CG-CE 4.37Å; Q155-M627 HydrophobicContact CG-SD 3.49Å; Q155-M627 WeakPolarHBondContact CG-SD 3.47Å; Q155-H656 PolarHBondContact OE1-ND1 3.22Å; Q155-D659 PolarHBondContact NE2-OD2 3.28Å
156	R	94.3	Very high	93.1	Very high	98 Å²	98	21.7 Å²	21.7	37%	0.37	13%	0.134	S	C	.	.	H	α-helix	trans	-59.9	-38.4	177.8	-72.5	-176.8	-71.8	-168.5	-9.6	113.1	D137 L152 S153 F154 I159 G160	D137-R156 IonicContact OD2-CZ 3.53Å; D137-R156 IonicContact OD2-NH1 2.72Å; D137-R156 PolarHBondContact OD2-NH1 3.02Å; D137-R156 IonicContact OD2-NH2 2.91Å; D137-R156 PolarHBondContact OD2-NH2 2.84Å; L152-R156 WeakPolarHBondContact O-CG 3.21Å; L152-R156 PolarHBondContact O-N 3.43Å; S153-R156 PolarHBondContact O-N 3.4Å; F154-R156 VanDerWaalsContact C-N 3.34Å; F154-R156 PolarHBondContact O-N 3.36Å; R156-I159 PolarHBondContact O-N 3.17Å; R156-G160 PolarHBondContact O-N 3.48Å
157	H	93.4	Very high	93.7	Very high	27 Å²	27	24.9 Å²	24.9	13%	0.125	15%	0.147	C	C	.	.	H	α-helix	trans	-70.2	-34.6	177.4	-71	80.4	0	0	0	112.1	S153 F154 Q155 L161 S222 M223 H226	S153-H157 PolarHBondContact O-N 3.48Å; S153-H157 PolarHBondContact O-ND1 3.46Å; F154-H157 PolarHBondContact O-N 3.5Å; F154-H157 VanDerWaalsContact O-N 3.16Å; Q155-H157 VanDerWaalsContact C-N 3.31Å; Q155-H157 PolarHBondContact O-N 3.11Å; H157-L161 WeakPolarHBondContact O-CB 3.33Å; H157-L161 PolarHBondContact O-N 3.48Å; H157-S222 PolarHBondContact O-OG 3.02Å; H157-M223 HydrophobicContact CB-CE 4.37Å; H157-H226 HydrophobicContact CB-CB 4.25Å; H157-H226 AromaticContact CE1-ND1 3.73Å; H157-H226 AromaticContact ND1-ND1 3.45Å; H157-H226 PolarHBondContact ND1-ND1 2.98Å
158	I	95	Very high	94.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68.7	-42.6	172.5	-66.7	178.3	0	0	0	111.2	F154 Q155 G160 L161 L162 M223 F631 M652 V684	F154-I158 HydrophobicContact CD1-CD1 3.76Å; F154-I158 HydrophobicContact CE1-CD1 3.24Å; F154-I158 HydrophobicContact CE1-CG1 4.33Å; F154-I158 HydrophobicContact CE2-CD1 4.35Å; F154-I158 HydrophobicContact CZ-CD1 3.63Å; F154-I158 PolarHBondContact O-N 2.74Å; F154-I158 VanDerWaalsContact O-N 3.11Å; Q155-I158 PolarHBondContact O-N 3.43Å; Q155-I158 VanDerWaalsContact O-N 3.16Å; I158-G160 PolarHBondContact O-N 3.5Å; I158-L161 WeakPolarHBondContact O-CB 3.27Å; I158-L161 PolarHBondContact O-N 2.97Å; I158-L162 HydrophobicContact CG2-CD1 4.24Å; I158-L162 HydrophobicContact CG2-CG 4.44Å; I158-L162 PolarHBondContact O-N 3.38Å; I158-M223 HydrophobicContact CG1-CE 4.28Å; I158-F631 HydrophobicContact CG2-CD2 3.47Å; I158-F631 VanDerWaalsContact CG2-CD2 3.47Å; I158-F631 HydrophobicContact CG2-CE2 3.77Å; I158-F631 HydrophobicContact CG2-CG 4.18Å; I158-M652 HydrophobicContact CB-CE 3.9Å; I158-M652 HydrophobicContact CD1-CE 4.41Å; I158-M652 HydrophobicContact CG2-CE 3.53Å; I158-M652 HydrophobicContact CG2-CG 4.26Å; I158-M652 HydrophobicContact CG2-SD 4.2Å; I158-V684 HydrophobicContact CD1-CG2 4.26Å
159	I	96.8	Very high	94.3	Very high	22 Å²	22	26.2 Å²	26.2	11%	0.113	15%	0.153	C	C	.	.	H	α-helix	trans	-58.5	-49.5	175.1	-69.4	162.3	0	0	0	109.8	Q155 R156 L161 L162 V163 L649 M652 L653 H656	Q155-I159 WeakPolarHBondContact O-CG1 3.43Å; Q155-I159 PolarHBondContact O-N 3.33Å; R156-I159 PolarHBondContact O-N 3.17Å; I159-L161 VanDerWaalsContact C-N 3.29Å; I159-L161 PolarHBondContact O-N 2.95Å; I159-L162 PolarHBondContact O-N 2.9Å; I159-L162 VanDerWaalsContact O-N 3.17Å; I159-V163 HydrophobicContact CG2-CG2 4.49Å; I159-V163 WeakPolarHBondContact O-CG2 3.24Å; I159-V163 PolarHBondContact O-N 3.47Å; I159-L649 HydrophobicContact CG2-CD1 4.05Å; I159-M652 HydrophobicContact CG1-CB 3.83Å; I159-L653 HydrophobicContact CD1-CD2 4.25Å; I159-L653 HydrophobicContact CG2-CD2 3.84Å; I159-H656 HydrophobicContact CD1-CB 3.8Å
160	G	96.2	Very high	94.5	Very high	39 Å²	39	27.4 Å²	27.4	40%	0.402	16%	0.161	S	C	.	.	H	α-helix	trans	-58.1	-40.1	176.4	0	0	0	0	0	112.9	R156 I158 V163 V164	R156-G160 PolarHBondContact O-N 3.48Å; I158-G160 PolarHBondContact O-N 3.5Å; G160-V163 PolarHBondContact O-N 3.49Å; G160-V164 WeakPolarHBondContact O-CG2 3.32Å; G160-V164 PolarHBondContact O-N 2.76Å
161	L	95.9	Very high	94.8	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-62.7	-47.4	174.2	175.5	62.8	0	0	0	111.9	H157 I158 I159 V163 V164 V165 L218 T219 F631	H157-L161 WeakPolarHBondContact O-CB 3.33Å; H157-L161 PolarHBondContact O-N 3.48Å; I158-L161 WeakPolarHBondContact O-CB 3.27Å; I158-L161 PolarHBondContact O-N 2.97Å; I159-L161 VanDerWaalsContact C-N 3.29Å; I159-L161 PolarHBondContact O-N 2.95Å; L161-V163 VanDerWaalsContact C-N 3.34Å; L161-V163 PolarHBondContact O-N 3.07Å; L161-V164 PolarHBondContact O-N 2.89Å; L161-V165 HydrophobicContact CD1-CG2 4.21Å; L161-V165 WeakPolarHBondContact O-CB 3.15Å; L161-V165 WeakPolarHBondContact O-CG2 3.38Å; L161-V165 PolarHBondContact O-N 3.3Å; L161-L218 HydrophobicContact CD1-CB 4.11Å; L161-L218 HydrophobicContact CD1-CD2 3.52Å; L161-L218 HydrophobicContact CD1-CG 3.46Å; L161-L218 VanDerWaalsContact CD1-CG 3.46Å; L161-T219 HydrophobicContact CD2-CG2 4.02Å; L161-F631 HydrophobicContact CD2-CE2 4.02Å; L161-F631 HydrophobicContact CD2-CZ 3.62Å
162	L	96.4	Very high	94.9	Very high	1 Å²	1	32 Å²	32	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-66.7	-31.2	178.8	-77.8	177	0	0	0	113.2	I158 I159 G166 F631 V634 M635 V645 L649 M652	I158-L162 HydrophobicContact CG2-CD1 4.24Å; I158-L162 HydrophobicContact CG2-CG 4.44Å; I158-L162 PolarHBondContact O-N 3.38Å; I159-L162 PolarHBondContact O-N 2.9Å; I159-L162 VanDerWaalsContact O-N 3.17Å; L162-G166 WeakPolarHBondContact O-CA 3.34Å; L162-G166 PolarHBondContact O-N 3.44Å; L162-F631 HydrophobicContact CD1-CD2 4.25Å; L162-F631 HydrophobicContact CD2-CD2 4.12Å; L162-F631 HydrophobicContact CD2-CE2 3.98Å; L162-F631 HydrophobicContact CG-CD2 4.16Å; L162-F631 HydrophobicContact CG-CE2 4.07Å; L162-V634 HydrophobicContact CD2-CG1 3.82Å; L162-M635 HydrophobicContact CD2-SD 4.29Å; L162-V645 HydrophobicContact CD2-CG1 4.42Å; L162-L649 HydrophobicContact CB-CD1 4.07Å; L162-M652 HydrophobicContact CD1-CB 4.12Å; L162-M652 HydrophobicContact CD1-CG 3.44Å; L162-M652 VanDerWaalsContact CD1-CG 3.44Å
163	V	97.4	Very high	94.9	Very high	67 Å²	67	31.8 Å²	31.8	41%	0.406	20%	0.196	S	C	.	.	H	α-helix	trans	-62.2	-49.3	172.8	169.9	0	0	0	0	110.1	I159 G160 L161 G166 V167 L649	I159-V163 HydrophobicContact CG2-CG2 4.49Å; I159-V163 WeakPolarHBondContact O-CG2 3.24Å; I159-V163 PolarHBondContact O-N 3.47Å; G160-V163 PolarHBondContact O-N 3.49Å; L161-V163 VanDerWaalsContact C-N 3.34Å; L161-V163 PolarHBondContact O-N 3.07Å; V163-G166 PolarHBondContact O-N 2.94Å; V163-V167 WeakPolarHBondContact O-CG2 3.32Å; V163-V167 PolarHBondContact O-N 3.19Å; V163-L649 HydrophobicContact CG2-CD1 3.71Å; V163-L649 HydrophobicContact CG2-CD2 4Å
164	V	96.9	Very high	94.9	Very high	65 Å²	65	32 Å²	32	39%	0.394	20%	0.195	S	C	.	.	H	α-helix	trans	-64.6	-46.1	179.4	177.4	0	0	0	0	110.9	G160 L161 G166 V167 L168 L218	G160-V164 WeakPolarHBondContact O-CG2 3.32Å; G160-V164 PolarHBondContact O-N 2.76Å; L161-V164 PolarHBondContact O-N 2.89Å; V164-G166 VanDerWaalsContact C-N 3.28Å; V164-G166 PolarHBondContact O-N 3.3Å; V164-V167 PolarHBondContact O-N 3.25Å; V164-L168 HydrophobicContact CG1-CD1 4.17Å; V164-L168 WeakPolarHBondContact O-CG 3.28Å; V164-L168 PolarHBondContact O-N 2.8Å; V164-L168 VanDerWaalsContact O-N 3.12Å; V164-L218 HydrophobicContact CB-CD2 3.85Å; V164-L218 HydrophobicContact CG1-CD1 4.21Å; V164-L218 HydrophobicContact CG1-CD2 3.45Å; V164-L218 VanDerWaalsContact CG1-CD2 3.45Å; V164-L218 HydrophobicContact CG1-CG 4.48Å
165	V	95.8	Very high	94.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.3	-39	174.7	168.9	0	0	0	0	111.2	L161 L168 S169 Y215 L218 M635 V645	L161-V165 HydrophobicContact CD1-CG2 4.21Å; L161-V165 WeakPolarHBondContact O-CB 3.15Å; L161-V165 WeakPolarHBondContact O-CG2 3.38Å; L161-V165 PolarHBondContact O-N 3.3Å; V165-L168 PolarHBondContact O-N 2.72Å; V165-S169 VanDerWaalsContact O-CB 3.25Å; V165-S169 WeakPolarHBondContact O-CB 2.97Å; V165-S169 PolarHBondContact O-N 3.47Å; V165-S169 PolarHBondContact O-OG 3.31Å; V165-Y215 HydrophobicContact CB-CE1 4.49Å; V165-Y215 HydrophobicContact CG1-CD2 4.1Å; V165-Y215 HydrophobicContact CG1-CE1 4.31Å; V165-Y215 HydrophobicContact CG1-CE2 3.57Å; V165-Y215 HydrophobicContact CG2-CD1 4.09Å; V165-Y215 HydrophobicContact CG2-CD2 4.42Å; V165-Y215 HydrophobicContact CG2-CE1 4.17Å; V165-Y215 HydrophobicContact CG2-CE2 4.48Å; V165-Y215 HydrophobicContact CG2-CG 4.23Å; V165-Y215 PolarHBondContact O-OH 3.29Å; V165-L218 HydrophobicContact CG2-CD2 4.02Å; V165-M635 HydrophobicContact CG1-SD 4.27Å; V165-M635 HydrophobicContact CG2-CE 4.29Å; V165-M635 HydrophobicContact CG2-SD 4.33Å; V165-V645 HydrophobicContact CG1-CG1 4.1Å; V165-V645 HydrophobicContact CG1-CG2 4.37Å
166	G	95.4	Very high	94.7	Very high	12 Å²	12	36.2 Å²	36.2	12%	0.124	22%	0.223	C	C	.	.	H	α-helix	trans	-63.8	-45.3	178.2	0	0	0	0	0	112.8	L162 V163 V164 L168 V170 V645	L162-G166 WeakPolarHBondContact O-CA 3.34Å; L162-G166 PolarHBondContact O-N 3.44Å; V163-G166 PolarHBondContact O-N 2.94Å; V164-G166 VanDerWaalsContact C-N 3.28Å; V164-G166 PolarHBondContact O-N 3.3Å; G166-L168 VanDerWaalsContact C-N 3.32Å; G166-L168 PolarHBondContact O-N 3.48Å; G166-V170 VanDerWaalsContact O-CB 3.32Å; G166-V170 WeakPolarHBondContact O-CB 3.48Å; G166-V170 WeakPolarHBondContact O-CG2 3.38Å; G166-V170 PolarHBondContact O-N 3.36Å; G166-V645 VanDerWaalsContact CA-CG1 3.46Å
167	V	96.1	Very high	94.4	Very high	101 Å²	101	31.6 Å²	31.6	61%	0.612	21%	0.205	S	C	*	.	H	α-helix	trans	-61.1	-42.7	175.4	173	0	0	0	0	110.9	V163 V164 G171	V163-V167 WeakPolarHBondContact O-CG2 3.32Å; V163-V167 PolarHBondContact O-N 3.19Å; V164-V167 PolarHBondContact O-N 3.25Å; V167-G171 VanDerWaalsContact O-CA 3.23Å; V167-G171 WeakPolarHBondContact O-CA 3.23Å; V167-G171 PolarHBondContact O-N 2.82Å
168	L	95.6	Very high	94.2	Very high	36 Å²	36	34.8 Å²	34.8	19%	0.188	22%	0.219	C	C	.	.	H	α-helix	trans	-69.3	-46.6	179.2	-69.6	177.2	0	0	0	112.5	V164 V165 G166 I172 V173 F211 L214 Y215	V164-L168 HydrophobicContact CG1-CD1 4.17Å; V164-L168 WeakPolarHBondContact O-CG 3.28Å; V164-L168 PolarHBondContact O-N 2.8Å; V164-L168 VanDerWaalsContact O-N 3.12Å; V165-L168 PolarHBondContact O-N 2.72Å; G166-L168 VanDerWaalsContact C-N 3.32Å; G166-L168 PolarHBondContact O-N 3.48Å; L168-I172 HydrophobicContact CD2-CD1 4.09Å; L168-I172 WeakPolarHBondContact O-CB 3.21Å; L168-I172 PolarHBondContact O-N 3.19Å; L168-I172 VanDerWaalsContact O-N 3.09Å; L168-V173 PolarHBondContact O-N 2.82Å; L168-F211 HydrophobicContact CB-CD1 4.12Å; L168-F211 HydrophobicContact CB-CE1 3.82Å; L168-F211 HydrophobicContact CD2-CE1 3.92Å; L168-F211 HydrophobicContact CG-CE1 4.28Å; L168-L214 HydrophobicContact CD1-CD2 3.88Å; L168-Y215 HydrophobicContact CB-CE1 4Å; L168-Y215 HydrophobicContact CD1-CE1 3.86Å
169	S	93.8	Very high	93.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	24%	0.244	C	C	.	.	I	π-helix	trans	-67.2	-49.8	179.9	-82.5	0	0	0	0	112	V165 V173 L174 Y215 S638	V165-S169 VanDerWaalsContact O-CB 3.25Å; V165-S169 WeakPolarHBondContact O-CB 2.97Å; V165-S169 PolarHBondContact O-N 3.47Å; V165-S169 PolarHBondContact O-OG 3.31Å; S169-V173 CarbonylContact O-C 3.55Å; S169-V173 WeakPolarHBondContact O-CB 3.22Å; S169-V173 PolarHBondContact O-N 3.08Å; S169-L174 PolarHBondContact O-N 3.42Å; S169-Y215 PolarHBondContact N-OH 3.16Å; S169-Y215 PolarHBondContact OG-OH 2.78Å; S169-S638 PolarHBondContact OG-O 3.28Å
170	V	94.1	Very high	93.1	Very high	56 Å²	56	37.7 Å²	37.7	34%	0.339	24%	0.242	S	C	.	.	I	π-helix	trans	-80.3	-35.6	-176.9	179.8	0	0	0	0	111.7	G166 L174 P175 P646	G166-V170 VanDerWaalsContact O-CB 3.32Å; G166-V170 WeakPolarHBondContact O-CB 3.48Å; G166-V170 WeakPolarHBondContact O-CG2 3.38Å; G166-V170 PolarHBondContact O-N 3.36Å; V170-L174 HydrophobicContact CG1-CD2 4.11Å; V170-P175 VanDerWaalsContact O-CD 3.25Å; V170-P175 WeakPolarHBondContact O-CD 3.37Å; V170-P646 HydrophobicContact CG2-CG 3.66Å
171	G	93.8	Very high	92.3	Very high	51 Å²	51	40.4 Å²	40.4	53%	0.526	25%	0.248	S	C	.	.	I	π-helix	trans	-78.5	-29.2	-177.9	0	0	0	0	0	114.3	V167	V167-G171 VanDerWaalsContact O-CA 3.23Å; V167-G171 WeakPolarHBondContact O-CA 3.23Å; V167-G171 PolarHBondContact O-N 2.82Å
172	I	94	Very high	91.3	Very high	69 Å²	69	43.8 Å²	43.8	35%	0.354	27%	0.265	S	S	.	.	I	π-helix	trans	-121	-56.4	-174.7	-54	174	0	0	0	111.3	L168 L174 P175 V176 L207 F211	L168-I172 HydrophobicContact CD2-CD1 4.09Å; L168-I172 WeakPolarHBondContact O-CB 3.21Å; L168-I172 PolarHBondContact O-N 3.19Å; L168-I172 VanDerWaalsContact O-N 3.09Å; I172-L174 PolarHBondContact O-N 3.37Å; I172-P175 WeakPolarHBondContact O-CD 3.06Å; I172-V176 VanDerWaalsContact O-CG2 3.23Å; I172-V176 WeakPolarHBondContact O-CG2 3.44Å; I172-V176 PolarHBondContact O-N 2.98Å; I172-L207 HydrophobicContact CG2-CD1 4.07Å; I172-L207 HydrophobicContact CG2-CD2 4.35Å; I172-F211 HydrophobicContact CB-CE1 4.35Å; I172-F211 HydrophobicContact CB-CZ 4.09Å; I172-F211 HydrophobicContact CD1-CE1 4.05Å; I172-F211 HydrophobicContact CD1-CZ 3.69Å; I172-F211 HydrophobicContact CG1-CZ 4.48Å; I172-F211 HydrophobicContact CG2-CE2 4.34Å; I172-F211 HydrophobicContact CG2-CZ 3.81Å
173	V	92.4	Very high	90.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.276	C	S	.	.	I	π-helix	trans	-66.8	-40.6	-173.1	-175	0	0	0	0	111.9	L168 S169 V176 N177 L207 F211 P642	L168-V173 PolarHBondContact O-N 2.82Å; S169-V173 CarbonylContact O-C 3.55Å; S169-V173 WeakPolarHBondContact O-CB 3.22Å; S169-V173 PolarHBondContact O-N 3.08Å; V173-V176 WeakPolarHBondContact O-CB 3.31Å; V173-V176 PolarHBondContact O-N 2.84Å; V173-N177 PolarHBondContact O-N 3.39Å; V173-L207 HydrophobicContact CG2-CD2 4.04Å; V173-F211 HydrophobicContact CG2-CD1 4.12Å; V173-F211 HydrophobicContact CG2-CE1 4.47Å; V173-F211 HydrophobicContact CG2-CG 4.34Å; V173-P642 HydrophobicContact CB-CG 4Å; V173-P642 HydrophobicContact CG1-CG 3.67Å
174	L	91.6	Very high	88.6	Confident	23 Å²	23	49.9 Å²	49.9	12%	0.12	29%	0.291	C	S	.	.	H	α-helix	trans	-65.3	-49	-179	179.6	67.2	0	0	0	113.2	S169 V170 I172 V176 N177 F178 P642 I643	S169-L174 PolarHBondContact O-N 3.42Å; V170-L174 HydrophobicContact CG1-CD2 4.11Å; I172-L174 PolarHBondContact O-N 3.37Å; L174-V176 VanDerWaalsContact C-N 3.26Å; L174-V176 PolarHBondContact O-N 3.41Å; L174-N177 WeakPolarHBondContact O-CB 3.44Å; L174-N177 PolarHBondContact O-N 2.73Å; L174-N177 VanDerWaalsContact O-N 3.13Å; L174-F178 HydrophobicContact CD1-CD2 4.12Å; L174-F178 HydrophobicContact CD1-CE2 3.68Å; L174-F178 HydrophobicContact CD1-CZ 4.33Å; L174-F178 HydrophobicContact CD2-CE2 4.15Å; L174-F178 HydrophobicContact CG-CD2 3.98Å; L174-F178 HydrophobicContact CG-CE2 3.68Å; L174-F178 WeakPolarHBondContact O-CD2 3.5Å; L174-F178 PolarHBondContact O-N 2.75Å; L174-P642 HydrophobicContact CB-CB 3.95Å; L174-P642 HydrophobicContact CB-CG 4.26Å; L174-P642 HydrophobicContact CD1-CB 4.45Å; L174-I643 HydrophobicContact CD1-CD1 4.36Å; L174-I643 HydrophobicContact CD1-CG1 4.08Å; L174-I643 HydrophobicContact CD2-CG1 4.36Å
175	P	92.5	Very high	87	Confident	68 Å²	68	53 Å²	53	44%	0.442	31%	0.305	S	S	.	.	H	α-helix	trans	-56.6	-38.7	171.5	-28.5	34.7	0	0	0	113.4	V170 I172 N177 F178 S179	V170-P175 VanDerWaalsContact O-CD 3.25Å; V170-P175 WeakPolarHBondContact O-CD 3.37Å; I172-P175 WeakPolarHBondContact O-CD 3.06Å; P175-N177 VanDerWaalsContact C-N 3.35Å; P175-N177 PolarHBondContact O-N 3.28Å; P175-F178 PolarHBondContact O-N 3.5Å; P175-S179 PolarHBondContact O-N 3.19Å
176	V	90.8	Very high	85.9	Confident	22 Å²	22	57.3 Å²	57.3	13%	0.133	33%	0.328	C	S	.	.	H	α-helix	trans	-61.9	-42.7	175.4	169.3	0	0	0	0	110.9	I172 V173 L174 F178 S179 L198 L204 L207	I172-V176 VanDerWaalsContact O-CG2 3.23Å; I172-V176 WeakPolarHBondContact O-CG2 3.44Å; I172-V176 PolarHBondContact O-N 2.98Å; V173-V176 WeakPolarHBondContact O-CB 3.31Å; V173-V176 PolarHBondContact O-N 2.84Å; L174-V176 VanDerWaalsContact C-N 3.26Å; L174-V176 PolarHBondContact O-N 3.41Å; V176-F178 VanDerWaalsContact C-N 3.34Å; V176-F178 PolarHBondContact O-N 3.21Å; V176-S179 WeakPolarHBondContact O-CB 3.23Å; V176-S179 PolarHBondContact O-N 2.97Å; V176-S179 PolarHBondContact O-OG 2.75Å; V176-L198 HydrophobicContact CG1-CD1 4.42Å; V176-L204 HydrophobicContact CG1-CB 3.98Å; V176-L204 HydrophobicContact CG1-CD1 4.19Å; V176-L204 HydrophobicContact CG1-CD2 4.11Å; V176-L204 HydrophobicContact CG1-CG 4.31Å; V176-L207 HydrophobicContact CG2-CD1 4.14Å
177	N	89	Confident	84.7	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-62.8	-39.4	175	-70.9	-16.5	0	0	0	112.6	V173 L174 P175 S179 G180 R192 T193 N197 H208	V173-N177 PolarHBondContact O-N 3.39Å; L174-N177 WeakPolarHBondContact O-CB 3.44Å; L174-N177 PolarHBondContact O-N 2.73Å; L174-N177 VanDerWaalsContact O-N 3.13Å; P175-N177 VanDerWaalsContact C-N 3.35Å; P175-N177 PolarHBondContact O-N 3.28Å; N177-S179 VanDerWaalsContact C-N 3.27Å; N177-S179 PolarHBondContact O-N 3.27Å; N177-G180 PolarHBondContact O-N 3.36Å; N177-R192 CarbonylContact C-O 3.56Å; N177-T193 PolarHBondContact ND2-O 3.12Å; N177-T193 VanDerWaalsContact ND2-O 3.1Å; N177-N197 PolarHBondContact O-ND2 2.94Å; N177-H208 PolarHBondContact OD1-NE2 3.34Å
178	F	88.2	Confident	83.5	Confident	94 Å²	94	64 Å²	64	41%	0.412	36%	0.357	S	S	.	.	H	α-helix	trans	-66.5	-26.4	176.5	-80.6	-58.2	0	0	0	113.9	L174 P175 V176 G180 R192 T193	L174-F178 HydrophobicContact CD1-CD2 4.12Å; L174-F178 HydrophobicContact CD1-CE2 3.68Å; L174-F178 HydrophobicContact CD1-CZ 4.33Å; L174-F178 HydrophobicContact CD2-CE2 4.15Å; L174-F178 HydrophobicContact CG-CD2 3.98Å; L174-F178 HydrophobicContact CG-CE2 3.68Å; L174-F178 WeakPolarHBondContact O-CD2 3.5Å; L174-F178 PolarHBondContact O-N 2.75Å; P175-F178 PolarHBondContact O-N 3.5Å; V176-F178 VanDerWaalsContact C-N 3.34Å; V176-F178 PolarHBondContact O-N 3.21Å; F178-G180 PolarHBondContact O-N 2.96Å; F178-R192 HydrophobicContact CD1-CB 4.27Å; F178-R192 HydrophobicContact CE1-CB 4.23Å; F178-T193 HydrophobicContact CE1-CG2 3.88Å; F178-T193 HydrophobicContact CZ-CG2 3.7Å
179	S	87.1	Confident	82.5	Confident	75 Å²	75	64.3 Å²	64.3	52%	0.524	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-14	176.1	77	0	0	0	0	113.8	P175 V176 N177	P175-S179 PolarHBondContact O-N 3.19Å; V176-S179 WeakPolarHBondContact O-CB 3.23Å; V176-S179 PolarHBondContact O-N 2.97Å; V176-S179 PolarHBondContact O-OG 2.75Å; N177-S179 VanDerWaalsContact C-N 3.27Å; N177-S179 PolarHBondContact O-N 3.27Å
180	G	82.5	Confident	81.9	Confident	8 Å²	8	64.6 Å²	64.6	8%	0.082	36%	0.363	C	S	.	.			trans	-68.5	150.2	175.5	0	0	0	0	0	113.4	N177 F178 N197	N177-G180 PolarHBondContact O-N 3.36Å; F178-G180 PolarHBondContact O-N 2.96Å; G180-N197 VanDerWaalsContact C-ND2 3.31Å; G180-N197 CarbonylContact C-O 3.57Å; G180-N197 VanDerWaalsContact CA-O 3.28Å; G180-N197 WeakPolarHBondContact CA-O 3.33Å; G180-N197 PolarHBondContact O-ND2 3.22Å
181	D	79.6	Confident	81.1	Confident	97 Å²	97	62 Å²	62	52%	0.519	35%	0.348	S	S	.	.			trans	-122.8	18.7	-174.5	64.8	-18	0	0	0	112.8	N197 K199	D181-N197 PolarHBondContact N-O 2.82Å; D181-K199 VanDerWaalsContact CG-CE 3.46Å; D181-K199 VanDerWaalsContact CG-NZ 3.27Å; D181-K199 WeakPolarHBondContact OD1-CD 3.4Å; D181-K199 WeakPolarHBondContact OD1-CE 3.01Å; D181-K199 IonicContact OD1-NZ 3.03Å; D181-K199 PolarHBondContact OD1-NZ 3.27Å; D181-K199 WeakPolarHBondContact OD2-CE 3.27Å; D181-K199 IonicContact OD2-NZ 2.95Å; D181-K199 PolarHBondContact OD2-NZ 3.46Å
182	L	73.9	Confident	80.5	Confident	75 Å²	75	62.1 Å²	62.1	39%	0.393	33%	0.333	S	S	.	.	S	Bend	trans	-87.1	-23.1	-172.7	-154.1	132.6	0	0	0	113.9	N197 K199	L182-N197 WeakPolarHBondContact CB-O 3.3Å; L182-N197 PolarHBondContact N-O 3.44Å; L182-N197 PolarHBondContact N-OD1 3.24Å; L182-K199 VanDerWaalsContact CD1-CA 3.47Å; L182-K199 HydrophobicContact CD1-CB 4.15Å; L182-K199 HydrophobicContact CD1-CG 3.63Å
183	L	71	Confident	80.1	Confident	45 Å²	45	58.9 Å²	58.9	24%	0.236	32%	0.316	C	S	.	.	S	Bend	trans	-106.8	150.6	175.8	-65.1	167.3	0	0	0	110.5	G191 R192 N197 P563	L183-G191 WeakPolarHBondContact CD1-O 3.3Å; L183-R192 HydrophobicContact CB-CG 4.49Å; L183-N197 WeakPolarHBondContact CB-OD1 3.43Å; L183-N197 HydrophobicContact CD1-CB 4.14Å; L183-N197 PolarHBondContact N-OD1 3.1Å; L183-N197 VanDerWaalsContact N-OD1 3.15Å; L183-P563 HydrophobicContact CD1-CG 4.43Å
184	E	65.8	Low	79.9	Confident	151 Å²	151	59.2 Å²	59.2	71%	0.706	32%	0.318	S	S	*	.			trans	-54.9	146.6	179.6	-69.8	177.3	-177.4	0	0	112.4	N186	E184-N186 PolarHBondContact O-N 3.01Å; E184-N186 PolarHBondContact OE2-ND2 3.48Å
185	N	64.8	Low	79.5	Confident	130 Å²	130	58.6 Å²	58.6	70%	0.695	32%	0.315	S	S	*	.	S	Bend	trans	-71.4	31.9	-176.5	-86.1	-29.7	0	0	0	114.6	R192	N185-R192 PolarHBondContact OD1-NH2 3.31Å
186	N	72.6	Confident	78.9	Confident	91 Å²	91	56 Å²	56	49%	0.487	30%	0.3	S	S	.	.			trans	-81.3	122.2	174	-71.2	-30	0	0	0	109.9	E184 Y188 S189 R192	E184-N186 PolarHBondContact O-N 3.01Å; E184-N186 PolarHBondContact OE2-ND2 3.48Å; N186-Y188 PolarHBondContact O-N 3.46Å; N186-S189 PolarHBondContact O-N 3.3Å; N186-R192 WeakPolarHBondContact O-CD 3.46Å
187	A	69	Low	78.5	Confident	81 Å²	81	55 Å²	55	67%	0.669	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.6	177.5	0	0	0	0	0	113	S189	A187-S189 VanDerWaalsContact C-N 3.34Å
188	Y	70.8	Confident	78.3	Confident	173 Å²	173	55 Å²	55	68%	0.678	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-2.1	-179.7	-58.5	-73.5	0	0	0	114.3	P37 F38 N186 F190	P37-Y188 HydrophobicContact CB-CD1 3.87Å; P37-Y188 HydrophobicContact CB-CG 4.34Å; F38-Y188 VanDerWaalsContact CA-O 3.27Å; F38-Y188 WeakPolarHBondContact CA-O 3.48Å; F38-Y188 PolarHBondContact N-O 3.27Å; N186-Y188 PolarHBondContact O-N 3.46Å; Y188-F190 PolarHBondContact O-N 3.06Å
189	S	76.1	Confident	77.8	Confident	41 Å²	41	55.3 Å²	55.3	29%	0.287	29%	0.294	S	S	.	.			trans	-84	111.6	179.6	-178.1	0	0	0	0	111.3	N186 A187 G191 R192	N186-S189 PolarHBondContact O-N 3.3Å; A187-S189 VanDerWaalsContact C-N 3.34Å; S189-G191 PolarHBondContact O-N 2.72Å; S189-R192 PolarHBondContact O-N 3.36Å
190	F	80.7	Confident	77	Confident	7 Å²	7	55.2 Å²	55.2	3%	0.031	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-57.3	-33.3	177.4	-178.4	-95.1	0	0	0	112.3	F38 V41 Y188 R192 T193 T194 P563 A567 V570 C641	F38-F190 AromaticContact CD1-CD2 3.88Å; F38-F190 HydrophobicContact CD1-CD2 3.88Å; F38-F190 HydrophobicContact CD2-CB 4.33Å; F38-F190 HydrophobicContact CD2-CD2 4.43Å; F38-F190 AromaticContact CE1-CD2 3.63Å; F38-F190 HydrophobicContact CE1-CD2 3.63Å; F38-F190 HydrophobicContact CE1-CE2 4.06Å; F38-F190 HydrophobicContact CE2-CD2 4.22Å; F38-F190 HydrophobicContact CG-CB 4.5Å; F38-F190 HydrophobicContact CG-CD2 4.28Å; F38-F190 AromaticContact CZ-CD2 3.83Å; F38-F190 HydrophobicContact CZ-CD2 3.83Å; F38-F190 HydrophobicContact CZ-CE2 4.36Å; V41-F190 HydrophobicContact CG2-CD2 4.41Å; V41-F190 HydrophobicContact CG2-CE2 4.13Å; Y188-F190 PolarHBondContact O-N 3.06Å; F190-R192 PolarHBondContact O-N 2.93Å; F190-R192 VanDerWaalsContact O-N 3.12Å; F190-T193 WeakPolarHBondContact O-CB 3.42Å; F190-T193 PolarHBondContact O-N 3.08Å; F190-T193 PolarHBondContact O-OG1 3.3Å; F190-T194 HydrophobicContact CD1-CG2 4.19Å; F190-T194 HydrophobicContact CE1-CG2 3.81Å; F190-P563 HydrophobicContact CD1-CB 4.46Å; F190-P563 WeakPolarHBondContact CD1-O 3.43Å; F190-P563 WeakPolarHBondContact CE1-O 3.46Å; F190-A567 HydrophobicContact CD1-CB 3.85Å; F190-A567 HydrophobicContact CD2-CB 4.19Å; F190-A567 HydrophobicContact CE1-CB 3.86Å; F190-A567 HydrophobicContact CE2-CB 4.18Å; F190-A567 HydrophobicContact CG-CB 4.02Å; F190-A567 HydrophobicContact CZ-CB 4.01Å; F190-V570 HydrophobicContact CZ-CG2 4.13Å; F190-C641 WeakPolarHBondContact CZ-SG 3.49Å
191	G	76.5	Confident	76.3	Confident	2 Å²	2	58.1 Å²	58.1	2%	0.021	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-62.8	-22.1	-175.7	0	0	0	0	0	115.8	L183 S189 T193 T194	L183-G191 WeakPolarHBondContact CD1-O 3.3Å; S189-G191 PolarHBondContact O-N 2.72Å; G191-T193 PolarHBondContact O-N 3.21Å; G191-T193 VanDerWaalsContact O-N 3.15Å; G191-T194 PolarHBondContact O-N 3Å; G191-T194 VanDerWaalsContact O-N 3.07Å; G191-T194 PolarHBondContact O-OG1 3.17Å
192	R	82	Confident	76.3	Confident	52 Å²	52	56.4 Å²	56.4	20%	0.196	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-60.3	-24	174.2	-65.2	-171.3	67.4	175.2	4.1	113.5	N177 F178 L183 N185 N186 S189 F190 T194	N177-R192 CarbonylContact C-O 3.56Å; F178-R192 HydrophobicContact CD1-CB 4.27Å; F178-R192 HydrophobicContact CE1-CB 4.23Å; L183-R192 HydrophobicContact CB-CG 4.49Å; N185-R192 PolarHBondContact OD1-NH2 3.31Å; N186-R192 WeakPolarHBondContact O-CD 3.46Å; S189-R192 PolarHBondContact O-N 3.36Å; F190-R192 PolarHBondContact O-N 2.93Å; F190-R192 VanDerWaalsContact O-N 3.12Å; R192-T194 VanDerWaalsContact C-N 3.31Å
193	T	86.1	Confident	76.7	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-85.5	-8.7	-178.6	70.9	0	0	0	0	113.1	F38 N177 F178 F190 G191 I643	F38-T193 HydrophobicContact CE2-CG2 3.87Å; F38-T193 HydrophobicContact CZ-CG2 3.85Å; N177-T193 PolarHBondContact ND2-O 3.12Å; N177-T193 VanDerWaalsContact ND2-O 3.1Å; F178-T193 HydrophobicContact CE1-CG2 3.88Å; F178-T193 HydrophobicContact CZ-CG2 3.7Å; F190-T193 WeakPolarHBondContact O-CB 3.42Å; F190-T193 PolarHBondContact O-N 3.08Å; F190-T193 PolarHBondContact O-OG1 3.3Å; G191-T193 PolarHBondContact O-N 3.21Å; G191-T193 VanDerWaalsContact O-N 3.15Å; T193-I643 VanDerWaalsContact CB-CD1 3.5Å; T193-I643 HydrophobicContact CG2-CD1 3.46Å; T193-I643 VanDerWaalsContact CG2-CD1 3.46Å
194	T	86.4	Confident	77.3	Confident	8 Å²	8	59.5 Å²	59.5	5%	0.049	33%	0.331	C	S	.	.	S	Bend	trans	-108.7	161.2	-171.9	69.4	0	0	0	0	111.5	F190 G191 R192 A196 N197 T640 C641	F190-T194 HydrophobicContact CD1-CG2 4.19Å; F190-T194 HydrophobicContact CE1-CG2 3.81Å; G191-T194 PolarHBondContact O-N 3Å; G191-T194 VanDerWaalsContact O-N 3.07Å; G191-T194 PolarHBondContact O-OG1 3.17Å; R192-T194 VanDerWaalsContact C-N 3.31Å; T194-A196 PolarHBondContact O-N 2.9Å; T194-A196 WeakPolarHBondContact OG1-CB 3.31Å; T194-N197 PolarHBondContact O-N 3.48Å; T194-N197 VanDerWaalsContact O-N 3.1Å; T194-T640 CarbonylContact C-O 3.56Å; T194-T640 WeakPolarHBondContact CA-O 3.34Å; T194-T640 WeakPolarHBondContact CB-O 3.29Å; T194-C641 HydrophobicContact CG2-CB 4.15Å
195	I	83.9	Confident	78.1	Confident	9 Å²	9	52.8 Å²	52.8	5%	0.046	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-56	-20.5	175.8	-167.3	171.3	0	0	0	113.2	N197 L198 H208 T640 F698 R702	I195-N197 PolarHBondContact O-N 3.47Å; I195-L198 HydrophobicContact CG1-CD1 4.42Å; I195-L198 PolarHBondContact O-N 3.5Å; I195-H208 HydrophobicContact CD1-CB 4.06Å; I195-H208 VanDerWaalsContact CD1-CD2 3.5Å; I195-H208 WeakPolarHBondContact CD1-CD2 3.49Å; I195-T640 HydrophobicContact CG2-CG2 4.1Å; I195-T640 PolarHBondContact N-O 3.42Å; I195-F698 HydrophobicContact CB-CE1 4.37Å; I195-F698 HydrophobicContact CB-CZ 4.33Å; I195-F698 HydrophobicContact CD1-CD1 3.92Å; I195-F698 HydrophobicContact CD1-CE1 3.54Å; I195-F698 HydrophobicContact CD1-CZ 4.34Å; I195-F698 HydrophobicContact CG1-CE1 3.69Å; I195-F698 HydrophobicContact CG1-CZ 4.05Å; I195-F698 HydrophobicContact CG2-CD1 4.4Å; I195-F698 HydrophobicContact CG2-CE1 3.83Å; I195-F698 HydrophobicContact CG2-CE2 3.94Å; I195-F698 HydrophobicContact CG2-CZ 3.56Å; I195-R702 PolarHBondContact O-NH1 3.08Å
196	A	79.8	Confident	79.2	Confident	15 Å²	15	51.4 Å²	51.4	12%	0.124	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-59.5	-26.7	176.9	0	0	0	0	0	113.1	T194 L198 P563 R702	T194-A196 PolarHBondContact O-N 2.9Å; T194-A196 WeakPolarHBondContact OG1-CB 3.31Å; A196-L198 VanDerWaalsContact C-N 3.26Å; A196-L198 PolarHBondContact O-N 3.43Å; A196-P563 HydrophobicContact CB-CG 3.88Å; A196-R702 PolarHBondContact O-NH1 3.06Å; A196-R702 PolarHBondContact O-NH2 3.3Å
197	N	83.5	Confident	80.1	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-72.1	-12.5	-178.2	-165.5	36.6	0	0	0	114.6	N177 G180 D181 L182 L183 T194 I195	N177-N197 PolarHBondContact O-ND2 2.94Å; G180-N197 VanDerWaalsContact C-ND2 3.31Å; G180-N197 CarbonylContact C-O 3.57Å; G180-N197 VanDerWaalsContact CA-O 3.28Å; G180-N197 WeakPolarHBondContact CA-O 3.33Å; G180-N197 PolarHBondContact O-ND2 3.22Å; D181-N197 PolarHBondContact N-O 2.82Å; L182-N197 WeakPolarHBondContact CB-O 3.3Å; L182-N197 PolarHBondContact N-O 3.44Å; L182-N197 PolarHBondContact N-OD1 3.24Å; L183-N197 WeakPolarHBondContact CB-OD1 3.43Å; L183-N197 HydrophobicContact CD1-CB 4.14Å; L183-N197 PolarHBondContact N-OD1 3.1Å; L183-N197 VanDerWaalsContact N-OD1 3.15Å; T194-N197 PolarHBondContact O-N 3.48Å; T194-N197 VanDerWaalsContact O-N 3.1Å; I195-N197 PolarHBondContact O-N 3.47Å
198	L	83.4	Confident	81	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.241	C	C	.	.	S	Bend	trans	-89	135	-177.3	-69.2	170.3	0	0	0	113.3	V176 I195 A196 L204 L205 H208 R702	V176-L198 HydrophobicContact CG1-CD1 4.42Å; I195-L198 HydrophobicContact CG1-CD1 4.42Å; I195-L198 PolarHBondContact O-N 3.5Å; A196-L198 VanDerWaalsContact C-N 3.26Å; A196-L198 PolarHBondContact O-N 3.43Å; L198-L204 HydrophobicContact CD2-CB 4.43Å; L198-L204 HydrophobicContact CD2-CD1 4.11Å; L198-L205 HydrophobicContact CB-CD1 4.4Å; L198-H208 VanDerWaalsContact CD1-CE1 3.42Å; L198-H208 WeakPolarHBondContact CD1-CE1 3.49Å; L198-R702 PolarHBondContact O-NH1 3.42Å; L198-R702 PolarHBondContact O-NH2 3.03Å
199	K	78.1	Confident	81.9	Confident	100 Å²	100	37.5 Å²	37.5	44%	0.435	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-59.9	143	174.7	-78.7	170.3	175.8	168.5	0	114.4	D181 L182 G201 N202	D181-K199 VanDerWaalsContact CG-CE 3.46Å; D181-K199 VanDerWaalsContact CG-NZ 3.27Å; D181-K199 WeakPolarHBondContact OD1-CD 3.4Å; D181-K199 WeakPolarHBondContact OD1-CE 3.01Å; D181-K199 IonicContact OD1-NZ 3.03Å; D181-K199 PolarHBondContact OD1-NZ 3.27Å; D181-K199 WeakPolarHBondContact OD2-CE 3.27Å; D181-K199 IonicContact OD2-NZ 2.95Å; D181-K199 PolarHBondContact OD2-NZ 3.46Å; L182-K199 VanDerWaalsContact CD1-CA 3.47Å; L182-K199 HydrophobicContact CD1-CB 4.15Å; L182-K199 HydrophobicContact CD1-CG 3.63Å; K199-G201 PolarHBondContact O-N 3.12Å; K199-N202 WeakPolarHBondContact O-CB 3.48Å; K199-N202 PolarHBondContact O-N 3Å
200	S	69.6	Low	82.5	Confident	73 Å²	73	38.3 Å²	38.3	51%	0.51	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	121.2	170.1	-58.8	0	0	0	0	109.3	R702	S200-R702 WeakPolarHBondContact OG-CG 3.42Å; S200-R702 PolarHBondContact OG-NE 3.21Å
201	G	68.4	Low	83.1	Confident	69 Å²	69	39.3 Å²	39.3	71%	0.711	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	101.1	-0.9	-176.8	0	0	0	0	0	115.6	K199	K199-G201 PolarHBondContact O-N 3.12Å
202	N	79.4	Confident	83.8	Confident	62 Å²	62	39.3 Å²	39.3	33%	0.332	22%	0.222	S	C	.	.			trans	-73.7	133.1	174.1	-167.5	-22.2	0	0	0	111.1	K199 L204 L205	K199-N202 WeakPolarHBondContact O-CB 3.48Å; K199-N202 PolarHBondContact O-N 3Å; N202-L204 PolarHBondContact O-N 2.98Å; N202-L204 WeakPolarHBondContact OD1-CG 3.45Å; N202-L204 PolarHBondContact OD1-N 2.95Å; N202-L204 VanDerWaalsContact OD1-N 3.1Å; N202-L205 HydrophobicContact CB-CD1 4.11Å; N202-L205 VanDerWaalsContact O-CD1 3.24Å; N202-L205 WeakPolarHBondContact O-CD1 3.4Å; N202-L205 PolarHBondContact O-N 2.94Å; N202-L205 VanDerWaalsContact O-N 3.12Å
203	N	82.8	Confident	84.2	Confident	131 Å²	131	40.7 Å²	40.7	70%	0.701	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.6	176.5	-70.1	-19	0	0	0	113.1	L205 W206	N203-L205 PolarHBondContact O-N 3.21Å; N203-W206 WeakPolarHBondContact O-CB 3.48Å; N203-W206 PolarHBondContact O-N 3.28Å; N203-W206 VanDerWaalsContact O-N 3.12Å
204	L	83.9	Confident	84.6	Confident	53 Å²	53	44.1 Å²	44.1	28%	0.277	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.2	175.4	-65	173.7	0	0	0	114.1	V176 L198 N202 W206 L207 H208	V176-L204 HydrophobicContact CG1-CB 3.98Å; V176-L204 HydrophobicContact CG1-CD1 4.19Å; V176-L204 HydrophobicContact CG1-CD2 4.11Å; V176-L204 HydrophobicContact CG1-CG 4.31Å; L198-L204 HydrophobicContact CD2-CB 4.43Å; L198-L204 HydrophobicContact CD2-CD1 4.11Å; N202-L204 PolarHBondContact O-N 2.98Å; N202-L204 WeakPolarHBondContact OD1-CG 3.45Å; N202-L204 PolarHBondContact OD1-N 2.95Å; N202-L204 VanDerWaalsContact OD1-N 3.1Å; L204-W206 PolarHBondContact O-N 2.96Å; L204-L207 WeakPolarHBondContact O-CB 3.42Å; L204-L207 PolarHBondContact O-N 3.14Å; L204-H208 PolarHBondContact O-ND1 2.06Å
205	L	82.3	Confident	84.9	Confident	11 Å²	11	43.8 Å²	43.8	6%	0.058	25%	0.245	C	C	.	.	H	α-helix	trans	-65.6	-28.5	172.8	-80.7	89.7	0	0	0	112.3	L198 N202 N203 L207 H208 T209 T703 T709	L198-L205 HydrophobicContact CB-CD1 4.4Å; N202-L205 HydrophobicContact CB-CD1 4.11Å; N202-L205 VanDerWaalsContact O-CD1 3.24Å; N202-L205 WeakPolarHBondContact O-CD1 3.4Å; N202-L205 PolarHBondContact O-N 2.94Å; N202-L205 VanDerWaalsContact O-N 3.12Å; N203-L205 PolarHBondContact O-N 3.21Å; L205-L207 PolarHBondContact O-N 2.81Å; L205-H208 PolarHBondContact O-N 3.18Å; L205-T209 PolarHBondContact O-N 3.04Å; L205-T703 HydrophobicContact CD2-CG2 4.34Å; L205-T709 HydrophobicContact CB-CG2 4.47Å
206	W	88.1	Confident	85.3	Confident	101 Å²	101	43.9 Å²	43.9	38%	0.383	25%	0.246	S	C	.	.	H	α-helix	trans	-62.3	-30.3	175.6	-80	100.9	0	0	0	113.1	N203 L204 T209 S210 P708 T709 F712	N203-W206 WeakPolarHBondContact O-CB 3.48Å; N203-W206 PolarHBondContact O-N 3.28Å; N203-W206 VanDerWaalsContact O-N 3.12Å; L204-W206 PolarHBondContact O-N 2.96Å; W206-T209 PolarHBondContact O-N 3.45Å; W206-S210 WeakPolarHBondContact O-CB 3.39Å; W206-S210 PolarHBondContact O-N 2.75Å; W206-S210 PolarHBondContact O-OG 3.07Å; W206-P708 HydrophobicContact CH2-CB 4.2Å; W206-P708 HydrophobicContact CZ2-CB 3.61Å; W206-T709 HydrophobicContact CD2-CG2 3.75Å; W206-T709 HydrophobicContact CE3-CG2 4.35Å; W206-T709 HydrophobicContact CG-CG2 3.94Å; W206-T709 HydrophobicContact CZ2-CG2 4.17Å; W206-F712 HydrophobicContact CH2-CB 4.17Å; W206-F712 HydrophobicContact CZ3-CB 3.94Å; W206-F712 HydrophobicContact CZ3-CD1 4.41Å; W206-F712 HydrophobicContact CZ3-CD2 4.29Å; W206-F712 AromaticContact CZ3-CG 3.96Å; W206-F712 HydrophobicContact CZ3-CG 3.96Å
207	L	90.4	Very high	85.9	Confident	41 Å²	41	47.5 Å²	47.5	22%	0.215	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-47.5	176.5	-171.5	146	0	0	0	110.2	I172 V173 V176 L204 L205 T209 S210 F211	I172-L207 HydrophobicContact CG2-CD1 4.07Å; I172-L207 HydrophobicContact CG2-CD2 4.35Å; V173-L207 HydrophobicContact CG2-CD2 4.04Å; V176-L207 HydrophobicContact CG2-CD1 4.14Å; L204-L207 WeakPolarHBondContact O-CB 3.42Å; L204-L207 PolarHBondContact O-N 3.14Å; L205-L207 PolarHBondContact O-N 2.81Å; L207-T209 VanDerWaalsContact C-N 3.35Å; L207-T209 PolarHBondContact O-N 3.01Å; L207-S210 PolarHBondContact O-N 3.29Å; L207-S210 VanDerWaalsContact O-N 3.15Å; L207-F211 HydrophobicContact CD1-CE2 4.24Å; L207-F211 HydrophobicContact CD2-CD2 3.65Å; L207-F211 HydrophobicContact CD2-CE2 3.68Å; L207-F211 HydrophobicContact CD2-CG 4.37Å; L207-F211 HydrophobicContact CD2-CZ 4.43Å; L207-F211 HydrophobicContact CG-CD2 3.8Å; L207-F211 HydrophobicContact CG-CE2 3.64Å; L207-F211 WeakPolarHBondContact O-CD2 3.48Å; L207-F211 PolarHBondContact O-N 3.15Å
208	H	89.6	Confident	86.3	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.009	27%	0.272	C	S	.	.	H	α-helix	trans	-59.1	-45.7	-179.9	-63.7	76.9	0	0	0	112	N177 I195 L198 L204 L205 F211 A212 I639	N177-H208 PolarHBondContact OD1-NE2 3.34Å; I195-H208 HydrophobicContact CD1-CB 4.06Å; I195-H208 VanDerWaalsContact CD1-CD2 3.5Å; I195-H208 WeakPolarHBondContact CD1-CD2 3.49Å; L198-H208 VanDerWaalsContact CD1-CE1 3.42Å; L198-H208 WeakPolarHBondContact CD1-CE1 3.49Å; L204-H208 PolarHBondContact O-ND1 2.06Å; L205-H208 PolarHBondContact O-N 3.18Å; H208-F211 PolarHBondContact O-N 3.34Å; H208-A212 PolarHBondContact O-N 3.04Å; H208-I639 HydrophobicContact CB-CG2 3.69Å
209	T	88.1	Confident	86.7	Confident	9 Å²	9	49.4 Å²	49.4	6%	0.055	27%	0.272	C	S	.	.	H	α-helix	trans	-62.7	-41.5	175.9	-66.1	0	0	0	0	112.7	L205 W206 L207 A212 F213 F712 T713	L205-T209 PolarHBondContact O-N 3.04Å; W206-T209 PolarHBondContact O-N 3.45Å; L207-T209 VanDerWaalsContact C-N 3.35Å; L207-T209 PolarHBondContact O-N 3.01Å; T209-A212 PolarHBondContact O-N 2.86Å; T209-F213 PolarHBondContact O-N 2.92Å; T209-F712 HydrophobicContact CG2-CD1 3.23Å; T209-F712 HydrophobicContact CG2-CE1 3.62Å; T209-F712 HydrophobicContact CG2-CG 4.34Å; T209-T713 HydrophobicContact CG2-CG2 3.35Å; T209-T713 WeakPolarHBondContact OG1-CG2 3.37Å
210	S	90.1	Very high	87.2	Confident	58 Å²	58	46.8 Å²	46.8	41%	0.406	26%	0.264	S	S	.	.	H	α-helix	trans	-68.1	-41.6	179.3	-57.3	0	0	0	0	111.8	W206 L207 A212 F213 L214	W206-S210 WeakPolarHBondContact O-CB 3.39Å; W206-S210 PolarHBondContact O-N 2.75Å; W206-S210 PolarHBondContact O-OG 3.07Å; L207-S210 PolarHBondContact O-N 3.29Å; L207-S210 VanDerWaalsContact O-N 3.15Å; S210-A212 VanDerWaalsContact C-N 3.33Å; S210-A212 PolarHBondContact O-N 3.23Å; S210-F213 PolarHBondContact O-N 2.77Å; S210-L214 PolarHBondContact O-N 3.27Å
211	F	92.3	Very high	88.2	Confident	28 Å²	28	49.9 Å²	49.9	12%	0.123	27%	0.266	C	S	.	.	H	α-helix	trans	-66.6	-33.6	176.2	-85.5	-108.8	0	0	0	112.2	L168 I172 V173 L207 H208 F213 L214 Y215 I639	L168-F211 HydrophobicContact CB-CD1 4.12Å; L168-F211 HydrophobicContact CB-CE1 3.82Å; L168-F211 HydrophobicContact CD2-CE1 3.92Å; L168-F211 HydrophobicContact CG-CE1 4.28Å; I172-F211 HydrophobicContact CB-CE1 4.35Å; I172-F211 HydrophobicContact CB-CZ 4.09Å; I172-F211 HydrophobicContact CD1-CE1 4.05Å; I172-F211 HydrophobicContact CD1-CZ 3.69Å; I172-F211 HydrophobicContact CG1-CZ 4.48Å; I172-F211 HydrophobicContact CG2-CE2 4.34Å; I172-F211 HydrophobicContact CG2-CZ 3.81Å; V173-F211 HydrophobicContact CG2-CD1 4.12Å; V173-F211 HydrophobicContact CG2-CE1 4.47Å; V173-F211 HydrophobicContact CG2-CG 4.34Å; L207-F211 HydrophobicContact CD1-CE2 4.24Å; L207-F211 HydrophobicContact CD2-CD2 3.65Å; L207-F211 HydrophobicContact CD2-CE2 3.68Å; L207-F211 HydrophobicContact CD2-CG 4.37Å; L207-F211 HydrophobicContact CD2-CZ 4.43Å; L207-F211 HydrophobicContact CG-CD2 3.8Å; L207-F211 HydrophobicContact CG-CE2 3.64Å; L207-F211 WeakPolarHBondContact O-CD2 3.48Å; L207-F211 PolarHBondContact O-N 3.15Å; H208-F211 PolarHBondContact O-N 3.34Å; F211-F213 VanDerWaalsContact C-N 3.33Å; F211-F213 PolarHBondContact O-N 2.63Å; F211-L214 WeakPolarHBondContact O-CB 3.18Å; F211-L214 PolarHBondContact O-N 3.07Å; F211-Y215 HydrophobicContact CD1-CE1 4.13Å; F211-Y215 WeakPolarHBondContact O-CB 3.01Å; F211-Y215 VanDerWaalsContact O-CD1 3.28Å; F211-Y215 WeakPolarHBondContact O-CD1 3.4Å; F211-Y215 VanDerWaalsContact O-CG 3.3Å; F211-Y215 PolarHBondContact O-N 2.75Å; F211-I639 HydrophobicContact CB-CD1 4.45Å
212	A	91	Very high	89.2	Confident	2 Å²	2	47.3 Å²	47.3	2%	0.017	24%	0.237	C	C	.	.	H	α-helix	trans	-61.2	-42.8	174.2	0	0	0	0	0	112.3	H208 T209 S210 Y215 L216 I639 L692 L695	H208-A212 PolarHBondContact O-N 3.04Å; T209-A212 PolarHBondContact O-N 2.86Å; S210-A212 VanDerWaalsContact C-N 3.33Å; S210-A212 PolarHBondContact O-N 3.23Å; A212-Y215 PolarHBondContact O-N 3.23Å; A212-L216 PolarHBondContact O-N 3.31Å; A212-L216 VanDerWaalsContact O-N 3.15Å; A212-I639 HydrophobicContact CB-CD1 3.49Å; A212-I639 VanDerWaalsContact CB-CD1 3.49Å; A212-L692 HydrophobicContact CB-CD2 3.56Å; A212-L692 HydrophobicContact CB-CG 4.42Å; A212-L695 HydrophobicContact CB-CD1 3.4Å; A212-L695 VanDerWaalsContact CB-CD1 3.4Å
213	F	91.3	Very high	89.6	Confident	81 Å²	81	44.5 Å²	44.5	36%	0.355	22%	0.222	S	C	.	.	H	α-helix	trans	-66.6	-40.6	173.9	-178.5	-115.5	0	0	0	112	T209 S210 F211 Y215 L216 L217 V716	T209-F213 PolarHBondContact O-N 2.92Å; S210-F213 PolarHBondContact O-N 2.77Å; F211-F213 VanDerWaalsContact C-N 3.33Å; F211-F213 PolarHBondContact O-N 2.63Å; F213-Y215 VanDerWaalsContact C-N 3.33Å; F213-Y215 PolarHBondContact O-N 3.01Å; F213-L216 HydrophobicContact CD2-CD2 4.38Å; F213-L216 WeakPolarHBondContact O-CB 3.47Å; F213-L216 PolarHBondContact O-N 2.88Å; F213-L217 HydrophobicContact CD1-CD1 4.14Å; F213-L217 HydrophobicContact CE1-CD1 3.66Å; F213-L217 HydrophobicContact CE1-CG 4.26Å; F213-L217 HydrophobicContact CE2-CG 4.47Å; F213-L217 HydrophobicContact CZ-CD1 3.98Å; F213-L217 HydrophobicContact CZ-CD2 4.21Å; F213-L217 HydrophobicContact CZ-CG 4.18Å; F213-L217 PolarHBondContact O-N 2.57Å; F213-L217 VanDerWaalsContact O-N 3.09Å; F213-V716 HydrophobicContact CD2-CG1 3.56Å; F213-V716 HydrophobicContact CE2-CG1 4.2Å; F213-V716 HydrophobicContact CG-CG1 4.38Å
214	L	93.8	Very high	89.7	Confident	73 Å²	73	46.9 Å²	46.9	38%	0.382	22%	0.221	S	C	.	.	H	α-helix	trans	-60.1	-41.4	174.1	-179.6	61.9	0	0	0	112.1	L168 S210 F211 L216 L217 L218	L168-L214 HydrophobicContact CD1-CD2 3.88Å; S210-L214 PolarHBondContact O-N 3.27Å; F211-L214 WeakPolarHBondContact O-CB 3.18Å; F211-L214 PolarHBondContact O-N 3.07Å; L214-L216 VanDerWaalsContact C-N 3.33Å; L214-L216 PolarHBondContact O-N 3.42Å; L214-L217 PolarHBondContact O-N 3.31Å; L214-L218 WeakPolarHBondContact O-CB 3.47Å; L214-L218 PolarHBondContact O-N 3.38Å
215	Y	94.1	Very high	89.7	Confident	2 Å²	2	50 Å²	50	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-65.3	-36.7	178.5	-72.9	5.5	0	0	0	112	V165 L168 S169 F211 A212 F213 T219 M635 S638 I639	V165-Y215 HydrophobicContact CB-CE1 4.49Å; V165-Y215 HydrophobicContact CG1-CD2 4.1Å; V165-Y215 HydrophobicContact CG1-CE1 4.31Å; V165-Y215 HydrophobicContact CG1-CE2 3.57Å; V165-Y215 HydrophobicContact CG2-CD1 4.09Å; V165-Y215 HydrophobicContact CG2-CD2 4.42Å; V165-Y215 HydrophobicContact CG2-CE1 4.17Å; V165-Y215 HydrophobicContact CG2-CE2 4.48Å; V165-Y215 HydrophobicContact CG2-CG 4.23Å; V165-Y215 PolarHBondContact O-OH 3.29Å; L168-Y215 HydrophobicContact CB-CE1 4Å; L168-Y215 HydrophobicContact CD1-CE1 3.86Å; S169-Y215 PolarHBondContact N-OH 3.16Å; S169-Y215 PolarHBondContact OG-OH 2.78Å; F211-Y215 HydrophobicContact CD1-CE1 4.13Å; F211-Y215 WeakPolarHBondContact O-CB 3.01Å; F211-Y215 VanDerWaalsContact O-CD1 3.28Å; F211-Y215 WeakPolarHBondContact O-CD1 3.4Å; F211-Y215 VanDerWaalsContact O-CG 3.3Å; F211-Y215 PolarHBondContact O-N 2.75Å; A212-Y215 PolarHBondContact O-N 3.23Å; F213-Y215 VanDerWaalsContact C-N 3.33Å; F213-Y215 PolarHBondContact O-N 3.01Å; Y215-T219 WeakPolarHBondContact O-CB 3.06Å; Y215-T219 PolarHBondContact O-N 3.03Å; Y215-T219 PolarHBondContact O-OG1 3.04Å; Y215-M635 HydrophobicContact CD2-CE 4.08Å; Y215-M635 HydrophobicContact CG-CE 4.32Å; Y215-S638 WeakPolarHBondContact CE2-OG 3.44Å; Y215-I639 HydrophobicContact CD2-CD1 3.9Å; Y215-I639 HydrophobicContact CD2-CG1 4.05Å; Y215-I639 HydrophobicContact CE2-CD1 4.04Å; Y215-I639 HydrophobicContact CE2-CG1 3.71Å
216	L	91.8	Very high	89.8	Confident	11 Å²	11	49.5 Å²	49.5	6%	0.058	23%	0.227	C	C	.	.	H	α-helix	trans	-60.2	-51.1	170.9	177.6	70.8	0	0	0	111.1	A212 F213 L214 L218 T219 V220 P688 I689 L692 T720	A212-L216 PolarHBondContact O-N 3.31Å; A212-L216 VanDerWaalsContact O-N 3.15Å; F213-L216 HydrophobicContact CD2-CD2 4.38Å; F213-L216 WeakPolarHBondContact O-CB 3.47Å; F213-L216 PolarHBondContact O-N 2.88Å; L214-L216 VanDerWaalsContact C-N 3.33Å; L214-L216 PolarHBondContact O-N 3.42Å; L216-L218 PolarHBondContact O-N 3.47Å; L216-T219 PolarHBondContact O-N 3.23Å; L216-V220 WeakPolarHBondContact O-CG2 3.24Å; L216-V220 PolarHBondContact O-N 2.88Å; L216-P688 HydrophobicContact CB-CB 4.14Å; L216-P688 HydrophobicContact CD1-CB 3.95Å; L216-P688 HydrophobicContact CD1-CG 3.71Å; L216-I689 HydrophobicContact CD1-CG1 4.3Å; L216-L692 HydrophobicContact CD2-CD1 4.09Å; L216-T720 HydrophobicContact CD1-CG2 3.96Å; L216-T720 HydrophobicContact CD2-CG2 3.6Å; L216-T720 VanDerWaalsContact CD2-OG1 3.32Å; L216-T720 WeakPolarHBondContact CD2-OG1 3.47Å; L216-T720 HydrophobicContact CG-CG2 4.41Å
217	L	91.1	Very high	89.5	Confident	90 Å²	90	48 Å²	48	47%	0.471	23%	0.229	S	C	.	.	H	α-helix	trans	-60.3	-44.7	179.6	-68.3	178.5	0	0	0	112.1	F213 L214 T219 V220 Y221	F213-L217 HydrophobicContact CD1-CD1 4.14Å; F213-L217 HydrophobicContact CE1-CD1 3.66Å; F213-L217 HydrophobicContact CE1-CG 4.26Å; F213-L217 HydrophobicContact CE2-CG 4.47Å; F213-L217 HydrophobicContact CZ-CD1 3.98Å; F213-L217 HydrophobicContact CZ-CD2 4.21Å; F213-L217 HydrophobicContact CZ-CG 4.18Å; F213-L217 PolarHBondContact O-N 2.57Å; F213-L217 VanDerWaalsContact O-N 3.09Å; L214-L217 PolarHBondContact O-N 3.31Å; L217-T219 VanDerWaalsContact C-N 3.35Å; L217-T219 PolarHBondContact O-N 3.41Å; L217-V220 PolarHBondContact O-N 3.04Å; L217-Y221 WeakPolarHBondContact O-CB 3.35Å; L217-Y221 PolarHBondContact O-N 3.26Å
218	L	93.4	Very high	88.9	Confident	40 Å²	40	50.4 Å²	50.4	21%	0.209	25%	0.249	C	C	.	.	H	α-helix	trans	-63.9	-40.3	178.9	-172.7	70.4	0	0	0	111.8	L161 V164 V165 L214 L216 Y221 S222	L161-L218 HydrophobicContact CD1-CB 4.11Å; L161-L218 HydrophobicContact CD1-CD2 3.52Å; L161-L218 HydrophobicContact CD1-CG 3.46Å; L161-L218 VanDerWaalsContact CD1-CG 3.46Å; V164-L218 HydrophobicContact CB-CD2 3.85Å; V164-L218 HydrophobicContact CG1-CD1 4.21Å; V164-L218 HydrophobicContact CG1-CD2 3.45Å; V164-L218 VanDerWaalsContact CG1-CD2 3.45Å; V164-L218 HydrophobicContact CG1-CG 4.48Å; V165-L218 HydrophobicContact CG2-CD2 4.02Å; L214-L218 WeakPolarHBondContact O-CB 3.47Å; L214-L218 PolarHBondContact O-N 3.38Å; L216-L218 PolarHBondContact O-N 3.47Å; L218-Y221 PolarHBondContact O-N 3.08Å; L218-S222 WeakPolarHBondContact O-CB 3.25Å; L218-S222 PolarHBondContact O-N 3.05Å
219	T	91.3	Very high	88.2	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.7	-48.3	176.1	-57.3	0	0	0	0	110.8	L161 Y215 L216 L217 Y221 S222 M223 V684 P688	L161-T219 HydrophobicContact CD2-CG2 4.02Å; Y215-T219 WeakPolarHBondContact O-CB 3.06Å; Y215-T219 PolarHBondContact O-N 3.03Å; Y215-T219 PolarHBondContact O-OG1 3.04Å; L216-T219 PolarHBondContact O-N 3.23Å; L217-T219 VanDerWaalsContact C-N 3.35Å; L217-T219 PolarHBondContact O-N 3.41Å; T219-Y221 VanDerWaalsContact C-N 3.34Å; T219-Y221 PolarHBondContact O-N 2.88Å; T219-S222 PolarHBondContact O-N 3.23Å; T219-M223 HydrophobicContact CG2-CG 4.39Å; T219-M223 WeakPolarHBondContact O-CB 3.4Å; T219-M223 VanDerWaalsContact O-CG 3.3Å; T219-M223 WeakPolarHBondContact O-CG 3.1Å; T219-M223 PolarHBondContact O-N 3.29Å; T219-V684 HydrophobicContact CG2-CG1 3.99Å; T219-P688 HydrophobicContact CG2-CG 4.07Å
220	V	89.1	Confident	87.5	Confident	45 Å²	45	57.7 Å²	57.7	27%	0.273	28%	0.281	S	S	.	.	H	α-helix	trans	-61.6	-42	177.5	172.8	0	0	0	0	111.2	L216 L217 R224 V685	L216-V220 WeakPolarHBondContact O-CG2 3.24Å; L216-V220 PolarHBondContact O-N 2.88Å; L217-V220 PolarHBondContact O-N 3.04Å; V220-R224 HydrophobicContact CG1-CG 4.44Å; V220-R224 WeakPolarHBondContact O-CB 3.12Å; V220-R224 WeakPolarHBondContact O-CG 3.23Å; V220-R224 PolarHBondContact O-N 3.08Å; V220-V685 HydrophobicContact CG2-CG1 4.29Å
221	Y	89.3	Confident	86.2	Confident	138 Å²	138	65.8 Å²	65.8	54%	0.541	30%	0.303	S	S	.	.	H	α-helix	trans	-61.6	-50.4	176	172.1	-96.7	0	0	0	112	L217 L218 T219 M223 R224 R225	L217-Y221 WeakPolarHBondContact O-CB 3.35Å; L217-Y221 PolarHBondContact O-N 3.26Å; L218-Y221 PolarHBondContact O-N 3.08Å; T219-Y221 VanDerWaalsContact C-N 3.34Å; T219-Y221 PolarHBondContact O-N 2.88Å; Y221-M223 VanDerWaalsContact C-N 3.32Å; Y221-M223 PolarHBondContact O-N 2.69Å; Y221-R224 PolarHBondContact O-N 3.49Å; Y221-R225 WeakPolarHBondContact O-CB 3.44Å; Y221-R225 PolarHBondContact O-N 3.05Å; Y221-R225 PolarHBondContact OH-NH1 2.67Å
222	S	90.6	Very high	85	Confident	15 Å²	15	68.1 Å²	68.1	11%	0.105	31%	0.311	C	S	.	.	H	α-helix	trans	-59.6	-44.2	179.2	-175	0	0	0	0	111.4	H157 L218 T219 R225 H226	H157-S222 PolarHBondContact O-OG 3.02Å; L218-S222 WeakPolarHBondContact O-CB 3.25Å; L218-S222 PolarHBondContact O-N 3.05Å; T219-S222 PolarHBondContact O-N 3.23Å; S222-R225 PolarHBondContact O-N 3.19Å; S222-H226 PolarHBondContact O-N 3.42Å
223	M	86.9	Confident	83.5	Confident	3 Å²	3	77.2 Å²	77.2	2%	0.015	35%	0.35	C	S	.	.	H	α-helix	trans	-66.5	-42.9	178.6	-74.8	-49.7	98.9	0	0	112.9	F154 H157 I158 T219 Y221 R225 H226 T227 V681 V684 V685	F154-M223 HydrophobicContact CE2-SD 4.04Å; H157-M223 HydrophobicContact CB-CE 4.37Å; I158-M223 HydrophobicContact CG1-CE 4.28Å; T219-M223 HydrophobicContact CG2-CG 4.39Å; T219-M223 WeakPolarHBondContact O-CB 3.4Å; T219-M223 VanDerWaalsContact O-CG 3.3Å; T219-M223 WeakPolarHBondContact O-CG 3.1Å; T219-M223 PolarHBondContact O-N 3.29Å; Y221-M223 VanDerWaalsContact C-N 3.32Å; Y221-M223 PolarHBondContact O-N 2.69Å; M223-R225 VanDerWaalsContact C-N 3.31Å; M223-R225 PolarHBondContact O-N 2.86Å; M223-H226 WeakPolarHBondContact O-CB 3.39Å; M223-H226 PolarHBondContact O-N 2.86Å; M223-T227 PolarHBondContact O-N 2.96Å; M223-T227 PolarHBondContact O-OG1 3.17Å; M223-T227 VanDerWaalsContact O-OG1 3.12Å; M223-V681 HydrophobicContact CB-CG1 3.8Å; M223-V681 HydrophobicContact CG-CG1 4.15Å; M223-V681 HydrophobicContact SD-CG1 4.2Å; M223-V681 HydrophobicContact SD-CG2 4.35Å; M223-V684 HydrophobicContact CE-CG1 4.3Å; M223-V684 HydrophobicContact CG-CG1 3.99Å; M223-V684 HydrophobicContact SD-CB 4.16Å; M223-V684 HydrophobicContact SD-CG1 3.79Å; M223-V685 HydrophobicContact CG-CG2 4.35Å
224	R	84.4	Confident	82.1	Confident	181 Å²	181	75.9 Å²	75.9	68%	0.683	35%	0.345	S	S	*	.	H	α-helix	trans	-61.1	-41.1	173.5	-79.2	-173.6	178.1	-174.9	1.4	111.9	V220 Y221 T227 S228	V220-R224 HydrophobicContact CG1-CG 4.44Å; V220-R224 WeakPolarHBondContact O-CB 3.12Å; V220-R224 WeakPolarHBondContact O-CG 3.23Å; V220-R224 PolarHBondContact O-N 3.08Å; Y221-R224 PolarHBondContact O-N 3.49Å; R224-T227 PolarHBondContact O-N 3.41Å; R224-S228 WeakPolarHBondContact O-CB 3.37Å; R224-S228 PolarHBondContact O-N 2.97Å
225	R	85.2	Confident	80.8	Confident	120 Å²	120	75.9 Å²	75.9	45%	0.453	35%	0.345	S	S	.	.	H	α-helix	trans	-62.1	-44.2	176.1	-175.1	173.6	-175.2	161.1	-2.3	111.2	Y221 S222 M223 S228 K229	Y221-R225 WeakPolarHBondContact O-CB 3.44Å; Y221-R225 PolarHBondContact O-N 3.05Å; Y221-R225 PolarHBondContact OH-NH1 2.67Å; S222-R225 PolarHBondContact O-N 3.19Å; M223-R225 VanDerWaalsContact C-N 3.31Å; M223-R225 PolarHBondContact O-N 2.86Å; R225-S228 PolarHBondContact O-N 3.45Å; R225-S228 PolarHBondContact O-OG 2.85Å; R225-K229 PolarHBondContact O-N 3.31Å
226	H	84.6	Confident	79.4	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-58.6	-52	175	176.7	63.9	0	0	0	111.4	F154 H157 S222 M223 S228 K229 M230	F154-H226 VanDerWaalsContact CA-CE1 3.42Å; F154-H226 WeakPolarHBondContact CA-CE1 3.45Å; F154-H226 AromaticContact CD2-CD2 3.84Å; F154-H226 AromaticContact CD2-NE2 3.71Å; F154-H226 PolarHBondContact N-CE1 3.46Å; F154-H226 VanDerWaalsContact N-CE1 3.31Å; H157-H226 HydrophobicContact CB-CB 4.25Å; H157-H226 AromaticContact CE1-ND1 3.73Å; H157-H226 AromaticContact ND1-ND1 3.45Å; H157-H226 PolarHBondContact ND1-ND1 2.98Å; S222-H226 PolarHBondContact O-N 3.42Å; M223-H226 WeakPolarHBondContact O-CB 3.39Å; M223-H226 PolarHBondContact O-N 2.86Å; H226-S228 VanDerWaalsContact C-N 3.3Å; H226-S228 PolarHBondContact O-N 3.47Å; H226-K229 PolarHBondContact O-N 3.42Å; H226-M230 WeakPolarHBondContact NE2-CE 3.42Å; H226-M230 PolarHBondContact NE2-SD 2.82Å; H226-M230 VanDerWaalsContact NE2-SD 3.41Å; H226-M230 WeakPolarHBondContact O-CG 3.45Å; H226-M230 PolarHBondContact O-N 3.2Å
227	T	81.5	Confident	78.6	Confident	70 Å²	70	80.6 Å²	80.6	43%	0.429	37%	0.371	S	S	.	.	H	α-helix	trans	-58.6	-39.5	178.6	-54.9	0	0	0	0	112.4	M223 R224 K229 M230	M223-T227 PolarHBondContact O-N 2.96Å; M223-T227 PolarHBondContact O-OG1 3.17Å; M223-T227 VanDerWaalsContact O-OG1 3.12Å; R224-T227 PolarHBondContact O-N 3.41Å; T227-K229 PolarHBondContact O-N 3.25Å; T227-M230 PolarHBondContact O-N 3.3Å
228	S	77.8	Confident	78.1	Confident	91 Å²	91	77.2 Å²	77.2	64%	0.636	35%	0.354	S	S	*	.	H	α-helix	trans	-64.9	-26.3	177.9	72.2	0	0	0	0	114	R224 R225 H226	R224-S228 WeakPolarHBondContact O-CB 3.37Å; R224-S228 PolarHBondContact O-N 2.97Å; R225-S228 PolarHBondContact O-N 3.45Å; R225-S228 PolarHBondContact O-OG 2.85Å; H226-S228 VanDerWaalsContact C-N 3.3Å; H226-S228 PolarHBondContact O-N 3.47Å
229	K	75.2	Confident	77.6	Confident	123 Å²	123	77.7 Å²	77.7	54%	0.535	35%	0.354	S	S	.	.	H	α-helix	trans	-87.4	-11.6	178.3	-73.4	-175.1	170.7	-170.1	0	113.3	R225 H226 T227 R231	R225-K229 PolarHBondContact O-N 3.31Å; H226-K229 PolarHBondContact O-N 3.42Å; T227-K229 PolarHBondContact O-N 3.25Å; K229-R231 PolarHBondContact O-N 2.98Å; K229-R231 VanDerWaalsContact O-N 3.08Å
230	M	72	Confident	77.4	Confident	41 Å²	41	80.8 Å²	80.8	20%	0.202	37%	0.366	C	S	.	.			trans	-76.4	95.1	177	-69.6	-179.6	125.2	0	0	109.6	H150 H226 T227 H677	H150-M230 HydrophobicContact CB-CE 3.57Å; H226-M230 WeakPolarHBondContact NE2-CE 3.42Å; H226-M230 PolarHBondContact NE2-SD 2.82Å; H226-M230 VanDerWaalsContact NE2-SD 3.41Å; H226-M230 WeakPolarHBondContact O-CG 3.45Å; H226-M230 PolarHBondContact O-N 3.2Å; T227-M230 PolarHBondContact O-N 3.3Å; M230-H677 HydrophobicContact CE-CB 3.51Å; M230-H677 HydrophobicContact SD-CB 4.23Å
231	R	64.3	Low	77.5	Confident	228 Å²	228	78.7 Å²	78.7	86%	0.86	35%	0.353	S	S	*	.			trans	-90.6	100.4	169.8	-70	-174.9	178.1	-177.1	-2.5	108.5	K229	K229-R231 PolarHBondContact O-N 2.98Å; K229-R231 VanDerWaalsContact O-N 3.08Å
232	Y	65.6	Low	77.6	Confident	77 Å²	77	72.1 Å²	72.1	30%	0.302	33%	0.327	S	S	.	.			trans	-91.1	112.4	176.4	-166.9	-99.8	0	0	0	109.1	E234 L672 K674	Y232-E234 HydrophobicContact CD1-CG 3.6Å; Y232-E234 HydrophobicContact CE1-CB 4.46Å; Y232-E234 HydrophobicContact CE1-CG 3.36Å; Y232-L672 PolarHBondContact OH-O 3.3Å; Y232-K674 HydrophobicContact CD1-CB 4.21Å; Y232-K674 HydrophobicContact CD1-CD 4.15Å; Y232-K674 HydrophobicContact CD2-CB 4.06Å; Y232-K674 HydrophobicContact CE1-CB 4.41Å; Y232-K674 HydrophobicContact CE2-CB 4.28Å; Y232-K674 HydrophobicContact CG-CB 4.04Å
233	K	59.8	Low	77.7	Confident	193 Å²	193	71.6 Å²	71.6	84%	0.839	32%	0.323	S	S	*	.			trans	-90.5	102	173	-167.3	177.1	-178.7	-176.8	0	107.3
234	E	62.4	Low	77.9	Confident	53 Å²	53	71.4 Å²	71.4	25%	0.248	32%	0.322	C	S	.	.			trans	-68.3	133.9	170.7	-82.6	166.6	-157.9	0	0	109.3	Y232 K239 K674	Y232-E234 HydrophobicContact CD1-CG 3.6Å; Y232-E234 HydrophobicContact CE1-CB 4.46Å; Y232-E234 HydrophobicContact CE1-CG 3.36Å; E234-K239 HydrophobicContact CB-CD 4.24Å; E234-K239 HydrophobicContact CB-CG 3.86Å; E234-K239 WeakPolarHBondContact O-CE 3.31Å; E234-K674 IonicContact OE1-NZ 3.28Å; E234-K674 PolarHBondContact OE1-NZ 2.9Å
235	D	65.9	Low	78.2	Confident	72 Å²	72	65 Å²	65	39%	0.385	30%	0.302	S	S	.	.			trans	-56.8	137.8	171.7	-77.4	34.3	0	0	0	110.4	L237 V238 K239 K671	D235-L237 PolarHBondContact O-N 3.26Å; D235-V238 HydrophobicContact CB-CB 4.45Å; D235-V238 HydrophobicContact CB-CG2 4.2Å; D235-V238 WeakPolarHBondContact O-CB 3.34Å; D235-V238 PolarHBondContact O-N 3.06Å; D235-K239 PolarHBondContact O-N 2.98Å; D235-K671 IonicContact OD1-NZ 3.29Å; D235-K671 PolarHBondContact OD1-NZ 3.08Å; D235-K671 IonicContact OD2-NZ 3.04Å; D235-K671 PolarHBondContact OD2-NZ 2.73Å
236	D	65.4	Low	78.2	Confident	80 Å²	80	60.8 Å²	60.8	43%	0.428	30%	0.295	S	S	.	.	H	α-helix	trans	-57.1	-35	-179.5	-171	38.4	0	0	0	112.2	K239 R240	D236-K239 PolarHBondContact O-N 3.43Å; D236-R240 WeakPolarHBondContact O-CB 3.45Å; D236-R240 VanDerWaalsContact O-CG 3.24Å; D236-R240 WeakPolarHBondContact O-CG 2.91Å; D236-R240 PolarHBondContact O-N 3.43Å; D236-R240 VanDerWaalsContact O-N 3.13Å; D236-R240 IonicContact OD1-CZ 3Å; D236-R240 VanDerWaalsContact OD1-CZ 3.31Å; D236-R240 IonicContact OD1-NE 3.84Å; D236-R240 PolarHBondContact OD1-NE 3.45Å; D236-R240 IonicContact OD1-NH2 2.69Å; D236-R240 PolarHBondContact OD1-NH2 2.8Å; D236-R240 IonicContact OD2-CZ 3.98Å; D236-R240 IonicContact OD2-NE 2.8Å; D236-R240 PolarHBondContact OD2-NE 3.03Å; D236-R240 VanDerWaalsContact OD2-NE 3.16Å; D236-R240 IonicContact OD2-NH1 3.16Å; D236-R240 IonicContact OD2-NH2 2.82Å; D236-R240 PolarHBondContact OD2-NH2 2.93Å
237	L	75.6	Confident	78.4	Confident	32 Å²	32	61.3 Å²	61.3	17%	0.168	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-47.1	173.3	-179.8	69.2	0	0	0	112.6	D235 K239 R240 T241 T365 P415 A769 Y771	D235-L237 PolarHBondContact O-N 3.26Å; L237-K239 VanDerWaalsContact C-N 3.29Å; L237-K239 PolarHBondContact O-N 2.95Å; L237-R240 PolarHBondContact O-N 3.44Å; L237-R240 VanDerWaalsContact O-N 3.13Å; L237-T241 PolarHBondContact O-N 3.29Å; L237-T241 PolarHBondContact O-OG1 3.42Å; L237-T241 VanDerWaalsContact O-OG1 3.09Å; L237-T365 HydrophobicContact CD1-CG2 4.19Å; L237-P415 HydrophobicContact CD2-CG 4.23Å; L237-A769 HydrophobicContact CD2-CB 3.9Å; L237-A769 WeakPolarHBondContact CD2-O 3.41Å; L237-Y771 HydrophobicContact CD1-CE2 4.36Å; L237-Y771 HydrophobicContact CD2-CE2 4.07Å; L237-Y771 HydrophobicContact CG-CE2 3.96Å
238	V	80.9	Confident	78.7	Confident	20 Å²	20	60.2 Å²	60.2	12%	0.121	29%	0.293	C	S	.	.	H	α-helix	trans	-62.9	-39.1	-179	167.6	0	0	0	0	110.9	D235 R240 T241 A412 D414	D235-V238 HydrophobicContact CB-CB 4.45Å; D235-V238 HydrophobicContact CB-CG2 4.2Å; D235-V238 WeakPolarHBondContact O-CB 3.34Å; D235-V238 PolarHBondContact O-N 3.06Å; V238-R240 VanDerWaalsContact C-N 3.27Å; V238-R240 PolarHBondContact O-N 3.07Å; V238-T241 PolarHBondContact O-N 2.92Å; V238-A412 WeakPolarHBondContact CG1-O 3.16Å; V238-D414 HydrophobicContact CG2-CB 4.18Å
239	K	81.4	Confident	79	Confident	49 Å²	49	62.3 Å²	62.3	21%	0.213	29%	0.291	C	S	.	.	H	α-helix	trans	-68.6	-26.8	177.8	-61.8	-179.6	172.7	-162.9	0	113.2	E234 D235 D236 L237 E369 T372	E234-K239 HydrophobicContact CB-CD 4.24Å; E234-K239 HydrophobicContact CB-CG 3.86Å; E234-K239 WeakPolarHBondContact O-CE 3.31Å; D235-K239 PolarHBondContact O-N 2.98Å; D236-K239 PolarHBondContact O-N 3.43Å; L237-K239 VanDerWaalsContact C-N 3.29Å; L237-K239 PolarHBondContact O-N 2.95Å; K239-E369 HydrophobicContact CB-CB 4.47Å; K239-E369 HydrophobicContact CB-CG 3.98Å; K239-E369 WeakPolarHBondContact CD-OE2 3.38Å; K239-E369 IonicContact NZ-OE1 2.82Å; K239-E369 IonicContact NZ-OE2 2.72Å; K239-T372 WeakPolarHBondContact O-CG2 3.3Å
240	R	87.9	Confident	79.4	Confident	66 Å²	66	65 Å²	65	25%	0.249	30%	0.299	C	S	.	.	H	α-helix	trans	-93.6	-11.4	-178.8	-70.5	177.1	-166.6	-157	12	113.8	D236 L237 V238 F366 H367 E369 T372	D236-R240 WeakPolarHBondContact O-CB 3.45Å; D236-R240 VanDerWaalsContact O-CG 3.24Å; D236-R240 WeakPolarHBondContact O-CG 2.91Å; D236-R240 PolarHBondContact O-N 3.43Å; D236-R240 VanDerWaalsContact O-N 3.13Å; D236-R240 IonicContact OD1-CZ 3Å; D236-R240 VanDerWaalsContact OD1-CZ 3.31Å; D236-R240 IonicContact OD1-NE 3.84Å; D236-R240 PolarHBondContact OD1-NE 3.45Å; D236-R240 IonicContact OD1-NH2 2.69Å; D236-R240 PolarHBondContact OD1-NH2 2.8Å; D236-R240 IonicContact OD2-CZ 3.98Å; D236-R240 IonicContact OD2-NE 2.8Å; D236-R240 PolarHBondContact OD2-NE 3.03Å; D236-R240 VanDerWaalsContact OD2-NE 3.16Å; D236-R240 IonicContact OD2-NH1 3.16Å; D236-R240 IonicContact OD2-NH2 2.82Å; D236-R240 PolarHBondContact OD2-NH2 2.93Å; L237-R240 PolarHBondContact O-N 3.44Å; L237-R240 VanDerWaalsContact O-N 3.13Å; V238-R240 VanDerWaalsContact C-N 3.27Å; V238-R240 PolarHBondContact O-N 3.07Å; R240-F366 WeakPolarHBondContact CB-O 3.5Å; R240-F366 WeakPolarHBondContact O-CD2 3.37Å; R240-F366 PolarHBondContact O-N 3.29Å; R240-H367 WeakPolarHBondContact CD-O 3.44Å; R240-H367 PolarHBondContact NH1-O 3.41Å; R240-E369 HydrophobicContact CG-CB 4.37Å; R240-T372 PolarHBondContact O-OG1 3.47Å
241	T	90.6	Very high	79.9	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.3	-177.7	-54.6	0	0	0	0	113.2	L237 V238 F363 V364 T365 A412 Y771	L237-T241 PolarHBondContact O-N 3.29Å; L237-T241 PolarHBondContact O-OG1 3.42Å; L237-T241 VanDerWaalsContact O-OG1 3.09Å; V238-T241 PolarHBondContact O-N 2.92Å; T241-F363 HydrophobicContact CG2-CB 4.16Å; T241-F363 HydrophobicContact CG2-CD1 4.39Å; T241-V364 CarbonylContact C-O 3.3Å; T241-V364 VanDerWaalsContact CA-O 3.32Å; T241-V364 WeakPolarHBondContact CA-O 3.35Å; T241-V364 WeakPolarHBondContact CG2-O 3.48Å; T241-T365 WeakPolarHBondContact OG1-CG2 3.39Å; T241-T365 PolarHBondContact OG1-OG1 2.97Å; T241-A412 HydrophobicContact CG2-CB 3.71Å; T241-A412 WeakPolarHBondContact O-CB 3.21Å; T241-A412 PolarHBondContact O-N 3.42Å; T241-Y771 HydrophobicContact CG2-CD2 3.7Å; T241-Y771 HydrophobicContact CG2-CE2 3.52Å; T241-Y771 HydrophobicContact CG2-CG 4.36Å; T241-Y771 WeakPolarHBondContact OG1-CE2 3.2Å
242	L	91.9	Very high	80.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	139.8	170.1	-61.7	177.4	0	0	0	111.2	I244 F363 V364 F366 T372 I375 L376 V409 S410 Y411	L242-I244 HydrophobicContact CB-CG1 4.44Å; L242-F363 WeakPolarHBondContact O-CA 3.46Å; L242-V364 PolarHBondContact N-O 3.19Å; L242-V364 PolarHBondContact O-N 3.44Å; L242-F366 HydrophobicContact CB-CE2 4.1Å; L242-F366 HydrophobicContact CD1-CD2 4.39Å; L242-F366 HydrophobicContact CD1-CE2 3.56Å; L242-F366 HydrophobicContact CD1-CZ 4.12Å; L242-F366 HydrophobicContact CG-CD2 4.34Å; L242-F366 HydrophobicContact CG-CE2 3.73Å; L242-T372 HydrophobicContact CD1-CG2 4.15Å; L242-T372 HydrophobicContact CD2-CG2 3.31Å; L242-T372 HydrophobicContact CG-CG2 3.58Å; L242-I375 HydrophobicContact CD1-CB 3.99Å; L242-I375 HydrophobicContact CD1-CG2 3.56Å; L242-L376 HydrophobicContact CD2-CB 4.45Å; L242-V409 HydrophobicContact CB-CG1 4.16Å; L242-V409 HydrophobicContact CD1-CG1 3.77Å; L242-V409 HydrophobicContact CD2-CG1 4.23Å; L242-V409 HydrophobicContact CG-CG1 4.26Å; L242-S410 WeakPolarHBondContact CA-O 3.26Å; L242-Y411 HydrophobicContact CD2-CD1 4.2Å; L242-Y411 HydrophobicContact CD2-CE1 4.47Å
243	F	92.2	Very high	81.9	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.018	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	119	165.2	178.8	-120.1	0	0	0	109.6	N245 M361 F363 S410 A412 W505	F243-N245 HydrophobicContact CE1-CB 4.47Å; F243-M361 HydrophobicContact CE2-CB 4.05Å; F243-M361 HydrophobicContact CE2-SD 4.32Å; F243-M361 HydrophobicContact CZ-CB 4.37Å; F243-M361 HydrophobicContact CZ-CG 4.45Å; F243-M361 HydrophobicContact CZ-SD 3.82Å; F243-F363 HydrophobicContact CB-CD1 4.15Å; F243-F363 HydrophobicContact CB-CE1 3.93Å; F243-F363 AromaticContact CD2-CD1 3.82Å; F243-F363 HydrophobicContact CD2-CD1 3.82Å; F243-F363 AromaticContact CD2-CE1 3.34Å; F243-F363 HydrophobicContact CD2-CE1 3.34Å; F243-F363 HydrophobicContact CD2-CE2 4.14Å; F243-F363 HydrophobicContact CD2-CG 4.4Å; F243-F363 AromaticContact CD2-CZ 3.51Å; F243-F363 HydrophobicContact CD2-CZ 3.51Å; F243-F363 HydrophobicContact CE2-CE1 4.09Å; F243-F363 HydrophobicContact CE2-CE2 4.21Å; F243-F363 AromaticContact CE2-CZ 3.77Å; F243-F363 HydrophobicContact CE2-CZ 3.77Å; F243-F363 HydrophobicContact CG-CD1 4.44Å; F243-F363 AromaticContact CG-CE1 3.92Å; F243-F363 HydrophobicContact CG-CE1 3.92Å; F243-F363 HydrophobicContact CG-CZ 4.4Å; F243-S410 PolarHBondContact N-O 2.89Å; F243-S410 PolarHBondContact O-N 3.31Å; F243-S410 PolarHBondContact O-OG 3.43Å; F243-A412 HydrophobicContact CB-CB 4.23Å; F243-W505 HydrophobicContact CD1-CH2 4.09Å; F243-W505 AromaticContact CE1-CH2 3.82Å; F243-W505 HydrophobicContact CE1-CH2 3.82Å; F243-W505 HydrophobicContact CE1-CZ2 4.09Å; F243-W505 HydrophobicContact CE1-CZ3 4.46Å; F243-W505 HydrophobicContact CZ-CH2 4.28Å; F243-W505 HydrophobicContact CZ-CZ3 4.48Å
244	I	91.9	Very high	83.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	130.9	-177.2	-51.9	173.8	0	0	0	108.6	L242 I247 F260 M361 A362 V364 W407 V409	L242-I244 HydrophobicContact CB-CG1 4.44Å; I244-I247 HydrophobicContact CB-CD1 3.9Å; I244-I247 HydrophobicContact CB-CG1 4.41Å; I244-I247 HydrophobicContact CG2-CD1 3.71Å; I244-I247 HydrophobicContact CG2-CG1 3.69Å; I244-F260 HydrophobicContact CD1-CE2 3.52Å; I244-F260 HydrophobicContact CD1-CZ 3.45Å; I244-F260 VanDerWaalsContact CD1-CZ 3.45Å; I244-M361 CarbonylContact O-C 3.57Å; I244-M361 VanDerWaalsContact O-CA 3.24Å; I244-M361 WeakPolarHBondContact O-CA 3.2Å; I244-A362 PolarHBondContact N-O 3.13Å; I244-A362 PolarHBondContact O-N 2.9Å; I244-V364 HydrophobicContact CD1-CB 4.26Å; I244-V364 HydrophobicContact CD1-CG2 3.57Å; I244-V364 HydrophobicContact CG1-CG2 4.46Å; I244-W407 HydrophobicContact CD1-CE3 4.44Å; I244-W407 HydrophobicContact CD1-CZ3 4.19Å; I244-W407 HydrophobicContact CG2-CB 4.23Å; I244-W407 HydrophobicContact CG2-CD2 3.8Å; I244-W407 HydrophobicContact CG2-CE3 3.63Å; I244-W407 HydrophobicContact CG2-CG 4.1Å; I244-W407 HydrophobicContact CG2-CZ3 4.21Å; I244-V409 HydrophobicContact CG1-CG2 4.36Å; I244-V409 HydrophobicContact CG2-CG2 4.35Å
245	N	89.4	Confident	84.6	Confident	46 Å²	46	55 Å²	55	25%	0.246	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	147	178.5	173.2	50.4	0	0	0	110.6	F243 M361 W407 T408	F243-N245 HydrophobicContact CE1-CB 4.47Å; N245-M361 HydrophobicContact CB-CG 4.38Å; N245-M361 WeakPolarHBondContact OD1-CG 3.3Å; N245-W407 CarbonylContact O-C 3.49Å; N245-W407 WeakPolarHBondContact O-CA 3.39Å; N245-T408 WeakPolarHBondContact CB-OG1 3.4Å; N245-T408 PolarHBondContact N-O 2.93Å; N245-T408 PolarHBondContact ND2-OG1 3.46Å; N245-T408 PolarHBondContact O-N 2.85Å; N245-T408 PolarHBondContact O-OG1 3.2Å
246	G	86.2	Confident	85.7	Confident	31 Å²	31	51.7 Å²	51.7	32%	0.32	26%	0.255	S	S	.	.	S	Bend	trans	92.1	19.4	-174.7	0	0	0	0	0	113.7	G360 W407	G246-G360 PolarHBondContact N-O 3.07Å; G246-W407 VanDerWaalsContact O-CD1 3.25Å
247	I	88.6	Confident	87	Confident	12 Å²	12	50.9 Å²	50.9	6%	0.062	25%	0.248	C	C	.	.			trans	-73.7	145.9	174	-58.2	168	0	0	0	108.7	I244 K249 A251 I256 G360 A362 W407	I244-I247 HydrophobicContact CB-CD1 3.9Å; I244-I247 HydrophobicContact CB-CG1 4.41Å; I244-I247 HydrophobicContact CG2-CD1 3.71Å; I244-I247 HydrophobicContact CG2-CG1 3.69Å; I247-K249 PolarHBondContact O-N 2.72Å; I247-A251 HydrophobicContact CG2-CB 3.56Å; I247-I256 HydrophobicContact CD1-CD1 4.18Å; I247-I256 HydrophobicContact CG2-CD1 4.16Å; I247-G360 PolarHBondContact N-O 3.19Å; I247-G360 VanDerWaalsContact O-CA 3.25Å; I247-G360 WeakPolarHBondContact O-CA 3.13Å; I247-A362 HydrophobicContact CD1-CB 3.41Å; I247-A362 VanDerWaalsContact CD1-CB 3.41Å; I247-W407 HydrophobicContact CB-CZ2 4.47Å; I247-W407 HydrophobicContact CG1-CD2 4.31Å; I247-W407 HydrophobicContact CG1-CZ2 3.89Å; I247-W407 HydrophobicContact CG2-CZ2 4.16Å
248	S	88.1	Confident	87.7	Confident	46 Å²	46	54.1 Å²	54.1	32%	0.322	26%	0.261	S	S	.	.			trans	-51.7	129.7	168.5	-177.9	0	0	0	0	110.3	Y250 A251	S248-Y250 PolarHBondContact O-N 2.7Å; S248-Y250 VanDerWaalsContact O-N 3.12Å; S248-A251 VanDerWaalsContact O-CB 3.24Å; S248-A251 WeakPolarHBondContact O-CB 3.27Å; S248-A251 PolarHBondContact O-N 3.34Å
249	K	83.3	Confident	88.2	Confident	136 Å²	136	53.1 Å²	53.1	59%	0.591	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-36.2	-170	-74.7	-174.5	-179.9	-179.5	0	113.1	I247 P358	I247-K249 PolarHBondContact O-N 2.72Å; K249-P358 HydrophobicContact CB-CG 4.11Å; K249-P358 WeakPolarHBondContact O-CB 3.37Å; K249-P358 WeakPolarHBondContact O-CG 3.21Å
250	Y	84	Confident	88.7	Confident	178 Å²	178	50.8 Å²	50.8	70%	0.698	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.7	24.6	-178.4	-55.9	-76.4	0	0	0	112.5	S248 E252 P358	S248-Y250 PolarHBondContact O-N 2.7Å; S248-Y250 VanDerWaalsContact O-N 3.12Å; Y250-E252 PolarHBondContact O-N 2.86Å; Y250-P358 HydrophobicContact CD1-CG 3.98Å; Y250-P358 HydrophobicContact CE1-CG 3.9Å
251	A	83.3	Confident	88.9	Confident	19 Å²	19	52.2 Å²	52.2	16%	0.157	25%	0.254	C	S	.	.			trans	-67.2	128.2	174.7	0	0	0	0	0	110.8	I247 S248 I256 L402	I247-A251 HydrophobicContact CG2-CB 3.56Å; S248-A251 VanDerWaalsContact O-CB 3.24Å; S248-A251 WeakPolarHBondContact O-CB 3.27Å; S248-A251 PolarHBondContact O-N 3.34Å; A251-I256 HydrophobicContact CB-CD1 4.43Å; A251-L402 HydrophobicContact CB-CD2 3.6Å
252	E	84.9	Confident	88.9	Confident	100 Å²	100	56.6 Å²	56.6	47%	0.467	27%	0.274	S	S	.	.			trans	-69.7	143.6	172.1	-72	152.5	-146.9	0	0	111	Y250 E254 K255 I256	Y250-E252 PolarHBondContact O-N 2.86Å; E252-E254 PolarHBondContact O-N 3.4Å; E252-K255 HydrophobicContact CB-CD 4.34Å; E252-K255 HydrophobicContact CB-CG 4.39Å; E252-K255 PolarHBondContact O-N 2.85Å; E252-K255 IonicContact OE1-NZ 2.82Å; E252-K255 PolarHBondContact OE1-NZ 3.25Å; E252-K255 VanDerWaalsContact OE2-CE 3.26Å; E252-K255 WeakPolarHBondContact OE2-CE 3.45Å; E252-K255 IonicContact OE2-NZ 2.73Å; E252-K255 PolarHBondContact OE2-NZ 3.47Å; E252-I256 PolarHBondContact O-N 2.95Å
253	S	86.9	Confident	88.8	Confident	35 Å²	35	56.9 Å²	56.9	25%	0.245	28%	0.277	C	S	.	.	H	α-helix	trans	-55.8	-40.1	175.9	173.8	0	0	0	0	112	K255 I256 K257 A272	S253-K255 PolarHBondContact O-N 3.4Å; S253-I256 WeakPolarHBondContact O-CB 3.42Å; S253-I256 PolarHBondContact O-N 3.07Å; S253-K257 PolarHBondContact O-N 3.45Å; S253-A272 PolarHBondContact OG-O 3Å
254	E	88.5	Confident	88.6	Confident	150 Å²	150	57 Å²	57	70%	0.701	28%	0.277	S	S	*	.	H	α-helix	trans	-62.3	-40.7	-179.4	-64.8	-175.2	174.7	0	0	112.9	E252 I256 K257 K258	E252-E254 PolarHBondContact O-N 3.4Å; E254-I256 VanDerWaalsContact C-N 3.3Å; E254-I256 PolarHBondContact O-N 2.97Å; E254-K257 PolarHBondContact O-N 2.77Å; E254-K258 WeakPolarHBondContact O-CB 3.5Å; E254-K258 PolarHBondContact O-N 2.93Å
255	K	89.4	Confident	88.3	Confident	80 Å²	80	61.5 Å²	61.5	35%	0.348	31%	0.307	S	S	.	.	H	α-helix	trans	-64.2	-36.4	176.6	-71.8	174.3	176.5	135.9	0	111.8	E252 S253 H259 L402	E252-K255 HydrophobicContact CB-CD 4.34Å; E252-K255 HydrophobicContact CB-CG 4.39Å; E252-K255 PolarHBondContact O-N 2.85Å; E252-K255 IonicContact OE1-NZ 2.82Å; E252-K255 PolarHBondContact OE1-NZ 3.25Å; E252-K255 VanDerWaalsContact OE2-CE 3.26Å; E252-K255 WeakPolarHBondContact OE2-CE 3.45Å; E252-K255 IonicContact OE2-NZ 2.73Å; E252-K255 PolarHBondContact OE2-NZ 3.47Å; S253-K255 PolarHBondContact O-N 3.4Å; K255-H259 PolarHBondContact O-N 2.93Å; K255-L402 HydrophobicContact CB-CD2 4.46Å
256	I	90.2	Very high	88	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-66.3	-44.9	175.8	-60.5	168.7	0	0	0	110.2	I247 A251 E252 S253 E254 H259 F260 A272 A362 V364 L402 W407	I247-I256 HydrophobicContact CD1-CD1 4.18Å; I247-I256 HydrophobicContact CG2-CD1 4.16Å; A251-I256 HydrophobicContact CB-CD1 4.43Å; E252-I256 PolarHBondContact O-N 2.95Å; S253-I256 WeakPolarHBondContact O-CB 3.42Å; S253-I256 PolarHBondContact O-N 3.07Å; E254-I256 VanDerWaalsContact C-N 3.3Å; E254-I256 PolarHBondContact O-N 2.97Å; I256-H259 PolarHBondContact O-N 3.46Å; I256-F260 HydrophobicContact CG2-CD2 4.18Å; I256-F260 HydrophobicContact CG2-CE2 3.93Å; I256-F260 VanDerWaalsContact O-CD2 3.26Å; I256-F260 WeakPolarHBondContact O-CD2 3.44Å; I256-F260 PolarHBondContact O-N 3.49Å; I256-A272 HydrophobicContact CB-CB 4.46Å; I256-A272 HydrophobicContact CG2-CB 4.26Å; I256-A362 HydrophobicContact CD1-CB 4.24Å; I256-V364 HydrophobicContact CG2-CG2 3.94Å; I256-L402 HydrophobicContact CG1-CD2 4.23Å; I256-W407 HydrophobicContact CG2-CH2 4.4Å
257	K	91.2	Very high	88	Confident	64 Å²	64	65.5 Å²	65.5	28%	0.278	32%	0.321	S	S	.	.	H	α-helix	trans	-59.4	-51.5	175.6	-66.3	-175.4	-179.1	-173.7	0	111	S253 E254 H259 F260 E261 V269 A272	S253-K257 PolarHBondContact O-N 3.45Å; E254-K257 PolarHBondContact O-N 2.77Å; K257-H259 VanDerWaalsContact C-N 3.29Å; K257-H259 PolarHBondContact O-N 3.31Å; K257-F260 PolarHBondContact O-N 3.49Å; K257-E261 WeakPolarHBondContact O-CG 3.18Å; K257-E261 PolarHBondContact O-N 3.19Å; K257-V269 HydrophobicContact CB-CB 4.49Å; K257-V269 HydrophobicContact CG-CB 4.36Å; K257-V269 HydrophobicContact CG-CG1 3.92Å; K257-A272 HydrophobicContact CG-CB 3.69Å
258	K	91	Very high	88	Confident	99 Å²	99	68.2 Å²	68.2	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-56.2	-40.9	179.8	-174.9	172.6	176.7	176.6	0	112.5	E254 F260 E261 E262	E254-K258 WeakPolarHBondContact O-CB 3.5Å; E254-K258 PolarHBondContact O-N 2.93Å; K258-F260 PolarHBondContact O-N 3.48Å; K258-E261 PolarHBondContact O-N 3.12Å; K258-E262 WeakPolarHBondContact CE-OE1 3.36Å; K258-E262 HydrophobicContact CG-CG 4.32Å; K258-E262 WeakPolarHBondContact CG-OE1 3.37Å; K258-E262 IonicContact NZ-OE1 2.9Å; K258-E262 WeakPolarHBondContact O-CB 3.25Å; K258-E262 WeakPolarHBondContact O-CG 3.42Å; K258-E262 PolarHBondContact O-N 3.01Å
259	H	91.2	Very high	88	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-55.4	-50.5	174.5	167.9	56.5	0	0	0	112.2	K255 I256 K257 E262 A263 S396 C398 L402 I404 W407	K255-H259 PolarHBondContact O-N 2.93Å; I256-H259 PolarHBondContact O-N 3.46Å; K257-H259 VanDerWaalsContact C-N 3.29Å; K257-H259 PolarHBondContact O-N 3.31Å; H259-E262 PolarHBondContact O-N 3.07Å; H259-A263 WeakPolarHBondContact O-CB 3.17Å; H259-A263 PolarHBondContact O-N 3.37Å; H259-S396 VanDerWaalsContact ND1-CB 3.33Å; H259-S396 WeakPolarHBondContact ND1-CB 3.48Å; H259-S396 PolarHBondContact ND1-OG 3.45Å; H259-C398 HydrophobicContact CB-CB 4.43Å; H259-L402 HydrophobicContact CB-CD1 3.92Å; H259-I404 WeakPolarHBondContact CE1-CD1 3.46Å; H259-I404 VanDerWaalsContact CG-CD1 3.5Å; H259-I404 WeakPolarHBondContact ND1-CD1 3.48Å; H259-I404 WeakPolarHBondContact NE2-CD1 3.23Å; H259-W407 AromaticContact CD2-CZ3 3.98Å
260	F	91.9	Very high	88.2	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-70.4	-35	-176	-77.3	-64.8	0	0	0	113.1	I244 I256 K257 K258 Y264 V269 V364 F366 I375 F379 W407	I244-F260 HydrophobicContact CD1-CE2 3.52Å; I244-F260 HydrophobicContact CD1-CZ 3.45Å; I244-F260 VanDerWaalsContact CD1-CZ 3.45Å; I256-F260 HydrophobicContact CG2-CD2 4.18Å; I256-F260 HydrophobicContact CG2-CE2 3.93Å; I256-F260 VanDerWaalsContact O-CD2 3.26Å; I256-F260 WeakPolarHBondContact O-CD2 3.44Å; I256-F260 PolarHBondContact O-N 3.49Å; K257-F260 PolarHBondContact O-N 3.49Å; K258-F260 PolarHBondContact O-N 3.48Å; F260-Y264 HydrophobicContact CD1-CD2 4.07Å; F260-Y264 AromaticContact CD1-CE2 3.93Å; F260-Y264 HydrophobicContact CD1-CE2 3.93Å; F260-Y264 HydrophobicContact CE1-CE2 4.32Å; F260-Y264 PolarHBondContact O-N 3.13Å; F260-V269 HydrophobicContact CB-CG2 3.73Å; F260-V364 HydrophobicContact CD2-CG1 4.14Å; F260-V364 HydrophobicContact CE2-CG1 4.24Å; F260-V364 HydrophobicContact CE2-CG2 4.23Å; F260-F366 HydrophobicContact CB-CE1 4.05Å; F260-F366 HydrophobicContact CD1-CE1 4.1Å; F260-F366 HydrophobicContact CD1-CZ 4.02Å; F260-F366 HydrophobicContact CD2-CE1 4.35Å; F260-F366 HydrophobicContact CD2-CZ 4.16Å; F260-F366 HydrophobicContact CE1-CZ 4.2Å; F260-F366 HydrophobicContact CE2-CZ 4.34Å; F260-F366 AromaticContact CG-CE1 3.91Å; F260-F366 HydrophobicContact CG-CE1 3.91Å; F260-F366 HydrophobicContact CG-CZ 4.01Å; F260-F366 HydrophobicContact CZ-CZ 4.36Å; F260-I375 HydrophobicContact CD1-CD1 3.86Å; F260-I375 HydrophobicContact CD1-CG1 4.5Å; F260-I375 HydrophobicContact CD1-CG2 4.31Å; F260-I375 HydrophobicContact CE1-CD1 4.23Å; F260-I375 HydrophobicContact CE1-CG2 3.67Å; F260-F379 HydrophobicContact CE1-CE2 4.15Å; F260-W407 HydrophobicContact CE2-CZ3 4.07Å; F260-W407 AromaticContact CZ-CZ3 3.91Å; F260-W407 HydrophobicContact CZ-CZ3 3.91Å
261	E	91.3	Very high	88.3	Confident	96 Å²	96	57.8 Å²	57.8	45%	0.449	30%	0.296	S	S	.	.	H	α-helix	trans	-70	-35.6	177	-67.6	175.2	166.3	0	0	111.9	K257 K258 V269	K257-E261 WeakPolarHBondContact O-CG 3.18Å; K257-E261 PolarHBondContact O-N 3.19Å; K258-E261 PolarHBondContact O-N 3.12Å; E261-V269 HydrophobicContact CG-CG2 4.16Å
262	E	91.4	Very high	88.6	Confident	91 Å²	91	57.1 Å²	57.1	43%	0.425	29%	0.291	S	S	.	.	H	α-helix	trans	-78.1	-41.3	176.2	-72.4	-179.8	179.9	0	0	113.1	K258 H259 S397	K258-E262 WeakPolarHBondContact CE-OE1 3.36Å; K258-E262 HydrophobicContact CG-CG 4.32Å; K258-E262 WeakPolarHBondContact CG-OE1 3.37Å; K258-E262 IonicContact NZ-OE1 2.9Å; K258-E262 WeakPolarHBondContact O-CB 3.25Å; K258-E262 WeakPolarHBondContact O-CG 3.42Å; K258-E262 PolarHBondContact O-N 3.01Å; H259-E262 PolarHBondContact O-N 3.07Å; E262-S397 VanDerWaalsContact CD-OG 3.24Å; E262-S397 PolarHBondContact OE1-OG 3.33Å; E262-S397 VanDerWaalsContact OE1-OG 3.1Å; E262-S397 VanDerWaalsContact OE2-CB 3.25Å; E262-S397 WeakPolarHBondContact OE2-CB 3.39Å; E262-S397 PolarHBondContact OE2-N 2.9Å; E262-S397 PolarHBondContact OE2-OG 3.45Å
263	A	88.9	Confident	88.8	Confident	7 Å²	7	53.3 Å²	53.3	6%	0.058	27%	0.272	C	S	.	.	H	α-helix	trans	-75.7	-25.8	-174	0	0	0	0	0	113.1	H259 R394	H259-A263 WeakPolarHBondContact O-CB 3.17Å; H259-A263 PolarHBondContact O-N 3.37Å; A263-R394 HydrophobicContact CB-CB 4.06Å; A263-R394 WeakPolarHBondContact O-CD 3.46Å
264	Y	89.5	Confident	89	Confident	5 Å²	5	53.3 Å²	53.3	2%	0.02	27%	0.271	C	S	.	.	S	Bend	trans	-125.6	114.7	-174.7	-61	-89.3	0	0	0	110.9	F260 C267 I374 I375 D378 F379	F260-Y264 HydrophobicContact CD1-CD2 4.07Å; F260-Y264 AromaticContact CD1-CE2 3.93Å; F260-Y264 HydrophobicContact CD1-CE2 3.93Å; F260-Y264 HydrophobicContact CE1-CE2 4.32Å; F260-Y264 PolarHBondContact O-N 3.13Å; Y264-C267 WeakPolarHBondContact O-CB 3.42Å; Y264-C267 PolarHBondContact O-N 3.35Å; Y264-I374 HydrophobicContact CD1-CG2 4.34Å; Y264-I374 HydrophobicContact CE1-CG2 4.41Å; Y264-I375 HydrophobicContact CD1-CG1 3.87Å; Y264-I375 HydrophobicContact CD2-CD1 4.31Å; Y264-I375 HydrophobicContact CD2-CG1 3.94Å; Y264-I375 HydrophobicContact CE1-CB 4.36Å; Y264-I375 HydrophobicContact CE1-CG1 3.73Å; Y264-I375 HydrophobicContact CE2-CD1 4.48Å; Y264-I375 HydrophobicContact CE2-CG1 3.84Å; Y264-I375 HydrophobicContact CE2-CG2 4.42Å; Y264-I375 HydrophobicContact CG-CG1 3.97Å; Y264-D378 HydrophobicContact CE1-CB 4.21Å; Y264-D378 WeakPolarHBondContact OH-CB 3.45Å; Y264-D378 PolarHBondContact OH-OD2 3.4Å; Y264-F379 WeakPolarHBondContact OH-CE2 3.21Å
265	P	84.5	Confident	89.1	Confident	96 Å²	96	46.4 Å²	46.4	62%	0.623	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	142.6	178.3	26.8	-33.3	0	0	0	110.7	C267	P265-C267 PolarHBondContact O-N 3.5Å
266	N	83.1	Confident	89.2	Confident	151 Å²	151	45.7 Å²	45.7	81%	0.807	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	18.6	-175.6	-54.3	-25.6	0	0	0	114.7	I371	N266-I371 WeakPolarHBondContact O-CD1 3.22Å
267	C	86.7	Confident	89.2	Confident	9 Å²	9	48.1 Å²	48.1	6%	0.061	25%	0.248	C	C	.	.			trans	-82.1	121	172.8	-173.7	0	0	0	0	110.6	Y264 P265 I371	Y264-C267 WeakPolarHBondContact O-CB 3.42Å; Y264-C267 PolarHBondContact O-N 3.35Å; P265-C267 PolarHBondContact O-N 3.5Å; C267-I371 HydrophobicContact CB-CG2 4.11Å
268	T	88.1	Confident	89.2	Confident	70 Å²	70	45.2 Å²	45.2	43%	0.429	24%	0.236	S	C	.	.			trans	-116.2	118.4	170.1	49.3	0	0	0	0	109.1	H367	T268-H367 PolarHBondContact O-N 2.92Å; T268-H367 WeakPolarHBondContact OG1-CB 3.27Å
269	V	88.7	Confident	89.2	Confident	14 Å²	14	41.8 Å²	41.8	9%	0.085	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112	177.8	-176.7	0	0	0	0	107.9	K257 F260 E261 E271 V364 F366	K257-V269 HydrophobicContact CB-CB 4.49Å; K257-V269 HydrophobicContact CG-CB 4.36Å; K257-V269 HydrophobicContact CG-CG1 3.92Å; F260-V269 HydrophobicContact CB-CG2 3.73Å; E261-V269 HydrophobicContact CG-CG2 4.16Å; V269-E271 VanDerWaalsContact C-N 3.34Å; V269-V364 HydrophobicContact CG1-CG1 3.6Å; V269-F366 HydrophobicContact CG2-CD1 4.03Å; V269-F366 HydrophobicContact CG2-CE1 3.82Å
270	L	86.7	Confident	89.1	Confident	76 Å²	76	48.9 Å²	48.9	40%	0.398	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	-45.4	174.7	-66.2	176.2	0	0	0	109.5	T365 H367	L270-T365 HydrophobicContact CB-CG2 4.47Å; L270-T365 HydrophobicContact CD1-CG2 4.25Å; L270-T365 PolarHBondContact N-O 3.04Å; L270-H367 HydrophobicContact CD2-CB 4.46Å; L270-H367 HydrophobicContact CG-CB 4.35Å
271	E	87.6	Confident	89.1	Confident	50 Å²	50	48.9 Å²	48.9	23%	0.234	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	144.4	-174.1	-161.4	168.2	-148.2	0	0	113.4	V269 R273 V364 T365	V269-E271 VanDerWaalsContact C-N 3.34Å; E271-R273 VanDerWaalsContact CD-NH2 3.32Å; E271-R273 HydrophobicContact CG-CG 3.85Å; E271-R273 IonicContact OE1-CZ 2.69Å; E271-R273 IonicContact OE1-NE 3.91Å; E271-R273 PolarHBondContact OE1-NE 3.33Å; E271-R273 IonicContact OE1-NH2 3.31Å; E271-R273 PolarHBondContact OE1-NH2 2.97Å; E271-R273 IonicContact OE2-CZ 3.16Å; E271-R273 IonicContact OE2-NE 2.9Å; E271-R273 PolarHBondContact OE2-NE 2.89Å; E271-R273 IonicContact OE2-NH2 3.66Å; E271-R273 PolarHBondContact OE2-NH2 3.25Å; E271-V364 CarbonylContact O-C 3.58Å; E271-V364 WeakPolarHBondContact O-CA 3.47Å; E271-T365 PolarHBondContact N-O 2.95Å; E271-T365 PolarHBondContact O-N 2.9Å
272	A	89.8	Confident	89.1	Confident	5 Å²	5	46.3 Å²	46.3	4%	0.041	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	110.5	169.6	0	0	0	0	0	108.8	S253 I256 K257 P274 F363 V364	S253-A272 PolarHBondContact OG-O 3Å; I256-A272 HydrophobicContact CB-CB 4.46Å; I256-A272 HydrophobicContact CG2-CB 4.26Å; K257-A272 HydrophobicContact CG-CB 3.69Å; A272-P274 WeakPolarHBondContact O-CD 3.46Å; A272-F363 CarbonylContact C-O 3.54Å; A272-F363 WeakPolarHBondContact CA-O 3.48Å; A272-V364 HydrophobicContact CB-CG1 4.41Å; A272-V364 HydrophobicContact CB-CG2 4.11Å
273	R	89.3	Confident	89	Confident	20 Å²	20	48 Å²	48	8%	0.075	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	105.3	-178.2	-65.3	-167.8	-178.8	-121.1	-16.4	110.5	E271 A362 F363 Y771 E780	E271-R273 VanDerWaalsContact CD-NH2 3.32Å; E271-R273 HydrophobicContact CG-CG 3.85Å; E271-R273 IonicContact OE1-CZ 2.69Å; E271-R273 IonicContact OE1-NE 3.91Å; E271-R273 PolarHBondContact OE1-NE 3.33Å; E271-R273 IonicContact OE1-NH2 3.31Å; E271-R273 PolarHBondContact OE1-NH2 2.97Å; E271-R273 IonicContact OE2-CZ 3.16Å; E271-R273 IonicContact OE2-NE 2.9Å; E271-R273 PolarHBondContact OE2-NE 2.89Å; E271-R273 IonicContact OE2-NH2 3.66Å; E271-R273 PolarHBondContact OE2-NH2 3.25Å; R273-A362 CarbonylContact O-C 3.57Å; R273-A362 WeakPolarHBondContact O-CA 3.32Å; R273-F363 PolarHBondContact N-O 2.92Å; R273-F363 PolarHBondContact O-N 3.34Å; R273-Y771 WeakPolarHBondContact CD-O 3.44Å; R273-E780 IonicContact NH2-OE1 3.04Å
274	P	90.4	Very high	89.2	Confident	35 Å²	35	48.3 Å²	48.3	23%	0.227	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	148.2	169.9	26.8	-31.7	0	0	0	110.9	A272 Y276 M361	A272-P274 WeakPolarHBondContact O-CD 3.46Å; P274-Y276 HydrophobicContact CB-CE2 4.35Å; P274-Y276 HydrophobicContact CG-CE2 3.95Å; P274-Y276 WeakPolarHBondContact CG-OH 3.26Å; P274-Y276 WeakPolarHBondContact O-CE2 3.34Å; P274-M361 CarbonylContact C-O 3.57Å; P274-M361 WeakPolarHBondContact CA-O 3.4Å
275	C	90.6	Very high	89.2	Confident	6 Å²	6	48.6 Å²	48.6	4%	0.041	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	135.5	-178.1	-61.6	0	0	0	0	111.4	L359 M361 F363 L423	C275-L359 HydrophobicContact CB-CB 4.44Å; C275-L359 HydrophobicContact CB-CD1 4.33Å; C275-L359 WeakPolarHBondContact O-CB 3.47Å; C275-L359 PolarHBondContact O-N 3.06Å; C275-M361 HydrophobicContact CB-CB 4.08Å; C275-M361 HydrophobicContact CB-CE 3.96Å; C275-M361 PolarHBondContact N-O 3Å; C275-F363 VanDerWaalsContact SG-CE2 3.52Å; C275-L423 HydrophobicContact CB-CD2 4.03Å
276	Y	90.5	Very high	89.2	Confident	64 Å²	64	46.8 Å²	46.8	25%	0.251	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	159.5	179.2	-58.2	-85.6	0	0	0	111.7	P274 V278 V354 P358 L359	P274-Y276 HydrophobicContact CB-CE2 4.35Å; P274-Y276 HydrophobicContact CG-CE2 3.95Å; P274-Y276 WeakPolarHBondContact CG-OH 3.26Å; P274-Y276 WeakPolarHBondContact O-CE2 3.34Å; Y276-V278 PolarHBondContact O-N 2.95Å; Y276-V278 VanDerWaalsContact O-N 3.12Å; Y276-V354 WeakPolarHBondContact CD1-O 3.22Å; Y276-V354 HydrophobicContact CG-CG1 4.03Å; Y276-P358 HydrophobicContact CD1-CB 4.21Å; Y276-P358 HydrophobicContact CE1-CB 4.19Å; Y276-L359 WeakPolarHBondContact O-CD1 3.43Å
277	N	91.3	Very high	89.5	Confident	52 Å²	52	42.9 Å²	42.9	28%	0.278	22%	0.22	S	C	.	.			trans	-74.8	99.9	172.5	-172	-5.8	0	0	0	111.1	A279 K357 L359	N277-A279 PolarHBondContact OD1-N 3.12Å; N277-K357 HydrophobicContact CB-CB 4Å; N277-K357 PolarHBondContact N-O 3.43Å; N277-L359 HydrophobicContact CB-CD2 4.17Å
278	V	90.9	Very high	89.6	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.024	23%	0.226	C	C	.	.			trans	-102	-0	-179.4	-64.3	0	0	0	0	114.1	Y276 R280 L281 M282 V354 W420 A773 V775 L776	Y276-V278 PolarHBondContact O-N 2.95Å; Y276-V278 VanDerWaalsContact O-N 3.12Å; V278-R280 PolarHBondContact O-N 3.33Å; V278-L281 WeakPolarHBondContact O-CB 3.49Å; V278-L281 PolarHBondContact O-N 2.95Å; V278-L281 VanDerWaalsContact O-N 3.08Å; V278-M282 HydrophobicContact CB-CG 4.37Å; V278-M282 HydrophobicContact CG2-CG 4.3Å; V278-M282 HydrophobicContact CG2-SD 3.81Å; V278-M282 WeakPolarHBondContact O-CG 3.49Å; V278-M282 PolarHBondContact O-N 2.96Å; V278-V354 HydrophobicContact CG1-CG1 4.31Å; V278-W420 HydrophobicContact CG2-CB 4.09Å; V278-A773 HydrophobicContact CB-CB 4.49Å; V278-A773 HydrophobicContact CG1-CB 4.39Å; V278-A773 HydrophobicContact CG2-CB 3.98Å; V278-V775 HydrophobicContact CB-CG2 4.46Å; V278-L776 HydrophobicContact CG1-CD1 3.69Å; V278-L776 HydrophobicContact CG1-CG 4.14Å
279	A	90.3	Very high	89.4	Confident	27 Å²	27	44.1 Å²	44.1	22%	0.223	22%	0.217	C	C	.	.	H	α-helix	trans	-57.2	-46.4	-170	0	0	0	0	0	113	N277 F283 E421	N277-A279 PolarHBondContact OD1-N 3.12Å; A279-F283 PolarHBondContact O-N 3.25Å; A279-F283 VanDerWaalsContact O-N 3.13Å; A279-E421 HydrophobicContact CB-CB 4.46Å; A279-E421 WeakPolarHBondContact CB-O 3.47Å
280	R	90.6	Very high	89.2	Confident	148 Å²	148	46.2 Å²	46.2	56%	0.558	23%	0.225	S	C	*	.	H	α-helix	trans	-69.3	-37.5	178	-172.6	171.6	-177.5	-157.6	10.4	112.4	V278 F283 L284 E350	V278-R280 PolarHBondContact O-N 3.33Å; R280-F283 PolarHBondContact O-N 3.08Å; R280-L284 HydrophobicContact CG-CD1 4.23Å; R280-L284 WeakPolarHBondContact O-CG 3.16Å; R280-L284 PolarHBondContact O-N 2.9Å; R280-E350 HydrophobicContact CB-CG 4.29Å; R280-E350 WeakPolarHBondContact CD-OE2 3.33Å; R280-E350 HydrophobicContact CG-CG 4.17Å; R280-E350 IonicContact CZ-OE2 2.72Å; R280-E350 IonicContact NE-OE2 3.16Å; R280-E350 IonicContact NH1-OE2 2.7Å; R280-E350 PolarHBondContact NH1-OE2 3.41Å
281	L	91.7	Very high	89.3	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-64.1	-43.7	178.1	-172.4	69.6	0	0	0	111.1	V278 L284 D285 Y347 E350 K351 V354 V775 L776	V278-L281 WeakPolarHBondContact O-CB 3.49Å; V278-L281 PolarHBondContact O-N 2.95Å; V278-L281 VanDerWaalsContact O-N 3.08Å; L281-L284 PolarHBondContact O-N 2.91Å; L281-D285 PolarHBondContact O-N 2.76Å; L281-Y347 HydrophobicContact CD1-CD2 3.41Å; L281-Y347 VanDerWaalsContact CD1-CD2 3.41Å; L281-Y347 HydrophobicContact CD1-CE2 3.36Å; L281-Y347 HydrophobicContact CD1-CG 4.07Å; L281-Y347 HydrophobicContact CD2-CE2 4.34Å; L281-Y347 HydrophobicContact CG-CD2 4.13Å; L281-Y347 HydrophobicContact CG-CE2 3.71Å; L281-E350 HydrophobicContact CD1-CB 4.3Å; L281-K351 HydrophobicContact CD1-CB 4.02Å; L281-V354 HydrophobicContact CD2-CG2 3.93Å; L281-V775 HydrophobicContact CD2-CB 4.15Å; L281-V775 HydrophobicContact CD2-CG2 3.82Å; L281-V775 HydrophobicContact CG-CB 4.41Å; L281-V775 HydrophobicContact CG-CG2 4.24Å; L281-L776 HydrophobicContact CD2-CD2 4.01Å
282	M	89.5	Confident	89.2	Confident	42 Å²	42	44.5 Å²	44.5	21%	0.207	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-43.5	175.7	-70.8	-177.8	65.9	0	0	112.2	V278 L284 D285 A286 W420 E421 V775	V278-M282 HydrophobicContact CB-CG 4.37Å; V278-M282 HydrophobicContact CG2-CG 4.3Å; V278-M282 HydrophobicContact CG2-SD 3.81Å; V278-M282 WeakPolarHBondContact O-CG 3.49Å; V278-M282 PolarHBondContact O-N 2.96Å; M282-L284 PolarHBondContact O-N 3.39Å; M282-D285 PolarHBondContact O-N 3.41Å; M282-A286 WeakPolarHBondContact O-CB 3.4Å; M282-A286 PolarHBondContact O-N 3Å; M282-W420 HydrophobicContact CE-CB 4.25Å; M282-W420 HydrophobicContact SD-CB 3.6Å; M282-E421 HydrophobicContact CB-CG 4.3Å; M282-E421 HydrophobicContact CE-CG 3.82Å; M282-E421 HydrophobicContact SD-CG 3.8Å; M282-V775 HydrophobicContact CG-CG1 4.03Å; M282-V775 HydrophobicContact CG-CG2 3.74Å
283	F	91	Very high	88.9	Confident	127 Å²	127	48.7 Å²	48.7	56%	0.557	23%	0.23	S	C	*	.	H	α-helix	trans	-59.5	-46.6	174.9	174.2	-98.4	0	0	0	112.1	A279 R280 A286 E287	A279-F283 PolarHBondContact O-N 3.25Å; A279-F283 VanDerWaalsContact O-N 3.13Å; R280-F283 PolarHBondContact O-N 3.08Å; F283-A286 PolarHBondContact O-N 2.82Å; F283-E287 HydrophobicContact CE1-CG 4.25Å; F283-E287 HydrophobicContact CE2-CG 4.12Å; F283-E287 HydrophobicContact CZ-CG 3.9Å; F283-E287 PolarHBondContact O-N 3.44Å
284	L	92.1	Very high	88.7	Confident	13 Å²	13	47.9 Å²	47.9	7%	0.068	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-40.4	177.7	-71.5	170.3	0	0	0	112.1	R280 L281 M282 E287 R288 L343 D346 E350	R280-L284 HydrophobicContact CG-CD1 4.23Å; R280-L284 WeakPolarHBondContact O-CG 3.16Å; R280-L284 PolarHBondContact O-N 2.9Å; L281-L284 PolarHBondContact O-N 2.91Å; M282-L284 PolarHBondContact O-N 3.39Å; L284-E287 PolarHBondContact O-N 3.42Å; L284-R288 VanDerWaalsContact O-CB 3.23Å; L284-R288 WeakPolarHBondContact O-CB 3.39Å; L284-R288 PolarHBondContact O-N 2.88Å; L284-L343 HydrophobicContact CD2-CD2 4.17Å; L284-D346 HydrophobicContact CD1-CB 4.3Å; L284-D346 HydrophobicContact CD2-CB 4.12Å; L284-E350 HydrophobicContact CD1-CB 3.94Å; L284-E350 HydrophobicContact CD1-CG 4.35Å
285	D	88.9	Confident	88.6	Confident	10 Å²	10	49.1 Å²	49.1	5%	0.053	23%	0.23	C	C	.	.	H	α-helix	trans	-64.7	-41.6	176.7	-174	55.9	0	0	0	112.4	L281 M282 R288 K289 Y347 V775	L281-D285 PolarHBondContact O-N 2.76Å; M282-D285 PolarHBondContact O-N 3.41Å; D285-R288 PolarHBondContact O-N 2.84Å; D285-R288 IonicContact OD1-CZ 2.76Å; D285-R288 IonicContact OD1-NE 3.69Å; D285-R288 PolarHBondContact OD1-NE 3.35Å; D285-R288 IonicContact OD1-NH2 2.95Å; D285-R288 PolarHBondContact OD1-NH2 3.2Å; D285-K289 WeakPolarHBondContact O-CB 3.3Å; D285-K289 WeakPolarHBondContact O-CG 3.41Å; D285-K289 PolarHBondContact O-N 3.08Å; D285-K289 IonicContact OD1-NZ 3.82Å; D285-K289 VanDerWaalsContact OD2-CE 3.3Å; D285-K289 WeakPolarHBondContact OD2-CE 3.38Å; D285-K289 IonicContact OD2-NZ 3.93Å; D285-K289 PolarHBondContact OD2-NZ 3.2Å; D285-Y347 HydrophobicContact CB-CD2 4.16Å; D285-Y347 HydrophobicContact CB-CE2 3.96Å; D285-V775 HydrophobicContact CB-CG1 3.75Å
286	A	85.8	Confident	88.3	Confident	58 Å²	58	53.6 Å²	53.6	48%	0.479	25%	0.253	S	S	.	.	H	α-helix	trans	-62.9	-45.2	176.7	0	0	0	0	0	112	M282 F283 K290	M282-A286 WeakPolarHBondContact O-CB 3.4Å; M282-A286 PolarHBondContact O-N 3Å; F283-A286 PolarHBondContact O-N 2.82Å; A286-K290 WeakPolarHBondContact O-CB 3.48Å; A286-K290 PolarHBondContact O-N 3.3Å
287	E	88.4	Confident	88	Confident	69 Å²	69	53.6 Å²	53.6	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-67.5	-37.2	176	-73.6	-65.8	113.7	0	0	111.9	F283 L284 K290 A291 L343	F283-E287 HydrophobicContact CE1-CG 4.25Å; F283-E287 HydrophobicContact CE2-CG 4.12Å; F283-E287 HydrophobicContact CZ-CG 3.9Å; F283-E287 PolarHBondContact O-N 3.44Å; L284-E287 PolarHBondContact O-N 3.42Å; E287-K290 WeakPolarHBondContact O-CB 3.36Å; E287-K290 PolarHBondContact O-N 3.08Å; E287-A291 PolarHBondContact O-N 2.85Å; E287-L343 HydrophobicContact CB-CD1 4.14Å; E287-L343 HydrophobicContact CB-CD2 4.15Å
288	R	88.8	Confident	87.8	Confident	50 Å²	50	51.3 Å²	51.3	19%	0.189	24%	0.24	C	C	.	.	H	α-helix	trans	-60	-53.5	174.9	-179.5	-174.3	70.6	118.2	-8.3	111.2	L284 D285 K290 A291 E292 L343	L284-R288 VanDerWaalsContact O-CB 3.23Å; L284-R288 WeakPolarHBondContact O-CB 3.39Å; L284-R288 PolarHBondContact O-N 2.88Å; D285-R288 PolarHBondContact O-N 2.84Å; D285-R288 IonicContact OD1-CZ 2.76Å; D285-R288 IonicContact OD1-NE 3.69Å; D285-R288 PolarHBondContact OD1-NE 3.35Å; D285-R288 IonicContact OD1-NH2 2.95Å; D285-R288 PolarHBondContact OD1-NH2 3.2Å; R288-K290 PolarHBondContact O-N 3.29Å; R288-A291 WeakPolarHBondContact O-CB 3.46Å; R288-A291 PolarHBondContact O-N 3.14Å; R288-E292 WeakPolarHBondContact O-CB 3.39Å; R288-E292 PolarHBondContact O-N 3.24Å; R288-L343 HydrophobicContact CB-CB 4.17Å
289	K	84.4	Confident	87.5	Confident	56 Å²	56	53.8 Å²	53.8	24%	0.243	26%	0.255	C	S	.	.	H	α-helix	trans	-59.5	-33.3	177.5	-75.6	172.2	174.1	160.1	0	111.9	D285 R293	D285-K289 WeakPolarHBondContact O-CB 3.3Å; D285-K289 WeakPolarHBondContact O-CG 3.41Å; D285-K289 PolarHBondContact O-N 3.08Å; D285-K289 IonicContact OD1-NZ 3.82Å; D285-K289 VanDerWaalsContact OD2-CE 3.3Å; D285-K289 WeakPolarHBondContact OD2-CE 3.38Å; D285-K289 IonicContact OD2-NZ 3.93Å; D285-K289 PolarHBondContact OD2-NZ 3.2Å; K289-R293 WeakPolarHBondContact O-CG 3.47Å; K289-R293 PolarHBondContact O-N 3.09Å; K289-R293 PolarHBondContact O-NE 3.49Å
290	K	84.7	Confident	87.3	Confident	57 Å²	57	55.8 Å²	55.8	25%	0.248	26%	0.263	C	S	.	.	H	α-helix	trans	-67.9	-41.7	173.4	172.6	173.5	179.9	-165.9	0	112.1	A286 E287 R288 G294 E606 N609	A286-K290 WeakPolarHBondContact O-CB 3.48Å; A286-K290 PolarHBondContact O-N 3.3Å; E287-K290 WeakPolarHBondContact O-CB 3.36Å; E287-K290 PolarHBondContact O-N 3.08Å; R288-K290 PolarHBondContact O-N 3.29Å; K290-G294 PolarHBondContact O-N 2.64Å; K290-G294 VanDerWaalsContact O-N 3.08Å; K290-E606 WeakPolarHBondContact CE-OE1 3.39Å; K290-E606 IonicContact NZ-OE1 2.74Å; K290-E606 PolarHBondContact NZ-OE1 2.82Å; K290-N609 VanDerWaalsContact CG-ND2 3.31Å; K290-N609 WeakPolarHBondContact CG-ND2 3.42Å
291	A	87.7	Confident	87	Confident	2 Å²	2	50.4 Å²	50.4	2%	0.017	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-43.9	177.4	0	0	0	0	0	112.1	E287 R288 G294 K295 Y336 L339 E340 L343	E287-A291 PolarHBondContact O-N 2.85Å; R288-A291 WeakPolarHBondContact O-CB 3.46Å; R288-A291 PolarHBondContact O-N 3.14Å; A291-G294 CarbonylContact O-C 3.58Å; A291-G294 WeakPolarHBondContact O-CA 3.4Å; A291-G294 PolarHBondContact O-N 3.19Å; A291-K295 PolarHBondContact O-N 3.2Å; A291-Y336 HydrophobicContact CB-CD1 4.36Å; A291-Y336 WeakPolarHBondContact O-CD1 3.43Å; A291-L339 HydrophobicContact CB-CD2 3.99Å; A291-L339 HydrophobicContact CB-CG 4.04Å; A291-E340 HydrophobicContact CB-CB 4.43Å; A291-L343 HydrophobicContact CB-CD1 3.96Å
292	E	86.4	Confident	86.7	Confident	89 Å²	89	53.4 Å²	53.4	42%	0.416	26%	0.259	S	S	.	.	H	α-helix	trans	-57.9	-48.8	177.1	-179.7	178.9	-163.2	0	0	111.9	R288 G294 K295 L296	R288-E292 WeakPolarHBondContact O-CB 3.39Å; R288-E292 PolarHBondContact O-N 3.24Å; E292-G294 VanDerWaalsContact C-N 3.26Å; E292-G294 PolarHBondContact O-N 2.78Å; E292-K295 WeakPolarHBondContact O-CB 3.32Å; E292-K295 PolarHBondContact O-N 3.18Å; E292-L296 PolarHBondContact O-N 3.35Å
293	R	83.3	Confident	86.5	Confident	93 Å²	93	55.1 Å²	55.1	35%	0.351	28%	0.275	S	S	.	.	H	α-helix	trans	-62.4	-36	173.4	-68.7	175.4	-138.7	173.3	0.2	112.4	K289 Y297 N609 H613	K289-R293 WeakPolarHBondContact O-CG 3.47Å; K289-R293 PolarHBondContact O-N 3.09Å; K289-R293 PolarHBondContact O-NE 3.49Å; R293-Y297 WeakPolarHBondContact O-CB 3.34Å; R293-Y297 PolarHBondContact O-N 3.02Å; R293-N609 PolarHBondContact NH1-OD1 2.98Å; R293-H613 PolarHBondContact NH1-CE1 3.49Å; R293-H613 PolarHBondContact NH1-NE2 3.03Å
294	G	85.8	Confident	86.3	Confident	3 Å²	3	55 Å²	55	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-59.4	-50.1	174.8	0	0	0	0	0	111.8	K290 A291 E292 Y297 F298	K290-G294 PolarHBondContact O-N 2.64Å; K290-G294 VanDerWaalsContact O-N 3.08Å; A291-G294 CarbonylContact O-C 3.58Å; A291-G294 WeakPolarHBondContact O-CA 3.4Å; A291-G294 PolarHBondContact O-N 3.19Å; E292-G294 VanDerWaalsContact C-N 3.26Å; E292-G294 PolarHBondContact O-N 2.78Å; G294-Y297 PolarHBondContact O-N 3.4Å; G294-F298 WeakPolarHBondContact O-CD2 3.2Å; G294-F298 PolarHBondContact O-N 3.4Å
295	K	87	Confident	85.9	Confident	60 Å²	60	60.2 Å²	60.2	26%	0.261	30%	0.298	S	S	.	.	H	α-helix	trans	-57.9	-54.4	175.3	-176.6	-177.7	175.9	-173.2	0	111.4	A291 E292 Y297 F298 T299 T337 E340	A291-K295 PolarHBondContact O-N 3.2Å; E292-K295 WeakPolarHBondContact O-CB 3.32Å; E292-K295 PolarHBondContact O-N 3.18Å; K295-Y297 VanDerWaalsContact C-N 3.25Å; K295-Y297 PolarHBondContact O-N 2.78Å; K295-F298 PolarHBondContact O-N 3.03Å; K295-T299 PolarHBondContact O-N 3.12Å; K295-T299 PolarHBondContact O-OG1 3Å; K295-T299 VanDerWaalsContact O-OG1 3.07Å; K295-T337 VanDerWaalsContact CE-OG1 3.31Å; K295-T337 WeakPolarHBondContact CE-OG1 3.14Å; K295-E340 WeakPolarHBondContact CD-OE2 3.2Å; K295-E340 IonicContact NZ-OE2 2.85Å; K295-E340 PolarHBondContact NZ-OE2 2.95Å
296	L	85.8	Confident	85.5	Confident	100 Å²	100	66.4 Å²	66.4	52%	0.524	33%	0.331	S	S	.	.	H	α-helix	trans	-54.7	-42.2	-179.2	-177.3	64.9	0	0	0	112	E292 F298 T299 N300	E292-L296 PolarHBondContact O-N 3.35Å; L296-F298 PolarHBondContact O-N 3.49Å; L296-T299 PolarHBondContact O-N 2.66Å; L296-N300 WeakPolarHBondContact O-CB 3.47Å; L296-N300 VanDerWaalsContact O-CG 3.26Å; L296-N300 PolarHBondContact O-N 3.14Å; L296-N300 PolarHBondContact O-ND2 3.21Å
297	Y	84.1	Confident	85.2	Confident	65 Å²	65	67.8 Å²	67.8	26%	0.255	33%	0.334	S	S	.	.	H	α-helix	trans	-59.3	-47.4	176.4	174.6	-91.4	0	0	0	112.5	R293 G294 K295 N300 L301 A604 A605	R293-Y297 WeakPolarHBondContact O-CB 3.34Å; R293-Y297 PolarHBondContact O-N 3.02Å; G294-Y297 PolarHBondContact O-N 3.4Å; K295-Y297 VanDerWaalsContact C-N 3.25Å; K295-Y297 PolarHBondContact O-N 2.78Å; Y297-N300 PolarHBondContact O-N 3.13Å; Y297-L301 HydrophobicContact CE1-CD2 4.33Å; Y297-L301 WeakPolarHBondContact O-CB 3.46Å; Y297-L301 PolarHBondContact O-N 3.43Å; Y297-A604 HydrophobicContact CE1-CB 4.04Å; Y297-A605 HydrophobicContact CD1-CB 3.66Å; Y297-A605 HydrophobicContact CE1-CB 4.38Å; Y297-A605 HydrophobicContact CG-CB 3.98Å
298	F	85.8	Confident	84.8	Confident	3 Å²	3	67.7 Å²	67.7	1%	0.013	34%	0.339	C	S	.	.	H	α-helix	trans	-74.6	-32.4	-178.7	-73.5	-67.4	0	0	0	112.8	G294 K295 L296 L301 Q302 T309 I311 A332 I333 Y336 A605	G294-F298 WeakPolarHBondContact O-CD2 3.2Å; G294-F298 PolarHBondContact O-N 3.4Å; K295-F298 PolarHBondContact O-N 3.03Å; L296-F298 PolarHBondContact O-N 3.49Å; F298-L301 HydrophobicContact CD1-CD2 4.27Å; F298-L301 PolarHBondContact O-N 3.12Å; F298-Q302 WeakPolarHBondContact O-CB 3.38Å; F298-Q302 PolarHBondContact O-N 3.45Å; F298-T309 HydrophobicContact CD1-CG2 4.12Å; F298-T309 HydrophobicContact CE1-CG2 3.93Å; F298-I311 HydrophobicContact CE1-CG2 4.14Å; F298-I311 HydrophobicContact CZ-CG2 3.86Å; F298-A332 HydrophobicContact CB-CB 4.03Å; F298-A332 HydrophobicContact CD1-CB 3.72Å; F298-A332 HydrophobicContact CD2-CB 3.73Å; F298-A332 HydrophobicContact CE1-CB 4.09Å; F298-A332 HydrophobicContact CE2-CB 4.12Å; F298-A332 HydrophobicContact CG-CB 3.54Å; F298-A332 HydrophobicContact CZ-CB 4.28Å; F298-I333 HydrophobicContact CB-CG1 3.91Å; F298-Y336 AromaticContact CD2-CD2 3.74Å; F298-Y336 HydrophobicContact CD2-CD2 3.74Å; F298-Y336 AromaticContact CD2-CE2 3.64Å; F298-Y336 HydrophobicContact CD2-CE2 3.64Å; F298-Y336 AromaticContact CE2-CD2 4Å; F298-Y336 HydrophobicContact CE2-CD2 4Å; F298-Y336 AromaticContact CE2-CE2 3.38Å; F298-Y336 HydrophobicContact CE2-CE2 3.38Å; F298-A605 HydrophobicContact CD2-CB 4.13Å; F298-A605 HydrophobicContact CE2-CB 3.45Å; F298-A605 VanDerWaalsContact CE2-CB 3.45Å; F298-A605 HydrophobicContact CZ-CB 4.03Å
299	T	86.1	Confident	84.5	Confident	56 Å²	56	67.1 Å²	67.1	34%	0.344	34%	0.341	S	S	.	.	H	α-helix	trans	-61.4	-46.6	171.1	-55.9	0	0	0	0	110.9	K295 L296 L301 Q302 S303	K295-T299 PolarHBondContact O-N 3.12Å; K295-T299 PolarHBondContact O-OG1 3Å; K295-T299 VanDerWaalsContact O-OG1 3.07Å; L296-T299 PolarHBondContact O-N 2.66Å; T299-L301 VanDerWaalsContact C-N 3.27Å; T299-L301 PolarHBondContact O-N 3.36Å; T299-Q302 PolarHBondContact O-N 2.7Å; T299-S303 PolarHBondContact O-N 2.84Å; T299-S303 PolarHBondContact O-OG 3.33Å
300	N	85.4	Confident	84.4	Confident	70 Å²	70	68.8 Å²	68.8	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-67.5	-27.1	176.9	-71.3	-11.8	0	0	0	113	L296 Y297 S303 K304	L296-N300 WeakPolarHBondContact O-CB 3.47Å; L296-N300 VanDerWaalsContact O-CG 3.26Å; L296-N300 PolarHBondContact O-N 3.14Å; L296-N300 PolarHBondContact O-ND2 3.21Å; Y297-N300 PolarHBondContact O-N 3.13Å; N300-S303 WeakPolarHBondContact CA-OG 3.41Å; N300-S303 PolarHBondContact O-OG 2.66Å; N300-K304 WeakPolarHBondContact O-CG 3.33Å; N300-K304 PolarHBondContact O-N 3.19Å
301	L	85	Confident	84.4	Confident	35 Å²	35	66.8 Å²	66.8	18%	0.183	34%	0.343	C	S	.	.	H	α-helix	trans	-74.6	-43.3	174.3	-171.7	65.4	0	0	0	110.9	Y297 F298 T299 S303 K304 E305 T309	Y297-L301 HydrophobicContact CE1-CD2 4.33Å; Y297-L301 WeakPolarHBondContact O-CB 3.46Å; Y297-L301 PolarHBondContact O-N 3.43Å; F298-L301 HydrophobicContact CD1-CD2 4.27Å; F298-L301 PolarHBondContact O-N 3.12Å; T299-L301 VanDerWaalsContact C-N 3.27Å; T299-L301 PolarHBondContact O-N 3.36Å; L301-S303 VanDerWaalsContact C-N 3.33Å; L301-S303 PolarHBondContact O-N 2.92Å; L301-K304 PolarHBondContact O-N 3.5Å; L301-K304 VanDerWaalsContact O-N 3.17Å; L301-E305 HydrophobicContact CD1-CG 4.27Å; L301-E305 PolarHBondContact O-N 3.18Å; L301-T309 HydrophobicContact CD2-CG2 4.44Å
302	Q	84.8	Confident	84	Confident	63 Å²	63	67.3 Å²	67.3	29%	0.294	35%	0.345	S	S	.	.	H	α-helix	trans	-63.2	-38.8	177	-175.4	178.5	59.6	0	0	111.8	F298 T299 K304 N306 I333	F298-Q302 WeakPolarHBondContact O-CB 3.38Å; F298-Q302 PolarHBondContact O-N 3.45Å; T299-Q302 PolarHBondContact O-N 2.7Å; Q302-K304 PolarHBondContact O-N 3.21Å; Q302-N306 VanDerWaalsContact O-CA 3.23Å; Q302-N306 WeakPolarHBondContact O-CA 2.85Å; Q302-N306 PolarHBondContact O-N 3.08Å; Q302-I333 HydrophobicContact CB-CD1 3.95Å; Q302-I333 VanDerWaalsContact CD-CD1 3.49Å; Q302-I333 HydrophobicContact CG-CD1 4.35Å
303	S	86	Confident	83.5	Confident	79 Å²	79	65 Å²	65	55%	0.552	34%	0.338	S	S	*	.	H	α-helix	trans	-66.2	-26.5	176.1	65	0	0	0	0	113.4	T299 N300 L301	T299-S303 PolarHBondContact O-N 2.84Å; T299-S303 PolarHBondContact O-OG 3.33Å; N300-S303 WeakPolarHBondContact CA-OG 3.41Å; N300-S303 PolarHBondContact O-OG 2.66Å; L301-S303 VanDerWaalsContact C-N 3.33Å; L301-S303 PolarHBondContact O-N 2.92Å
304	K	85.4	Confident	83.1	Confident	123 Å²	123	66.3 Å²	66.3	54%	0.535	35%	0.346	S	S	.	.	H	α-helix	trans	-85.8	-44	178	-73	-176.7	179.4	-160.1	0	113.2	N300 L301 Q302	N300-K304 WeakPolarHBondContact O-CG 3.33Å; N300-K304 PolarHBondContact O-N 3.19Å; L301-K304 PolarHBondContact O-N 3.5Å; L301-K304 VanDerWaalsContact O-N 3.17Å; Q302-K304 PolarHBondContact O-N 3.21Å
305	E	84.4	Confident	82.1	Confident	123 Å²	123	70.1 Å²	70.1	58%	0.575	37%	0.37	S	S	*	.	H	α-helix	trans	-97.6	-10.7	-172.8	-64.8	-174.3	175.5	0	0	113.2	L301 V307	L301-E305 HydrophobicContact CD1-CG 4.27Å; L301-E305 PolarHBondContact O-N 3.18Å; E305-V307 PolarHBondContact O-N 3.48Å
306	N	81	Confident	81	Confident	140 Å²	140	69.6 Å²	69.6	75%	0.749	37%	0.373	S	S	*	.			trans	54.3	17.8	-175.7	-70.7	-54.6	0	0	0	114.9	Q302	Q302-N306 VanDerWaalsContact O-CA 3.23Å; Q302-N306 WeakPolarHBondContact O-CA 2.85Å; Q302-N306 PolarHBondContact O-N 3.08Å
307	V	79.3	Confident	79.9	Confident	88 Å²	88	65.2 Å²	65.2	53%	0.533	35%	0.352	S	S	.	.	S	Bend	trans	-121.6	131.1	179	179.7	0	0	0	0	109.9	E305 T309	E305-V307 PolarHBondContact O-N 3.48Å; V307-T309 PolarHBondContact O-N 3.25Å
308	P	79.4	Confident	79	Confident	66 Å²	66	67.5 Å²	67.5	43%	0.429	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-66	126.1	175.4	26.1	-32.6	0	0	0	110.8	E331	P308-E331 HydrophobicContact CB-CG 4.46Å
309	T	82.7	Confident	77.8	Confident	38 Å²	38	73.3 Å²	73.3	23%	0.233	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-83.7	127.3	179.6	-42	0	0	0	0	111.1	F298 L301 V307 A332	F298-T309 HydrophobicContact CD1-CG2 4.12Å; F298-T309 HydrophobicContact CE1-CG2 3.93Å; L301-T309 HydrophobicContact CD2-CG2 4.44Å; V307-T309 PolarHBondContact O-N 3.25Å; T309-A332 WeakPolarHBondContact O-CB 3.5Å; T309-A332 PolarHBondContact O-N 3.32Å
310	M	83.1	Confident	76.6	Confident	91 Å²	91	72.8 Å²	72.8	45%	0.448	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133.2	176.2	-62.1	-61	-78.4	0	0	110.7	Q329 E331	M310-Q329 HydrophobicContact CB-CB 4.15Å; M310-Q329 HydrophobicContact CE-CB 4.04Å; M310-Q329 WeakPolarHBondContact CE-O 3.44Å; M310-E331 HydrophobicContact SD-CB 4.22Å
311	I	83.4	Confident	75	Confident	15 Å²	15	75.4 Å²	75.4	8%	0.077	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	153.1	179	59	161.2	0	0	0	111.8	F298 Q329 V330 A332 Y335 Y336	F298-I311 HydrophobicContact CE1-CG2 4.14Å; F298-I311 HydrophobicContact CZ-CG2 3.86Å; I311-Q329 WeakPolarHBondContact O-CA 3.41Å; I311-V330 WeakPolarHBondContact CG1-O 3.37Å; I311-V330 PolarHBondContact N-O 3.31Å; I311-V330 PolarHBondContact O-N 3.5Å; I311-A332 HydrophobicContact CB-CB 4.45Å; I311-A332 HydrophobicContact CD1-CB 4.07Å; I311-A332 HydrophobicContact CG1-CB 3.89Å; I311-A332 HydrophobicContact CG2-CB 3.8Å; I311-Y335 HydrophobicContact CD1-CD1 3.68Å; I311-Y335 HydrophobicContact CD1-CE1 4.34Å; I311-Y335 HydrophobicContact CD1-CG 4.14Å; I311-Y336 HydrophobicContact CD1-CD2 4.3Å; I311-Y336 HydrophobicContact CD1-CE2 3.79Å
312	N	80.1	Confident	73.6	Confident	14 Å²	14	77.5 Å²	77.5	8%	0.075	43%	0.433	C	S	.	.			trans	-98.7	119.6	170.2	-178.2	-12.2	0	0	0	109.7	K314 C327	N312-K314 PolarHBondContact O-N 2.98Å; N312-K314 WeakPolarHBondContact OD1-CB 3.39Å; N312-K314 PolarHBondContact OD1-N 3.35Å; N312-C327 VanDerWaalsContact ND2-CB 3.32Å; N312-C327 WeakPolarHBondContact ND2-CB 3.45Å; N312-C327 PolarHBondContact ND2-SG 3.45Å; N312-C327 VanDerWaalsContact ND2-SG 3.39Å
313	P	74.9	Confident	72.2	Confident	39 Å²	39	80.5 Å²	80.5	25%	0.253	46%	0.456	S	S	.	.			trans	-74.3	-5.9	-176.2	28.7	-34.4	0	0	0	114.5	Y335 R602	P313-Y335 HydrophobicContact CB-CD2 4.33Å; P313-Y335 HydrophobicContact CB-CE2 3.72Å; P313-R602 WeakPolarHBondContact O-CD 3.35Å
314	K	75	Confident	70.9	Confident	122 Å²	122	80.8 Å²	80.8	53%	0.53	45%	0.454	S	S	.	.	S	Bend	trans	-79.4	151.5	178.9	-64.5	-68.1	-175.4	177.2	0	112.2	N312 G317	N312-K314 PolarHBondContact O-N 2.98Å; N312-K314 WeakPolarHBondContact OD1-CB 3.39Å; N312-K314 PolarHBondContact OD1-N 3.35Å; K314-G317 WeakPolarHBondContact O-CA 3.36Å; K314-G317 PolarHBondContact O-N 3.38Å
315	P	64.5	Low	69.2	Low	83 Å²	83	87.2 Å²	87.2	54%	0.539	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	140.1	171.6	24.4	-33	0	0	0	110.8	G317	P315-G317 PolarHBondContact O-N 3.49Å
316	C	64.5	Low	67.9	Low	48 Å²	48	83.8 Å²	83.8	32%	0.324	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	18.9	-171.2	-53.4	0	0	0	0	115.3	H318 L319	C316-H318 PolarHBondContact O-N 2.92Å; C316-L319 PolarHBondContact O-N 3.36Å
317	G	62.9	Low	67	Low	8 Å²	8	78.5 Å²	78.5	8%	0.082	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-54.9	-28.6	-176.8	0	0	0	0	0	114.9	K314 P315 C320	K314-G317 WeakPolarHBondContact O-CA 3.36Å; K314-G317 PolarHBondContact O-N 3.38Å; P315-G317 PolarHBondContact O-N 3.49Å; G317-C320 PolarHBondContact O-N 3.49Å
318	H	65.1	Low	66.7	Low	113 Å²	113	81.7 Å²	81.7	52%	0.523	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-73.5	-24.3	176.3	177.9	76.2	0	0	0	114.6	C316 C320 R607	C316-H318 PolarHBondContact O-N 2.92Å; H318-C320 VanDerWaalsContact C-N 3.28Å; H318-R607 PolarHBondContact CD2-NH2 2.98Å; H318-R607 PolarHBondContact NE2-NH2 3.39Å
319	L	61.7	Low	66.5	Low	125 Å²	125	83.6 Å²	83.6	65%	0.654	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-80.1	-14.2	175.7	-112.3	77.9	0	0	0	112.3	C316 C321	C316-L319 PolarHBondContact O-N 3.36Å; L319-C321 PolarHBondContact O-N 3.1Å
320	C	59.5	Low	66.5	Low	46 Å²	46	84.1 Å²	84.1	31%	0.311	46%	0.461	S	S	.	.			trans	-84.9	94.1	179.9	-156.6	0	0	0	0	109.4	G317 H318 C322 C327	G317-C320 PolarHBondContact O-N 3.49Å; H318-C320 VanDerWaalsContact C-N 3.28Å; C320-C322 VanDerWaalsContact C-N 3.28Å; C320-C322 PolarHBondContact SG-O 2.98Å; C320-C327 VanDerWaalsContact SG-SG 3.64Å
321	C	53.3	Low	66.8	Low	125 Å²	125	82.9 Å²	82.9	85%	0.845	45%	0.454	S	S	*	.			trans	-79.4	-6.3	177.9	48.2	0	0	0	0	113.9	L319	L319-C321 PolarHBondContact O-N 3.1Å
322	C	55.3	Low	66.9	Low	79 Å²	79	82.2 Å²	82.2	53%	0.534	45%	0.451	S	S	.	.	S	Bend	trans	-120.7	138.4	-175.5	-60.2	0	0	0	0	111.2	C320 V324	C320-C322 VanDerWaalsContact C-N 3.28Å; C320-C322 PolarHBondContact SG-O 2.98Å; C322-V324 HydrophobicContact CB-CG2 3.99Å; C322-V324 PolarHBondContact O-N 3.36Å
323	V	54.9	Low	67.3	Low	126 Å²	126	83 Å²	83	76%	0.764	46%	0.455	S	S	*	.			trans	-73.6	78.2	171.6	-172.8	0	0	0	0	108.9
324	V	59.2	Low	68.1	Low	85 Å²	85	85.1 Å²	85.1	52%	0.515	46%	0.461	S	S	.	.			trans	-86.2	144.2	173.4	-173.2	0	0	0	0	108.8	C322 G326 C327	C322-V324 HydrophobicContact CB-CG2 3.99Å; C322-V324 PolarHBondContact O-N 3.36Å; V324-G326 PolarHBondContact O-N 3.42Å; V324-C327 PolarHBondContact O-N 2.9Å
325	R	49.7	Very low	68.8	Low	257 Å²	257	81.9 Å²	81.9	97%	0.97	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	112.8	171.2	-107.1	-179.8	177.1	174.5	0	109.7
326	G	57.1	Low	70	Confident	51 Å²	51	78.8 Å²	78.8	53%	0.526	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	114.1	-7.3	-174.8	0	0	0	0	0	115.7	V324	V324-G326 PolarHBondContact O-N 3.42Å
327	C	60.4	Low	71.3	Confident	29 Å²	29	78.7 Å²	78.7	20%	0.196	42%	0.422	C	S	.	.			trans	-118.8	58.6	175.1	-72.8	0	0	0	0	111.1	N312 C320 V324 Q329	N312-C327 VanDerWaalsContact ND2-CB 3.32Å; N312-C327 WeakPolarHBondContact ND2-CB 3.45Å; N312-C327 PolarHBondContact ND2-SG 3.45Å; N312-C327 VanDerWaalsContact ND2-SG 3.39Å; C320-C327 VanDerWaalsContact SG-SG 3.64Å; V324-C327 PolarHBondContact O-N 2.9Å; C327-Q329 PolarHBondContact O-N 3.39Å
328	E	73.4	Confident	72.8	Confident	156 Å²	156	84.2 Å²	84.2	73%	0.729	44%	0.444	S	S	*	.			trans	-67.9	127.8	176.3	-70.3	174.4	-174	0	0	110.2
329	Q	75.1	Confident	74.1	Confident	106 Å²	106	81.3 Å²	81.3	50%	0.495	43%	0.432	S	S	.	.			trans	-82.9	134.1	174.7	-67.6	-173.6	-12.8	0	0	109.5	M310 I311 C327	M310-Q329 HydrophobicContact CB-CB 4.15Å; M310-Q329 HydrophobicContact CE-CB 4.04Å; M310-Q329 WeakPolarHBondContact CE-O 3.44Å; I311-Q329 WeakPolarHBondContact O-CA 3.41Å; C327-Q329 PolarHBondContact O-N 3.39Å
330	V	84	Confident	75.5	Confident	49 Å²	49	77 Å²	77	30%	0.297	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	148.2	178.3	-172.7	0	0	0	0	108.1	I311 A332	I311-V330 WeakPolarHBondContact CG1-O 3.37Å; I311-V330 PolarHBondContact N-O 3.31Å; I311-V330 PolarHBondContact O-N 3.5Å; V330-A332 PolarHBondContact O-N 3.16Å
331	E	88.5	Confident	77.2	Confident	65 Å²	65	80.1 Å²	80.1	30%	0.304	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	130.1	174.1	-172.2	179.1	171.5	0	0	110.7	P308 M310 I333 E334 Y335	P308-E331 HydrophobicContact CB-CG 4.46Å; M310-E331 HydrophobicContact SD-CB 4.22Å; E331-I333 PolarHBondContact O-N 3.39Å; E331-E334 HydrophobicContact CB-CB 4.19Å; E331-Y335 WeakPolarHBondContact O-CB 3.47Å; E331-Y335 PolarHBondContact O-N 2.87Å
332	A	86.2	Confident	79.2	Confident	1 Å²	1	80.2 Å²	80.2	1%	0.008	40%	0.404	C	S	.	.	H	α-helix	trans	-64.2	-45	-172.1	0	0	0	0	0	112.8	F298 T309 I311 V330 Y335 Y336	F298-A332 HydrophobicContact CB-CB 4.03Å; F298-A332 HydrophobicContact CD1-CB 3.72Å; F298-A332 HydrophobicContact CD2-CB 3.73Å; F298-A332 HydrophobicContact CE1-CB 4.09Å; F298-A332 HydrophobicContact CE2-CB 4.12Å; F298-A332 HydrophobicContact CG-CB 3.54Å; F298-A332 HydrophobicContact CZ-CB 4.28Å; T309-A332 WeakPolarHBondContact O-CB 3.5Å; T309-A332 PolarHBondContact O-N 3.32Å; I311-A332 HydrophobicContact CB-CB 4.45Å; I311-A332 HydrophobicContact CD1-CB 4.07Å; I311-A332 HydrophobicContact CG1-CB 3.89Å; I311-A332 HydrophobicContact CG2-CB 3.8Å; V330-A332 PolarHBondContact O-N 3.16Å; A332-Y335 PolarHBondContact O-N 3.48Å; A332-Y336 VanDerWaalsContact O-CD2 3.23Å; A332-Y336 WeakPolarHBondContact O-CD2 3.39Å; A332-Y336 PolarHBondContact O-N 3.19Å
333	I	88.3	Confident	81	Confident	29 Å²	29	77.3 Å²	77.3	15%	0.149	38%	0.383	C	S	.	.	H	α-helix	trans	-66.1	-45.4	-177.5	-63.8	170.8	0	0	0	110	F298 Q302 E331 Y335 Y336 T337	F298-I333 HydrophobicContact CB-CG1 3.91Å; Q302-I333 HydrophobicContact CB-CD1 3.95Å; Q302-I333 VanDerWaalsContact CD-CD1 3.49Å; Q302-I333 HydrophobicContact CG-CD1 4.35Å; E331-I333 PolarHBondContact O-N 3.39Å; I333-Y335 PolarHBondContact O-N 3.03Å; I333-Y336 PolarHBondContact O-N 3.36Å; I333-T337 WeakPolarHBondContact O-CB 3.2Å; I333-T337 PolarHBondContact O-N 2.78Å; I333-T337 PolarHBondContact O-OG1 2.6Å
334	E	90.9	Very high	82.9	Confident	84 Å²	84	77.1 Å²	77.1	39%	0.393	37%	0.372	S	S	.	.	H	α-helix	trans	-60.8	-45.5	176.8	-167	-170.5	-179.2	0	0	111.3	E331 T337 K338	E331-E334 HydrophobicContact CB-CB 4.19Å; E334-T337 PolarHBondContact O-N 2.94Å; E334-K338 HydrophobicContact CG-CD 4.38Å; E334-K338 WeakPolarHBondContact O-CG 3.23Å; E334-K338 PolarHBondContact O-N 2.87Å; E334-K338 WeakPolarHBondContact OE1-CE 3.45Å; E334-K338 IonicContact OE1-NZ 2.72Å; E334-K338 PolarHBondContact OE1-NZ 3.05Å
335	Y	90.1	Very high	84.6	Confident	55 Å²	55	77.8 Å²	77.8	22%	0.216	37%	0.37	C	S	.	.	H	α-helix	trans	-59.6	-52.4	177.3	174.3	-97.4	0	0	0	112.3	I311 P313 E331 A332 I333 T337 K338 L339	I311-Y335 HydrophobicContact CD1-CD1 3.68Å; I311-Y335 HydrophobicContact CD1-CE1 4.34Å; I311-Y335 HydrophobicContact CD1-CG 4.14Å; P313-Y335 HydrophobicContact CB-CD2 4.33Å; P313-Y335 HydrophobicContact CB-CE2 3.72Å; E331-Y335 WeakPolarHBondContact O-CB 3.47Å; E331-Y335 PolarHBondContact O-N 2.87Å; A332-Y335 PolarHBondContact O-N 3.48Å; I333-Y335 PolarHBondContact O-N 3.03Å; Y335-T337 VanDerWaalsContact C-N 3.32Å; Y335-T337 PolarHBondContact O-N 3.4Å; Y335-K338 PolarHBondContact O-N 2.85Å; Y335-L339 HydrophobicContact CE1-CD2 4.07Å; Y335-L339 WeakPolarHBondContact O-CB 3.34Å; Y335-L339 PolarHBondContact O-N 3.21Å
336	Y	90.1	Very high	86.7	Confident	17 Å²	17	67.7 Å²	67.7	7%	0.067	34%	0.335	C	S	.	.	H	α-helix	trans	-68.2	-32.1	-178.9	-81.2	-73.5	0	0	0	112.2	A291 F298 I311 A332 I333 L339 E340 S603	A291-Y336 HydrophobicContact CB-CD1 4.36Å; A291-Y336 WeakPolarHBondContact O-CD1 3.43Å; F298-Y336 AromaticContact CD2-CD2 3.74Å; F298-Y336 HydrophobicContact CD2-CD2 3.74Å; F298-Y336 AromaticContact CD2-CE2 3.64Å; F298-Y336 HydrophobicContact CD2-CE2 3.64Å; F298-Y336 AromaticContact CE2-CD2 4Å; F298-Y336 HydrophobicContact CE2-CD2 4Å; F298-Y336 AromaticContact CE2-CE2 3.38Å; F298-Y336 HydrophobicContact CE2-CE2 3.38Å; I311-Y336 HydrophobicContact CD1-CD2 4.3Å; I311-Y336 HydrophobicContact CD1-CE2 3.79Å; A332-Y336 VanDerWaalsContact O-CD2 3.23Å; A332-Y336 WeakPolarHBondContact O-CD2 3.39Å; A332-Y336 PolarHBondContact O-N 3.19Å; I333-Y336 PolarHBondContact O-N 3.36Å; Y336-L339 HydrophobicContact CD1-CD2 4.35Å; Y336-L339 PolarHBondContact O-N 2.92Å; Y336-E340 WeakPolarHBondContact O-CB 3.47Å; Y336-E340 PolarHBondContact O-N 3.42Å; Y336-S603 PolarHBondContact OH-OG 3.16Å
337	T	92.4	Very high	88.4	Confident	47 Å²	47	66.3 Å²	66.3	29%	0.288	31%	0.314	S	S	.	.	H	α-helix	trans	-65.4	-47.4	174.6	-58.8	0	0	0	0	111.3	K295 I333 E334 Y335 L339 E340 Q341	K295-T337 VanDerWaalsContact CE-OG1 3.31Å; K295-T337 WeakPolarHBondContact CE-OG1 3.14Å; I333-T337 WeakPolarHBondContact O-CB 3.2Å; I333-T337 PolarHBondContact O-N 2.78Å; I333-T337 PolarHBondContact O-OG1 2.6Å; E334-T337 PolarHBondContact O-N 2.94Å; Y335-T337 VanDerWaalsContact C-N 3.32Å; Y335-T337 PolarHBondContact O-N 3.4Å; T337-L339 VanDerWaalsContact C-N 3.32Å; T337-L339 PolarHBondContact O-N 2.84Å; T337-E340 PolarHBondContact O-N 2.72Å; T337-Q341 WeakPolarHBondContact O-CB 3.37Å; T337-Q341 PolarHBondContact O-N 3.49Å
338	K	93.6	Very high	89.9	Confident	123 Å²	123	71.3 Å²	71.3	54%	0.535	33%	0.333	S	S	.	.	H	α-helix	trans	-61.8	-40.3	174.7	-73.2	177.6	-176.2	170	0	111.8	E334 Y335 K342	E334-K338 HydrophobicContact CG-CD 4.38Å; E334-K338 WeakPolarHBondContact O-CG 3.23Å; E334-K338 PolarHBondContact O-N 2.87Å; E334-K338 WeakPolarHBondContact OE1-CE 3.45Å; E334-K338 IonicContact OE1-NZ 2.72Å; E334-K338 PolarHBondContact OE1-NZ 3.05Å; Y335-K338 PolarHBondContact O-N 2.85Å; K338-K342 WeakPolarHBondContact O-CB 3.39Å; K338-K342 PolarHBondContact O-N 2.92Å
339	L	91.6	Very high	90.9	Very high	52 Å²	52	70.3 Å²	70.3	27%	0.272	32%	0.322	S	S	.	.	H	α-helix	trans	-66.5	-46.4	178.7	-178.9	61.7	0	0	0	111.8	A291 Y335 Y336 T337 K342 L343	A291-L339 HydrophobicContact CB-CD2 3.99Å; A291-L339 HydrophobicContact CB-CG 4.04Å; Y335-L339 HydrophobicContact CE1-CD2 4.07Å; Y335-L339 WeakPolarHBondContact O-CB 3.34Å; Y335-L339 PolarHBondContact O-N 3.21Å; Y336-L339 HydrophobicContact CD1-CD2 4.35Å; Y336-L339 PolarHBondContact O-N 2.92Å; T337-L339 VanDerWaalsContact C-N 3.32Å; T337-L339 PolarHBondContact O-N 2.84Å; L339-K342 PolarHBondContact O-N 3.47Å; L339-L343 HydrophobicContact CD1-CD1 3.95Å; L339-L343 HydrophobicContact CD1-CG 4.26Å; L339-L343 HydrophobicContact CG-CD1 3.86Å; L339-L343 WeakPolarHBondContact O-CB 3.3Å; L339-L343 VanDerWaalsContact O-CG 3.25Å; L339-L343 WeakPolarHBondContact O-CG 3.34Å; L339-L343 PolarHBondContact O-N 3.24Å
340	E	92.6	Very high	91.7	Very high	34 Å²	34	65.8 Å²	65.8	16%	0.159	30%	0.301	C	S	.	.	H	α-helix	trans	-59.1	-49	176.9	-174.1	-158.8	161	0	0	110.8	A291 K295 Y336 T337 K342 L343 K344	A291-E340 HydrophobicContact CB-CB 4.43Å; K295-E340 WeakPolarHBondContact CD-OE2 3.2Å; K295-E340 IonicContact NZ-OE2 2.85Å; K295-E340 PolarHBondContact NZ-OE2 2.95Å; Y336-E340 WeakPolarHBondContact O-CB 3.47Å; Y336-E340 PolarHBondContact O-N 3.42Å; T337-E340 PolarHBondContact O-N 2.72Å; E340-K342 PolarHBondContact O-N 3.45Å; E340-L343 PolarHBondContact O-N 3.38Å; E340-K344 WeakPolarHBondContact O-CB 3.37Å; E340-K344 PolarHBondContact O-N 3.16Å
341	Q	94.1	Very high	92	Very high	112 Å²	112	66.7 Å²	66.7	52%	0.523	30%	0.301	S	S	.	.	H	α-helix	trans	-59.2	-48.7	178.8	-176.7	179.4	-9.2	0	0	111.3	T337 L343 K344 E345	T337-Q341 WeakPolarHBondContact O-CB 3.37Å; T337-Q341 PolarHBondContact O-N 3.49Å; Q341-L343 VanDerWaalsContact C-N 3.34Å; Q341-L343 PolarHBondContact O-N 3.26Å; Q341-K344 PolarHBondContact O-N 3.36Å; Q341-E345 WeakPolarHBondContact CG-OE1 3.2Å; Q341-E345 PolarHBondContact NE2-OE1 3.16Å; Q341-E345 VanDerWaalsContact NE2-OE1 3.12Å; Q341-E345 WeakPolarHBondContact O-CG 3.28Å; Q341-E345 PolarHBondContact O-N 3.05Å
342	K	95.3	Very high	92.1	Very high	127 Å²	127	69.7 Å²	69.7	55%	0.552	32%	0.315	S	S	*	.	H	α-helix	trans	-58	-45.7	177	-178.1	179.7	178	179.3	0	111.9	K338 L339 E340 K344 E345 D346	K338-K342 WeakPolarHBondContact O-CB 3.39Å; K338-K342 PolarHBondContact O-N 2.92Å; L339-K342 PolarHBondContact O-N 3.47Å; E340-K342 PolarHBondContact O-N 3.45Å; K342-K344 VanDerWaalsContact C-N 3.33Å; K342-K344 PolarHBondContact O-N 3.47Å; K342-E345 PolarHBondContact O-N 3.11Å; K342-D346 WeakPolarHBondContact O-CB 3.34Å; K342-D346 PolarHBondContact O-N 3.18Å
343	L	94.4	Very high	92.2	Very high	18 Å²	18	73.8 Å²	73.8	9%	0.094	33%	0.333	C	S	.	.	H	α-helix	trans	-67	-34.6	179	-71.7	168.1	0	0	0	112.1	L284 E287 R288 A291 L339 E340 Q341 Y347	L284-L343 HydrophobicContact CD2-CD2 4.17Å; E287-L343 HydrophobicContact CB-CD1 4.14Å; E287-L343 HydrophobicContact CB-CD2 4.15Å; R288-L343 HydrophobicContact CB-CB 4.17Å; A291-L343 HydrophobicContact CB-CD1 3.96Å; L339-L343 HydrophobicContact CD1-CD1 3.95Å; L339-L343 HydrophobicContact CD1-CG 4.26Å; L339-L343 HydrophobicContact CG-CD1 3.86Å; L339-L343 WeakPolarHBondContact O-CB 3.3Å; L339-L343 VanDerWaalsContact O-CG 3.25Å; L339-L343 WeakPolarHBondContact O-CG 3.34Å; L339-L343 PolarHBondContact O-N 3.24Å; E340-L343 PolarHBondContact O-N 3.38Å; Q341-L343 VanDerWaalsContact C-N 3.34Å; Q341-L343 PolarHBondContact O-N 3.26Å; L343-Y347 WeakPolarHBondContact O-CB 3.28Å; L343-Y347 PolarHBondContact O-N 2.87Å
344	K	93.5	Very high	92.2	Very high	123 Å²	123	72.5 Å²	72.5	54%	0.535	33%	0.326	S	S	.	.	H	α-helix	trans	-67.1	-42.2	175.5	-167.9	174.1	-176.5	174.2	0	111.4	E340 Q341 K342 Y347 K348	E340-K344 WeakPolarHBondContact O-CB 3.37Å; E340-K344 PolarHBondContact O-N 3.16Å; Q341-K344 PolarHBondContact O-N 3.36Å; K342-K344 VanDerWaalsContact C-N 3.33Å; K342-K344 PolarHBondContact O-N 3.47Å; K344-Y347 PolarHBondContact O-N 3.31Å; K344-K348 PolarHBondContact O-N 2.96Å
345	E	95	Very high	91.9	Very high	98 Å²	98	74 Å²	74	46%	0.458	34%	0.337	S	S	.	.	H	α-helix	trans	-64.1	-46.8	174	-71.6	173.4	-164.6	0	0	111.9	Q341 K342 Y347 K348 R349	Q341-E345 WeakPolarHBondContact CG-OE1 3.2Å; Q341-E345 PolarHBondContact NE2-OE1 3.16Å; Q341-E345 VanDerWaalsContact NE2-OE1 3.12Å; Q341-E345 WeakPolarHBondContact O-CG 3.28Å; Q341-E345 PolarHBondContact O-N 3.05Å; K342-E345 PolarHBondContact O-N 3.11Å; E345-Y347 VanDerWaalsContact C-N 3.34Å; E345-Y347 PolarHBondContact O-N 3.2Å; E345-K348 PolarHBondContact O-N 3.18Å; E345-R349 WeakPolarHBondContact O-CB 3.49Å; E345-R349 PolarHBondContact O-N 3Å
346	D	94.2	Very high	91.7	Very high	46 Å²	46	77.6 Å²	77.6	25%	0.246	36%	0.356	C	S	.	.	H	α-helix	trans	-63.2	-39.5	176.7	-77.9	-23.7	0	0	0	111.6	L284 K342 E350	L284-D346 HydrophobicContact CD1-CB 4.3Å; L284-D346 HydrophobicContact CD2-CB 4.12Å; K342-D346 WeakPolarHBondContact O-CB 3.34Å; K342-D346 PolarHBondContact O-N 3.18Å; D346-E350 WeakPolarHBondContact O-CB 3.32Å; D346-E350 PolarHBondContact O-N 3.14Å
347	Y	93.2	Very high	91.6	Very high	21 Å²	21	80.3 Å²	80.3	8%	0.082	37%	0.368	C	S	.	.	H	α-helix	trans	-62.1	-48.8	174.7	173.7	-88.8	0	0	0	111.4	L281 D285 L343 K344 E345 R349 E350 K351 V775	L281-Y347 HydrophobicContact CD1-CD2 3.41Å; L281-Y347 VanDerWaalsContact CD1-CD2 3.41Å; L281-Y347 HydrophobicContact CD1-CE2 3.36Å; L281-Y347 HydrophobicContact CD1-CG 4.07Å; L281-Y347 HydrophobicContact CD2-CE2 4.34Å; L281-Y347 HydrophobicContact CG-CD2 4.13Å; L281-Y347 HydrophobicContact CG-CE2 3.71Å; D285-Y347 HydrophobicContact CB-CD2 4.16Å; D285-Y347 HydrophobicContact CB-CE2 3.96Å; L343-Y347 WeakPolarHBondContact O-CB 3.28Å; L343-Y347 PolarHBondContact O-N 2.87Å; K344-Y347 PolarHBondContact O-N 3.31Å; E345-Y347 VanDerWaalsContact C-N 3.34Å; E345-Y347 PolarHBondContact O-N 3.2Å; Y347-R349 PolarHBondContact O-N 3.21Å; Y347-E350 PolarHBondContact O-N 2.83Å; Y347-K351 HydrophobicContact CE1-CD 3.86Å; Y347-K351 VanDerWaalsContact O-CB 3.3Å; Y347-K351 WeakPolarHBondContact O-CB 3.43Å; Y347-K351 PolarHBondContact O-N 3.18Å; Y347-V775 PolarHBondContact OH-O 3.26Å
348	K	92.5	Very high	91.5	Very high	135 Å²	135	79 Å²	79	59%	0.587	36%	0.36	S	S	*	.	H	α-helix	trans	-59.5	-46.4	178.5	-175.2	177.8	177.4	178.7	0	111.3	K344 E345 E350 K351 E352	K344-K348 PolarHBondContact O-N 2.96Å; E345-K348 PolarHBondContact O-N 3.18Å; K348-E350 VanDerWaalsContact C-N 3.35Å; K348-E350 PolarHBondContact O-N 2.9Å; K348-K351 WeakPolarHBondContact O-CB 3.47Å; K348-K351 PolarHBondContact O-N 3.43Å; K348-E352 WeakPolarHBondContact CE-OE1 3.26Å; K348-E352 WeakPolarHBondContact O-CG 3.34Å; K348-E352 PolarHBondContact O-N 3.45Å; K348-E352 VanDerWaalsContact O-N 3.08Å
349	R	93.1	Very high	91.3	Very high	135 Å²	135	75 Å²	75	51%	0.509	35%	0.345	S	S	.	.	H	α-helix	trans	-61.8	-39.9	177.9	-171.8	-172.2	-57.9	176	4.9	112.8	E345 Y347 K353	E345-R349 WeakPolarHBondContact O-CB 3.49Å; E345-R349 PolarHBondContact O-N 3Å; Y347-R349 PolarHBondContact O-N 3.21Å; R349-K353 WeakPolarHBondContact O-CG 3Å
350	E	92.4	Very high	91.2	Very high	10 Å²	10	73 Å²	73	5%	0.047	34%	0.335	C	S	.	.	H	α-helix	trans	-74.2	-35	177.1	-167.6	67.4	-155.6	0	0	111.2	R280 L281 L284 D346 Y347 K348 E352 K353 V354 K357	R280-E350 HydrophobicContact CB-CG 4.29Å; R280-E350 WeakPolarHBondContact CD-OE2 3.33Å; R280-E350 HydrophobicContact CG-CG 4.17Å; R280-E350 IonicContact CZ-OE2 2.72Å; R280-E350 IonicContact NE-OE2 3.16Å; R280-E350 IonicContact NH1-OE2 2.7Å; R280-E350 PolarHBondContact NH1-OE2 3.41Å; L281-E350 HydrophobicContact CD1-CB 4.3Å; L284-E350 HydrophobicContact CD1-CB 3.94Å; L284-E350 HydrophobicContact CD1-CG 4.35Å; D346-E350 WeakPolarHBondContact O-CB 3.32Å; D346-E350 PolarHBondContact O-N 3.14Å; Y347-E350 PolarHBondContact O-N 2.83Å; K348-E350 VanDerWaalsContact C-N 3.35Å; K348-E350 PolarHBondContact O-N 2.9Å; E350-E352 PolarHBondContact O-N 3.32Å; E350-K353 PolarHBondContact O-N 3.35Å; E350-K353 VanDerWaalsContact O-N 3.1Å; E350-V354 WeakPolarHBondContact O-CG2 3.31Å; E350-V354 PolarHBondContact O-N 3.35Å; E350-K357 IonicContact OE1-NZ 2.99Å; E350-K357 PolarHBondContact OE1-NZ 3.28Å; E350-K357 IonicContact OE2-NZ 3.14Å
351	K	89.8	Confident	91.1	Very high	69 Å²	69	71.8 Å²	71.8	30%	0.3	33%	0.33	S	S	.	.	H	α-helix	trans	-59.1	-45.6	176.5	-171.8	172.8	-177.3	171	0	111.7	L281 Y347 K348 K353 V354 S779	L281-K351 HydrophobicContact CD1-CB 4.02Å; Y347-K351 HydrophobicContact CE1-CD 3.86Å; Y347-K351 VanDerWaalsContact O-CB 3.3Å; Y347-K351 WeakPolarHBondContact O-CB 3.43Å; Y347-K351 PolarHBondContact O-N 3.18Å; K348-K351 WeakPolarHBondContact O-CB 3.47Å; K348-K351 PolarHBondContact O-N 3.43Å; K351-K353 PolarHBondContact O-N 2.93Å; K351-V354 PolarHBondContact O-N 3.44Å; K351-S779 WeakPolarHBondContact CE-OG 3.44Å; K351-S779 PolarHBondContact NZ-OG 3.16Å
352	E	90.3	Very high	91	Very high	127 Å²	127	66.4 Å²	66.4	59%	0.593	31%	0.305	S	S	*	.	H	α-helix	trans	-58.6	-32.2	175.8	-71.2	167	-170.2	0	0	112.3	K348 E350	K348-E352 WeakPolarHBondContact CE-OE1 3.26Å; K348-E352 WeakPolarHBondContact O-CG 3.34Å; K348-E352 PolarHBondContact O-N 3.45Å; K348-E352 VanDerWaalsContact O-N 3.08Å; E350-E352 PolarHBondContact O-N 3.32Å
353	K	90	Very high	90.9	Very high	88 Å²	88	60.5 Å²	60.5	38%	0.383	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-5.1	-178.3	-64.5	178	-176.8	-173.1	0	114.5	R349 E350 K351 N355 E356	R349-K353 WeakPolarHBondContact O-CG 3Å; E350-K353 PolarHBondContact O-N 3.35Å; E350-K353 VanDerWaalsContact O-N 3.1Å; K351-K353 PolarHBondContact O-N 2.93Å; K353-N355 VanDerWaalsContact C-N 3.35Å; K353-N355 PolarHBondContact O-N 3.42Å; K353-E356 WeakPolarHBondContact O-CB 3.49Å; K353-E356 PolarHBondContact O-N 3.41Å
354	V	88.1	Confident	90.8	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.012	28%	0.275	C	S	.	.	S	Bend	trans	-63.8	-42.3	-176.3	172.1	0	0	0	0	111.3	Y276 V278 L281 E350 K351 E356 K357 L776	Y276-V354 WeakPolarHBondContact CD1-O 3.22Å; Y276-V354 HydrophobicContact CG-CG1 4.03Å; V278-V354 HydrophobicContact CG1-CG1 4.31Å; L281-V354 HydrophobicContact CD2-CG2 3.93Å; E350-V354 WeakPolarHBondContact O-CG2 3.31Å; E350-V354 PolarHBondContact O-N 3.35Å; K351-V354 PolarHBondContact O-N 3.44Å; V354-E356 PolarHBondContact O-N 2.99Å; V354-K357 PolarHBondContact O-N 3.07Å; V354-L776 HydrophobicContact CG1-CD2 4.31Å
355	N	83.8	Confident	90.7	Very high	114 Å²	114	54.4 Å²	54.4	61%	0.61	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.8	-178.8	-68.1	-21.1	0	0	0	112.5	K353 K357	K353-N355 VanDerWaalsContact C-N 3.35Å; K353-N355 PolarHBondContact O-N 3.42Å; N355-K357 VanDerWaalsContact C-N 3.27Å; N355-K357 PolarHBondContact O-N 2.99Å
356	E	86.3	Confident	90.5	Very high	132 Å²	132	49.7 Å²	49.7	62%	0.617	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-10.2	176.2	-55.1	-179.2	157.8	0	0	113.2	K353 V354 P358	K353-E356 WeakPolarHBondContact O-CB 3.49Å; K353-E356 PolarHBondContact O-N 3.41Å; V354-E356 PolarHBondContact O-N 2.99Å; E356-P358 WeakPolarHBondContact O-CD 3.35Å
357	K	87.7	Confident	90.2	Very high	73 Å²	73	50.9 Å²	50.9	32%	0.317	24%	0.235	S	C	.	.			trans	-116.4	57.7	-175.8	-58.8	176.8	-170.7	176.4	0	112.8	N277 E350 V354 N355	N277-K357 HydrophobicContact CB-CB 4Å; N277-K357 PolarHBondContact N-O 3.43Å; E350-K357 IonicContact OE1-NZ 2.99Å; E350-K357 PolarHBondContact OE1-NZ 3.28Å; E350-K357 IonicContact OE2-NZ 3.14Å; V354-K357 PolarHBondContact O-N 3.07Å; N355-K357 VanDerWaalsContact C-N 3.27Å; N355-K357 PolarHBondContact O-N 2.99Å
358	P	90.3	Very high	89.9	Confident	19 Å²	19	53 Å²	53	12%	0.123	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	147.4	178.5	32.8	-36.6	0	0	0	112	K249 Y250 Y276 E356	K249-P358 HydrophobicContact CB-CG 4.11Å; K249-P358 WeakPolarHBondContact O-CB 3.37Å; K249-P358 WeakPolarHBondContact O-CG 3.21Å; Y250-P358 HydrophobicContact CD1-CG 3.98Å; Y250-P358 HydrophobicContact CE1-CG 3.9Å; Y276-P358 HydrophobicContact CD1-CB 4.21Å; Y276-P358 HydrophobicContact CE1-CB 4.19Å; E356-P358 WeakPolarHBondContact O-CD 3.35Å
359	L	88.9	Confident	89.6	Confident	41 Å²	41	48.8 Å²	48.8	22%	0.215	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-6.3	-174.9	-62.5	176	0	0	0	113.9	C275 Y276 N277 M361 L423	C275-L359 HydrophobicContact CB-CB 4.44Å; C275-L359 HydrophobicContact CB-CD1 4.33Å; C275-L359 WeakPolarHBondContact O-CB 3.47Å; C275-L359 PolarHBondContact O-N 3.06Å; Y276-L359 WeakPolarHBondContact O-CD1 3.43Å; N277-L359 HydrophobicContact CB-CD2 4.17Å; L359-M361 HydrophobicContact CB-CE 3.42Å; L359-M361 VanDerWaalsContact CB-CE 3.42Å; L359-M361 HydrophobicContact CD1-CE 3.54Å; L359-M361 HydrophobicContact CG-CE 4.11Å; L359-L423 HydrophobicContact CD1-CD2 4.28Å; L359-L423 HydrophobicContact CD1-CG 4.17Å
360	G	89.1	Confident	89.2	Confident	8 Å²	8	46.7 Å²	46.7	8%	0.082	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	71.6	34	-176.4	0	0	0	0	0	113.4	G246 I247	G246-G360 PolarHBondContact N-O 3.07Å; I247-G360 PolarHBondContact N-O 3.19Å; I247-G360 VanDerWaalsContact O-CA 3.25Å; I247-G360 WeakPolarHBondContact O-CA 3.13Å
361	M	90.9	Very high	89	Confident	9 Å²	9	47 Å²	47	4%	0.044	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	154.1	-179.7	-52	175.2	-59.2	0	0	109.4	F243 I244 N245 P274 C275 L359 L423 R426	F243-M361 HydrophobicContact CE2-CB 4.05Å; F243-M361 HydrophobicContact CE2-SD 4.32Å; F243-M361 HydrophobicContact CZ-CB 4.37Å; F243-M361 HydrophobicContact CZ-CG 4.45Å; F243-M361 HydrophobicContact CZ-SD 3.82Å; I244-M361 CarbonylContact O-C 3.57Å; I244-M361 VanDerWaalsContact O-CA 3.24Å; I244-M361 WeakPolarHBondContact O-CA 3.2Å; N245-M361 HydrophobicContact CB-CG 4.38Å; N245-M361 WeakPolarHBondContact OD1-CG 3.3Å; P274-M361 CarbonylContact C-O 3.57Å; P274-M361 WeakPolarHBondContact CA-O 3.4Å; C275-M361 HydrophobicContact CB-CB 4.08Å; C275-M361 HydrophobicContact CB-CE 3.96Å; C275-M361 PolarHBondContact N-O 3Å; L359-M361 HydrophobicContact CB-CE 3.42Å; L359-M361 VanDerWaalsContact CB-CE 3.42Å; L359-M361 HydrophobicContact CD1-CE 3.54Å; L359-M361 HydrophobicContact CG-CE 4.11Å; M361-L423 HydrophobicContact CE-CD1 3.89Å; M361-L423 HydrophobicContact CE-CD2 3.98Å; M361-L423 HydrophobicContact CE-CG 3.57Å; M361-R426 PolarHBondContact SD-NH1 2.88Å
362	A	92.2	Very high	88.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	149	176.3	0	0	0	0	0	111.9	I244 I247 I256 R273 V364	I244-A362 PolarHBondContact N-O 3.13Å; I244-A362 PolarHBondContact O-N 2.9Å; I247-A362 HydrophobicContact CD1-CB 3.41Å; I247-A362 VanDerWaalsContact CD1-CB 3.41Å; I256-A362 HydrophobicContact CD1-CB 4.24Å; R273-A362 CarbonylContact O-C 3.57Å; R273-A362 WeakPolarHBondContact O-CA 3.32Å; A362-V364 HydrophobicContact CB-CG2 4.41Å
363	F	93.4	Very high	88.7	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.009	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124.5	164	-66.8	-79.1	0	0	0	108.5	T241 L242 F243 A272 R273 C275 A412 I418 W420 Y771	T241-F363 HydrophobicContact CG2-CB 4.16Å; T241-F363 HydrophobicContact CG2-CD1 4.39Å; L242-F363 WeakPolarHBondContact O-CA 3.46Å; F243-F363 HydrophobicContact CB-CD1 4.15Å; F243-F363 HydrophobicContact CB-CE1 3.93Å; F243-F363 AromaticContact CD2-CD1 3.82Å; F243-F363 HydrophobicContact CD2-CD1 3.82Å; F243-F363 AromaticContact CD2-CE1 3.34Å; F243-F363 HydrophobicContact CD2-CE1 3.34Å; F243-F363 HydrophobicContact CD2-CE2 4.14Å; F243-F363 HydrophobicContact CD2-CG 4.4Å; F243-F363 AromaticContact CD2-CZ 3.51Å; F243-F363 HydrophobicContact CD2-CZ 3.51Å; F243-F363 HydrophobicContact CE2-CE1 4.09Å; F243-F363 HydrophobicContact CE2-CE2 4.21Å; F243-F363 AromaticContact CE2-CZ 3.77Å; F243-F363 HydrophobicContact CE2-CZ 3.77Å; F243-F363 HydrophobicContact CG-CD1 4.44Å; F243-F363 AromaticContact CG-CE1 3.92Å; F243-F363 HydrophobicContact CG-CE1 3.92Å; F243-F363 HydrophobicContact CG-CZ 4.4Å; A272-F363 CarbonylContact C-O 3.54Å; A272-F363 WeakPolarHBondContact CA-O 3.48Å; R273-F363 PolarHBondContact N-O 2.92Å; R273-F363 PolarHBondContact O-N 3.34Å; C275-F363 VanDerWaalsContact SG-CE2 3.52Å; F363-A412 HydrophobicContact CD1-CB 3.79Å; F363-A412 HydrophobicContact CE1-CB 3.97Å; F363-I418 HydrophobicContact CE1-CD1 4.01Å; F363-I418 HydrophobicContact CE2-CD1 4.34Å; F363-I418 HydrophobicContact CZ-CD1 3.61Å; F363-W420 HydrophobicContact CD2-CH2 4.38Å; F363-W420 AromaticContact CE2-CH2 3.93Å; F363-W420 HydrophobicContact CE2-CH2 3.93Å; F363-W420 HydrophobicContact CE2-CZ3 4.04Å; F363-Y771 HydrophobicContact CB-CD1 4.3Å; F363-Y771 HydrophobicContact CB-CG 3.97Å; F363-Y771 AromaticContact CD1-CD1 3.48Å; F363-Y771 HydrophobicContact CD1-CD1 3.48Å; F363-Y771 VanDerWaalsContact CD1-CD1 3.48Å; F363-Y771 AromaticContact CD1-CE1 3.87Å; F363-Y771 HydrophobicContact CD1-CE1 3.87Å; F363-Y771 HydrophobicContact CD1-CG 4.01Å; F363-Y771 HydrophobicContact CD2-CD1 4.19Å; F363-Y771 HydrophobicContact CD2-CG 4.47Å; F363-Y771 AromaticContact CE1-CD1 3.76Å; F363-Y771 HydrophobicContact CE1-CD1 3.76Å; F363-Y771 AromaticContact CE1-CE1 3.96Å; F363-Y771 HydrophobicContact CE1-CE1 3.96Å; F363-Y771 HydrophobicContact CE2-CD1 4.43Å; F363-Y771 AromaticContact CG-CD1 3.73Å; F363-Y771 HydrophobicContact CG-CD1 3.73Å; F363-Y771 AromaticContact CG-CG 3.9Å; F363-Y771 HydrophobicContact CG-CG 3.9Å; F363-Y771 HydrophobicContact CZ-CD1 4.24Å
364	V	92.7	Very high	88.6	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	116.9	-179.6	-174	0	0	0	0	108.9	T241 L242 I244 I256 F260 V269 E271 A272 A362 F366	T241-V364 CarbonylContact C-O 3.3Å; T241-V364 VanDerWaalsContact CA-O 3.32Å; T241-V364 WeakPolarHBondContact CA-O 3.35Å; T241-V364 WeakPolarHBondContact CG2-O 3.48Å; L242-V364 PolarHBondContact N-O 3.19Å; L242-V364 PolarHBondContact O-N 3.44Å; I244-V364 HydrophobicContact CD1-CB 4.26Å; I244-V364 HydrophobicContact CD1-CG2 3.57Å; I244-V364 HydrophobicContact CG1-CG2 4.46Å; I256-V364 HydrophobicContact CG2-CG2 3.94Å; F260-V364 HydrophobicContact CD2-CG1 4.14Å; F260-V364 HydrophobicContact CE2-CG1 4.24Å; F260-V364 HydrophobicContact CE2-CG2 4.23Å; V269-V364 HydrophobicContact CG1-CG1 3.6Å; E271-V364 CarbonylContact O-C 3.58Å; E271-V364 WeakPolarHBondContact O-CA 3.47Å; A272-V364 HydrophobicContact CB-CG1 4.41Å; A272-V364 HydrophobicContact CB-CG2 4.11Å; A362-V364 HydrophobicContact CB-CG2 4.41Å; V364-F366 HydrophobicContact CB-CE2 4.07Å; V364-F366 HydrophobicContact CB-CZ 4.13Å; V364-F366 HydrophobicContact CG1-CE1 4.01Å; V364-F366 HydrophobicContact CG1-CE2 3.78Å; V364-F366 HydrophobicContact CG1-CZ 3.48Å; V364-F366 VanDerWaalsContact CG1-CZ 3.48Å; V364-F366 WeakPolarHBondContact O-CE2 3.15Å
365	T	91.3	Very high	88.6	Confident	13 Å²	13	38.9 Å²	38.9	8%	0.08	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	124.5	-178.2	-56.6	0	0	0	0	109.6	L237 T241 L270 E271	L237-T365 HydrophobicContact CD1-CG2 4.19Å; T241-T365 WeakPolarHBondContact OG1-CG2 3.39Å; T241-T365 PolarHBondContact OG1-OG1 2.97Å; L270-T365 HydrophobicContact CB-CG2 4.47Å; L270-T365 HydrophobicContact CD1-CG2 4.25Å; L270-T365 PolarHBondContact N-O 3.04Å; E271-T365 PolarHBondContact N-O 2.95Å; E271-T365 PolarHBondContact O-N 2.9Å
366	F	90.8	Very high	88.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	158.1	-179.8	-59.4	-86.3	0	0	0	110.8	R240 L242 F260 V269 V364 T372 I375	R240-F366 WeakPolarHBondContact CB-O 3.5Å; R240-F366 WeakPolarHBondContact O-CD2 3.37Å; R240-F366 PolarHBondContact O-N 3.29Å; L242-F366 HydrophobicContact CB-CE2 4.1Å; L242-F366 HydrophobicContact CD1-CD2 4.39Å; L242-F366 HydrophobicContact CD1-CE2 3.56Å; L242-F366 HydrophobicContact CD1-CZ 4.12Å; L242-F366 HydrophobicContact CG-CD2 4.34Å; L242-F366 HydrophobicContact CG-CE2 3.73Å; F260-F366 HydrophobicContact CB-CE1 4.05Å; F260-F366 HydrophobicContact CD1-CE1 4.1Å; F260-F366 HydrophobicContact CD1-CZ 4.02Å; F260-F366 HydrophobicContact CD2-CE1 4.35Å; F260-F366 HydrophobicContact CD2-CZ 4.16Å; F260-F366 HydrophobicContact CE1-CZ 4.2Å; F260-F366 HydrophobicContact CE2-CZ 4.34Å; F260-F366 AromaticContact CG-CE1 3.91Å; F260-F366 HydrophobicContact CG-CE1 3.91Å; F260-F366 HydrophobicContact CG-CZ 4.01Å; F260-F366 HydrophobicContact CZ-CZ 4.36Å; V269-F366 HydrophobicContact CG2-CD1 4.03Å; V269-F366 HydrophobicContact CG2-CE1 3.82Å; V364-F366 HydrophobicContact CB-CE2 4.07Å; V364-F366 HydrophobicContact CB-CZ 4.13Å; V364-F366 HydrophobicContact CG1-CE1 4.01Å; V364-F366 HydrophobicContact CG1-CE2 3.78Å; V364-F366 HydrophobicContact CG1-CZ 3.48Å; V364-F366 VanDerWaalsContact CG1-CZ 3.48Å; V364-F366 WeakPolarHBondContact O-CE2 3.15Å; F366-T372 HydrophobicContact CD2-CG2 4.5Å; F366-I375 HydrophobicContact CD1-CD1 3.95Å; F366-I375 HydrophobicContact CE1-CD1 3.37Å; F366-I375 HydrophobicContact CE2-CD1 4.16Å; F366-I375 HydrophobicContact CZ-CD1 3.5Å
367	H	87	Confident	88.7	Confident	71 Å²	71	33.7 Å²	33.7	33%	0.329	18%	0.175	S	C	.	.	S	Bend	trans	-68.1	-40.6	176.1	-172.6	72.4	0	0	0	112.4	R240 T268 L270	R240-H367 WeakPolarHBondContact CD-O 3.44Å; R240-H367 PolarHBondContact NH1-O 3.41Å; T268-H367 PolarHBondContact O-N 2.92Å; T268-H367 WeakPolarHBondContact OG1-CB 3.27Å; L270-H367 HydrophobicContact CD2-CB 4.46Å; L270-H367 HydrophobicContact CG-CB 4.35Å
368	N	86.4	Confident	88.6	Confident	66 Å²	66	31.7 Å²	31.7	35%	0.353	17%	0.167	S	C	.	.			trans	-115.9	133.4	-172.9	-71.3	-30.9	0	0	0	112.5	T370 I371 T372	N368-T370 VanDerWaalsContact C-N 3.27Å; N368-T370 PolarHBondContact O-N 2.81Å; N368-I371 HydrophobicContact CB-CD1 3.94Å; N368-I371 HydrophobicContact CB-CG1 3.91Å; N368-I371 PolarHBondContact O-N 2.79Å; N368-T372 PolarHBondContact O-N 3.39Å; N368-T372 PolarHBondContact O-OG1 3.45Å
369	E	86.4	Confident	88.2	Confident	46 Å²	46	32 Å²	32	22%	0.215	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-36.5	174.3	172.3	179.7	-179.8	0	0	112.6	K239 R240 I371 T372 A373	K239-E369 HydrophobicContact CB-CB 4.47Å; K239-E369 HydrophobicContact CB-CG 3.98Å; K239-E369 WeakPolarHBondContact CD-OE2 3.38Å; K239-E369 IonicContact NZ-OE1 2.82Å; K239-E369 IonicContact NZ-OE2 2.72Å; R240-E369 HydrophobicContact CG-CB 4.37Å; E369-I371 VanDerWaalsContact C-N 3.29Å; E369-I371 PolarHBondContact O-N 2.82Å; E369-T372 VanDerWaalsContact O-CB 3.31Å; E369-T372 WeakPolarHBondContact O-CB 3.46Å; E369-T372 PolarHBondContact O-N 3.23Å; E369-A373 PolarHBondContact O-N 2.79Å
370	T	86.3	Confident	87.6	Confident	90 Å²	90	34.3 Å²	34.3	55%	0.552	18%	0.18	S	C	*	.	H	α-helix	trans	-61.7	-38.8	-177.9	53.1	0	0	0	0	112	N368 A373 I374	N368-T370 VanDerWaalsContact C-N 3.27Å; N368-T370 PolarHBondContact O-N 2.81Å; T370-A373 PolarHBondContact O-N 3.11Å; T370-I374 VanDerWaalsContact O-CG1 3.28Å; T370-I374 WeakPolarHBondContact O-CG1 3.34Å; T370-I374 PolarHBondContact O-N 3.43Å
371	I	87.1	Confident	87	Confident	16 Å²	16	37 Å²	37	8%	0.082	19%	0.194	C	C	.	.	H	α-helix	trans	-68	-43.5	178.7	-57.7	-177	0	0	0	109.7	N266 C267 N368 E369 A373 I374 I375	N266-I371 WeakPolarHBondContact O-CD1 3.22Å; C267-I371 HydrophobicContact CB-CG2 4.11Å; N368-I371 HydrophobicContact CB-CD1 3.94Å; N368-I371 HydrophobicContact CB-CG1 3.91Å; N368-I371 PolarHBondContact O-N 2.79Å; E369-I371 VanDerWaalsContact C-N 3.29Å; E369-I371 PolarHBondContact O-N 2.82Å; I371-A373 VanDerWaalsContact C-N 3.29Å; I371-A373 PolarHBondContact O-N 3.4Å; I371-I374 PolarHBondContact O-N 2.71Å; I371-I374 VanDerWaalsContact O-N 3.09Å; I371-I375 HydrophobicContact CG2-CD1 3.78Å; I371-I375 HydrophobicContact CG2-CG1 4.28Å; I371-I375 VanDerWaalsContact O-CG1 3.31Å; I371-I375 WeakPolarHBondContact O-CG1 3.26Å; I371-I375 PolarHBondContact O-N 2.71Å
372	T	87.4	Confident	85.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-54.8	-45	174.6	-55	0	0	0	0	112	K239 R240 L242 F366 N368 E369 L376 Y411	K239-T372 WeakPolarHBondContact O-CG2 3.3Å; R240-T372 PolarHBondContact O-OG1 3.47Å; L242-T372 HydrophobicContact CD1-CG2 4.15Å; L242-T372 HydrophobicContact CD2-CG2 3.31Å; L242-T372 HydrophobicContact CG-CG2 3.58Å; F366-T372 HydrophobicContact CD2-CG2 4.5Å; N368-T372 PolarHBondContact O-N 3.39Å; N368-T372 PolarHBondContact O-OG1 3.45Å; E369-T372 VanDerWaalsContact O-CB 3.31Å; E369-T372 WeakPolarHBondContact O-CB 3.46Å; E369-T372 PolarHBondContact O-N 3.23Å; T372-L376 VanDerWaalsContact O-CB 3.31Å; T372-L376 WeakPolarHBondContact O-CB 3.06Å; T372-L376 PolarHBondContact O-N 3.13Å; T372-Y411 HydrophobicContact CG2-CD1 4.12Å; T372-Y411 HydrophobicContact CG2-CE1 3.6Å
373	A	87.1	Confident	84	Confident	22 Å²	22	45.4 Å²	45.4	18%	0.182	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-38.6	176.3	0	0	0	0	0	112.9	E369 T370 I371 K377	E369-A373 PolarHBondContact O-N 2.79Å; T370-A373 PolarHBondContact O-N 3.11Å; I371-A373 VanDerWaalsContact C-N 3.29Å; I371-A373 PolarHBondContact O-N 3.4Å; A373-K377 WeakPolarHBondContact O-CB 3.33Å; A373-K377 PolarHBondContact O-N 2.81Å
374	I	87.1	Confident	82	Confident	94 Å²	94	49.1 Å²	49.1	48%	0.482	27%	0.265	S	S	.	.	H	α-helix	trans	-64.2	-48.3	176.3	-69.3	163.4	0	0	0	110.8	Y264 T370 I371 K377 D378	Y264-I374 HydrophobicContact CD1-CG2 4.34Å; Y264-I374 HydrophobicContact CE1-CG2 4.41Å; T370-I374 VanDerWaalsContact O-CG1 3.28Å; T370-I374 WeakPolarHBondContact O-CG1 3.34Å; T370-I374 PolarHBondContact O-N 3.43Å; I371-I374 PolarHBondContact O-N 2.71Å; I371-I374 VanDerWaalsContact O-N 3.09Å; I374-K377 WeakPolarHBondContact O-CB 3.42Å; I374-K377 PolarHBondContact O-N 3.05Å; I374-D378 PolarHBondContact O-N 2.76Å
375	I	88.5	Confident	79.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-59.8	-49.6	178.1	-67	168.8	0	0	0	109.7	L242 F260 Y264 F366 I371 K377 D378 F379	L242-I375 HydrophobicContact CD1-CB 3.99Å; L242-I375 HydrophobicContact CD1-CG2 3.56Å; F260-I375 HydrophobicContact CD1-CD1 3.86Å; F260-I375 HydrophobicContact CD1-CG1 4.5Å; F260-I375 HydrophobicContact CD1-CG2 4.31Å; F260-I375 HydrophobicContact CE1-CD1 4.23Å; F260-I375 HydrophobicContact CE1-CG2 3.67Å; Y264-I375 HydrophobicContact CD1-CG1 3.87Å; Y264-I375 HydrophobicContact CD2-CD1 4.31Å; Y264-I375 HydrophobicContact CD2-CG1 3.94Å; Y264-I375 HydrophobicContact CE1-CB 4.36Å; Y264-I375 HydrophobicContact CE1-CG1 3.73Å; Y264-I375 HydrophobicContact CE2-CD1 4.48Å; Y264-I375 HydrophobicContact CE2-CG1 3.84Å; Y264-I375 HydrophobicContact CE2-CG2 4.42Å; Y264-I375 HydrophobicContact CG-CG1 3.97Å; F366-I375 HydrophobicContact CD1-CD1 3.95Å; F366-I375 HydrophobicContact CE1-CD1 3.37Å; F366-I375 HydrophobicContact CE2-CD1 4.16Å; F366-I375 HydrophobicContact CZ-CD1 3.5Å; I371-I375 HydrophobicContact CG2-CD1 3.78Å; I371-I375 HydrophobicContact CG2-CG1 4.28Å; I371-I375 VanDerWaalsContact O-CG1 3.31Å; I371-I375 WeakPolarHBondContact O-CG1 3.26Å; I371-I375 PolarHBondContact O-N 2.71Å; I375-K377 PolarHBondContact O-N 3.12Å; I375-D378 PolarHBondContact O-N 2.92Å; I375-D378 VanDerWaalsContact O-N 3.12Å; I375-F379 HydrophobicContact CG2-CD2 3.84Å; I375-F379 HydrophobicContact CG2-CE2 3.95Å; I375-F379 WeakPolarHBondContact O-CD2 3.44Å; I375-F379 PolarHBondContact O-N 3.38Å
376	L	87.1	Confident	78.1	Confident	7 Å²	7	59.7 Å²	59.7	4%	0.037	33%	0.334	C	S	.	.	H	α-helix	trans	-60.1	-37.3	179.4	-176.6	66.3	0	0	0	111.9	L242 T372 N380 V409 Y411 Y741	L242-L376 HydrophobicContact CD2-CB 4.45Å; T372-L376 VanDerWaalsContact O-CB 3.31Å; T372-L376 WeakPolarHBondContact O-CB 3.06Å; T372-L376 PolarHBondContact O-N 3.13Å; L376-N380 VanDerWaalsContact CD1-ND2 3.33Å; L376-N380 WeakPolarHBondContact CD1-ND2 3.06Å; L376-N380 WeakPolarHBondContact O-CB 3Å; L376-N380 PolarHBondContact O-N 3.39Å; L376-N380 PolarHBondContact O-ND2 3.48Å; L376-V409 HydrophobicContact CD1-CB 4.42Å; L376-V409 HydrophobicContact CD1-CG1 4.04Å; L376-V409 VanDerWaalsContact CD1-O 3.27Å; L376-V409 WeakPolarHBondContact CD1-O 3.43Å; L376-Y411 HydrophobicContact CD2-CD2 3.43Å; L376-Y411 VanDerWaalsContact CD2-CD2 3.43Å; L376-Y411 HydrophobicContact CD2-CE1 4.49Å; L376-Y411 HydrophobicContact CD2-CE2 3.07Å; L376-Y411 HydrophobicContact CD2-CG 4.27Å; L376-Y741 WeakPolarHBondContact CD2-OH 3.04Å
377	K	84.3	Confident	76.2	Confident	131 Å²	131	66.5 Å²	66.5	57%	0.57	38%	0.38	S	S	*	.	H	α-helix	trans	-66	-45.7	175.1	-172.6	178.8	179.2	-178.7	0	111.1	A373 I374 I375 F379 N380 V381	A373-K377 WeakPolarHBondContact O-CB 3.33Å; A373-K377 PolarHBondContact O-N 2.81Å; I374-K377 WeakPolarHBondContact O-CB 3.42Å; I374-K377 PolarHBondContact O-N 3.05Å; I375-K377 PolarHBondContact O-N 3.12Å; K377-F379 PolarHBondContact O-N 3.2Å; K377-N380 PolarHBondContact O-N 3.49Å; K377-V381 HydrophobicContact CG-CG2 4.27Å; K377-V381 WeakPolarHBondContact O-CG2 3.43Å; K377-V381 PolarHBondContact O-N 3.32Å
378	D	85.6	Confident	74.1	Confident	30 Å²	30	68.2 Å²	68.2	16%	0.16	40%	0.395	C	S	.	.	H	α-helix	trans	-58.7	-47.9	-179.7	-167.7	58.2	0	0	0	112	Y264 I374 I375 N380 V381 P393 R394	Y264-D378 HydrophobicContact CE1-CB 4.21Å; Y264-D378 WeakPolarHBondContact OH-CB 3.45Å; Y264-D378 PolarHBondContact OH-OD2 3.4Å; I374-D378 PolarHBondContact O-N 2.76Å; I375-D378 PolarHBondContact O-N 2.92Å; I375-D378 VanDerWaalsContact O-N 3.12Å; D378-N380 VanDerWaalsContact C-N 3.3Å; D378-N380 PolarHBondContact O-N 2.76Å; D378-V381 PolarHBondContact O-N 3.23Å; D378-P393 VanDerWaalsContact OD2-CA 3.26Å; D378-P393 WeakPolarHBondContact OD2-CA 3.44Å; D378-P393 WeakPolarHBondContact OD2-CB 3.48Å; D378-R394 PolarHBondContact OD2-N 3.43Å
379	F	82.8	Confident	72.6	Confident	26 Å²	26	68.8 Å²	68.8	11%	0.114	40%	0.403	C	S	.	.	H	α-helix	trans	-67.8	-25.6	178.7	-84.4	-91.8	0	0	0	114.1	F260 Y264 I375 K377 P393 I404 W407 V409	F260-F379 HydrophobicContact CE1-CE2 4.15Å; Y264-F379 WeakPolarHBondContact OH-CE2 3.21Å; I375-F379 HydrophobicContact CG2-CD2 3.84Å; I375-F379 HydrophobicContact CG2-CE2 3.95Å; I375-F379 WeakPolarHBondContact O-CD2 3.44Å; I375-F379 PolarHBondContact O-N 3.38Å; K377-F379 PolarHBondContact O-N 3.2Å; F379-P393 HydrophobicContact CD1-CB 4.06Å; F379-P393 HydrophobicContact CD1-CG 4.13Å; F379-P393 HydrophobicContact CD2-CB 4.27Å; F379-P393 HydrophobicContact CE1-CB 3.95Å; F379-P393 HydrophobicContact CE1-CG 3.82Å; F379-P393 HydrophobicContact CE2-CB 4.17Å; F379-P393 HydrophobicContact CG-CB 4.23Å; F379-P393 HydrophobicContact CZ-CB 4.01Å; F379-P393 HydrophobicContact CZ-CG 4.21Å; F379-I404 HydrophobicContact CE1-CG2 3.57Å; F379-I404 HydrophobicContact CZ-CG2 3.68Å; F379-W407 HydrophobicContact CD1-CB 4.45Å; F379-W407 HydrophobicContact CE1-CB 4Å; F379-W407 HydrophobicContact CE1-CE3 4.07Å; F379-W407 HydrophobicContact CZ-CE3 4.01Å; F379-V409 HydrophobicContact CB-CB 4.05Å; F379-V409 HydrophobicContact CB-CG2 3.98Å; F379-V409 HydrophobicContact CD1-CG2 3.56Å; F379-V409 HydrophobicContact CD2-CG2 4.03Å; F379-V409 HydrophobicContact CE1-CG2 3.98Å; F379-V409 HydrophobicContact CE2-CG2 4.41Å; F379-V409 HydrophobicContact CG-CB 4.18Å; F379-V409 HydrophobicContact CG-CG2 3.58Å; F379-V409 HydrophobicContact CZ-CG2 4.39Å
380	N	77.4	Confident	71.3	Confident	90 Å²	90	73.6 Å²	73.6	48%	0.481	42%	0.419	S	S	.	.	H	α-helix	trans	-91.6	-10.7	177.8	-74.6	-50.7	0	0	0	113.7	L376 K377 D378 C382	L376-N380 VanDerWaalsContact CD1-ND2 3.33Å; L376-N380 WeakPolarHBondContact CD1-ND2 3.06Å; L376-N380 WeakPolarHBondContact O-CB 3Å; L376-N380 PolarHBondContact O-N 3.39Å; L376-N380 PolarHBondContact O-ND2 3.48Å; K377-N380 PolarHBondContact O-N 3.49Å; D378-N380 VanDerWaalsContact C-N 3.3Å; D378-N380 PolarHBondContact O-N 2.76Å; N380-C382 PolarHBondContact O-N 2.85Å; N380-C382 VanDerWaalsContact O-N 3.15Å
381	V	74.5	Confident	70.2	Confident	64 Å²	64	70.5 Å²	70.5	39%	0.388	41%	0.405	S	S	.	.			trans	-72.3	109.8	177.4	166.7	0	0	0	0	109	K377 D378 K383	K377-V381 HydrophobicContact CG-CG2 4.27Å; K377-V381 WeakPolarHBondContact O-CG2 3.43Å; K377-V381 PolarHBondContact O-N 3.32Å; D378-V381 PolarHBondContact O-N 3.23Å; V381-K383 HydrophobicContact CG1-CG 4.24Å; V381-K383 PolarHBondContact O-N 3.03Å
382	C	65.6	Low	69.3	Low	80 Å²	80	75.7 Å²	75.7	54%	0.541	43%	0.429	S	S	.	.			trans	-81.5	111.5	172.9	-154.9	0	0	0	0	109.1	N380	N380-C382 PolarHBondContact O-N 2.85Å; N380-C382 VanDerWaalsContact O-N 3.15Å
383	K	55.5	Low	68.9	Low	106 Å²	106	76.7 Å²	76.7	46%	0.461	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	116.6	170.6	-67.3	176.4	-174.7	155.6	0	107.6	V381 R390 E392	V381-K383 HydrophobicContact CG1-CG 4.24Å; V381-K383 PolarHBondContact O-N 3.03Å; K383-R390 PolarHBondContact N-O 2.88Å; K383-R390 PolarHBondContact O-N 2.97Å; K383-E392 PolarHBondContact NZ-O 3.44Å; K383-E392 VanDerWaalsContact NZ-O 3.07Å
384	C	51.2	Low	68.7	Low	79 Å²	79	81 Å²	81	53%	0.534	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	115.6	172.1	-61.4	0	0	0	0	108.7	C389	C384-C389 HydrophobicContact CB-CB 4.17Å; C384-C389 WeakPolarHBondContact CB-SG 3.12Å; C384-C389 WeakPolarHBondContact SG-CB 3.33Å; C384-C389 CovalentContact SG-SG 2.06Å; C384-C389 PolarHBondContact SG-SG 2.93Å
385	Q	42.9	Very low	68.5	Low	161 Å²	161	81.7 Å²	81.7	75%	0.752	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	108	165.5	-77.6	-177.6	-10.6	0	0	107.1	T388	Q385-T388 PolarHBondContact N-O 2.82Å; Q385-T388 PolarHBondContact O-OG1 3.27Å; Q385-T388 VanDerWaalsContact O-OG1 3.07Å
386	G	59.5	Low	68.5	Low	75 Å²	75	82.8 Å²	82.8	77%	0.773	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	-141.1	-176	0	0	0	0	0	113.4	T388	G386-T388 PolarHBondContact O-N 3.5Å
387	C	50	Low	68.4	Low	143 Å²	143	86.4 Å²	86.4	97%	0.966	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-0.6	177.3	-63	0	0	0	0	114.1
388	T	43.7	Very low	68.5	Low	107 Å²	107	80.8 Å²	80.8	66%	0.656	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	114.7	-179.8	45.9	0	0	0	0	110.4	Q385 G386	Q385-T388 PolarHBondContact N-O 2.82Å; Q385-T388 PolarHBondContact O-OG1 3.27Å; Q385-T388 VanDerWaalsContact O-OG1 3.07Å; G386-T388 PolarHBondContact O-N 3.5Å
389	C	55.3	Low	68.4	Low	77 Å²	77	80.4 Å²	80.4	52%	0.52	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	113.6	172.5	-66.3	0	0	0	0	108.8	C384	C384-C389 HydrophobicContact CB-CB 4.17Å; C384-C389 WeakPolarHBondContact CB-SG 3.12Å; C384-C389 WeakPolarHBondContact SG-CB 3.33Å; C384-C389 CovalentContact SG-SG 2.06Å; C384-C389 PolarHBondContact SG-SG 2.93Å
390	R	58.1	Low	68.4	Low	147 Å²	147	87.4 Å²	87.4	56%	0.555	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.3	134	177	-153.7	174.7	-175.4	-178.5	0.5	109.6	K383 E392	K383-R390 PolarHBondContact N-O 2.88Å; K383-R390 PolarHBondContact O-N 2.97Å; R390-E392 PolarHBondContact O-N 3.43Å
391	G	62.7	Low	68.6	Low	25 Å²	25	86.3 Å²	86.3	26%	0.258	50%	0.5	S	S	.	.			trans	-72.2	115.8	170.2	0	0	0	0	0	109	P393	G391-P393 VanDerWaalsContact O-CD 3.32Å; G391-P393 WeakPolarHBondContact O-CD 3.38Å
392	E	69.3	Low	69.1	Low	125 Å²	125	83.4 Å²	83.4	58%	0.584	48%	0.483	S	S	*	.			trans	-106.8	95.3	168.8	-74.2	-171.4	170.5	0	0	108.6	K383 R390	K383-E392 PolarHBondContact NZ-O 3.44Å; K383-E392 VanDerWaalsContact NZ-O 3.07Å; R390-E392 PolarHBondContact O-N 3.43Å
393	P	78.4	Confident	70	Confident	21 Å²	21	84.6 Å²	84.6	14%	0.136	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-71.1	168.1	175.6	30.9	-34	0	0	0	110.6	D378 F379 G391 I404	D378-P393 VanDerWaalsContact OD2-CA 3.26Å; D378-P393 WeakPolarHBondContact OD2-CA 3.44Å; D378-P393 WeakPolarHBondContact OD2-CB 3.48Å; F379-P393 HydrophobicContact CD1-CB 4.06Å; F379-P393 HydrophobicContact CD1-CG 4.13Å; F379-P393 HydrophobicContact CD2-CB 4.27Å; F379-P393 HydrophobicContact CE1-CB 3.95Å; F379-P393 HydrophobicContact CE1-CG 3.82Å; F379-P393 HydrophobicContact CE2-CB 4.17Å; F379-P393 HydrophobicContact CG-CB 4.23Å; F379-P393 HydrophobicContact CZ-CB 4.01Å; F379-P393 HydrophobicContact CZ-CG 4.21Å; G391-P393 VanDerWaalsContact O-CD 3.32Å; G391-P393 WeakPolarHBondContact O-CD 3.38Å; P393-I404 HydrophobicContact CG-CG2 3.69Å
394	R	82.8	Confident	71.4	Confident	114 Å²	114	80 Å²	80	43%	0.43	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-57.2	128.2	-179.9	-70.2	-172.9	179	-161.9	-1.9	112.1	A263 D378	A263-R394 HydrophobicContact CB-CB 4.06Å; A263-R394 WeakPolarHBondContact O-CD 3.46Å; D378-R394 PolarHBondContact OD2-N 3.43Å
395	P	83	Confident	72.8	Confident	107 Å²	107	79.2 Å²	79.2	70%	0.695	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-77.9	162.1	178.8	32.7	-35.1	0	0	0	112.1
396	S	88.3	Confident	74.8	Confident	24 Å²	24	76.1 Å²	76.1	17%	0.168	45%	0.445	C	S	.	.			trans	-148.2	173	176.2	69.6	0	0	0	0	109.2	H259 C398 S399	H259-S396 VanDerWaalsContact ND1-CB 3.33Å; H259-S396 WeakPolarHBondContact ND1-CB 3.48Å; H259-S396 PolarHBondContact ND1-OG 3.45Å; S396-C398 PolarHBondContact O-N 3.21Å; S396-C398 VanDerWaalsContact O-N 3.17Å; S396-C398 PolarHBondContact OG-N 2.84Å; S396-S399 PolarHBondContact N-OG 2.99Å; S396-S399 WeakPolarHBondContact O-CB 3.42Å; S396-S399 PolarHBondContact O-N 3.12Å; S396-S399 VanDerWaalsContact O-N 3.16Å; S396-S399 PolarHBondContact O-OG 3.44Å; S396-S399 PolarHBondContact OG-N 3.37Å; S396-S399 PolarHBondContact OG-OG 2.94Å
397	S	86.4	Confident	76.2	Confident	83 Å²	83	73.4 Å²	73.4	58%	0.58	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-27.8	175	66.1	0	0	0	0	113.4	E262	E262-S397 VanDerWaalsContact CD-OG 3.24Å; E262-S397 PolarHBondContact OE1-OG 3.33Å; E262-S397 VanDerWaalsContact OE1-OG 3.1Å; E262-S397 VanDerWaalsContact OE2-CB 3.25Å; E262-S397 WeakPolarHBondContact OE2-CB 3.39Å; E262-S397 PolarHBondContact OE2-N 2.9Å; E262-S397 PolarHBondContact OE2-OG 3.45Å
398	C	84.8	Confident	77.9	Confident	12 Å²	12	70.4 Å²	70.4	8%	0.081	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-0.8	-176.4	-62.7	0	0	0	0	113.4	H259 S396 E400 S401 L402	H259-C398 HydrophobicContact CB-CB 4.43Å; S396-C398 PolarHBondContact O-N 3.21Å; S396-C398 VanDerWaalsContact O-N 3.17Å; S396-C398 PolarHBondContact OG-N 2.84Å; C398-E400 PolarHBondContact O-N 2.98Å; C398-S401 PolarHBondContact O-N 2.7Å; C398-S401 PolarHBondContact O-OG 2.98Å; C398-L402 HydrophobicContact CB-CD1 3.88Å; C398-L402 HydrophobicContact CB-CG 4.46Å; C398-L402 WeakPolarHBondContact O-CB 3.39Å; C398-L402 WeakPolarHBondContact O-CG 3.48Å; C398-L402 PolarHBondContact O-N 3.24Å; C398-L402 VanDerWaalsContact O-N 3.1Å
399	S	83.9	Confident	80.1	Confident	22 Å²	22	65.8 Å²	65.8	15%	0.154	36%	0.36	C	S	.	.	H	α-helix	trans	-64.8	-37.6	-168.3	-68.7	0	0	0	0	115	S396 H403 I404	S396-S399 PolarHBondContact N-OG 2.99Å; S396-S399 WeakPolarHBondContact O-CB 3.42Å; S396-S399 PolarHBondContact O-N 3.12Å; S396-S399 VanDerWaalsContact O-N 3.16Å; S396-S399 PolarHBondContact O-OG 3.44Å; S396-S399 PolarHBondContact OG-N 3.37Å; S396-S399 PolarHBondContact OG-OG 2.94Å; S399-H403 PolarHBondContact O-N 3.46Å; S399-I404 PolarHBondContact O-N 3.49Å; S399-I404 WeakPolarHBondContact OG-CD1 3.43Å
400	E	82.2	Confident	81.7	Confident	173 Å²	173	64.5 Å²	64.5	81%	0.808	35%	0.352	S	S	*	.	H	α-helix	trans	-69.9	-45.5	177.9	-170.6	172.1	-168.3	0	0	111	C398 L402 H403	C398-E400 PolarHBondContact O-N 2.98Å; E400-L402 VanDerWaalsContact C-N 3.28Å; E400-L402 PolarHBondContact O-N 2.9Å; E400-H403 PolarHBondContact O-N 3.34Å; E400-H403 PolarHBondContact O-ND1 3.08Å
401	S	83.3	Confident	83.1	Confident	67 Å²	67	60.5 Å²	60.5	47%	0.469	34%	0.337	S	S	.	.	H	α-helix	trans	-63.8	-30.4	-179.9	73	0	0	0	0	114	C398	C398-S401 PolarHBondContact O-N 2.7Å; C398-S401 PolarHBondContact O-OG 2.98Å
402	L	83.7	Confident	84.3	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.016	33%	0.326	C	S	.	.	H	α-helix	trans	-92.9	-7.8	-176.5	-74.3	174.3	0	0	0	113.4	A251 K255 I256 H259 C398 E400 I404 W407	A251-L402 HydrophobicContact CB-CD2 3.6Å; K255-L402 HydrophobicContact CB-CD2 4.46Å; I256-L402 HydrophobicContact CG1-CD2 4.23Å; H259-L402 HydrophobicContact CB-CD1 3.92Å; C398-L402 HydrophobicContact CB-CD1 3.88Å; C398-L402 HydrophobicContact CB-CG 4.46Å; C398-L402 WeakPolarHBondContact O-CB 3.39Å; C398-L402 WeakPolarHBondContact O-CG 3.48Å; C398-L402 PolarHBondContact O-N 3.24Å; C398-L402 VanDerWaalsContact O-N 3.1Å; E400-L402 VanDerWaalsContact C-N 3.28Å; E400-L402 PolarHBondContact O-N 2.9Å; L402-I404 HydrophobicContact CB-CD1 4.36Å; L402-I404 HydrophobicContact CB-CG1 3.82Å; L402-I404 PolarHBondContact O-N 3.17Å; L402-W407 HydrophobicContact CB-CH2 4.44Å; L402-W407 HydrophobicContact CB-CZ2 3.73Å; L402-W407 HydrophobicContact CD1-CH2 4.06Å; L402-W407 HydrophobicContact CD1-CZ2 4.11Å; L402-W407 HydrophobicContact CD2-CZ2 4.23Å; L402-W407 HydrophobicContact CG-CZ2 4.24Å; L402-W407 PolarHBondContact O-NE1 3.3Å
403	H	84.5	Confident	85.2	Confident	106 Å²	106	54.7 Å²	54.7	49%	0.491	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	52.4	-174.9	-62.3	-59.6	0	0	0	113.3	S399 E400 S405 N406	S399-H403 PolarHBondContact O-N 3.46Å; E400-H403 PolarHBondContact O-N 3.34Å; E400-H403 PolarHBondContact O-ND1 3.08Å; H403-S405 PolarHBondContact O-N 3.18Å; H403-S405 VanDerWaalsContact O-N 3.1Å; H403-N406 PolarHBondContact O-N 2.77Å
404	I	85	Confident	85.5	Confident	8 Å²	8	54.6 Å²	54.6	4%	0.041	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-60.2	-27.6	-170.5	-58.8	-168.2	0	0	0	113.4	H259 F379 P393 S399 L402 N406 W407	H259-I404 WeakPolarHBondContact CE1-CD1 3.46Å; H259-I404 VanDerWaalsContact CG-CD1 3.5Å; H259-I404 WeakPolarHBondContact ND1-CD1 3.48Å; H259-I404 WeakPolarHBondContact NE2-CD1 3.23Å; F379-I404 HydrophobicContact CE1-CG2 3.57Å; F379-I404 HydrophobicContact CZ-CG2 3.68Å; P393-I404 HydrophobicContact CG-CG2 3.69Å; S399-I404 PolarHBondContact O-N 3.49Å; S399-I404 WeakPolarHBondContact OG-CD1 3.43Å; L402-I404 HydrophobicContact CB-CD1 4.36Å; L402-I404 HydrophobicContact CB-CG1 3.82Å; L402-I404 PolarHBondContact O-N 3.17Å; I404-N406 PolarHBondContact O-N 3.16Å; I404-N406 VanDerWaalsContact O-N 3.12Å; I404-W407 HydrophobicContact CG1-CD2 4.43Å; I404-W407 HydrophobicContact CG1-CH2 4.48Å; I404-W407 HydrophobicContact CG1-CZ2 4.25Å; I404-W407 HydrophobicContact CG2-CD2 4.32Å; I404-W407 HydrophobicContact CG2-CE3 4.26Å; I404-W407 VanDerWaalsContact O-CB 3.32Å; I404-W407 WeakPolarHBondContact O-CB 3.46Å; I404-W407 PolarHBondContact O-N 3.3Å
405	S	80.8	Confident	85.6	Confident	63 Å²	63	50 Å²	50	44%	0.441	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-63.7	-15.5	176.7	57.9	0	0	0	0	114.3	H403	H403-S405 PolarHBondContact O-N 3.18Å; H403-S405 VanDerWaalsContact O-N 3.1Å
406	N	84.7	Confident	85.6	Confident	97 Å²	97	50.2 Å²	50.2	52%	0.519	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-96.8	-1.9	176.2	-65.1	-18	0	0	0	112.9	H403 I404	H403-N406 PolarHBondContact O-N 2.77Å; I404-N406 PolarHBondContact O-N 3.16Å; I404-N406 VanDerWaalsContact O-N 3.12Å
407	W	88.9	Confident	85.5	Confident	17 Å²	17	49.3 Å²	49.3	6%	0.064	28%	0.275	C	S	.	.			trans	-75.6	138.5	-175.6	-69.1	14.1	0	0	0	111.3	I244 N245 G246 I247 I256 H259 F260 F379 L402 I404	I244-W407 HydrophobicContact CD1-CE3 4.44Å; I244-W407 HydrophobicContact CD1-CZ3 4.19Å; I244-W407 HydrophobicContact CG2-CB 4.23Å; I244-W407 HydrophobicContact CG2-CD2 3.8Å; I244-W407 HydrophobicContact CG2-CE3 3.63Å; I244-W407 HydrophobicContact CG2-CG 4.1Å; I244-W407 HydrophobicContact CG2-CZ3 4.21Å; N245-W407 CarbonylContact O-C 3.49Å; N245-W407 WeakPolarHBondContact O-CA 3.39Å; G246-W407 VanDerWaalsContact O-CD1 3.25Å; I247-W407 HydrophobicContact CB-CZ2 4.47Å; I247-W407 HydrophobicContact CG1-CD2 4.31Å; I247-W407 HydrophobicContact CG1-CZ2 3.89Å; I247-W407 HydrophobicContact CG2-CZ2 4.16Å; I256-W407 HydrophobicContact CG2-CH2 4.4Å; H259-W407 AromaticContact CD2-CZ3 3.98Å; F260-W407 HydrophobicContact CE2-CZ3 4.07Å; F260-W407 AromaticContact CZ-CZ3 3.91Å; F260-W407 HydrophobicContact CZ-CZ3 3.91Å; F379-W407 HydrophobicContact CD1-CB 4.45Å; F379-W407 HydrophobicContact CE1-CB 4Å; F379-W407 HydrophobicContact CE1-CE3 4.07Å; F379-W407 HydrophobicContact CZ-CE3 4.01Å; L402-W407 HydrophobicContact CB-CH2 4.44Å; L402-W407 HydrophobicContact CB-CZ2 3.73Å; L402-W407 HydrophobicContact CD1-CH2 4.06Å; L402-W407 HydrophobicContact CD1-CZ2 4.11Å; L402-W407 HydrophobicContact CD2-CZ2 4.23Å; L402-W407 HydrophobicContact CG-CZ2 4.24Å; L402-W407 PolarHBondContact O-NE1 3.3Å; I404-W407 HydrophobicContact CG1-CD2 4.43Å; I404-W407 HydrophobicContact CG1-CH2 4.48Å; I404-W407 HydrophobicContact CG1-CZ2 4.25Å; I404-W407 HydrophobicContact CG2-CD2 4.32Å; I404-W407 HydrophobicContact CG2-CE3 4.26Å; I404-W407 VanDerWaalsContact O-CB 3.32Å; I404-W407 WeakPolarHBondContact O-CB 3.46Å; I404-W407 PolarHBondContact O-N 3.3Å
408	T	86.8	Confident	85.6	Confident	80 Å²	80	45.9 Å²	45.9	49%	0.491	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.4	170.2	48.9	0	0	0	0	107.8	N245	N245-T408 WeakPolarHBondContact CB-OG1 3.4Å; N245-T408 PolarHBondContact N-O 2.93Å; N245-T408 PolarHBondContact ND2-OG1 3.46Å; N245-T408 PolarHBondContact O-N 2.85Å; N245-T408 PolarHBondContact O-OG1 3.2Å
409	V	88.8	Confident	85.8	Confident	11 Å²	11	48 Å²	48	7%	0.067	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.4	-172.7	-176.3	0	0	0	0	109.5	L242 I244 L376 F379	L242-V409 HydrophobicContact CB-CG1 4.16Å; L242-V409 HydrophobicContact CD1-CG1 3.77Å; L242-V409 HydrophobicContact CD2-CG1 4.23Å; L242-V409 HydrophobicContact CG-CG1 4.26Å; I244-V409 HydrophobicContact CG1-CG2 4.36Å; I244-V409 HydrophobicContact CG2-CG2 4.35Å; L376-V409 HydrophobicContact CD1-CB 4.42Å; L376-V409 HydrophobicContact CD1-CG1 4.04Å; L376-V409 VanDerWaalsContact CD1-O 3.27Å; L376-V409 WeakPolarHBondContact CD1-O 3.43Å; F379-V409 HydrophobicContact CB-CB 4.05Å; F379-V409 HydrophobicContact CB-CG2 3.98Å; F379-V409 HydrophobicContact CD1-CG2 3.56Å; F379-V409 HydrophobicContact CD2-CG2 4.03Å; F379-V409 HydrophobicContact CE1-CG2 3.98Å; F379-V409 HydrophobicContact CE2-CG2 4.41Å; F379-V409 HydrophobicContact CG-CB 4.18Å; F379-V409 HydrophobicContact CG-CG2 3.58Å; F379-V409 HydrophobicContact CZ-CG2 4.39Å
410	S	88.8	Confident	86.1	Confident	50 Å²	50	48.8 Å²	48.8	35%	0.35	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	159.4	177.7	56.6	0	0	0	0	110.1	L242 F243 A412	L242-S410 WeakPolarHBondContact CA-O 3.26Å; F243-S410 PolarHBondContact N-O 2.89Å; F243-S410 PolarHBondContact O-N 3.31Å; F243-S410 PolarHBondContact O-OG 3.43Å; S410-A412 PolarHBondContact O-N 3.4Å
411	Y	87.6	Confident	86.3	Confident	62 Å²	62	45.3 Å²	45.3	24%	0.243	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	139.5	168.6	-75.4	-73	0	0	0	110.5	L242 T372 L376 Y741	L242-Y411 HydrophobicContact CD2-CD1 4.2Å; L242-Y411 HydrophobicContact CD2-CE1 4.47Å; T372-Y411 HydrophobicContact CG2-CD1 4.12Å; T372-Y411 HydrophobicContact CG2-CE1 3.6Å; L376-Y411 HydrophobicContact CD2-CD2 3.43Å; L376-Y411 VanDerWaalsContact CD2-CD2 3.43Å; L376-Y411 HydrophobicContact CD2-CE1 4.49Å; L376-Y411 HydrophobicContact CD2-CE2 3.07Å; L376-Y411 HydrophobicContact CD2-CG 4.27Å; Y411-Y741 AromaticContact CE2-CE1 3.96Å; Y411-Y741 HydrophobicContact CE2-CE1 3.96Å
412	A	88.7	Confident	86.6	Confident	3 Å²	3	44 Å²	44	3%	0.025	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-68.5	140.2	175.4	0	0	0	0	0	110.3	V238 T241 F243 F363 S410 Y771	V238-A412 WeakPolarHBondContact CG1-O 3.16Å; T241-A412 HydrophobicContact CG2-CB 3.71Å; T241-A412 WeakPolarHBondContact O-CB 3.21Å; T241-A412 PolarHBondContact O-N 3.42Å; F243-A412 HydrophobicContact CB-CB 4.23Å; F363-A412 HydrophobicContact CD1-CB 3.79Å; F363-A412 HydrophobicContact CE1-CB 3.97Å; S410-A412 PolarHBondContact O-N 3.4Å; A412-Y771 HydrophobicContact CB-CE1 3.76Å; A412-Y771 HydrophobicContact CB-CE2 4.42Å; A412-Y771 WeakPolarHBondContact CB-OH 3.35Å
413	P	87.8	Confident	86.9	Confident	25 Å²	25	44 Å²	44	16%	0.162	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-67.6	165.2	166.8	30.4	-34.5	0	0	0	110.2	I418 W505 T506 Y771	P413-I418 HydrophobicContact CB-CG1 4.48Å; P413-I418 HydrophobicContact CG-CD1 3.98Å; P413-I418 HydrophobicContact CG-CG1 3.66Å; P413-W505 HydrophobicContact CG-CH2 3.95Å; P413-W505 HydrophobicContact CG-CZ3 3.84Å; P413-T506 HydrophobicContact CB-CG2 4.42Å; P413-T506 HydrophobicContact CG-CG2 4.18Å; P413-Y771 WeakPolarHBondContact O-CE1 3.32Å; P413-Y771 VanDerWaalsContact O-CZ 3.32Å; P413-Y771 PolarHBondContact O-OH 3.04Å
414	D	85.7	Confident	87	Confident	19 Å²	19	40.8 Å²	40.8	10%	0.102	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-56.6	139.9	170.8	-173	-81.8	0	0	0	111.3	V238 Q416 N417 K671	V238-D414 HydrophobicContact CG2-CB 4.18Å; D414-Q416 PolarHBondContact O-N 3.19Å; D414-Q416 VanDerWaalsContact OD1-CB 3.31Å; D414-Q416 WeakPolarHBondContact OD1-CB 3.42Å; D414-Q416 PolarHBondContact OD1-N 3.18Å; D414-N417 HydrophobicContact CB-CB 4.17Å; D414-N417 WeakPolarHBondContact O-CA 3.17Å; D414-N417 VanDerWaalsContact O-CB 3.27Å; D414-N417 WeakPolarHBondContact O-CB 3.28Å; D414-N417 PolarHBondContact O-N 2.89Å; D414-K671 HydrophobicContact CB-CD 4.36Å; D414-K671 WeakPolarHBondContact OD2-CD 3.49Å; D414-K671 WeakPolarHBondContact OD2-CE 3.3Å; D414-K671 IonicContact OD2-NZ 2.6Å; D414-K671 PolarHBondContact OD2-NZ 3.23Å
415	P	84.8	Confident	87	Confident	19 Å²	19	42.7 Å²	42.7	12%	0.123	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-54.3	-33	179.3	-26.8	34.4	0	0	0	114.7	L237 N417 I418 Y771	L237-P415 HydrophobicContact CD2-CG 4.23Å; P415-N417 VanDerWaalsContact C-N 3.28Å; P415-N417 PolarHBondContact O-N 3.41Å; P415-I418 PolarHBondContact O-N 3.34Å; P415-Y771 HydrophobicContact CG-CD1 4.06Å; P415-Y771 HydrophobicContact CG-CD2 4.35Å; P415-Y771 HydrophobicContact CG-CE1 3.78Å; P415-Y771 HydrophobicContact CG-CE2 4.1Å; P415-Y771 HydrophobicContact CG-CG 4.34Å
416	Q	82.1	Confident	86.7	Confident	110 Å²	110	43.6 Å²	43.6	51%	0.514	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-74.5	-18.1	176.8	-61.5	-178	-13.7	0	0	112.9	D414 I418	D414-Q416 PolarHBondContact O-N 3.19Å; D414-Q416 VanDerWaalsContact OD1-CB 3.31Å; D414-Q416 WeakPolarHBondContact OD1-CB 3.42Å; D414-Q416 PolarHBondContact OD1-N 3.18Å; Q416-I418 VanDerWaalsContact C-N 3.34Å
417	N	86.5	Confident	86.7	Confident	6 Å²	6	41.5 Å²	41.5	3%	0.032	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-85.6	-6.6	178.4	-173.1	29.7	0	0	0	112.5	D414 P415 T506 R507 S508	D414-N417 HydrophobicContact CB-CB 4.17Å; D414-N417 WeakPolarHBondContact O-CA 3.17Å; D414-N417 VanDerWaalsContact O-CB 3.27Å; D414-N417 WeakPolarHBondContact O-CB 3.28Å; D414-N417 PolarHBondContact O-N 2.89Å; P415-N417 VanDerWaalsContact C-N 3.28Å; P415-N417 PolarHBondContact O-N 3.41Å; N417-T506 CarbonylContact O-C 3.58Å; N417-T506 VanDerWaalsContact O-CA 3.3Å; N417-T506 WeakPolarHBondContact O-CA 3.36Å; N417-R507 PolarHBondContact O-N 3.46Å; N417-R507 WeakPolarHBondContact OD1-CB 3.43Å; N417-R507 PolarHBondContact OD1-N 3.47Å; N417-S508 PolarHBondContact ND2-OG 3.38Å; N417-S508 WeakPolarHBondContact OD1-CB 3Å; N417-S508 PolarHBondContact OD1-N 3.11Å; N417-S508 PolarHBondContact OD1-OG 3.04Å
418	I	89	Confident	86.5	Confident	10 Å²	10	47.8 Å²	47.8	5%	0.051	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-92.4	125.8	-177.3	-59.7	169.9	0	0	0	110.5	F363 P413 P415 Q416 W420 W505 Y771	F363-I418 HydrophobicContact CE1-CD1 4.01Å; F363-I418 HydrophobicContact CE2-CD1 4.34Å; F363-I418 HydrophobicContact CZ-CD1 3.61Å; P413-I418 HydrophobicContact CB-CG1 4.48Å; P413-I418 HydrophobicContact CG-CD1 3.98Å; P413-I418 HydrophobicContact CG-CG1 3.66Å; P415-I418 PolarHBondContact O-N 3.34Å; Q416-I418 VanDerWaalsContact C-N 3.34Å; I418-W420 HydrophobicContact CB-CZ2 4.45Å; I418-W420 HydrophobicContact CD1-CH2 4.3Å; I418-W420 HydrophobicContact CD1-CZ2 4.08Å; I418-W420 HydrophobicContact CG2-CD2 3.93Å; I418-W420 HydrophobicContact CG2-CE3 4.28Å; I418-W420 HydrophobicContact CG2-CG 4.26Å; I418-W420 HydrophobicContact CG2-CZ2 4.32Å; I418-W420 PolarHBondContact O-N 3.43Å; I418-W505 HydrophobicContact CG1-CZ3 4.5Å; I418-W505 HydrophobicContact CG2-CE3 4.46Å; I418-Y771 HydrophobicContact CD1-CD1 4Å; I418-Y771 HydrophobicContact CD1-CE1 3.99Å
419	Y	88.8	Confident	86.6	Confident	57 Å²	57	50 Å²	50	22%	0.224	26%	0.256	C	S	.	.			trans	-87	93.6	164.2	-69.9	-59.3	0	0	0	110	E421 H422 L423 H504 W505 R507 E510	Y419-E421 PolarHBondContact O-N 2.72Å; Y419-H422 PolarHBondContact O-N 3.49Å; Y419-H422 VanDerWaalsContact O-N 3.08Å; Y419-L423 PolarHBondContact O-N 3.28Å; Y419-H504 WeakPolarHBondContact CD2-O 3.44Å; Y419-W505 PolarHBondContact N-O 3.1Å; Y419-R507 HydrophobicContact CD2-CB 4.42Å; Y419-R507 VanDerWaalsContact CE2-CA 3.48Å; Y419-R507 HydrophobicContact CE2-CB 3.75Å; Y419-R507 HydrophobicContact CE2-CG 4.27Å; Y419-R507 PolarHBondContact OH-NE 3.09Å; Y419-E510 WeakPolarHBondContact CE2-OE2 3.47Å; Y419-E510 PolarHBondContact OH-OE2 3.16Å
420	W	89.1	Confident	86.7	Confident	39 Å²	39	52.9 Å²	52.9	15%	0.148	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-31.8	-180	-63.8	99	0	0	0	113.2	V278 M282 F363 I418 L423 A773	V278-W420 HydrophobicContact CG2-CB 4.09Å; M282-W420 HydrophobicContact CE-CB 4.25Å; M282-W420 HydrophobicContact SD-CB 3.6Å; F363-W420 HydrophobicContact CD2-CH2 4.38Å; F363-W420 AromaticContact CE2-CH2 3.93Å; F363-W420 HydrophobicContact CE2-CH2 3.93Å; F363-W420 HydrophobicContact CE2-CZ3 4.04Å; I418-W420 HydrophobicContact CB-CZ2 4.45Å; I418-W420 HydrophobicContact CD1-CH2 4.3Å; I418-W420 HydrophobicContact CD1-CZ2 4.08Å; I418-W420 HydrophobicContact CG2-CD2 3.93Å; I418-W420 HydrophobicContact CG2-CE3 4.28Å; I418-W420 HydrophobicContact CG2-CG 4.26Å; I418-W420 HydrophobicContact CG2-CZ2 4.32Å; I418-W420 PolarHBondContact O-N 3.43Å; W420-L423 HydrophobicContact CE3-CD2 4.07Å; W420-L423 HydrophobicContact CZ3-CD2 4.22Å; W420-L423 WeakPolarHBondContact O-CB 3.41Å; W420-L423 PolarHBondContact O-N 2.94Å; W420-A773 HydrophobicContact CB-CB 4.32Å; W420-A773 HydrophobicContact CD2-CB 4.07Å; W420-A773 HydrophobicContact CE3-CB 4.25Å; W420-A773 HydrophobicContact CG-CB 4.1Å
421	E	87.6	Confident	86.8	Confident	99 Å²	99	57 Å²	57	46%	0.463	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-36	177.3	-60.4	175.8	-166.2	0	0	113	A279 M282 Y419	A279-E421 HydrophobicContact CB-CB 4.46Å; A279-E421 WeakPolarHBondContact CB-O 3.47Å; M282-E421 HydrophobicContact CB-CG 4.3Å; M282-E421 HydrophobicContact CE-CG 3.82Å; M282-E421 HydrophobicContact SD-CG 3.8Å; Y419-E421 PolarHBondContact O-N 2.72Å
422	H	89.8	Confident	87	Confident	39 Å²	39	57.9 Å²	57.9	18%	0.181	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-10.4	-177.5	-62.9	163.9	0	0	0	113	Y419 S424 I425 H504 W505	Y419-H422 PolarHBondContact O-N 3.49Å; Y419-H422 VanDerWaalsContact O-N 3.08Å; H422-S424 PolarHBondContact O-N 2.71Å; H422-S424 VanDerWaalsContact O-N 3.09Å; H422-I425 PolarHBondContact O-N 3.49Å; H422-H504 PolarHBondContact ND1-O 3.29Å; H422-W505 HydrophobicContact CB-CB 4.38Å
423	L	88.6	Confident	87.1	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.016	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-28.1	-176.4	-170.2	66.2	0	0	0	112.9	C275 L359 M361 Y419 W420 W505	C275-L423 HydrophobicContact CB-CD2 4.03Å; L359-L423 HydrophobicContact CD1-CD2 4.28Å; L359-L423 HydrophobicContact CD1-CG 4.17Å; M361-L423 HydrophobicContact CE-CD1 3.89Å; M361-L423 HydrophobicContact CE-CD2 3.98Å; M361-L423 HydrophobicContact CE-CG 3.57Å; Y419-L423 PolarHBondContact O-N 3.28Å; W420-L423 HydrophobicContact CE3-CD2 4.07Å; W420-L423 HydrophobicContact CZ3-CD2 4.22Å; W420-L423 WeakPolarHBondContact O-CB 3.41Å; W420-L423 PolarHBondContact O-N 2.94Å; L423-W505 HydrophobicContact CD1-CB 4.43Å; L423-W505 HydrophobicContact CD1-CD2 4.2Å; L423-W505 HydrophobicContact CD1-CE3 3.68Å; L423-W505 HydrophobicContact CD1-CZ3 4.32Å
424	S	87.6	Confident	87.2	Confident	40 Å²	40	62.1 Å²	62.1	28%	0.28	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-20.6	177.3	64.7	0	0	0	0	114.3	H422 R426	H422-S424 PolarHBondContact O-N 2.71Å; H422-S424 VanDerWaalsContact O-N 3.09Å; S424-R426 PolarHBondContact O-N 3.17Å
425	I	84.1	Confident	87.5	Confident	48 Å²	48	64.6 Å²	64.6	25%	0.246	31%	0.31	C	S	.	.			trans	-93.1	84.7	-175.1	-51.9	174.5	0	0	0	108.7	H422 A503	H422-I425 PolarHBondContact O-N 3.49Å; I425-A503 HydrophobicContact CD1-CB 4.27Å
426	R	76.1	Confident	87.9	Confident	82 Å²	82	67.2 Å²	67.2	31%	0.309	33%	0.326	S	S	.	.			trans	-135.9	173.2	-179.7	-68.7	-175.2	77.5	-170.6	3.1	112.9	M361 S424	M361-R426 PolarHBondContact SD-NH1 2.88Å; S424-R426 PolarHBondContact O-N 3.17Å
427	G	82.9	Confident	88.4	Confident	53 Å²	53	63.4 Å²	63.4	55%	0.546	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-144.9	175.2	0	0	0	0	0	113.3	I429 W430 W431	G427-I429 VanDerWaalsContact C-N 3.32Å; G427-I429 PolarHBondContact O-N 3Å; G427-W430 PolarHBondContact O-N 3.41Å; G427-W431 PolarHBondContact O-N 3.11Å; G427-W431 VanDerWaalsContact O-N 3.12Å
428	F	86.1	Confident	88.5	Confident	149 Å²	149	65.1 Å²	65.1	65%	0.654	32%	0.318	S	S	*	.	H	α-helix	trans	-60.7	-37.7	-174.2	-177.3	-102	0	0	0	113.2	W430 W431 L432	F428-W430 VanDerWaalsContact C-N 3.35Å; F428-W430 PolarHBondContact O-N 3.39Å; F428-W431 HydrophobicContact CE2-CE3 4.39Å; F428-W431 PolarHBondContact O-N 3.15Å; F428-L432 HydrophobicContact CE1-CD2 4.49Å; F428-L432 WeakPolarHBondContact O-CB 3.37Å; F428-L432 PolarHBondContact O-N 3.41Å
429	I	87.9	Confident	88.5	Confident	125 Å²	125	68.1 Å²	68.1	64%	0.641	34%	0.337	S	S	*	.	H	α-helix	trans	-62.8	-43.5	179.4	-63.2	169.8	0	0	0	110.8	G427 R433	G427-I429 VanDerWaalsContact C-N 3.32Å; G427-I429 PolarHBondContact O-N 3Å; I429-R433 WeakPolarHBondContact O-CB 2.98Å; I429-R433 PolarHBondContact O-N 2.92Å
430	W	90.7	Very high	88.6	Confident	72 Å²	72	69.4 Å²	69.4	27%	0.273	35%	0.35	S	S	.	.	H	α-helix	trans	-64.7	-43.3	176.4	178.5	85.8	0	0	0	111.4	G427 F428 R433 C434 E502 H504	G427-W430 PolarHBondContact O-N 3.41Å; F428-W430 VanDerWaalsContact C-N 3.35Å; F428-W430 PolarHBondContact O-N 3.39Å; W430-R433 PolarHBondContact O-N 2.89Å; W430-C434 VanDerWaalsContact O-CB 3.32Å; W430-C434 WeakPolarHBondContact O-CB 3.37Å; W430-C434 PolarHBondContact O-N 2.99Å; W430-E502 PolarHBondContact NE1-O 3.31Å; W430-H504 AromaticContact CZ2-CE1 3.62Å; W430-H504 AromaticContact CZ2-ND1 3.86Å
431	W	90.9	Very high	88.4	Confident	137 Å²	137	67.7 Å²	67.7	52%	0.519	34%	0.344	S	S	.	.	H	α-helix	trans	-64.1	-42.9	178.2	-176.2	87	0	0	0	112.4	G427 F428 C434 L435	G427-W431 PolarHBondContact O-N 3.11Å; G427-W431 VanDerWaalsContact O-N 3.12Å; F428-W431 HydrophobicContact CE2-CE3 4.39Å; F428-W431 PolarHBondContact O-N 3.15Å; W431-C434 WeakPolarHBondContact O-CB 3.34Å; W431-C434 PolarHBondContact O-N 3.47Å; W431-L435 HydrophobicContact CH2-CD1 3.33Å; W431-L435 HydrophobicContact CZ2-CD1 3.8Å; W431-L435 HydrophobicContact CZ3-CD1 3.75Å; W431-L435 WeakPolarHBondContact O-CB 3.41Å; W431-L435 PolarHBondContact O-N 3.45Å
432	L	91.4	Very high	88.2	Confident	80 Å²	80	68.9 Å²	68.9	42%	0.419	35%	0.348	S	S	.	.	H	α-helix	trans	-61.8	-44.7	175.4	-179	64.5	0	0	0	111.2	F428 C434 L435 V436	F428-L432 HydrophobicContact CE1-CD2 4.49Å; F428-L432 WeakPolarHBondContact O-CB 3.37Å; F428-L432 PolarHBondContact O-N 3.41Å; L432-C434 PolarHBondContact O-N 2.89Å; L432-L435 PolarHBondContact O-N 3.37Å; L432-V436 HydrophobicContact CD1-CG2 4.34Å; L432-V436 WeakPolarHBondContact O-CG2 3.49Å; L432-V436 PolarHBondContact O-N 3.15Å
433	R	91.3	Very high	87.8	Confident	96 Å²	96	71 Å²	71	36%	0.362	36%	0.359	S	S	.	.	H	α-helix	trans	-58.8	-47.6	175.3	179.9	174.2	178.1	163.9	-2.4	111.3	I429 W430 L435 V436 I437 F501	I429-R433 WeakPolarHBondContact O-CB 2.98Å; I429-R433 PolarHBondContact O-N 2.92Å; W430-R433 PolarHBondContact O-N 2.89Å; R433-L435 PolarHBondContact O-N 3.09Å; R433-V436 PolarHBondContact O-N 3.25Å; R433-I437 HydrophobicContact CG-CD1 3.7Å; R433-I437 WeakPolarHBondContact O-CB 3.33Å; R433-I437 WeakPolarHBondContact O-CD1 3.23Å; R433-I437 VanDerWaalsContact O-CG1 3.22Å; R433-I437 WeakPolarHBondContact O-CG1 3.43Å; R433-I437 PolarHBondContact O-N 3.21Å; R433-F501 PolarHBondContact NE-O 3.41Å; R433-F501 PolarHBondContact NH2-O 3.2Å
434	C	90.6	Very high	87.3	Confident	22 Å²	22	74.1 Å²	74.1	15%	0.149	38%	0.376	C	S	.	.	H	α-helix	trans	-58.6	-46	175.4	-176.7	0	0	0	0	111.5	W430 W431 L432 N438 E502	W430-C434 VanDerWaalsContact O-CB 3.32Å; W430-C434 WeakPolarHBondContact O-CB 3.37Å; W430-C434 PolarHBondContact O-N 2.99Å; W431-C434 WeakPolarHBondContact O-CB 3.34Å; W431-C434 PolarHBondContact O-N 3.47Å; L432-C434 PolarHBondContact O-N 2.89Å; C434-N438 WeakPolarHBondContact O-CB 3.48Å; C434-N438 PolarHBondContact O-N 3.24Å; C434-N438 PolarHBondContact O-ND2 3.41Å; C434-N438 PolarHBondContact SG-ND2 3.08Å; C434-E502 PolarHBondContact SG-OE1 3.48Å
435	L	91.3	Very high	86.7	Confident	71 Å²	71	72.4 Å²	72.4	37%	0.372	36%	0.363	S	S	.	.	H	α-helix	trans	-61.2	-50.6	177.7	-176.2	151.7	0	0	0	111.6	W431 L432 R433 I437 N438 V439	W431-L435 HydrophobicContact CH2-CD1 3.33Å; W431-L435 HydrophobicContact CZ2-CD1 3.8Å; W431-L435 HydrophobicContact CZ3-CD1 3.75Å; W431-L435 WeakPolarHBondContact O-CB 3.41Å; W431-L435 PolarHBondContact O-N 3.45Å; L432-L435 PolarHBondContact O-N 3.37Å; R433-L435 PolarHBondContact O-N 3.09Å; L435-I437 PolarHBondContact O-N 3.38Å; L435-N438 PolarHBondContact O-N 3.21Å; L435-V439 HydrophobicContact CD2-CG2 4Å; L435-V439 HydrophobicContact CG-CG2 4.42Å; L435-V439 WeakPolarHBondContact O-CB 3.35Å; L435-V439 VanDerWaalsContact O-CG2 3.28Å; L435-V439 WeakPolarHBondContact O-CG2 3.48Å; L435-V439 PolarHBondContact O-N 3.13Å
436	V	93	Very high	86.1	Confident	74 Å²	74	72 Å²	72	45%	0.448	36%	0.36	S	S	.	.	H	α-helix	trans	-59.9	-47.3	-179.1	171.1	0	0	0	0	110.8	L432 R433 N438 V439 V440	L432-V436 HydrophobicContact CD1-CG2 4.34Å; L432-V436 WeakPolarHBondContact O-CG2 3.49Å; L432-V436 PolarHBondContact O-N 3.15Å; R433-V436 PolarHBondContact O-N 3.25Å; V436-N438 PolarHBondContact O-N 3.37Å; V436-V439 PolarHBondContact O-N 3.31Å; V436-V440 HydrophobicContact CG1-CG2 4.4Å; V436-V440 WeakPolarHBondContact O-CB 3.36Å; V436-V440 VanDerWaalsContact O-CG2 3.3Å; V436-V440 WeakPolarHBondContact O-CG2 3.5Å; V436-V440 PolarHBondContact O-N 2.98Å
437	I	92.3	Very high	85.8	Confident	30 Å²	30	72.8 Å²	72.8	15%	0.154	37%	0.366	C	S	.	.	H	α-helix	trans	-61.4	-44.9	179.3	-68.3	167.1	0	0	0	110.8	R433 L435 V440 L441 F501 E502	R433-I437 HydrophobicContact CG-CD1 3.7Å; R433-I437 WeakPolarHBondContact O-CB 3.33Å; R433-I437 WeakPolarHBondContact O-CD1 3.23Å; R433-I437 VanDerWaalsContact O-CG1 3.22Å; R433-I437 WeakPolarHBondContact O-CG1 3.43Å; R433-I437 PolarHBondContact O-N 3.21Å; L435-I437 PolarHBondContact O-N 3.38Å; I437-V440 PolarHBondContact O-N 3.36Å; I437-L441 VanDerWaalsContact O-CB 3.23Å; I437-L441 WeakPolarHBondContact O-CB 3.41Å; I437-L441 PolarHBondContact O-N 3.07Å; I437-F501 HydrophobicContact CD1-CB 3.84Å; I437-F501 VanDerWaalsContact CD1-O 3.25Å; I437-F501 WeakPolarHBondContact CD1-O 3.33Å; I437-E502 HydrophobicContact CD1-CG 4.1Å; I437-E502 HydrophobicContact CG2-CG 4.43Å
438	N	89.6	Confident	85	Confident	42 Å²	42	71 Å²	71	23%	0.225	34%	0.344	C	S	.	.	H	α-helix	trans	-70.1	-34.3	-179.4	-71.7	-58.2	0	0	0	112.9	C434 L435 V436 F442 E502 K517	C434-N438 WeakPolarHBondContact O-CB 3.48Å; C434-N438 PolarHBondContact O-N 3.24Å; C434-N438 PolarHBondContact O-ND2 3.41Å; C434-N438 PolarHBondContact SG-ND2 3.08Å; L435-N438 PolarHBondContact O-N 3.21Å; V436-N438 PolarHBondContact O-N 3.37Å; N438-F442 WeakPolarHBondContact O-CB 3.35Å; N438-F442 PolarHBondContact O-N 3.02Å; N438-E502 PolarHBondContact ND2-OE1 2.83Å; N438-K517 PolarHBondContact ND2-NZ 3.43Å; N438-K517 WeakPolarHBondContact OD1-CE 3.34Å; N438-K517 PolarHBondContact OD1-NZ 3.45Å
439	V	89.3	Confident	83.9	Confident	73 Å²	73	65.3 Å²	65.3	44%	0.442	32%	0.321	S	S	.	.	H	α-helix	trans	-66.1	-47.3	173.6	169.4	0	0	0	0	110.6	L435 V436 L441 F442 I443	L435-V439 HydrophobicContact CD2-CG2 4Å; L435-V439 HydrophobicContact CG-CG2 4.42Å; L435-V439 WeakPolarHBondContact O-CB 3.35Å; L435-V439 VanDerWaalsContact O-CG2 3.28Å; L435-V439 WeakPolarHBondContact O-CG2 3.48Å; L435-V439 PolarHBondContact O-N 3.13Å; V436-V439 PolarHBondContact O-N 3.31Å; V439-L441 VanDerWaalsContact C-N 3.33Å; V439-L441 PolarHBondContact O-N 3.35Å; V439-F442 PolarHBondContact O-N 2.78Å; V439-I443 HydrophobicContact CG1-CD1 3.88Å; V439-I443 WeakPolarHBondContact O-CG1 3.33Å; V439-I443 PolarHBondContact O-N 3.01Å
440	V	89.3	Confident	82.6	Confident	83 Å²	83	60 Å²	60	50%	0.503	30%	0.295	S	S	.	.	H	α-helix	trans	-60.6	-44.7	175.9	171.1	0	0	0	0	110.5	V436 I437 F442 I443 L444	V436-V440 HydrophobicContact CG1-CG2 4.4Å; V436-V440 WeakPolarHBondContact O-CB 3.36Å; V436-V440 VanDerWaalsContact O-CG2 3.3Å; V436-V440 WeakPolarHBondContact O-CG2 3.5Å; V436-V440 PolarHBondContact O-N 2.98Å; I437-V440 PolarHBondContact O-N 3.36Å; V440-F442 PolarHBondContact O-N 3.31Å; V440-I443 PolarHBondContact O-N 3.37Å; V440-L444 WeakPolarHBondContact O-CB 3.12Å; V440-L444 PolarHBondContact O-N 2.78Å
441	L	86.4	Confident	80.9	Confident	4 Å²	4	57.3 Å²	57.3	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-59.3	-47.1	176.1	-178.5	68.8	0	0	0	111.3	I437 V439 I443 L444 L445 I494 V495 S498 F521	I437-L441 VanDerWaalsContact O-CB 3.23Å; I437-L441 WeakPolarHBondContact O-CB 3.41Å; I437-L441 PolarHBondContact O-N 3.07Å; V439-L441 VanDerWaalsContact C-N 3.33Å; V439-L441 PolarHBondContact O-N 3.35Å; L441-I443 PolarHBondContact O-N 3.14Å; L441-L444 PolarHBondContact O-N 3.44Å; L441-L445 HydrophobicContact CD1-CD1 3.79Å; L441-L445 HydrophobicContact CD1-CD2 4.35Å; L441-L445 HydrophobicContact CD1-CG 3.88Å; L441-L445 HydrophobicContact CD2-CD1 4.35Å; L441-L445 HydrophobicContact CG-CD1 3.73Å; L441-L445 HydrophobicContact CG-CG 4.14Å; L441-L445 VanDerWaalsContact O-CB 3.29Å; L441-L445 WeakPolarHBondContact O-CB 3.47Å; L441-L445 WeakPolarHBondContact O-CG 3.44Å; L441-L445 PolarHBondContact O-N 3.39Å; L441-I494 HydrophobicContact CD1-CG2 3.71Å; L441-V495 HydrophobicContact CD1-CG2 4.23Å; L441-S498 WeakPolarHBondContact CD2-OG 3.39Å; L441-F521 HydrophobicContact CD2-CD2 4.24Å; L441-F521 HydrophobicContact CD2-CE2 3.49Å; L441-F521 VanDerWaalsContact CD2-CE2 3.49Å; L441-F521 HydrophobicContact CD2-CZ 3.95Å; L441-F521 HydrophobicContact CG-CE2 4.28Å; L441-F521 HydrophobicContact CG-CZ 4.35Å
442	F	83.3	Confident	79	Confident	124 Å²	124	53.5 Å²	53.5	54%	0.544	28%	0.284	S	S	.	.	H	α-helix	trans	-59.7	-48.1	178.9	177.4	-97.1	0	0	0	111.6	N438 V439 V440 F446	N438-F442 WeakPolarHBondContact O-CB 3.35Å; N438-F442 PolarHBondContact O-N 3.02Å; V439-F442 PolarHBondContact O-N 2.78Å; V440-F442 PolarHBondContact O-N 3.31Å; F442-F446 WeakPolarHBondContact O-CB 3.31Å; F442-F446 PolarHBondContact O-N 3.16Å
443	I	80.7	Confident	77.1	Confident	83 Å²	83	51 Å²	51	43%	0.426	27%	0.271	S	S	.	.	H	α-helix	trans	-58	-53.7	176.3	-71	170.1	0	0	0	110	V439 V440 L441 L445 F446 F447	V439-I443 HydrophobicContact CG1-CD1 3.88Å; V439-I443 WeakPolarHBondContact O-CG1 3.33Å; V439-I443 PolarHBondContact O-N 3.01Å; V440-I443 PolarHBondContact O-N 3.37Å; L441-I443 PolarHBondContact O-N 3.14Å; I443-L445 PolarHBondContact O-N 2.74Å; I443-F446 PolarHBondContact O-N 2.87Å; I443-F447 HydrophobicContact CG2-CD2 3.76Å; I443-F447 HydrophobicContact CG2-CE2 3.84Å; I443-F447 WeakPolarHBondContact O-CD2 3.39Å; I443-F447 PolarHBondContact O-N 3.46Å
444	L	78.8	Confident	75.4	Confident	69 Å²	69	49.4 Å²	49.4	36%	0.361	27%	0.269	S	S	.	.	H	α-helix	trans	-55.7	-52.1	-178.1	-177.6	61.2	0	0	0	111	V440 L441 F447 L448 I494	V440-L444 WeakPolarHBondContact O-CB 3.12Å; V440-L444 PolarHBondContact O-N 2.78Å; L441-L444 PolarHBondContact O-N 3.44Å; L444-F447 PolarHBondContact O-N 2.93Å; L444-L448 HydrophobicContact CD1-CD1 3.32Å; L444-L448 HydrophobicContact CD1-CG 4.28Å; L444-L448 HydrophobicContact CD2-CD1 4.46Å; L444-L448 HydrophobicContact CG-CD1 3.49Å; L444-L448 VanDerWaalsContact CG-CD1 3.49Å; L444-L448 VanDerWaalsContact O-CB 3.24Å; L444-L448 WeakPolarHBondContact O-CB 3.42Å; L444-L448 WeakPolarHBondContact O-CD1 3.43Å; L444-L448 WeakPolarHBondContact O-CG 3.43Å; L444-L448 PolarHBondContact O-N 3.25Å; L444-I494 HydrophobicContact CD2-CD1 4.2Å; L444-I494 HydrophobicContact CD2-CG2 3.59Å
445	L	74.9	Confident	73.8	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-65.1	-40.7	179	-66.7	-178.7	0	0	0	112.4	L441 I443 F447 T449 L491 V495 F521 M525	L441-L445 HydrophobicContact CD1-CD1 3.79Å; L441-L445 HydrophobicContact CD1-CD2 4.35Å; L441-L445 HydrophobicContact CD1-CG 3.88Å; L441-L445 HydrophobicContact CD2-CD1 4.35Å; L441-L445 HydrophobicContact CG-CD1 3.73Å; L441-L445 HydrophobicContact CG-CG 4.14Å; L441-L445 VanDerWaalsContact O-CB 3.29Å; L441-L445 WeakPolarHBondContact O-CB 3.47Å; L441-L445 WeakPolarHBondContact O-CG 3.44Å; L441-L445 PolarHBondContact O-N 3.39Å; I443-L445 PolarHBondContact O-N 2.74Å; L445-F447 VanDerWaalsContact C-N 3.32Å; L445-F447 PolarHBondContact O-N 3.16Å; L445-T449 WeakPolarHBondContact O-CB 3.5Å; L445-T449 WeakPolarHBondContact O-CG2 3.46Å; L445-T449 PolarHBondContact O-N 2.87Å; L445-T449 PolarHBondContact O-OG1 3.23Å; L445-L491 HydrophobicContact CD2-CD2 3.2Å; L445-V495 HydrophobicContact CD1-CG2 3.95Å; L445-V495 HydrophobicContact CD2-CG2 4.19Å; L445-F521 HydrophobicContact CD1-CB 4.19Å; L445-F521 HydrophobicContact CD1-CD1 3.29Å; L445-F521 HydrophobicContact CD1-CD2 3.88Å; L445-F521 HydrophobicContact CD1-CE1 3.46Å; L445-F521 VanDerWaalsContact CD1-CE1 3.46Å; L445-F521 HydrophobicContact CD1-CE2 4.05Å; L445-F521 HydrophobicContact CD1-CG 3.52Å; L445-F521 HydrophobicContact CD1-CZ 3.85Å; L445-M525 HydrophobicContact CB-CE 3.98Å
446	F	72.1	Confident	71.8	Confident	39 Å²	39	50.8 Å²	50.8	17%	0.171	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-41.4	178.4	-177	-92.6	0	0	0	112.1	F442 I443 T449 S536 F540	F442-F446 WeakPolarHBondContact O-CB 3.31Å; F442-F446 PolarHBondContact O-N 3.16Å; I443-F446 PolarHBondContact O-N 2.87Å; F446-T449 PolarHBondContact O-OG1 3.41Å; F446-S536 VanDerWaalsContact CZ-O 3.23Å; F446-S536 WeakPolarHBondContact CZ-O 3.3Å; F446-S536 PolarHBondContact O-OG 3.33Å; F446-F540 HydrophobicContact CE1-CB 4.19Å; F446-F540 HydrophobicContact CE1-CG 4.43Å; F446-F540 HydrophobicContact CZ-CB 3.59Å; F446-F540 HydrophobicContact CZ-CG 4.16Å
447	F	69.9	Low	69.9	Low	99 Å²	99	49.4 Å²	49.4	43%	0.434	27%	0.269	S	S	.	.	H	α-helix	trans	-80	-40.4	178.6	-73.7	-68.9	0	0	0	113.6	I443 L444 L445 T449 L537	I443-F447 HydrophobicContact CG2-CD2 3.76Å; I443-F447 HydrophobicContact CG2-CE2 3.84Å; I443-F447 WeakPolarHBondContact O-CD2 3.39Å; I443-F447 PolarHBondContact O-N 3.46Å; L444-F447 PolarHBondContact O-N 2.93Å; L445-F447 VanDerWaalsContact C-N 3.32Å; L445-F447 PolarHBondContact O-N 3.16Å; F447-T449 PolarHBondContact O-N 3.4Å; F447-L537 HydrophobicContact CD1-CD1 3.85Å; F447-L537 HydrophobicContact CE1-CD1 3.96Å
448	L	65.2	Low	68.1	Low	16 Å²	16	51 Å²	51	8%	0.084	28%	0.277	C	S	.	.	H	α-helix	trans	-66	-24.2	-178.7	-90.2	155.8	0	0	0	114.2	L444 T450 P451 F487 L491 I494	L444-L448 HydrophobicContact CD1-CD1 3.32Å; L444-L448 HydrophobicContact CD1-CG 4.28Å; L444-L448 HydrophobicContact CD2-CD1 4.46Å; L444-L448 HydrophobicContact CG-CD1 3.49Å; L444-L448 VanDerWaalsContact CG-CD1 3.49Å; L444-L448 VanDerWaalsContact O-CB 3.24Å; L444-L448 WeakPolarHBondContact O-CB 3.42Å; L444-L448 WeakPolarHBondContact O-CD1 3.43Å; L444-L448 WeakPolarHBondContact O-CG 3.43Å; L444-L448 PolarHBondContact O-N 3.25Å; L448-T450 PolarHBondContact O-N 2.99Å; L448-P451 VanDerWaalsContact O-CD 3.3Å; L448-P451 WeakPolarHBondContact O-CD 3.49Å; L448-P451 WeakPolarHBondContact O-CG 3.27Å; L448-F487 HydrophobicContact CD2-CB 4.04Å; L448-F487 HydrophobicContact CD2-CD1 3.09Å; L448-F487 HydrophobicContact CD2-CD2 4.02Å; L448-F487 HydrophobicContact CD2-CE1 3.34Å; L448-F487 HydrophobicContact CD2-CE2 4.2Å; L448-F487 HydrophobicContact CD2-CG 3.47Å; L448-F487 VanDerWaalsContact CD2-CG 3.47Å; L448-F487 HydrophobicContact CD2-CZ 3.9Å; L448-L491 HydrophobicContact CB-CD2 4.11Å; L448-I494 HydrophobicContact CD1-CD1 4.11Å
449	T	62.5	Low	66.3	Low	30 Å²	30	53.1 Å²	53.1	18%	0.184	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-1.3	-172.9	48.8	0	0	0	0	114	L445 F446 F447 P451 L491 M525 S536	L445-T449 WeakPolarHBondContact O-CB 3.5Å; L445-T449 WeakPolarHBondContact O-CG2 3.46Å; L445-T449 PolarHBondContact O-N 2.87Å; L445-T449 PolarHBondContact O-OG1 3.23Å; F446-T449 PolarHBondContact O-OG1 3.41Å; F447-T449 PolarHBondContact O-N 3.4Å; T449-P451 VanDerWaalsContact C-CD 3.47Å; T449-L491 HydrophobicContact CG2-CD1 4.17Å; T449-L491 HydrophobicContact CG2-CD2 4.25Å; T449-M525 HydrophobicContact CG2-CE 3.4Å; T449-M525 HydrophobicContact CG2-CG 3.78Å; T449-M525 HydrophobicContact CG2-SD 3.09Å; T449-M525 WeakPolarHBondContact CG2-SD 3.28Å; T449-S536 PolarHBondContact OG1-OG 3.37Å
450	T	61.1	Low	64.5	Low	13 Å²	13	58 Å²	58	8%	0.08	30%	0.304	C	S	.	.			trans	-123	70.8	165.6	-40.8	0	0	0	0	112.9	L448 A452 I453 I454 S535 S536	L448-T450 PolarHBondContact O-N 2.99Å; T450-A452 PolarHBondContact O-N 3.18Å; T450-I453 HydrophobicContact CG2-CB 3.49Å; T450-I453 VanDerWaalsContact CG2-CB 3.49Å; T450-I453 HydrophobicContact CG2-CD1 3.8Å; T450-I453 HydrophobicContact CG2-CG1 3.45Å; T450-I453 VanDerWaalsContact CG2-CG1 3.45Å; T450-I453 PolarHBondContact O-N 2.84Å; T450-I453 VanDerWaalsContact O-N 3.09Å; T450-I454 PolarHBondContact O-N 2.77Å; T450-S535 WeakPolarHBondContact OG1-CB 3.32Å; T450-S536 PolarHBondContact OG1-N 3.3Å; T450-S536 PolarHBondContact OG1-OG 3.25Å
451	P	55	Low	62.9	Low	15 Å²	15	61.6 Å²	61.6	10%	0.097	31%	0.313	C	S	.	.	H	α-helix	trans	-59	-34.8	177.1	-19.3	30.7	0	0	0	112.4	L448 T449 I453 I454 I455 L484 F487	L448-P451 VanDerWaalsContact O-CD 3.3Å; L448-P451 WeakPolarHBondContact O-CD 3.49Å; L448-P451 WeakPolarHBondContact O-CG 3.27Å; T449-P451 VanDerWaalsContact C-CD 3.47Å; P451-I453 VanDerWaalsContact C-N 3.33Å; P451-I453 PolarHBondContact O-N 3.12Å; P451-I454 PolarHBondContact O-N 3.34Å; P451-I455 WeakPolarHBondContact O-CG1 3.33Å; P451-I455 PolarHBondContact O-N 2.87Å; P451-I455 VanDerWaalsContact O-N 3.17Å; P451-L484 HydrophobicContact CB-CB 4.28Å; P451-L484 HydrophobicContact CB-CD1 4.06Å; P451-L484 HydrophobicContact CB-CG 4.44Å; P451-L484 HydrophobicContact CG-CB 4.47Å; P451-L484 HydrophobicContact CG-CD1 3.98Å; P451-L484 HydrophobicContact CG-CG 4.21Å; P451-F487 HydrophobicContact CB-CD2 4.21Å; P451-F487 HydrophobicContact CG-CD2 4.28Å
452	A	51.3	Low	61.1	Low	57 Å²	57	65.9 Å²	65.9	47%	0.471	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-36.2	177.3	0	0	0	0	0	112.8	T450 I455 T456	T450-A452 PolarHBondContact O-N 3.18Å; A452-I455 PolarHBondContact O-N 2.72Å; A452-T456 VanDerWaalsContact O-CG2 3.28Å; A452-T456 WeakPolarHBondContact O-CG2 3.4Å; A452-T456 PolarHBondContact O-N 3.18Å; A452-T456 PolarHBondContact O-OG1 3.11Å
453	I	51.4	Low	59.7	Low	27 Å²	27	64.4 Å²	64.4	14%	0.138	34%	0.337	C	S	.	.	H	α-helix	trans	-72.3	-42.1	177.4	-78.3	-172.7	0	0	0	110.8	T450 P451 I455 T456 T457 S535 L537 D538	T450-I453 HydrophobicContact CG2-CB 3.49Å; T450-I453 VanDerWaalsContact CG2-CB 3.49Å; T450-I453 HydrophobicContact CG2-CD1 3.8Å; T450-I453 HydrophobicContact CG2-CG1 3.45Å; T450-I453 VanDerWaalsContact CG2-CG1 3.45Å; T450-I453 PolarHBondContact O-N 2.84Å; T450-I453 VanDerWaalsContact O-N 3.09Å; P451-I453 VanDerWaalsContact C-N 3.33Å; P451-I453 PolarHBondContact O-N 3.12Å; I453-I455 PolarHBondContact O-N 3.41Å; I453-T456 WeakPolarHBondContact CA-OG1 3.24Å; I453-T456 CarbonylContact O-C 3.58Å; I453-T456 PolarHBondContact O-N 2.93Å; I453-T456 VanDerWaalsContact O-N 3.11Å; I453-T456 PolarHBondContact O-OG1 2.96Å; I453-T457 HydrophobicContact CG2-CG2 3.8Å; I453-T457 WeakPolarHBondContact O-CB 3.38Å; I453-T457 WeakPolarHBondContact O-CG2 3.43Å; I453-T457 PolarHBondContact O-N 3.42Å; I453-T457 PolarHBondContact O-OG1 3.32Å; I453-S535 WeakPolarHBondContact CD1-OG 3.44Å; I453-L537 HydrophobicContact CD1-CB 4.25Å; I453-L537 HydrophobicContact CG2-CB 4.29Å; I453-L537 HydrophobicContact CG2-CD1 4.16Å; I453-L537 HydrophobicContact CG2-CD2 3.96Å; I453-L537 HydrophobicContact CG2-CG 4.38Å; I453-D538 HydrophobicContact CD1-CB 3.98Å
454	I	55.1	Low	58.3	Low	64 Å²	64	61.2 Å²	61.2	33%	0.328	32%	0.321	S	S	.	.	H	α-helix	trans	-52.4	-47.2	175.1	-64.2	174.1	0	0	0	109.7	T450 P451 T457 M458	T450-I454 PolarHBondContact O-N 2.77Å; P451-I454 PolarHBondContact O-N 3.34Å; I454-T457 WeakPolarHBondContact CA-OG1 3.33Å; I454-T457 PolarHBondContact O-N 2.89Å; I454-T457 PolarHBondContact O-OG1 2.8Å; I454-M458 WeakPolarHBondContact O-CB 3.45Å; I454-M458 PolarHBondContact O-N 3.4Å
455	I	56.5	Low	57.1	Low	38 Å²	38	63.4 Å²	63.4	20%	0.195	33%	0.328	C	S	.	.	H	α-helix	trans	-62.3	-49.7	178.2	-63.4	168.6	0	0	0	111.2	P451 A452 I453 T457 M458 D459 P480 L483	P451-I455 WeakPolarHBondContact O-CG1 3.33Å; P451-I455 PolarHBondContact O-N 2.87Å; P451-I455 VanDerWaalsContact O-N 3.17Å; A452-I455 PolarHBondContact O-N 2.72Å; I453-I455 PolarHBondContact O-N 3.41Å; I455-T457 VanDerWaalsContact C-N 3.32Å; I455-T457 PolarHBondContact O-N 3.03Å; I455-M458 PolarHBondContact O-N 3.36Å; I455-D459 WeakPolarHBondContact O-CB 3.26Å; I455-D459 PolarHBondContact O-N 2.87Å; I455-P480 VanDerWaalsContact CD1-CA 3.5Å; I455-P480 HydrophobicContact CD1-CB 3.53Å; I455-P480 HydrophobicContact CD1-CG 4.07Å; I455-P480 HydrophobicContact CG2-CG 4.42Å; I455-L483 HydrophobicContact CD1-CD2 4.11Å; I455-L483 HydrophobicContact CG1-CD2 4.1Å
456	T	50.3	Low	56.1	Low	83 Å²	83	67.6 Å²	67.6	51%	0.509	36%	0.355	S	S	.	.	H	α-helix	trans	-66.6	-29.4	178.6	61.7	0	0	0	0	113.8	A452 I453 K460	A452-T456 VanDerWaalsContact O-CG2 3.28Å; A452-T456 WeakPolarHBondContact O-CG2 3.4Å; A452-T456 PolarHBondContact O-N 3.18Å; A452-T456 PolarHBondContact O-OG1 3.11Å; I453-T456 WeakPolarHBondContact CA-OG1 3.24Å; I453-T456 CarbonylContact O-C 3.58Å; I453-T456 PolarHBondContact O-N 2.93Å; I453-T456 VanDerWaalsContact O-N 3.11Å; I453-T456 PolarHBondContact O-OG1 2.96Å; T456-K460 WeakPolarHBondContact O-CB 3.35Å; T456-K460 PolarHBondContact O-N 3.43Å
457	T	52.3	Low	55.2	Low	45 Å²	45	68.4 Å²	68.4	28%	0.276	36%	0.363	S	S	.	.	H	α-helix	trans	-77.5	-38.8	174.8	51.7	0	0	0	0	111.4	I453 I454 I455 D459 K460 F461	I453-T457 HydrophobicContact CG2-CG2 3.8Å; I453-T457 WeakPolarHBondContact O-CB 3.38Å; I453-T457 WeakPolarHBondContact O-CG2 3.43Å; I453-T457 PolarHBondContact O-N 3.42Å; I453-T457 PolarHBondContact O-OG1 3.32Å; I454-T457 WeakPolarHBondContact CA-OG1 3.33Å; I454-T457 PolarHBondContact O-N 2.89Å; I454-T457 PolarHBondContact O-OG1 2.8Å; I455-T457 VanDerWaalsContact C-N 3.32Å; I455-T457 PolarHBondContact O-N 3.03Å; T457-D459 PolarHBondContact O-N 3.08Å; T457-K460 CarbonylContact O-C 3.55Å; T457-K460 PolarHBondContact O-N 2.83Å; T457-K460 VanDerWaalsContact O-N 3.15Å; T457-F461 WeakPolarHBondContact O-CB 3.4Å; T457-F461 WeakPolarHBondContact O-CD2 3.38Å; T457-F461 PolarHBondContact O-N 3.27Å
458	M	54.4	Low	54.5	Low	63 Å²	63	69.5 Å²	69.5	31%	0.31	37%	0.37	S	S	.	.	H	α-helix	trans	-62	-36.2	174.5	-166.8	175.6	78.3	0	0	110.7	I454 I455 V463 T464	I454-M458 WeakPolarHBondContact O-CB 3.45Å; I454-M458 PolarHBondContact O-N 3.4Å; I455-M458 PolarHBondContact O-N 3.36Å; M458-V463 HydrophobicContact CG-CB 3.91Å; M458-V463 HydrophobicContact CG-CG1 4.19Å; M458-V463 PolarHBondContact O-N 3.43Å; M458-T464 HydrophobicContact CE-CG2 3.72Å; M458-T464 HydrophobicContact CG-CG2 4.36Å
459	D	52.5	Low	54	Low	88 Å²	88	79 Å²	79	47%	0.471	41%	0.406	S	S	.	.	H	α-helix	trans	-66.7	-46.9	170.9	-157.8	44.9	0	0	0	112.2	I455 T457 F461 N462 T464	I455-D459 WeakPolarHBondContact O-CB 3.26Å; I455-D459 PolarHBondContact O-N 2.87Å; T457-D459 PolarHBondContact O-N 3.08Å; D459-F461 VanDerWaalsContact C-N 3.29Å; D459-F461 PolarHBondContact O-N 3.06Å; D459-N462 PolarHBondContact O-N 3.43Å; D459-N462 VanDerWaalsContact O-N 3.14Å; D459-T464 WeakPolarHBondContact CA-OG1 3.49Å; D459-T464 PolarHBondContact OD1-OG1 3.39Å
460	K	51.9	Low	53.7	Low	176 Å²	176	81.9 Å²	81.9	77%	0.765	42%	0.42	S	S	*	.	H	α-helix	trans	-63	-29.2	176.4	-170.4	175.4	-179.2	178.2	0	114.2	T456 T457 N462	T456-K460 WeakPolarHBondContact O-CB 3.35Å; T456-K460 PolarHBondContact O-N 3.43Å; T457-K460 CarbonylContact O-C 3.55Å; T457-K460 PolarHBondContact O-N 2.83Å; T457-K460 VanDerWaalsContact O-N 3.15Å; K460-N462 VanDerWaalsContact C-N 3.33Å
461	F	54.7	Low	53.5	Low	157 Å²	157	88.5 Å²	88.5	69%	0.689	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	11.9	177.6	-72.7	-66.4	0	0	0	113.5	T457 D459 V463	T457-F461 WeakPolarHBondContact O-CB 3.4Å; T457-F461 WeakPolarHBondContact O-CD2 3.38Å; T457-F461 PolarHBondContact O-N 3.27Å; D459-F461 VanDerWaalsContact C-N 3.29Å; D459-F461 PolarHBondContact O-N 3.06Å; F461-V463 HydrophobicContact CB-CG2 4.06Å; F461-V463 PolarHBondContact O-N 3.29Å
462	N	50.2	Low	53.8	Low	94 Å²	94	92 Å²	92	50%	0.503	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	17.2	178.9	-89.4	-19.7	0	0	0	114.7	D459 K460 T464 K465	D459-N462 PolarHBondContact O-N 3.43Å; D459-N462 VanDerWaalsContact O-N 3.14Å; K460-N462 VanDerWaalsContact C-N 3.33Å; N462-T464 PolarHBondContact O-N 2.99Å; N462-K465 HydrophobicContact CB-CD 4.28Å; N462-K465 HydrophobicContact CB-CG 4.38Å; N462-K465 VanDerWaalsContact CG-CE 3.48Å; N462-K465 PolarHBondContact O-N 2.92Å; N462-K465 WeakPolarHBondContact OD1-CE 3.46Å
463	V	53	Low	54.2	Low	93 Å²	93	93 Å²	93	56%	0.564	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-15.2	177.9	-175.6	0	0	0	0	110.9	M458 F461 P466	M458-V463 HydrophobicContact CG-CB 3.91Å; M458-V463 HydrophobicContact CG-CG1 4.19Å; M458-V463 PolarHBondContact O-N 3.43Å; F461-V463 HydrophobicContact CB-CG2 4.06Å; F461-V463 PolarHBondContact O-N 3.29Å; V463-P466 WeakPolarHBondContact O-CD 3.32Å
464	T	51.5	Low	54.5	Low	17 Å²	17	97.5 Å²	97.5	10%	0.104	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-5.5	176.2	40.1	0	0	0	0	115.3	M458 D459 N462 P466 V467 E468	M458-T464 HydrophobicContact CE-CG2 3.72Å; M458-T464 HydrophobicContact CG-CG2 4.36Å; D459-T464 WeakPolarHBondContact CA-OG1 3.49Å; D459-T464 PolarHBondContact OD1-OG1 3.39Å; N462-T464 PolarHBondContact O-N 2.99Å; T464-P466 VanDerWaalsContact C-N 3.31Å; T464-V467 CarbonylContact O-C 3.56Å; T464-V467 WeakPolarHBondContact O-CA 3.29Å; T464-V467 WeakPolarHBondContact O-CB 3.47Å; T464-V467 PolarHBondContact O-N 3.32Å; T464-E468 PolarHBondContact O-N 3.32Å
465	K	53.8	Low	54.7	Low	115 Å²	115	97.6 Å²	97.6	50%	0.5	50%	0.498	S	S	.	.	H	α-helix	trans	-53.6	-35.1	178.6	-78.4	-171.8	169.6	179.6	0	115.4	N462 V467	N462-K465 HydrophobicContact CB-CD 4.28Å; N462-K465 HydrophobicContact CB-CG 4.38Å; N462-K465 VanDerWaalsContact CG-CE 3.48Å; N462-K465 PolarHBondContact O-N 2.92Å; N462-K465 WeakPolarHBondContact OD1-CE 3.46Å; K465-V467 VanDerWaalsContact C-N 3.28Å; K465-V467 PolarHBondContact O-N 2.98Å
466	P	53.8	Low	54.7	Low	91 Å²	91	99.3 Å²	99.3	59%	0.591	51%	0.51	S	S	*	.	H	α-helix	trans	-70.5	-22.8	172.1	-17.1	31.2	0	0	0	113.6	V463 T464	V463-P466 WeakPolarHBondContact O-CD 3.32Å; T464-P466 VanDerWaalsContact C-N 3.31Å
467	V	53.6	Low	55.1	Low	55 Å²	55	102.2 Å²	102.2	33%	0.333	52%	0.518	S	S	.	.	H	α-helix	trans	-87.6	-30.7	-178.5	-177	0	0	0	0	111.5	T464 K465 Y469 L470 I475	T464-V467 CarbonylContact O-C 3.56Å; T464-V467 WeakPolarHBondContact O-CA 3.29Å; T464-V467 WeakPolarHBondContact O-CB 3.47Å; T464-V467 PolarHBondContact O-N 3.32Å; K465-V467 VanDerWaalsContact C-N 3.28Å; K465-V467 PolarHBondContact O-N 2.98Å; V467-Y469 PolarHBondContact O-N 3.02Å; V467-L470 CarbonylContact O-C 3.48Å; V467-L470 WeakPolarHBondContact O-CA 3.49Å; V467-L470 WeakPolarHBondContact O-CB 3.11Å; V467-L470 PolarHBondContact O-N 3.43Å; V467-I475 HydrophobicContact CG1-CG2 4.39Å
468	E	53.9	Low	55.8	Low	123 Å²	123	105.8 Å²	105.8	58%	0.575	53%	0.53	S	S	*	.	H	α-helix	trans	-62.1	-30.1	169.9	-77.7	-178.2	142.1	0	0	112.6	T464 L470	T464-E468 PolarHBondContact O-N 3.32Å; E468-L470 PolarHBondContact O-N 3.32Å
469	Y	55.6	Low	56.2	Low	214 Å²	214	107.7 Å²	107.7	84%	0.839	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-22.7	171.5	-99.2	-85.9	0	0	0	113	V467 N471	V467-Y469 PolarHBondContact O-N 3.02Å; Y469-N471 VanDerWaalsContact C-N 3.27Å; Y469-N471 PolarHBondContact O-N 2.93Å; Y469-N471 VanDerWaalsContact O-N 3.13Å
470	L	56.6	Low	56.4	Low	91 Å²	91	105.4 Å²	105.4	48%	0.476	53%	0.527	S	S	.	.	S	Bend	trans	-85.2	75.1	169	-66.4	165	0	0	0	108	V467 E468 N472 I475	V467-L470 CarbonylContact O-C 3.48Å; V467-L470 WeakPolarHBondContact O-CA 3.49Å; V467-L470 WeakPolarHBondContact O-CB 3.11Å; V467-L470 PolarHBondContact O-N 3.43Å; E468-L470 PolarHBondContact O-N 3.32Å; L470-N472 PolarHBondContact O-N 3.36Å; L470-I475 HydrophobicContact CB-CD1 4.34Å
471	N	56.9	Low	56.7	Low	153 Å²	153	100.4 Å²	100.4	82%	0.818	51%	0.511	S	S	*	.			trans	-69.2	40.2	-176.9	-132	1.6	0	0	0	113.3	Y469	Y469-N471 VanDerWaalsContact C-N 3.27Å; Y469-N471 PolarHBondContact O-N 2.93Å; Y469-N471 VanDerWaalsContact O-N 3.13Å
472	N	61.2	Low	57.2	Low	88 Å²	88	96.2 Å²	96.2	47%	0.471	50%	0.496	S	S	.	.			trans	-100.7	114.5	178.7	-98.9	-46.5	0	0	0	109.3	L470 I474 I475 T476	L470-N472 PolarHBondContact O-N 3.36Å; N472-I474 PolarHBondContact O-N 3.36Å; N472-I475 HydrophobicContact CB-CD1 4.18Å; N472-I475 HydrophobicContact CB-CG1 4.19Å; N472-I475 PolarHBondContact O-N 3.02Å; N472-T476 PolarHBondContact O-N 3.39Å
473	P	58.9	Low	57.8	Low	79 Å²	79	93.5 Å²	93.5	51%	0.513	48%	0.481	S	S	.	.	H	α-helix	trans	-59.7	-22.7	179.2	24.3	-33.1	0	0	0	112.3	T476 Q477	P473-T476 PolarHBondContact O-OG1 3.25Å; P473-Q477 WeakPolarHBondContact O-CB 3.42Å; P473-Q477 WeakPolarHBondContact O-CG 3.3Å; P473-Q477 PolarHBondContact O-N 2.97Å; P473-Q477 VanDerWaalsContact O-N 3.15Å
474	I	56.8	Low	58.2	Low	121 Å²	121	93.4 Å²	93.4	62%	0.621	48%	0.477	S	S	*	.	H	α-helix	trans	-63.1	-49.7	173	-59	172.7	0	0	0	110	N472 F478	N472-I474 PolarHBondContact O-N 3.36Å; I474-F478 HydrophobicContact CG2-CB 4.45Å; I474-F478 WeakPolarHBondContact O-CA 3.41Å; I474-F478 WeakPolarHBondContact O-CB 3.42Å; I474-F478 PolarHBondContact O-N 2.84Å
475	I	60.6	Low	58.9	Low	65 Å²	65	101 Å²	101	33%	0.333	50%	0.504	S	S	.	.	H	α-helix	trans	-69.8	-41.7	-175.4	-61.7	174.4	0	0	0	110.7	V467 L470 N472 F479	V467-I475 HydrophobicContact CG1-CG2 4.39Å; L470-I475 HydrophobicContact CB-CD1 4.34Å; N472-I475 HydrophobicContact CB-CD1 4.18Å; N472-I475 HydrophobicContact CB-CG1 4.19Å; N472-I475 PolarHBondContact O-N 3.02Å; I475-F479 WeakPolarHBondContact O-CB 3.42Å; I475-F479 PolarHBondContact O-N 2.85Å; I475-F479 VanDerWaalsContact O-N 3.13Å
476	T	57	Low	59.6	Low	74 Å²	74	98.3 Å²	98.3	45%	0.454	50%	0.498	S	S	.	.	H	α-helix	trans	-73.7	-27.8	-175.8	55.9	0	0	0	0	113.8	N472 P473 P480	N472-T476 PolarHBondContact O-N 3.39Å; P473-T476 PolarHBondContact O-OG1 3.25Å; T476-P480 VanDerWaalsContact O-CD 3.31Å; T476-P480 WeakPolarHBondContact O-CD 3.41Å; T476-P480 WeakPolarHBondContact O-CG 3.33Å
477	Q	57.6	Low	60.3	Low	144 Å²	144	96.3 Å²	96.3	67%	0.673	48%	0.48	S	S	*	.	H	α-helix	trans	-98.2	-34	177.9	-61.9	-177.4	-3.6	0	0	113.6	P473 T481	P473-Q477 WeakPolarHBondContact O-CB 3.42Å; P473-Q477 WeakPolarHBondContact O-CG 3.3Å; P473-Q477 PolarHBondContact O-N 2.97Å; P473-Q477 VanDerWaalsContact O-N 3.15Å; Q477-T481 PolarHBondContact O-OG1 3.27Å
478	F	66.3	Low	60.8	Low	121 Å²	121	97.4 Å²	97.4	53%	0.531	49%	0.491	S	S	.	.	H	α-helix	trans	-81.5	-36.3	-178.3	-172	-108.3	0	0	0	112.8	I474 T481 L482	I474-F478 HydrophobicContact CG2-CB 4.45Å; I474-F478 WeakPolarHBondContact O-CA 3.41Å; I474-F478 WeakPolarHBondContact O-CB 3.42Å; I474-F478 PolarHBondContact O-N 2.84Å; F478-T481 WeakPolarHBondContact CA-OG1 3.21Å; F478-T481 PolarHBondContact O-N 3.23Å; F478-T481 PolarHBondContact O-OG1 2.95Å; F478-L482 HydrophobicContact CD1-CB 4.33Å; F478-L482 HydrophobicContact CD1-CD2 4.38Å; F478-L482 HydrophobicContact CE1-CB 4.16Å; F478-L482 HydrophobicContact CE1-CD1 4.37Å; F478-L482 HydrophobicContact CE1-CD2 3.83Å; F478-L482 HydrophobicContact CE1-CG 4.34Å; F478-L482 HydrophobicContact CZ-CB 4.46Å; F478-L482 HydrophobicContact CZ-CD1 4.27Å; F478-L482 VanDerWaalsContact O-CB 3.24Å; F478-L482 WeakPolarHBondContact O-CB 3.39Å; F478-L482 PolarHBondContact O-N 2.92Å
479	F	64.3	Low	61.6	Low	102 Å²	102	94.3 Å²	94.3	45%	0.447	49%	0.486	S	S	.	.	H	α-helix	trans	-62.4	-45.6	-177.4	-178.3	-95.4	0	0	0	112.6	I475 T481 L483	I475-F479 WeakPolarHBondContact O-CB 3.42Å; I475-F479 PolarHBondContact O-N 2.85Å; I475-F479 VanDerWaalsContact O-N 3.13Å; F479-T481 VanDerWaalsContact C-N 3.35Å; F479-T481 PolarHBondContact O-N 3.4Å; F479-L483 HydrophobicContact CE1-CD2 4.3Å; F479-L483 WeakPolarHBondContact O-CB 3.31Å; F479-L483 PolarHBondContact O-N 3.38Å
480	P	55.6	Low	62.4	Low	40 Å²	40	88 Å²	88	26%	0.26	47%	0.466	S	S	.	.	H	α-helix	trans	-58	-41.8	174.1	-31.1	40.3	0	0	0	114.9	I455 T476 L484	I455-P480 VanDerWaalsContact CD1-CA 3.5Å; I455-P480 HydrophobicContact CD1-CB 3.53Å; I455-P480 HydrophobicContact CD1-CG 4.07Å; I455-P480 HydrophobicContact CG2-CG 4.42Å; T476-P480 VanDerWaalsContact O-CD 3.31Å; T476-P480 WeakPolarHBondContact O-CD 3.41Å; T476-P480 WeakPolarHBondContact O-CG 3.33Å; P480-L484 WeakPolarHBondContact O-CB 3.46Å; P480-L484 PolarHBondContact O-N 3.26Å
481	T	58.5	Low	63.2	Low	72 Å²	72	85 Å²	85	44%	0.442	45%	0.451	S	S	.	.	H	α-helix	trans	-74.7	-42.8	-177	36.3	0	0	0	0	111.4	Q477 F478 F479 L484 W485	Q477-T481 PolarHBondContact O-OG1 3.27Å; F478-T481 WeakPolarHBondContact CA-OG1 3.21Å; F478-T481 PolarHBondContact O-N 3.23Å; F478-T481 PolarHBondContact O-OG1 2.95Å; F479-T481 VanDerWaalsContact C-N 3.35Å; F479-T481 PolarHBondContact O-N 3.4Å; T481-L484 PolarHBondContact O-N 2.85Å; T481-W485 WeakPolarHBondContact O-CB 3.32Å; T481-W485 PolarHBondContact O-N 2.95Å
482	L	65.2	Low	63.8	Low	69 Å²	69	78.7 Å²	78.7	36%	0.361	42%	0.418	S	S	.	.	H	α-helix	trans	-61.5	-44	172	-177.7	70.4	0	0	0	111.3	F478 L484 W485 C486	F478-L482 HydrophobicContact CD1-CB 4.33Å; F478-L482 HydrophobicContact CD1-CD2 4.38Å; F478-L482 HydrophobicContact CE1-CB 4.16Å; F478-L482 HydrophobicContact CE1-CD1 4.37Å; F478-L482 HydrophobicContact CE1-CD2 3.83Å; F478-L482 HydrophobicContact CE1-CG 4.34Å; F478-L482 HydrophobicContact CZ-CB 4.46Å; F478-L482 HydrophobicContact CZ-CD1 4.27Å; F478-L482 VanDerWaalsContact O-CB 3.24Å; F478-L482 WeakPolarHBondContact O-CB 3.39Å; F478-L482 PolarHBondContact O-N 2.92Å; L482-L484 PolarHBondContact O-N 3.19Å; L482-W485 PolarHBondContact O-N 2.98Å; L482-C486 WeakPolarHBondContact O-CB 3.41Å; L482-C486 PolarHBondContact O-N 3.41Å; L482-C486 PolarHBondContact O-SG 2.94Å
483	L	62.8	Low	64.6	Low	37 Å²	37	77.3 Å²	77.3	19%	0.194	41%	0.413	C	S	.	.	H	α-helix	trans	-61.7	-44.9	179.3	-172.3	70.6	0	0	0	111.3	I455 F479 C486 F487	I455-L483 HydrophobicContact CD1-CD2 4.11Å; I455-L483 HydrophobicContact CG1-CD2 4.1Å; F479-L483 HydrophobicContact CE1-CD2 4.3Å; F479-L483 WeakPolarHBondContact O-CB 3.31Å; F479-L483 PolarHBondContact O-N 3.38Å; L483-C486 PolarHBondContact O-N 3.47Å; L483-F487 HydrophobicContact CD1-CD2 4.05Å; L483-F487 HydrophobicContact CD1-CE2 3.36Å; L483-F487 HydrophobicContact CD1-CZ 3.7Å; L483-F487 HydrophobicContact CD2-CE2 3.9Å; L483-F487 HydrophobicContact CG-CD2 3.77Å; L483-F487 HydrophobicContact CG-CE2 3.37Å; L483-F487 HydrophobicContact CG-CZ 4.23Å; L483-F487 WeakPolarHBondContact O-CD2 3.23Å; L483-F487 WeakPolarHBondContact O-CG 3.49Å; L483-F487 PolarHBondContact O-N 3.44Å
484	L	62.3	Low	65.7	Low	90 Å²	90	75 Å²	75	47%	0.471	40%	0.396	S	S	.	.	H	α-helix	trans	-63.4	-42.1	176.4	-174.5	128	0	0	0	111.8	P451 P480 T481 L482 S488	P451-L484 HydrophobicContact CB-CB 4.28Å; P451-L484 HydrophobicContact CB-CD1 4.06Å; P451-L484 HydrophobicContact CB-CG 4.44Å; P451-L484 HydrophobicContact CG-CB 4.47Å; P451-L484 HydrophobicContact CG-CD1 3.98Å; P451-L484 HydrophobicContact CG-CG 4.21Å; P480-L484 WeakPolarHBondContact O-CB 3.46Å; P480-L484 PolarHBondContact O-N 3.26Å; T481-L484 PolarHBondContact O-N 2.85Å; L482-L484 PolarHBondContact O-N 3.19Å; L484-S488 WeakPolarHBondContact O-CB 3.34Å; L484-S488 PolarHBondContact O-N 3.42Å
485	W	65.4	Low	67	Low	178 Å²	178	69.5 Å²	69.5	67%	0.674	37%	0.368	S	S	*	.	H	α-helix	trans	-64.9	-46.8	176.5	-174.5	81.9	0	0	0	112.1	T481 L482 F487 S488 A489	T481-W485 WeakPolarHBondContact O-CB 3.32Å; T481-W485 PolarHBondContact O-N 2.95Å; L482-W485 PolarHBondContact O-N 2.98Å; W485-F487 PolarHBondContact O-N 3.22Å; W485-S488 PolarHBondContact O-N 3.33Å; W485-A489 PolarHBondContact O-N 3Å
486	C	68.1	Low	68	Low	57 Å²	57	68.8 Å²	68.8	39%	0.385	36%	0.361	S	S	.	.	H	α-helix	trans	-58.8	-45.1	176.6	-76.8	0	0	0	0	111.9	L482 L483 A489 L490	L482-C486 WeakPolarHBondContact O-CB 3.41Å; L482-C486 PolarHBondContact O-N 3.41Å; L482-C486 PolarHBondContact O-SG 2.94Å; L483-C486 PolarHBondContact O-N 3.47Å; C486-A489 PolarHBondContact O-N 3.04Å; C486-L490 VanDerWaalsContact O-CB 3.24Å; C486-L490 WeakPolarHBondContact O-CB 3.46Å; C486-L490 PolarHBondContact O-N 3.33Å
487	F	68.8	Low	69.4	Low	49 Å²	49	69.4 Å²	69.4	22%	0.215	36%	0.356	C	S	.	.	H	α-helix	trans	-68.6	-38.5	177.7	-71.2	-43.2	0	0	0	112.7	L448 P451 L483 W485 A489 L490 L491	L448-F487 HydrophobicContact CD2-CB 4.04Å; L448-F487 HydrophobicContact CD2-CD1 3.09Å; L448-F487 HydrophobicContact CD2-CD2 4.02Å; L448-F487 HydrophobicContact CD2-CE1 3.34Å; L448-F487 HydrophobicContact CD2-CE2 4.2Å; L448-F487 HydrophobicContact CD2-CG 3.47Å; L448-F487 VanDerWaalsContact CD2-CG 3.47Å; L448-F487 HydrophobicContact CD2-CZ 3.9Å; P451-F487 HydrophobicContact CB-CD2 4.21Å; P451-F487 HydrophobicContact CG-CD2 4.28Å; L483-F487 HydrophobicContact CD1-CD2 4.05Å; L483-F487 HydrophobicContact CD1-CE2 3.36Å; L483-F487 HydrophobicContact CD1-CZ 3.7Å; L483-F487 HydrophobicContact CD2-CE2 3.9Å; L483-F487 HydrophobicContact CG-CD2 3.77Å; L483-F487 HydrophobicContact CG-CE2 3.37Å; L483-F487 HydrophobicContact CG-CZ 4.23Å; L483-F487 WeakPolarHBondContact O-CD2 3.23Å; L483-F487 WeakPolarHBondContact O-CG 3.49Å; L483-F487 PolarHBondContact O-N 3.44Å; W485-F487 PolarHBondContact O-N 3.22Å; F487-A489 VanDerWaalsContact C-N 3.31Å; F487-A489 PolarHBondContact O-N 3.26Å; F487-L490 PolarHBondContact O-N 2.96Å; F487-L491 WeakPolarHBondContact O-CB 3.33Å; F487-L491 WeakPolarHBondContact O-CD1 3.38Å; F487-L491 WeakPolarHBondContact O-CG 3.39Å; F487-L491 PolarHBondContact O-N 3.16Å
488	S	65.3	Low	70.9	Confident	79 Å²	79	62.9 Å²	62.9	55%	0.552	33%	0.326	S	S	*	.	H	α-helix	trans	-60.1	-40.1	174.3	-174.8	0	0	0	0	112.2	L484 W485 P492	L484-S488 WeakPolarHBondContact O-CB 3.34Å; L484-S488 PolarHBondContact O-N 3.42Å; W485-S488 PolarHBondContact O-N 3.33Å; S488-P492 WeakPolarHBondContact O-CD 3.25Å
489	A	69.2	Low	71.8	Confident	57 Å²	57	57.1 Å²	57.1	47%	0.471	30%	0.301	S	S	.	.	H	α-helix	trans	-73.2	-32.4	175.8	0	0	0	0	0	113.5	W485 C486 F487	W485-A489 PolarHBondContact O-N 3Å; C486-A489 PolarHBondContact O-N 3.04Å; F487-A489 VanDerWaalsContact C-N 3.31Å; F487-A489 PolarHBondContact O-N 3.26Å
490	L	73.6	Confident	72.8	Confident	82 Å²	82	56.8 Å²	56.8	43%	0.429	30%	0.299	S	S	.	.	H	α-helix	trans	-78.8	-33.6	-177.3	-173.2	66.5	0	0	0	113	C486 F487 T493 I494	C486-L490 VanDerWaalsContact O-CB 3.24Å; C486-L490 WeakPolarHBondContact O-CB 3.46Å; C486-L490 PolarHBondContact O-N 3.33Å; F487-L490 PolarHBondContact O-N 2.96Å; L490-T493 WeakPolarHBondContact O-CB 3.4Å; L490-T493 PolarHBondContact O-N 3.46Å; L490-T493 VanDerWaalsContact O-N 3.09Å; L490-I494 HydrophobicContact CD1-CG1 4.43Å; L490-I494 HydrophobicContact CD2-CD1 3.84Å; L490-I494 HydrophobicContact CD2-CG1 4.47Å; L490-I494 HydrophobicContact CG-CD1 3.65Å; L490-I494 HydrophobicContact CG-CG1 3.93Å; L490-I494 WeakPolarHBondContact O-CG1 3.31Å; L490-I494 PolarHBondContact O-N 3.41Å
491	L	72.8	Confident	74.4	Confident	28 Å²	28	60 Å²	60	15%	0.147	31%	0.309	C	S	.	.	H	α-helix	trans	-50.6	-50.9	-174.2	-86.2	163.9	0	0	0	114.2	L445 L448 T449 F487 T493 I494 V495	L445-L491 HydrophobicContact CD2-CD2 3.2Å; L448-L491 HydrophobicContact CB-CD2 4.11Å; T449-L491 HydrophobicContact CG2-CD1 4.17Å; T449-L491 HydrophobicContact CG2-CD2 4.25Å; F487-L491 WeakPolarHBondContact O-CB 3.33Å; F487-L491 WeakPolarHBondContact O-CD1 3.38Å; F487-L491 WeakPolarHBondContact O-CG 3.39Å; F487-L491 PolarHBondContact O-N 3.16Å; L491-T493 VanDerWaalsContact C-N 3.3Å; L491-T493 PolarHBondContact O-N 3.25Å; L491-I494 PolarHBondContact O-N 3.47Å; L491-V495 PolarHBondContact O-N 3.4Å
492	P	69.5	Low	75.8	Confident	20 Å²	20	56.6 Å²	56.6	13%	0.13	29%	0.289	C	S	.	.	H	α-helix	trans	-68.2	-32.3	-179.4	-18.5	32.5	0	0	0	113	S488 V495 Y496 L522 W626	S488-P492 WeakPolarHBondContact O-CD 3.25Å; P492-V495 PolarHBondContact O-N 2.92Å; P492-Y496 PolarHBondContact O-N 3.4Å; P492-L522 HydrophobicContact CG-CD2 4.4Å; P492-W626 HydrophobicContact CB-CH2 3.9Å; P492-W626 HydrophobicContact CB-CZ2 3.17Å; P492-W626 HydrophobicContact CG-CH2 3.39Å; P492-W626 HydrophobicContact CG-CZ2 3.22Å
493	T	77.5	Confident	76.9	Confident	59 Å²	59	53.5 Å²	53.5	36%	0.362	27%	0.273	S	S	.	.	H	α-helix	trans	-66.9	-40.2	176.7	-55.6	0	0	0	0	110.7	L490 L491 Y496 Y497	L490-T493 WeakPolarHBondContact O-CB 3.4Å; L490-T493 PolarHBondContact O-N 3.46Å; L490-T493 VanDerWaalsContact O-N 3.09Å; L491-T493 VanDerWaalsContact C-N 3.3Å; L491-T493 PolarHBondContact O-N 3.25Å; T493-Y496 PolarHBondContact O-N 2.79Å; T493-Y497 HydrophobicContact CG2-CD2 3.61Å; T493-Y497 HydrophobicContact CG2-CE2 3.45Å; T493-Y497 VanDerWaalsContact CG2-CE2 3.45Å; T493-Y497 VanDerWaalsContact O-CD2 3.22Å; T493-Y497 WeakPolarHBondContact O-CD2 3.28Å; T493-Y497 PolarHBondContact O-N 3.42Å
494	I	82.8	Confident	78.2	Confident	32 Å²	32	52.7 Å²	52.7	16%	0.164	27%	0.268	C	S	.	.	H	α-helix	trans	-59.9	-46.5	173.2	-69.7	166.1	0	0	0	110.7	L441 L444 L448 L490 L491 Y496 Y497 S498	L441-I494 HydrophobicContact CD1-CG2 3.71Å; L444-I494 HydrophobicContact CD2-CD1 4.2Å; L444-I494 HydrophobicContact CD2-CG2 3.59Å; L448-I494 HydrophobicContact CD1-CD1 4.11Å; L490-I494 HydrophobicContact CD1-CG1 4.43Å; L490-I494 HydrophobicContact CD2-CD1 3.84Å; L490-I494 HydrophobicContact CD2-CG1 4.47Å; L490-I494 HydrophobicContact CG-CD1 3.65Å; L490-I494 HydrophobicContact CG-CG1 3.93Å; L490-I494 WeakPolarHBondContact O-CG1 3.31Å; L490-I494 PolarHBondContact O-N 3.41Å; L491-I494 PolarHBondContact O-N 3.47Å; I494-Y496 VanDerWaalsContact C-N 3.33Å; I494-Y496 PolarHBondContact O-N 3.03Å; I494-Y497 PolarHBondContact O-N 2.87Å; I494-S498 WeakPolarHBondContact O-CB 3.49Å; I494-S498 PolarHBondContact O-N 3.37Å
495	V	83.3	Confident	79.5	Confident	5 Å²	5	51 Å²	51	3%	0.03	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-41.7	179	179.7	0	0	0	0	110.8	L441 L445 L491 P492 S498 A499 K517 C518 F521	L441-V495 HydrophobicContact CD1-CG2 4.23Å; L445-V495 HydrophobicContact CD1-CG2 3.95Å; L445-V495 HydrophobicContact CD2-CG2 4.19Å; L491-V495 PolarHBondContact O-N 3.4Å; P492-V495 PolarHBondContact O-N 2.92Å; V495-S498 PolarHBondContact O-N 2.79Å; V495-S498 PolarHBondContact O-OG 2.87Å; V495-A499 PolarHBondContact O-N 3.46Å; V495-K517 HydrophobicContact CG1-CB 4.15Å; V495-C518 HydrophobicContact CG1-CB 4.21Å; V495-F521 HydrophobicContact CG1-CD2 4.12Å; V495-F521 HydrophobicContact CG2-CB 4.36Å; V495-F521 HydrophobicContact CG2-CD2 4.26Å
496	Y	82.4	Confident	80.6	Confident	49 Å²	49	43.5 Å²	43.5	19%	0.192	23%	0.23	C	C	.	.	H	α-helix	trans	-59.7	-52.4	175.2	169.8	-103.6	0	0	0	112	P492 T493 I494 S498 A499 F500 T514 Q619	P492-Y496 PolarHBondContact O-N 3.4Å; T493-Y496 PolarHBondContact O-N 2.79Å; I494-Y496 VanDerWaalsContact C-N 3.33Å; I494-Y496 PolarHBondContact O-N 3.03Å; Y496-S498 PolarHBondContact O-N 3.08Å; Y496-A499 PolarHBondContact O-N 2.74Å; Y496-A499 VanDerWaalsContact O-N 3.13Å; Y496-F500 PolarHBondContact O-N 3.21Å; Y496-T514 HydrophobicContact CD2-CG2 4.06Å; Y496-Q619 VanDerWaalsContact CE2-CD 3.44Å; Y496-Q619 PolarHBondContact OH-NE2 2.98Å
497	Y	85.2	Confident	81.5	Confident	87 Å²	87	42.7 Å²	42.7	34%	0.341	22%	0.219	S	C	.	.	H	α-helix	trans	-64.5	-29.8	179.3	-80.2	-64.3	0	0	0	112.9	T493 I494 A499 F500 F501	T493-Y497 HydrophobicContact CG2-CD2 3.61Å; T493-Y497 HydrophobicContact CG2-CE2 3.45Å; T493-Y497 VanDerWaalsContact CG2-CE2 3.45Å; T493-Y497 VanDerWaalsContact O-CD2 3.22Å; T493-Y497 WeakPolarHBondContact O-CD2 3.28Å; T493-Y497 PolarHBondContact O-N 3.42Å; I494-Y497 PolarHBondContact O-N 2.87Å; Y497-A499 VanDerWaalsContact C-N 3.29Å; Y497-A499 PolarHBondContact O-N 2.82Å; Y497-F500 WeakPolarHBondContact O-CB 3.36Å; Y497-F500 PolarHBondContact O-N 3.2Å; Y497-F501 WeakPolarHBondContact O-CD2 3.14Å; Y497-F501 WeakPolarHBondContact O-CG 3.22Å; Y497-F501 PolarHBondContact O-N 3.12Å
498	S	89.2	Confident	82.5	Confident	8 Å²	8	40.8 Å²	40.8	6%	0.056	21%	0.211	C	C	.	.	H	α-helix	trans	-58.8	-41.5	174.5	79	0	0	0	0	111.9	L441 I494 V495 Y496 F501 E502	L441-S498 WeakPolarHBondContact CD2-OG 3.39Å; I494-S498 WeakPolarHBondContact O-CB 3.49Å; I494-S498 PolarHBondContact O-N 3.37Å; V495-S498 PolarHBondContact O-N 2.79Å; V495-S498 PolarHBondContact O-OG 2.87Å; Y496-S498 PolarHBondContact O-N 3.08Å; S498-F501 PolarHBondContact O-N 2.8Å; S498-E502 WeakPolarHBondContact O-CG 3.05Å; S498-E502 PolarHBondContact O-N 3.4Å
499	A	86.1	Confident	83.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-72.3	-36.2	178.3	0	0	0	0	0	111.9	V495 Y496 Y497 F501 E502 T514	V495-A499 PolarHBondContact O-N 3.46Å; Y496-A499 PolarHBondContact O-N 2.74Å; Y496-A499 VanDerWaalsContact O-N 3.13Å; Y497-A499 VanDerWaalsContact C-N 3.29Å; Y497-A499 PolarHBondContact O-N 2.82Å; A499-F501 VanDerWaalsContact C-N 3.35Å; A499-E502 WeakPolarHBondContact O-CB 3.3Å; A499-E502 PolarHBondContact O-N 3.05Å; A499-T514 WeakPolarHBondContact CB-OG1 3.47Å
500	F	85.7	Confident	84.5	Confident	94 Å²	94	35.9 Å²	35.9	41%	0.412	18%	0.175	S	C	.	.	H	α-helix	trans	-59.9	-45.1	172.2	179.3	-99.4	0	0	0	111.5	Y496 Y497 E502 A503	Y496-F500 PolarHBondContact O-N 3.21Å; Y497-F500 WeakPolarHBondContact O-CB 3.36Å; Y497-F500 PolarHBondContact O-N 3.2Å; F500-E502 PolarHBondContact O-N 2.68Å; F500-E502 VanDerWaalsContact O-N 3.15Å; F500-A503 PolarHBondContact O-N 3.34Å; F500-A503 VanDerWaalsContact O-N 3.15Å
501	F	88.1	Confident	85.3	Confident	107 Å²	107	32.9 Å²	32.9	47%	0.469	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-10.4	178.6	-72.6	-56.6	0	0	0	114	R433 I437 Y497 S498 A499 A503	R433-F501 PolarHBondContact NE-O 3.41Å; R433-F501 PolarHBondContact NH2-O 3.2Å; I437-F501 HydrophobicContact CD1-CB 3.84Å; I437-F501 VanDerWaalsContact CD1-O 3.25Å; I437-F501 WeakPolarHBondContact CD1-O 3.33Å; Y497-F501 WeakPolarHBondContact O-CD2 3.14Å; Y497-F501 WeakPolarHBondContact O-CG 3.22Å; Y497-F501 PolarHBondContact O-N 3.12Å; S498-F501 PolarHBondContact O-N 2.8Å; A499-F501 VanDerWaalsContact C-N 3.35Å; F501-A503 PolarHBondContact O-N 3.46Å
502	E	88.6	Confident	86	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-13.8	172.8	-70.1	-178.8	152.5	0	0	113.5	W430 C434 I437 N438 S498 A499 F500 H504 T513 K517	W430-E502 PolarHBondContact NE1-O 3.31Å; C434-E502 PolarHBondContact SG-OE1 3.48Å; I437-E502 HydrophobicContact CD1-CG 4.1Å; I437-E502 HydrophobicContact CG2-CG 4.43Å; N438-E502 PolarHBondContact ND2-OE1 2.83Å; S498-E502 WeakPolarHBondContact O-CG 3.05Å; S498-E502 PolarHBondContact O-N 3.4Å; A499-E502 WeakPolarHBondContact O-CB 3.3Å; A499-E502 PolarHBondContact O-N 3.05Å; F500-E502 PolarHBondContact O-N 2.68Å; F500-E502 VanDerWaalsContact O-N 3.15Å; E502-H504 IonicContact OE2-NE2 2.74Å; E502-H504 PolarHBondContact OE2-NE2 2.99Å; E502-H504 VanDerWaalsContact OE2-NE2 3.14Å; E502-T513 WeakPolarHBondContact OE2-CG2 3.44Å; E502-K517 IonicContact OE1-NZ 3.19Å; E502-K517 PolarHBondContact OE1-NZ 3.32Å; E502-K517 IonicContact OE2-NZ 3.28Å; E502-K517 PolarHBondContact OE2-NZ 3.41Å
503	A	88.5	Confident	87	Confident	4 Å²	4	37.5 Å²	37.5	3%	0.033	18%	0.176	C	C	.	.			trans	52	58	177.1	0	0	0	0	0	112.7	I425 F500 F501	I425-A503 HydrophobicContact CD1-CB 4.27Å; F500-A503 PolarHBondContact O-N 3.34Å; F500-A503 VanDerWaalsContact O-N 3.15Å; F501-A503 PolarHBondContact O-N 3.46Å
504	H	89.3	Confident	87.6	Confident	20 Å²	20	34.9 Å²	34.9	9%	0.093	16%	0.16	C	C	.	.			trans	-64.2	140.2	172.2	-69.5	-92	0	0	0	110.1	Y419 H422 W430 E502 T506 E510 T513	Y419-H504 WeakPolarHBondContact CD2-O 3.44Å; H422-H504 PolarHBondContact ND1-O 3.29Å; W430-H504 AromaticContact CZ2-CE1 3.62Å; W430-H504 AromaticContact CZ2-ND1 3.86Å; E502-H504 IonicContact OE2-NE2 2.74Å; E502-H504 PolarHBondContact OE2-NE2 2.99Å; E502-H504 VanDerWaalsContact OE2-NE2 3.14Å; H504-T506 VanDerWaalsContact C-N 3.31Å; H504-E510 HydrophobicContact CB-CB 4.04Å; H504-T513 PolarHBondContact CE1-OG1 3.38Å
505	W	89.5	Confident	88	Confident	54 Å²	54	33.4 Å²	33.4	21%	0.205	15%	0.152	C	C	.	.	S	Bend	trans	-81.3	-9.3	179.2	71.3	-83.3	0	0	0	113.9	F243 P413 I418 Y419 H422 L423	F243-W505 HydrophobicContact CD1-CH2 4.09Å; F243-W505 AromaticContact CE1-CH2 3.82Å; F243-W505 HydrophobicContact CE1-CH2 3.82Å; F243-W505 HydrophobicContact CE1-CZ2 4.09Å; F243-W505 HydrophobicContact CE1-CZ3 4.46Å; F243-W505 HydrophobicContact CZ-CH2 4.28Å; F243-W505 HydrophobicContact CZ-CZ3 4.48Å; P413-W505 HydrophobicContact CG-CH2 3.95Å; P413-W505 HydrophobicContact CG-CZ3 3.84Å; I418-W505 HydrophobicContact CG1-CZ3 4.5Å; I418-W505 HydrophobicContact CG2-CE3 4.46Å; Y419-W505 PolarHBondContact N-O 3.1Å; H422-W505 HydrophobicContact CB-CB 4.38Å; L423-W505 HydrophobicContact CD1-CB 4.43Å; L423-W505 HydrophobicContact CD1-CD2 4.2Å; L423-W505 HydrophobicContact CD1-CE3 3.68Å; L423-W505 HydrophobicContact CD1-CZ3 4.32Å
506	T	89.5	Confident	88.3	Confident	21 Å²	21	36.2 Å²	36.2	13%	0.129	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-121.7	140	171.5	56	0	0	0	0	110.7	P413 N417 H504 S508 G509 E510	P413-T506 HydrophobicContact CB-CG2 4.42Å; P413-T506 HydrophobicContact CG-CG2 4.18Å; N417-T506 CarbonylContact O-C 3.58Å; N417-T506 VanDerWaalsContact O-CA 3.3Å; N417-T506 WeakPolarHBondContact O-CA 3.36Å; H504-T506 VanDerWaalsContact C-N 3.31Å; T506-S508 VanDerWaalsContact C-N 3.29Å; T506-S508 PolarHBondContact O-N 2.93Å; T506-G509 PolarHBondContact O-N 3.48Å; T506-G509 PolarHBondContact OG1-N 2.9Å; T506-E510 PolarHBondContact O-N 3.19Å
507	R	87.3	Confident	88.6	Confident	41 Å²	41	35.3 Å²	35.3	16%	0.155	16%	0.162	C	C	.	.	H	α-helix	trans	-64.2	-35.6	175.8	-175.2	174.6	-67.5	174.8	-18.5	112.5	N417 Y419 N511 E617 L672	N417-R507 PolarHBondContact O-N 3.46Å; N417-R507 WeakPolarHBondContact OD1-CB 3.43Å; N417-R507 PolarHBondContact OD1-N 3.47Å; Y419-R507 HydrophobicContact CD2-CB 4.42Å; Y419-R507 VanDerWaalsContact CE2-CA 3.48Å; Y419-R507 HydrophobicContact CE2-CB 3.75Å; Y419-R507 HydrophobicContact CE2-CG 4.27Å; Y419-R507 PolarHBondContact OH-NE 3.09Å; R507-N511 PolarHBondContact O-N 3.41Å; R507-N511 PolarHBondContact O-ND2 2.87Å; R507-E617 VanDerWaalsContact CD-OE2 3.26Å; R507-E617 WeakPolarHBondContact CD-OE2 3.48Å; R507-E617 IonicContact CZ-OE1 3.07Å; R507-E617 IonicContact CZ-OE2 3.97Å; R507-E617 IonicContact NE-OE1 2.82Å; R507-E617 IonicContact NE-OE2 2.64Å; R507-E617 PolarHBondContact NE-OE2 2.78Å; R507-E617 IonicContact NH1-OE1 3.55Å; R507-E617 PolarHBondContact NH1-OE1 2.93Å; R507-E617 IonicContact NH1-OE2 2.78Å; R507-E617 PolarHBondContact NH1-OE2 3.35Å; R507-E617 VanDerWaalsContact NH1-OE2 3.12Å; R507-E617 IonicContact NH2-OE1 3.74Å; R507-E617 PolarHBondContact NH2-OE1 3.1Å; R507-E617 IonicContact NH2-OE2 2.6Å; R507-E617 PolarHBondContact NH2-OE2 3.27Å; R507-E617 VanDerWaalsContact NH2-OE2 3.07Å; R507-L672 HydrophobicContact CG-CD2 4.15Å
508	S	88.7	Confident	88.8	Confident	8 Å²	8	31.4 Å²	31.4	6%	0.056	15%	0.147	C	C	.	.	H	α-helix	trans	-66.4	-38.7	173.7	-63.1	0	0	0	0	112.6	N417 T506 R512 L672 D673 I676	N417-S508 PolarHBondContact ND2-OG 3.38Å; N417-S508 WeakPolarHBondContact OD1-CB 3Å; N417-S508 PolarHBondContact OD1-N 3.11Å; N417-S508 PolarHBondContact OD1-OG 3.04Å; T506-S508 VanDerWaalsContact C-N 3.29Å; T506-S508 PolarHBondContact O-N 2.93Å; S508-R512 VanDerWaalsContact O-CB 3.27Å; S508-R512 WeakPolarHBondContact O-CB 3.41Å; S508-R512 PolarHBondContact O-N 3.48Å; S508-L672 WeakPolarHBondContact OG-CA 3.41Å; S508-D673 PolarHBondContact OG-N 3.04Å; S508-I676 WeakPolarHBondContact O-CD1 3.27Å
509	G	88.6	Confident	88.8	Confident	19 Å²	19	31.6 Å²	31.6	20%	0.196	15%	0.147	C	C	.	.	H	α-helix	trans	-65.6	-43.6	176.6	0	0	0	0	0	112.5	T506 T513	T506-G509 PolarHBondContact O-N 3.48Å; T506-G509 PolarHBondContact OG1-N 2.9Å; G509-T513 WeakPolarHBondContact O-CB 3.47Å; G509-T513 PolarHBondContact O-N 2.97Å; G509-T513 PolarHBondContact O-OG1 2.82Å
510	E	88.8	Confident	88.9	Confident	15 Å²	15	35.8 Å²	35.8	7%	0.07	17%	0.173	C	C	.	.	H	α-helix	trans	-57.4	-57.7	173.8	-169.7	-170.4	160.4	0	0	110.7	Y419 H504 T506 R512 T513 T514	Y419-E510 WeakPolarHBondContact CE2-OE2 3.47Å; Y419-E510 PolarHBondContact OH-OE2 3.16Å; H504-E510 HydrophobicContact CB-CB 4.04Å; T506-E510 PolarHBondContact O-N 3.19Å; E510-R512 VanDerWaalsContact C-N 3.31Å; E510-R512 PolarHBondContact O-N 3.13Å; E510-T513 PolarHBondContact O-N 2.94Å; E510-T513 VanDerWaalsContact O-N 3.11Å; E510-T514 PolarHBondContact O-N 2.61Å; E510-T514 PolarHBondContact O-OG1 3.35Å
511	N	89.4	Confident	88.9	Confident	18 Å²	18	33.3 Å²	33.3	10%	0.096	16%	0.162	C	C	.	.	H	α-helix	trans	-58.8	-40.4	-178.4	-85	-74.3	0	0	0	112.8	R507 M515 G621 I676	R507-N511 PolarHBondContact O-N 3.41Å; R507-N511 PolarHBondContact O-ND2 2.87Å; N511-M515 WeakPolarHBondContact O-CB 3.18Å; N511-M515 PolarHBondContact O-N 2.89Å; N511-G621 VanDerWaalsContact O-CA 3.31Å; N511-G621 WeakPolarHBondContact O-CA 3.09Å; N511-G621 PolarHBondContact OD1-N 3.49Å; N511-I676 HydrophobicContact CB-CD1 3.9Å
512	R	88.9	Confident	88.7	Confident	110 Å²	110	28.9 Å²	28.9	42%	0.415	14%	0.143	S	C	.	.	H	α-helix	trans	-63.6	-43.7	177.1	-176.5	178.5	174.2	-176.2	-0.9	111.6	S508 E510 M515 H516 I676	S508-R512 VanDerWaalsContact O-CB 3.27Å; S508-R512 WeakPolarHBondContact O-CB 3.41Å; S508-R512 PolarHBondContact O-N 3.48Å; E510-R512 VanDerWaalsContact C-N 3.31Å; E510-R512 PolarHBondContact O-N 3.13Å; R512-M515 WeakPolarHBondContact O-CB 3.46Å; R512-M515 PolarHBondContact O-N 3.42Å; R512-H516 PolarHBondContact O-N 3.21Å; R512-H516 VanDerWaalsContact O-N 3.16Å; R512-H516 PolarHBondContact O-ND1 3.28Å; R512-I676 HydrophobicContact CB-CG1 4.06Å
513	T	89.8	Confident	88.6	Confident	36 Å²	36	29.5 Å²	29.5	22%	0.221	15%	0.146	C	C	.	.	H	α-helix	trans	-67.5	-44	180	-57.1	0	0	0	0	110.6	E502 H504 G509 E510 M515 H516 K517	E502-T513 WeakPolarHBondContact OE2-CG2 3.44Å; H504-T513 PolarHBondContact CE1-OG1 3.38Å; G509-T513 WeakPolarHBondContact O-CB 3.47Å; G509-T513 PolarHBondContact O-N 2.97Å; G509-T513 PolarHBondContact O-OG1 2.82Å; E510-T513 PolarHBondContact O-N 2.94Å; E510-T513 VanDerWaalsContact O-N 3.11Å; T513-M515 VanDerWaalsContact C-N 3.32Å; T513-M515 PolarHBondContact O-N 2.89Å; T513-H516 PolarHBondContact O-N 3Å; T513-K517 HydrophobicContact CG2-CD 3.93Å; T513-K517 VanDerWaalsContact CG2-CE 3.47Å; T513-K517 HydrophobicContact CG2-CG 4.45Å; T513-K517 WeakPolarHBondContact O-CB 3.3Å; T513-K517 WeakPolarHBondContact O-CG 3.36Å; T513-K517 PolarHBondContact O-N 3.4Å
514	T	89.8	Confident	88.2	Confident	4 Å²	4	33 Å²	33	3%	0.025	16%	0.161	C	C	.	.	H	α-helix	trans	-54.7	-47.3	172.4	-57.8	0	0	0	0	111.2	Y496 A499 E510 H516 K517 C518 A622	Y496-T514 HydrophobicContact CD2-CG2 4.06Å; A499-T514 WeakPolarHBondContact CB-OG1 3.47Å; E510-T514 PolarHBondContact O-N 2.61Å; E510-T514 PolarHBondContact O-OG1 3.35Å; T514-H516 PolarHBondContact O-N 3.28Å; T514-K517 PolarHBondContact O-N 3.46Å; T514-C518 WeakPolarHBondContact O-CB 3.19Å; T514-C518 PolarHBondContact O-N 3.32Å; T514-A622 HydrophobicContact CG2-CB 4.46Å
515	M	91.1	Very high	87.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57.9	-50.8	178.6	-174	179.6	68.4	0	0	112.3	N511 R512 T513 Y519 G621 Y624 M628 A680	N511-M515 WeakPolarHBondContact O-CB 3.18Å; N511-M515 PolarHBondContact O-N 2.89Å; R512-M515 WeakPolarHBondContact O-CB 3.46Å; R512-M515 PolarHBondContact O-N 3.42Å; T513-M515 VanDerWaalsContact C-N 3.32Å; T513-M515 PolarHBondContact O-N 2.89Å; M515-Y519 WeakPolarHBondContact O-CB 3.47Å; M515-Y519 PolarHBondContact O-N 3.48Å; M515-G621 WeakPolarHBondContact CA-O 3.27Å; M515-G621 WeakPolarHBondContact CB-O 3.48Å; M515-Y624 HydrophobicContact SD-CD2 4.24Å; M515-Y624 HydrophobicContact SD-CG 4.13Å; M515-M628 HydrophobicContact CG-CE 3.9Å; M515-M628 HydrophobicContact SD-CE 4.02Å; M515-A680 HydrophobicContact SD-CB 3.94Å
516	H	89.5	Confident	87.1	Confident	65 Å²	65	32.3 Å²	32.3	30%	0.301	16%	0.162	S	C	.	.	H	α-helix	trans	-65.3	-44.1	-177.6	-72.8	71.4	0	0	0	112.2	R512 T513 T514 T520 Q683	R512-H516 PolarHBondContact O-N 3.21Å; R512-H516 VanDerWaalsContact O-N 3.16Å; R512-H516 PolarHBondContact O-ND1 3.28Å; T513-H516 PolarHBondContact O-N 3Å; T514-H516 PolarHBondContact O-N 3.28Å; H516-T520 WeakPolarHBondContact O-CB 3.3Å; H516-T520 PolarHBondContact O-N 3.41Å; H516-T520 PolarHBondContact O-OG1 3.42Å; H516-Q683 PolarHBondContact CD2-NE2 3.22Å; H516-Q683 PolarHBondContact CE1-NE2 3.26Å; H516-Q683 VanDerWaalsContact CE1-NE2 3.31Å; H516-Q683 PolarHBondContact ND1-NE2 3.24Å; H516-Q683 PolarHBondContact NE2-NE2 3.46Å; H516-Q683 VanDerWaalsContact NE2-NE2 3.13Å
517	K	89.3	Confident	86.6	Confident	29 Å²	29	31.4 Å²	31.4	13%	0.126	16%	0.156	C	C	.	.	H	α-helix	trans	-66.7	-51.9	179.6	-72	179.4	-179	177.9	0	111.3	N438 V495 E502 T513 T514 Y519 T520 F521	N438-K517 PolarHBondContact ND2-NZ 3.43Å; N438-K517 WeakPolarHBondContact OD1-CE 3.34Å; N438-K517 PolarHBondContact OD1-NZ 3.45Å; V495-K517 HydrophobicContact CG1-CB 4.15Å; E502-K517 IonicContact OE1-NZ 3.19Å; E502-K517 PolarHBondContact OE1-NZ 3.32Å; E502-K517 IonicContact OE2-NZ 3.28Å; E502-K517 PolarHBondContact OE2-NZ 3.41Å; T513-K517 HydrophobicContact CG2-CD 3.93Å; T513-K517 VanDerWaalsContact CG2-CE 3.47Å; T513-K517 HydrophobicContact CG2-CG 4.45Å; T513-K517 WeakPolarHBondContact O-CB 3.3Å; T513-K517 WeakPolarHBondContact O-CG 3.36Å; T513-K517 PolarHBondContact O-N 3.4Å; T514-K517 PolarHBondContact O-N 3.46Å; K517-Y519 VanDerWaalsContact C-N 3.33Å; K517-Y519 PolarHBondContact O-N 3.15Å; K517-T520 PolarHBondContact O-N 3.35Å; K517-F521 HydrophobicContact CB-CD2 4.24Å; K517-F521 HydrophobicContact CB-CE2 4.31Å; K517-F521 WeakPolarHBondContact O-CB 3.43Å; K517-F521 WeakPolarHBondContact O-CD2 3.32Å; K517-F521 PolarHBondContact O-N 2.94Å
518	C	88.4	Confident	86.2	Confident	5 Å²	5	31.5 Å²	31.5	3%	0.034	16%	0.16	C	C	.	.	H	α-helix	trans	-58.4	-46.8	-179.9	-171	0	0	0	0	110.6	V495 T514 T520 L522 A625	V495-C518 HydrophobicContact CG1-CB 4.21Å; T514-C518 WeakPolarHBondContact O-CB 3.19Å; T514-C518 PolarHBondContact O-N 3.32Å; C518-T520 PolarHBondContact O-N 2.83Å; C518-L522 WeakPolarHBondContact O-CB 3.42Å; C518-L522 WeakPolarHBondContact O-CG 3.47Å; C518-L522 PolarHBondContact O-N 3.2Å; C518-L522 WeakPolarHBondContact SG-CD1 3.33Å; C518-A625 HydrophobicContact CB-CB 3.58Å
519	Y	90.3	Very high	85.4	Confident	13 Å²	13	32 Å²	32	5%	0.051	16%	0.162	C	C	.	.	H	α-helix	trans	-60.1	-49	177	179.6	-110.6	0	0	0	112.9	M515 K517 L522 I523 M628 T632 Q683	M515-Y519 WeakPolarHBondContact O-CB 3.47Å; M515-Y519 PolarHBondContact O-N 3.48Å; K517-Y519 VanDerWaalsContact C-N 3.33Å; K517-Y519 PolarHBondContact O-N 3.15Å; Y519-L522 PolarHBondContact O-N 2.73Å; Y519-I523 HydrophobicContact CD1-CD1 4.09Å; Y519-I523 HydrophobicContact CD2-CD1 3.97Å; Y519-I523 HydrophobicContact CD2-CG1 4.44Å; Y519-I523 HydrophobicContact CE1-CD1 3.52Å; Y519-I523 HydrophobicContact CE2-CD1 3.36Å; Y519-I523 HydrophobicContact CE2-CG1 4.15Å; Y519-I523 HydrophobicContact CG-CD1 4.31Å; Y519-I523 WeakPolarHBondContact O-CB 3.47Å; Y519-I523 WeakPolarHBondContact O-CG1 3.37Å; Y519-I523 PolarHBondContact O-N 3.29Å; Y519-I523 VanDerWaalsContact OH-CD1 3.3Å; Y519-I523 WeakPolarHBondContact OH-CD1 3.25Å; Y519-M628 HydrophobicContact CD2-CB 3.9Å; Y519-M628 HydrophobicContact CD2-CE 4.45Å; Y519-M628 HydrophobicContact CE2-CB 3.74Å; Y519-T632 PolarHBondContact OH-OG1 3.27Å; Y519-Q683 HydrophobicContact CD1-CB 4.32Å; Y519-Q683 HydrophobicContact CD1-CG 4.22Å; Y519-Q683 HydrophobicContact CE1-CB 4.04Å; Y519-Q683 HydrophobicContact CE1-CG 4.28Å; Y519-Q683 PolarHBondContact OH-O 3.44Å
520	T	88.1	Confident	84.5	Confident	88 Å²	88	33.1 Å²	33.1	54%	0.54	17%	0.166	S	C	.	.	H	α-helix	trans	-63.6	-45.4	-178.1	-54.7	0	0	0	0	111.6	H516 K517 C518 F524	H516-T520 WeakPolarHBondContact O-CB 3.3Å; H516-T520 PolarHBondContact O-N 3.41Å; H516-T520 PolarHBondContact O-OG1 3.42Å; K517-T520 PolarHBondContact O-N 3.35Å; C518-T520 PolarHBondContact O-N 2.83Å; T520-F524 WeakPolarHBondContact O-CB 3.22Å; T520-F524 PolarHBondContact O-N 3.26Å; T520-F524 VanDerWaalsContact O-N 3.08Å
521	F	84.7	Confident	83.7	Confident	41 Å²	41	32.5 Å²	32.5	18%	0.18	16%	0.163	C	C	.	.	H	α-helix	trans	-69.8	-42.5	178.9	-73.5	-60.5	0	0	0	112.1	L441 L445 V495 K517 I523 F524 M525	L441-F521 HydrophobicContact CD2-CD2 4.24Å; L441-F521 HydrophobicContact CD2-CE2 3.49Å; L441-F521 VanDerWaalsContact CD2-CE2 3.49Å; L441-F521 HydrophobicContact CD2-CZ 3.95Å; L441-F521 HydrophobicContact CG-CE2 4.28Å; L441-F521 HydrophobicContact CG-CZ 4.35Å; L445-F521 HydrophobicContact CD1-CB 4.19Å; L445-F521 HydrophobicContact CD1-CD1 3.29Å; L445-F521 HydrophobicContact CD1-CD2 3.88Å; L445-F521 HydrophobicContact CD1-CE1 3.46Å; L445-F521 VanDerWaalsContact CD1-CE1 3.46Å; L445-F521 HydrophobicContact CD1-CE2 4.05Å; L445-F521 HydrophobicContact CD1-CG 3.52Å; L445-F521 HydrophobicContact CD1-CZ 3.85Å; V495-F521 HydrophobicContact CG1-CD2 4.12Å; V495-F521 HydrophobicContact CG2-CB 4.36Å; V495-F521 HydrophobicContact CG2-CD2 4.26Å; K517-F521 HydrophobicContact CB-CD2 4.24Å; K517-F521 HydrophobicContact CB-CE2 4.31Å; K517-F521 WeakPolarHBondContact O-CB 3.43Å; K517-F521 WeakPolarHBondContact O-CD2 3.32Å; K517-F521 PolarHBondContact O-N 2.94Å; F521-I523 PolarHBondContact O-N 2.51Å; F521-F524 PolarHBondContact O-N 3Å; F521-M525 WeakPolarHBondContact O-CB 3.34Å; F521-M525 VanDerWaalsContact O-CG 3.27Å; F521-M525 WeakPolarHBondContact O-CG 3.29Å; F521-M525 PolarHBondContact O-N 2.82Å
522	L	84.6	Confident	82.6	Confident	15 Å²	15	33.7 Å²	33.7	8%	0.079	17%	0.169	C	C	.	.	H	α-helix	trans	-61.6	-42.4	176.5	-73.4	176.2	0	0	0	111.5	P492 C518 Y519 F524 M525 V526 W626 C629	P492-L522 HydrophobicContact CG-CD2 4.4Å; C518-L522 WeakPolarHBondContact O-CB 3.42Å; C518-L522 WeakPolarHBondContact O-CG 3.47Å; C518-L522 PolarHBondContact O-N 3.2Å; C518-L522 WeakPolarHBondContact SG-CD1 3.33Å; Y519-L522 PolarHBondContact O-N 2.73Å; L522-F524 PolarHBondContact O-N 3.02Å; L522-M525 PolarHBondContact O-N 3.28Å; L522-V526 WeakPolarHBondContact O-CB 3.29Å; L522-V526 WeakPolarHBondContact O-CG2 3.3Å; L522-V526 PolarHBondContact O-N 2.72Å; L522-W626 HydrophobicContact CD1-CD2 3.59Å; L522-W626 HydrophobicContact CD1-CE3 3.65Å; L522-W626 HydrophobicContact CD1-CG 4.09Å; L522-W626 HydrophobicContact CD1-CZ2 4.48Å; L522-W626 HydrophobicContact CD1-CZ3 4.1Å; L522-W626 HydrophobicContact CD2-CE3 4.26Å; L522-W626 HydrophobicContact CD2-CH2 3.86Å; L522-W626 HydrophobicContact CD2-CZ2 4.27Å; L522-W626 HydrophobicContact CD2-CZ3 3.82Å; L522-C629 HydrophobicContact CB-CB 4.16Å; L522-C629 HydrophobicContact CD1-CB 4.27Å
523	I	86.3	Confident	81	Confident	13 Å²	13	29.9 Å²	29.9	7%	0.067	16%	0.164	C	C	.	.	I	π-helix	trans	-61.6	-45.3	174.5	-77.5	178	0	0	0	111.4	Y519 F521 M525 L527 L528 T632 L690	Y519-I523 HydrophobicContact CD1-CD1 4.09Å; Y519-I523 HydrophobicContact CD2-CD1 3.97Å; Y519-I523 HydrophobicContact CD2-CG1 4.44Å; Y519-I523 HydrophobicContact CE1-CD1 3.52Å; Y519-I523 HydrophobicContact CE2-CD1 3.36Å; Y519-I523 HydrophobicContact CE2-CG1 4.15Å; Y519-I523 HydrophobicContact CG-CD1 4.31Å; Y519-I523 WeakPolarHBondContact O-CB 3.47Å; Y519-I523 WeakPolarHBondContact O-CG1 3.37Å; Y519-I523 PolarHBondContact O-N 3.29Å; Y519-I523 VanDerWaalsContact OH-CD1 3.3Å; Y519-I523 WeakPolarHBondContact OH-CD1 3.25Å; F521-I523 PolarHBondContact O-N 2.51Å; I523-M525 VanDerWaalsContact C-N 3.3Å; I523-M525 PolarHBondContact O-N 2.82Å; I523-L527 HydrophobicContact CG2-CD2 4.45Å; I523-L527 WeakPolarHBondContact O-CA 3.5Å; I523-L527 VanDerWaalsContact O-CB 3.32Å; I523-L527 WeakPolarHBondContact O-CB 3.45Å; I523-L527 PolarHBondContact O-N 2.71Å; I523-L528 HydrophobicContact CG2-CD1 4.2Å; I523-L528 HydrophobicContact CG2-CG 4.23Å; I523-L528 PolarHBondContact O-N 3.3Å; I523-T632 HydrophobicContact CD1-CG2 3.86Å; I523-T632 HydrophobicContact CG1-CG2 4.33Å; I523-L690 HydrophobicContact CD1-CD1 4.06Å; I523-L690 HydrophobicContact CG2-CD1 4.25Å
524	F	80.8	Confident	79.2	Confident	79 Å²	79	28.8 Å²	28.8	35%	0.346	16%	0.157	S	C	.	.	I	π-helix	trans	-62.2	-41.1	-179.4	-174.4	-102.4	0	0	0	111.7	T520 F521 L522 L528 L529	T520-F524 WeakPolarHBondContact O-CB 3.22Å; T520-F524 PolarHBondContact O-N 3.26Å; T520-F524 VanDerWaalsContact O-N 3.08Å; F521-F524 PolarHBondContact O-N 3Å; L522-F524 PolarHBondContact O-N 3.02Å; F524-L528 HydrophobicContact CD2-CB 4.3Å; F524-L528 HydrophobicContact CD2-CD1 3.95Å; F524-L528 PolarHBondContact O-N 2.75Å; F524-L529 HydrophobicContact CD1-CD1 4.12Å; F524-L529 HydrophobicContact CD1-CG 4.18Å; F524-L529 HydrophobicContact CE1-CD1 3.72Å; F524-L529 HydrophobicContact CE1-CD2 3.98Å; F524-L529 HydrophobicContact CE1-CG 3.82Å; F524-L529 HydrophobicContact CE2-CD2 4.36Å; F524-L529 HydrophobicContact CZ-CD1 4.36Å; F524-L529 HydrophobicContact CZ-CD2 3.74Å; F524-L529 HydrophobicContact CZ-CG 4.03Å; F524-L529 WeakPolarHBondContact O-CG 3.48Å; F524-L529 PolarHBondContact O-N 3.39Å
525	M	76.5	Confident	77.6	Confident	32 Å²	32	30 Å²	30	16%	0.158	17%	0.165	C	C	.	.	I	π-helix	trans	-83.5	-41.3	-176.7	-61.3	-42.5	172.4	0	0	115	L445 T449 F521 L522 I523 L529 P530	L445-M525 HydrophobicContact CB-CE 3.98Å; T449-M525 HydrophobicContact CG2-CE 3.4Å; T449-M525 HydrophobicContact CG2-CG 3.78Å; T449-M525 HydrophobicContact CG2-SD 3.09Å; T449-M525 WeakPolarHBondContact CG2-SD 3.28Å; F521-M525 WeakPolarHBondContact O-CB 3.34Å; F521-M525 VanDerWaalsContact O-CG 3.27Å; F521-M525 WeakPolarHBondContact O-CG 3.29Å; F521-M525 PolarHBondContact O-N 2.82Å; L522-M525 PolarHBondContact O-N 3.28Å; I523-M525 VanDerWaalsContact C-N 3.3Å; I523-M525 PolarHBondContact O-N 2.82Å; M525-L529 HydrophobicContact SD-CD1 3.45Å; M525-L529 WeakPolarHBondContact SD-CD1 3.5Å; M525-L529 HydrophobicContact SD-CG 4.47Å; M525-P530 WeakPolarHBondContact O-CD 3.45Å; M525-P530 WeakPolarHBondContact O-CG 3.44Å
526	V	78	Confident	76	Confident	26 Å²	26	30.2 Å²	30.2	16%	0.158	17%	0.167	C	C	.	.	I	π-helix	trans	-82.8	-43.9	-176.6	176.4	0	0	0	0	109.9	L522 P530 F569 Y572 V633	L522-V526 WeakPolarHBondContact O-CB 3.29Å; L522-V526 WeakPolarHBondContact O-CG2 3.3Å; L522-V526 PolarHBondContact O-N 2.72Å; V526-P530 WeakPolarHBondContact O-CG 3.37Å; V526-F569 WeakPolarHBondContact O-CE1 3.47Å; V526-F569 WeakPolarHBondContact O-CZ 3.45Å; V526-Y572 HydrophobicContact CG1-CD1 4.26Å; V526-Y572 HydrophobicContact CG1-CE1 3.63Å; V526-Y572 HydrophobicContact CG1-CE2 4.07Å; V526-V633 HydrophobicContact CG1-CG2 4.13Å
527	L	79.9	Confident	74.2	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.01	16%	0.16	C	C	.	.	I	π-helix	trans	-98.9	-59.6	-172.9	-174	123.6	0	0	0	111.9	I523 S531 V633 T636 Y637	I523-L527 HydrophobicContact CG2-CD2 4.45Å; I523-L527 WeakPolarHBondContact O-CA 3.5Å; I523-L527 VanDerWaalsContact O-CB 3.32Å; I523-L527 WeakPolarHBondContact O-CB 3.45Å; I523-L527 PolarHBondContact O-N 2.71Å; L527-S531 WeakPolarHBondContact O-CB 3.39Å; L527-S531 PolarHBondContact O-N 3.26Å; L527-S531 PolarHBondContact O-OG 3.5Å; L527-V633 HydrophobicContact CB-CG2 4.41Å; L527-V633 HydrophobicContact CD1-CB 4.29Å; L527-V633 HydrophobicContact CD1-CG2 3.88Å; L527-T636 HydrophobicContact CD1-CG2 4.09Å; L527-Y637 HydrophobicContact CD1-CE2 4.26Å
528	L	78.4	Confident	72.5	Confident	44 Å²	44	28.6 Å²	28.6	23%	0.23	16%	0.162	C	C	.	.	I	π-helix	trans	-69.8	-52.8	-167.2	-64.9	173.9	0	0	0	113.7	I523 F524 L532	I523-L528 HydrophobicContact CG2-CD1 4.2Å; I523-L528 HydrophobicContact CG2-CG 4.23Å; I523-L528 PolarHBondContact O-N 3.3Å; F524-L528 HydrophobicContact CD2-CB 4.3Å; F524-L528 HydrophobicContact CD2-CD1 3.95Å; F524-L528 PolarHBondContact O-N 2.75Å; L528-L532 VanDerWaalsContact O-CG 3.26Å; L528-L532 WeakPolarHBondContact O-CG 3.39Å; L528-L532 PolarHBondContact O-N 2.98Å; L528-L532 VanDerWaalsContact O-N 3.08Å
529	L	71.9	Confident	71	Confident	19 Å²	19	31.3 Å²	31.3	10%	0.099	18%	0.175	C	C	.	.	H	α-helix	trans	-62.9	-49.5	-177.2	-69.5	179.6	0	0	0	113.4	F524 M525 S531 L532 G533	F524-L529 HydrophobicContact CD1-CD1 4.12Å; F524-L529 HydrophobicContact CD1-CG 4.18Å; F524-L529 HydrophobicContact CE1-CD1 3.72Å; F524-L529 HydrophobicContact CE1-CD2 3.98Å; F524-L529 HydrophobicContact CE1-CG 3.82Å; F524-L529 HydrophobicContact CE2-CD2 4.36Å; F524-L529 HydrophobicContact CZ-CD1 4.36Å; F524-L529 HydrophobicContact CZ-CD2 3.74Å; F524-L529 HydrophobicContact CZ-CG 4.03Å; F524-L529 WeakPolarHBondContact O-CG 3.48Å; F524-L529 PolarHBondContact O-N 3.39Å; M525-L529 HydrophobicContact SD-CD1 3.45Å; M525-L529 WeakPolarHBondContact SD-CD1 3.5Å; M525-L529 HydrophobicContact SD-CG 4.47Å; L529-S531 VanDerWaalsContact C-N 3.32Å; L529-S531 PolarHBondContact O-N 2.99Å; L529-L532 PolarHBondContact O-N 3.5Å; L529-G533 PolarHBondContact O-N 2.85Å
530	P	70.3	Confident	69.3	Low	42 Å²	42	34.6 Å²	34.6	27%	0.273	19%	0.19	S	C	.	.	H	α-helix	trans	-66.4	-36.4	-178.9	-23.3	37.8	0	0	0	112	R27 M525 V526 G533 F568 F569	R27-P530 PolarHBondContact NH2-O 3.24Å; M525-P530 WeakPolarHBondContact O-CD 3.45Å; M525-P530 WeakPolarHBondContact O-CG 3.44Å; V526-P530 WeakPolarHBondContact O-CG 3.37Å; P530-G533 PolarHBondContact O-N 2.91Å; P530-G533 VanDerWaalsContact O-N 3.1Å; P530-F568 HydrophobicContact CB-CE1 4.29Å; P530-F569 HydrophobicContact CB-CZ 4.37Å
531	S	71.4	Confident	68	Low	1 Å²	1	34.9 Å²	34.9	1%	0.007	18%	0.184	C	C	.	.	H	α-helix	trans	-63.4	-45.9	177.9	-57.5	0	0	0	0	111.2	L527 L529 G533 V560 F569 Y637	L527-S531 WeakPolarHBondContact O-CB 3.39Å; L527-S531 PolarHBondContact O-N 3.26Å; L527-S531 PolarHBondContact O-OG 3.5Å; L529-S531 VanDerWaalsContact C-N 3.32Å; L529-S531 PolarHBondContact O-N 2.99Å; S531-G533 PolarHBondContact O-N 3.32Å; S531-G533 VanDerWaalsContact O-N 3.17Å; S531-V560 WeakPolarHBondContact O-CG1 3.24Å; S531-F569 WeakPolarHBondContact OG-CE2 3.14Å; S531-F569 WeakPolarHBondContact OG-CZ 3.5Å; S531-Y637 PolarHBondContact OG-OH 2.96Å
532	L	66.7	Low	66.9	Low	44 Å²	44	37.2 Å²	37.2	23%	0.23	19%	0.191	C	C	.	.	H	α-helix	trans	-67.1	-13.6	176.7	-64.9	172.9	0	0	0	113.1	L528 L529 L534 F557 V560	L528-L532 VanDerWaalsContact O-CG 3.26Å; L528-L532 WeakPolarHBondContact O-CG 3.39Å; L528-L532 PolarHBondContact O-N 2.98Å; L528-L532 VanDerWaalsContact O-N 3.08Å; L529-L532 PolarHBondContact O-N 3.5Å; L532-L534 HydrophobicContact CB-CB 4.34Å; L532-L534 HydrophobicContact CB-CD1 3.98Å; L532-L534 HydrophobicContact CB-CG 4.22Å; L532-L534 WeakPolarHBondContact O-CG 3.37Å; L532-L534 PolarHBondContact O-N 3.42Å; L532-F557 HydrophobicContact CD2-CE1 4.23Å; L532-V560 WeakPolarHBondContact O-CG2 3.48Å
533	G	56.5	Low	65.8	Low	30 Å²	30	45 Å²	45	31%	0.309	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	20.9	-177.6	0	0	0	0	0	113	L529 P530 S531	L529-G533 PolarHBondContact O-N 2.85Å; P530-G533 PolarHBondContact O-N 2.91Å; P530-G533 VanDerWaalsContact O-N 3.1Å; S531-G533 PolarHBondContact O-N 3.32Å; S531-G533 VanDerWaalsContact O-N 3.17Å
534	L	51.5	Low	64.7	Low	13 Å²	13	48.4 Å²	48.4	7%	0.068	24%	0.238	C	C	.	.			trans	-111.3	126.9	-175.9	-66.1	165.5	0	0	0	108.9	L532 L539 F557	L532-L534 HydrophobicContact CB-CB 4.34Å; L532-L534 HydrophobicContact CB-CD1 3.98Å; L532-L534 HydrophobicContact CB-CG 4.22Å; L532-L534 WeakPolarHBondContact O-CG 3.37Å; L532-L534 PolarHBondContact O-N 3.42Å; L534-L539 HydrophobicContact CB-CD1 3.92Å; L534-L539 HydrophobicContact CD1-CD1 3.42Å; L534-L539 VanDerWaalsContact CD1-CD1 3.42Å; L534-L539 HydrophobicContact CD1-CG 4.48Å; L534-L539 HydrophobicContact CG-CD1 4.14Å; L534-F557 HydrophobicContact CD1-CE1 4.06Å; L534-F557 HydrophobicContact CD1-CZ 4.29Å
535	S	56	Low	63.7	Low	29 Å²	29	51.9 Å²	51.9	20%	0.203	25%	0.253	C	S	.	.			trans	-72.4	138.2	161.6	45.1	0	0	0	0	110.4	T450 I453 L537 D538 L539	T450-S535 WeakPolarHBondContact OG1-CB 3.32Å; I453-S535 WeakPolarHBondContact CD1-OG 3.44Å; S535-L537 PolarHBondContact O-N 3.49Å; S535-D538 PolarHBondContact O-N 2.9Å; S535-D538 WeakPolarHBondContact OG-CB 3.39Å; S535-L539 PolarHBondContact O-N 2.91Å
536	S	56.6	Low	63	Low	4 Å²	4	53.2 Å²	53.2	3%	0.028	26%	0.261	C	S	.	.	H	α-helix	trans	-52.8	-41.2	-178.7	51.2	0	0	0	0	112.8	F446 T449 T450 F540	F446-S536 VanDerWaalsContact CZ-O 3.23Å; F446-S536 WeakPolarHBondContact CZ-O 3.3Å; F446-S536 PolarHBondContact O-OG 3.33Å; T449-S536 PolarHBondContact OG1-OG 3.37Å; T450-S536 PolarHBondContact OG1-N 3.3Å; T450-S536 PolarHBondContact OG1-OG 3.25Å; S536-F540 PolarHBondContact O-N 3.26Å; S536-F540 VanDerWaalsContact O-N 3.08Å
537	L	52.4	Low	62.1	Low	30 Å²	30	62 Å²	62	16%	0.157	30%	0.297	C	S	.	.	H	α-helix	trans	-76.5	-42.3	-175.7	-158.3	152.2	0	0	0	113.2	F447 I453 S535 L539 F540 F541	F447-L537 HydrophobicContact CD1-CD1 3.85Å; F447-L537 HydrophobicContact CE1-CD1 3.96Å; I453-L537 HydrophobicContact CD1-CB 4.25Å; I453-L537 HydrophobicContact CG2-CB 4.29Å; I453-L537 HydrophobicContact CG2-CD1 4.16Å; I453-L537 HydrophobicContact CG2-CD2 3.96Å; I453-L537 HydrophobicContact CG2-CG 4.38Å; S535-L537 PolarHBondContact O-N 3.49Å; L537-L539 PolarHBondContact O-N 2.85Å; L537-F540 PolarHBondContact O-N 3.29Å; L537-F541 HydrophobicContact CD1-CE2 4.44Å; L537-F541 HydrophobicContact CD2-CD2 3.21Å; L537-F541 HydrophobicContact CD2-CE2 3.36Å; L537-F541 HydrophobicContact CD2-CG 4.31Å; L537-F541 HydrophobicContact CG-CD2 3.79Å; L537-F541 HydrophobicContact CG-CE2 3.76Å; L537-F541 WeakPolarHBondContact O-CD2 3.32Å; L537-F541 PolarHBondContact O-N 3.37Å
538	D	54.6	Low	61.1	Low	31 Å²	31	69.8 Å²	69.8	17%	0.166	33%	0.331	C	S	.	.	H	α-helix	trans	-57.6	-40.2	172.6	-173.4	51.2	0	0	0	111	I453 S535 R542 R556	I453-D538 HydrophobicContact CD1-CB 3.98Å; S535-D538 PolarHBondContact O-N 2.9Å; S535-D538 WeakPolarHBondContact OG-CB 3.39Å; D538-R542 VanDerWaalsContact CG-NH1 3.27Å; D538-R542 WeakPolarHBondContact O-CB 3.34Å; D538-R542 VanDerWaalsContact O-CG 3.25Å; D538-R542 WeakPolarHBondContact O-CG 3.15Å; D538-R542 PolarHBondContact O-N 3.08Å; D538-R542 VanDerWaalsContact OD1-CD 3.29Å; D538-R542 WeakPolarHBondContact OD1-CD 3.4Å; D538-R542 IonicContact OD1-CZ 3Å; D538-R542 IonicContact OD1-NE 3.11Å; D538-R542 PolarHBondContact OD1-NE 3.44Å; D538-R542 VanDerWaalsContact OD1-NE 3.11Å; D538-R542 IonicContact OD1-NH1 3.03Å; D538-R542 PolarHBondContact OD1-NH1 3.31Å; D538-R542 IonicContact OD1-NH2 3.64Å; D538-R542 IonicContact OD2-CZ 3.55Å; D538-R542 IonicContact OD2-NH1 2.72Å; D538-R542 PolarHBondContact OD2-NH1 3.31Å; D538-R556 IonicContact OD2-NH1 3.88Å; D538-R556 PolarHBondContact OD2-NH1 3.5Å
539	L	55.5	Low	60.1	Low	61 Å²	61	68.9 Å²	68.9	32%	0.319	33%	0.325	S	S	.	.	H	α-helix	trans	-67.4	-46.3	178.1	-159.2	155.7	0	0	0	111.6	L534 S535 L537 W543	L534-L539 HydrophobicContact CB-CD1 3.92Å; L534-L539 HydrophobicContact CD1-CD1 3.42Å; L534-L539 VanDerWaalsContact CD1-CD1 3.42Å; L534-L539 HydrophobicContact CD1-CG 4.48Å; L534-L539 HydrophobicContact CG-CD1 4.14Å; S535-L539 PolarHBondContact O-N 2.91Å; L537-L539 PolarHBondContact O-N 2.85Å; L539-W543 WeakPolarHBondContact O-CB 3.41Å; L539-W543 PolarHBondContact O-N 2.88Å
540	F	55.5	Low	59.3	Low	82 Å²	82	71.8 Å²	71.8	36%	0.36	34%	0.34	S	S	.	.	H	α-helix	trans	-65.8	-47	178.5	173.4	-98.2	0	0	0	112.8	F446 S536 L537 W543 L544	F446-F540 HydrophobicContact CE1-CB 4.19Å; F446-F540 HydrophobicContact CE1-CG 4.43Å; F446-F540 HydrophobicContact CZ-CB 3.59Å; F446-F540 HydrophobicContact CZ-CG 4.16Å; S536-F540 PolarHBondContact O-N 3.26Å; S536-F540 VanDerWaalsContact O-N 3.08Å; L537-F540 PolarHBondContact O-N 3.29Å; F540-W543 PolarHBondContact O-N 3.19Å; F540-L544 HydrophobicContact CE1-CD2 4.25Å; F540-L544 HydrophobicContact CZ-CD2 4.15Å; F540-L544 WeakPolarHBondContact O-CB 3.34Å; F540-L544 PolarHBondContact O-N 3.35Å
541	F	60.3	Low	58.7	Low	95 Å²	95	72.9 Å²	72.9	42%	0.417	35%	0.353	S	S	.	.	H	α-helix	trans	-69.1	-39.8	-179.9	-83.1	-87.4	0	0	0	112.4	L537 L544 F545	L537-F541 HydrophobicContact CD1-CE2 4.44Å; L537-F541 HydrophobicContact CD2-CD2 3.21Å; L537-F541 HydrophobicContact CD2-CE2 3.36Å; L537-F541 HydrophobicContact CD2-CG 4.31Å; L537-F541 HydrophobicContact CG-CD2 3.79Å; L537-F541 HydrophobicContact CG-CE2 3.76Å; L537-F541 WeakPolarHBondContact O-CD2 3.32Å; L537-F541 PolarHBondContact O-N 3.37Å; F541-L544 PolarHBondContact O-N 3.22Å; F541-F545 AromaticContact CD1-CD2 3.92Å; F541-F545 HydrophobicContact CD1-CD2 3.92Å; F541-F545 AromaticContact CD1-CE2 3.7Å; F541-F545 HydrophobicContact CD1-CE2 3.7Å; F541-F545 HydrophobicContact CE1-CE2 4.1Å; F541-F545 WeakPolarHBondContact O-CB 3.39Å; F541-F545 VanDerWaalsContact O-CD2 3.32Å; F541-F545 WeakPolarHBondContact O-CD2 3.3Å; F541-F545 PolarHBondContact O-N 3.01Å
542	R	61.1	Low	57.9	Low	89 Å²	89	78 Å²	78	34%	0.336	38%	0.377	S	S	.	.	H	α-helix	trans	-71.4	-36.8	175.6	-69.9	179.1	164	158	3.5	112.4	D538 D546 F549	D538-R542 VanDerWaalsContact CG-NH1 3.27Å; D538-R542 WeakPolarHBondContact O-CB 3.34Å; D538-R542 VanDerWaalsContact O-CG 3.25Å; D538-R542 WeakPolarHBondContact O-CG 3.15Å; D538-R542 PolarHBondContact O-N 3.08Å; D538-R542 VanDerWaalsContact OD1-CD 3.29Å; D538-R542 WeakPolarHBondContact OD1-CD 3.4Å; D538-R542 IonicContact OD1-CZ 3Å; D538-R542 IonicContact OD1-NE 3.11Å; D538-R542 PolarHBondContact OD1-NE 3.44Å; D538-R542 VanDerWaalsContact OD1-NE 3.11Å; D538-R542 IonicContact OD1-NH1 3.03Å; D538-R542 PolarHBondContact OD1-NH1 3.31Å; D538-R542 IonicContact OD1-NH2 3.64Å; D538-R542 IonicContact OD2-CZ 3.55Å; D538-R542 IonicContact OD2-NH1 2.72Å; D538-R542 PolarHBondContact OD2-NH1 3.31Å; R542-D546 HydrophobicContact CB-CB 4.49Å; R542-D546 WeakPolarHBondContact O-CA 3.25Å; R542-D546 VanDerWaalsContact O-CB 3.29Å; R542-D546 WeakPolarHBondContact O-CB 3.38Å; R542-D546 PolarHBondContact O-N 3.43Å; R542-F549 HydrophobicContact CB-CD2 3.71Å; R542-F549 HydrophobicContact CB-CE2 4.09Å; R542-F549 HydrophobicContact CB-CG 4.24Å; R542-F549 HydrophobicContact CG-CD2 4.48Å
543	W	61.3	Low	57.4	Low	178 Å²	178	76.2 Å²	76.2	67%	0.674	37%	0.368	S	S	*	.	H	α-helix	trans	-65	-39.6	172.7	175.3	80.5	0	0	0	112.4	L539 F540	L539-W543 WeakPolarHBondContact O-CB 3.41Å; L539-W543 PolarHBondContact O-N 2.88Å; F540-W543 PolarHBondContact O-N 3.19Å
544	L	62.9	Low	57.3	Low	85 Å²	85	76.4 Å²	76.4	45%	0.445	37%	0.367	S	S	.	.	H	α-helix	trans	-74.2	-31.8	-179.1	-160.4	78.8	0	0	0	112.5	F540 F541	F540-L544 HydrophobicContact CE1-CD2 4.25Å; F540-L544 HydrophobicContact CZ-CD2 4.15Å; F540-L544 WeakPolarHBondContact O-CB 3.34Å; F540-L544 PolarHBondContact O-N 3.35Å; F541-L544 PolarHBondContact O-N 3.22Å
545	F	61.2	Low	57.5	Low	152 Å²	152	79.5 Å²	79.5	67%	0.667	38%	0.383	S	S	*	.	H	α-helix	trans	-121.5	-13.5	-169.5	-64	-67.7	0	0	0	116.4	F541	F541-F545 AromaticContact CD1-CD2 3.92Å; F541-F545 HydrophobicContact CD1-CD2 3.92Å; F541-F545 AromaticContact CD1-CE2 3.7Å; F541-F545 HydrophobicContact CD1-CE2 3.7Å; F541-F545 HydrophobicContact CE1-CE2 4.1Å; F541-F545 WeakPolarHBondContact O-CB 3.39Å; F541-F545 VanDerWaalsContact O-CD2 3.32Å; F541-F545 WeakPolarHBondContact O-CD2 3.3Å; F541-F545 PolarHBondContact O-N 3.01Å
546	D	60.5	Low	57.5	Low	61 Å²	61	82.5 Å²	82.5	33%	0.326	39%	0.39	S	S	.	.			trans	-121.1	109.3	-173.6	-165.9	-7.1	0	0	0	113.5	R542 K548 F549	R542-D546 HydrophobicContact CB-CB 4.49Å; R542-D546 WeakPolarHBondContact O-CA 3.25Å; R542-D546 VanDerWaalsContact O-CB 3.29Å; R542-D546 WeakPolarHBondContact O-CB 3.38Å; R542-D546 PolarHBondContact O-N 3.43Å; D546-K548 VanDerWaalsContact C-N 3.32Å; D546-K548 PolarHBondContact O-N 3.29Å; D546-K548 WeakPolarHBondContact OD1-CB 3.23Å; D546-K548 PolarHBondContact OD1-N 3.46Å; D546-F549 HydrophobicContact CB-CB 4.33Å; D546-F549 WeakPolarHBondContact O-CB 3.37Å
547	K	60.2	Low	57.7	Low	211 Å²	211	83.3 Å²	83.3	92%	0.917	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-15.4	176.3	-66	-169.4	179.3	-177.2	0	113.7
548	K	58.2	Low	57.8	Low	164 Å²	164	87.5 Å²	87.5	71%	0.713	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-8.9	177.2	-66.1	-176.9	178.9	-179.8	0	113.1	D546 L550 A551	D546-K548 VanDerWaalsContact C-N 3.32Å; D546-K548 PolarHBondContact O-N 3.29Å; D546-K548 WeakPolarHBondContact OD1-CB 3.23Å; D546-K548 PolarHBondContact OD1-N 3.46Å; K548-L550 VanDerWaalsContact C-N 3.25Å; K548-L550 PolarHBondContact O-N 3.5Å; K548-A551 PolarHBondContact O-N 2.83Å; K548-A551 VanDerWaalsContact O-N 3.08Å
549	F	57.8	Low	57.7	Low	25 Å²	25	86.7 Å²	86.7	11%	0.11	41%	0.408	C	S	.	.	H	α-helix	trans	-52.2	-38.7	179.9	176.3	-106.8	0	0	0	113.7	R542 D546 A551 E552 A553	R542-F549 HydrophobicContact CB-CD2 3.71Å; R542-F549 HydrophobicContact CB-CE2 4.09Å; R542-F549 HydrophobicContact CB-CG 4.24Å; R542-F549 HydrophobicContact CG-CD2 4.48Å; D546-F549 HydrophobicContact CB-CB 4.33Å; D546-F549 WeakPolarHBondContact O-CB 3.37Å; F549-A551 PolarHBondContact O-N 3.34Å; F549-E552 PolarHBondContact O-N 3.23Å; F549-A553 HydrophobicContact CE1-CB 4.23Å; F549-A553 HydrophobicContact CZ-CB 4.24Å; F549-A553 WeakPolarHBondContact O-CB 3.35Å; F549-A553 PolarHBondContact O-N 2.88Å
550	L	55.9	Low	57.8	Low	80 Å²	80	83.9 Å²	83.9	42%	0.419	39%	0.393	S	S	.	.	H	α-helix	trans	-63.1	-28.9	-178.3	-71.1	171.4	0	0	0	113.4	L5 L9 K548	L5-L550 HydrophobicContact CD2-CD1 4.05Å; L9-L550 HydrophobicContact CD1-CB 3.92Å; L9-L550 HydrophobicContact CD1-CD1 4.35Å; K548-L550 VanDerWaalsContact C-N 3.25Å; K548-L550 PolarHBondContact O-N 3.5Å
551	A	56.4	Low	57.7	Low	66 Å²	66	81.6 Å²	81.6	55%	0.545	38%	0.383	S	S	.	.	H	α-helix	trans	-79.4	-41.5	178.8	0	0	0	0	0	112.2	K548 F549	K548-A551 PolarHBondContact O-N 2.83Å; K548-A551 VanDerWaalsContact O-N 3.08Å; F549-A551 PolarHBondContact O-N 3.34Å
552	E	53.9	Low	57.6	Low	109 Å²	109	78.3 Å²	78.3	51%	0.509	37%	0.37	S	S	.	.	H	α-helix	trans	-73	-29.9	174.4	-73.5	-178.5	177.7	0	0	112.6	F549 A554 I555 R556	F549-E552 PolarHBondContact O-N 3.23Å; E552-A554 VanDerWaalsContact C-N 3.31Å; E552-A554 PolarHBondContact O-N 3.23Å; E552-I555 PolarHBondContact O-N 3.44Å; E552-R556 PolarHBondContact O-N 2.86Å
553	A	56.3	Low	57.4	Low	6 Å²	6	74.9 Å²	74.9	5%	0.05	36%	0.359	C	S	.	.	H	α-helix	trans	-64.2	-35.4	178.3	0	0	0	0	0	111.9	F549 I555 R556 F557	F549-A553 HydrophobicContact CE1-CB 4.23Å; F549-A553 HydrophobicContact CZ-CB 4.24Å; F549-A553 WeakPolarHBondContact O-CB 3.35Å; F549-A553 PolarHBondContact O-N 2.88Å; A553-I555 VanDerWaalsContact C-N 3.34Å; A553-I555 PolarHBondContact O-N 2.93Å; A553-R556 PolarHBondContact O-N 2.89Å; A553-F557 VanDerWaalsContact C-CD2 3.44Å; A553-F557 HydrophobicContact CB-CD2 4.04Å; A553-F557 HydrophobicContact CB-CE2 3.61Å; A553-F557 HydrophobicContact CB-CZ 4.44Å; A553-F557 WeakPolarHBondContact O-CB 3.39Å; A553-F557 WeakPolarHBondContact O-CD2 3.37Å; A553-F557 VanDerWaalsContact O-CG 3.27Å; A553-F557 WeakPolarHBondContact O-CG 3.25Å; A553-F557 PolarHBondContact O-N 3.46Å
554	A	54.3	Low	57.4	Low	33 Å²	33	69.5 Å²	69.5	27%	0.273	34%	0.344	S	S	.	.	H	α-helix	trans	-57.4	-44.2	176.7	0	0	0	0	0	112.5	L6 E552 F557 E558	L6-A554 HydrophobicContact CD2-CB 4.44Å; E552-A554 VanDerWaalsContact C-N 3.31Å; E552-A554 PolarHBondContact O-N 3.23Å; A554-F557 PolarHBondContact O-N 2.95Å; A554-E558 PolarHBondContact O-N 3.41Å
555	I	55.8	Low	57.7	Low	78 Å²	78	66.2 Å²	66.2	40%	0.4	33%	0.327	S	S	.	.	H	α-helix	trans	-67.3	-40.7	176.9	-58.9	168	0	0	0	110.4	Y22 E552 A553 F557 E558 C559	Y22-I555 HydrophobicContact CD1-CG2 3.99Å; Y22-I555 HydrophobicContact CE1-CG2 4.14Å; E552-I555 PolarHBondContact O-N 3.44Å; A553-I555 VanDerWaalsContact C-N 3.34Å; A553-I555 PolarHBondContact O-N 2.93Å; I555-F557 PolarHBondContact O-N 3Å; I555-E558 WeakPolarHBondContact O-CB 3.28Å; I555-E558 PolarHBondContact O-N 3.33Å; I555-C559 PolarHBondContact O-N 3.08Å; I555-C559 PolarHBondContact O-SG 2.83Å
556	R	56.1	Low	58.5	Low	93 Å²	93	59.3 Å²	59.3	35%	0.351	30%	0.298	S	S	.	.	H	α-helix	trans	-68.4	-34.5	178.7	-151.9	174.6	-162.7	-176.2	3.8	112.6	D538 E552 A553 E558 C559 V560	D538-R556 IonicContact OD2-NH1 3.88Å; D538-R556 PolarHBondContact OD2-NH1 3.5Å; E552-R556 PolarHBondContact O-N 2.86Å; A553-R556 PolarHBondContact O-N 2.89Å; R556-E558 VanDerWaalsContact C-N 3.3Å; R556-C559 WeakPolarHBondContact O-CB 3.46Å; R556-C559 PolarHBondContact O-N 3.09Å; R556-V560 PolarHBondContact O-N 3.38Å
557	F	60.9	Low	59.3	Low	20 Å²	20	56.6 Å²	56.6	9%	0.088	28%	0.284	C	S	.	.	H	α-helix	trans	-69.8	-26.8	174.5	-71.3	-53.9	0	0	0	112.4	L6 L532 L534 A553 A554 I555 C559 V560 F697 M701	L6-F557 HydrophobicContact CD1-CD2 4.01Å; L6-F557 HydrophobicContact CD1-CE2 4.15Å; L6-F557 HydrophobicContact CD2-CD2 3.74Å; L6-F557 HydrophobicContact CD2-CE2 4.05Å; L532-F557 HydrophobicContact CD2-CE1 4.23Å; L534-F557 HydrophobicContact CD1-CE1 4.06Å; L534-F557 HydrophobicContact CD1-CZ 4.29Å; A553-F557 VanDerWaalsContact C-CD2 3.44Å; A553-F557 HydrophobicContact CB-CD2 4.04Å; A553-F557 HydrophobicContact CB-CE2 3.61Å; A553-F557 HydrophobicContact CB-CZ 4.44Å; A553-F557 WeakPolarHBondContact O-CB 3.39Å; A553-F557 WeakPolarHBondContact O-CD2 3.37Å; A553-F557 VanDerWaalsContact O-CG 3.27Å; A553-F557 WeakPolarHBondContact O-CG 3.25Å; A553-F557 PolarHBondContact O-N 3.46Å; A554-F557 PolarHBondContact O-N 2.95Å; I555-F557 PolarHBondContact O-N 3Å; F557-C559 PolarHBondContact O-N 3.37Å; F557-V560 HydrophobicContact CD1-CG2 4.17Å; F557-V560 WeakPolarHBondContact O-CB 3.49Å; F557-V560 PolarHBondContact O-N 3.4Å; F557-F697 HydrophobicContact CB-CZ 4.2Å; F557-F697 AromaticContact CD1-CZ 3.86Å; F557-F697 HydrophobicContact CD1-CZ 3.86Å; F557-F697 HydrophobicContact CG-CZ 4.24Å; F557-M701 VanDerWaalsContact C-CE 3.5Å; F557-M701 HydrophobicContact CB-CE 3.72Å; F557-M701 HydrophobicContact CB-SD 4.1Å
558	E	54.3	Low	60.3	Low	118 Å²	118	51 Å²	51	55%	0.551	26%	0.26	S	S	*	.	H	α-helix	trans	-65.5	-32.3	171.9	-154	176.4	170.7	0	0	111	A554 I555 R556 M701	A554-E558 PolarHBondContact O-N 3.41Å; I555-E558 WeakPolarHBondContact O-CB 3.28Å; I555-E558 PolarHBondContact O-N 3.33Å; R556-E558 VanDerWaalsContact C-N 3.3Å; E558-M701 HydrophobicContact CB-CE 4.12Å
559	C	54.1	Low	61.6	Low	14 Å²	14	43.2 Å²	43.2	10%	0.095	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-80.3	-8.1	176	-42.5	0	0	0	0	114.6	C23 I555 R556 F557 F561 L562	C23-C559 WeakPolarHBondContact CA-SG 3.33Å; C23-C559 HydrophobicContact CB-CB 3.7Å; C23-C559 WeakPolarHBondContact CB-SG 3.24Å; C23-C559 WeakPolarHBondContact SG-CB 3.42Å; C23-C559 CovalentContact SG-SG 2.03Å; C23-C559 PolarHBondContact SG-SG 3.35Å; I555-C559 PolarHBondContact O-N 3.08Å; I555-C559 PolarHBondContact O-SG 2.83Å; R556-C559 WeakPolarHBondContact O-CB 3.46Å; R556-C559 PolarHBondContact O-N 3.09Å; F557-C559 PolarHBondContact O-N 3.37Å; C559-F561 PolarHBondContact O-N 3.49Å; C559-L562 HydrophobicContact CB-CD1 4.21Å; C559-L562 WeakPolarHBondContact O-CD1 3.2Å; C559-L562 WeakPolarHBondContact O-CG 3.36Å; C559-L562 PolarHBondContact O-N 2.92Å
560	V	56.4	Low	63	Low	3 Å²	3	42 Å²	42	2%	0.018	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-68.8	-20.3	-176.4	158.5	0	0	0	0	113	S531 L532 R556 F557 N565 W694 F697	S531-V560 WeakPolarHBondContact O-CG1 3.24Å; L532-V560 WeakPolarHBondContact O-CG2 3.48Å; R556-V560 PolarHBondContact O-N 3.38Å; F557-V560 HydrophobicContact CD1-CG2 4.17Å; F557-V560 WeakPolarHBondContact O-CB 3.49Å; F557-V560 PolarHBondContact O-N 3.4Å; V560-N565 PolarHBondContact O-ND2 3.15Å; V560-W694 HydrophobicContact CG1-CH2 3.9Å; V560-W694 HydrophobicContact CG1-CZ2 4.21Å; V560-F697 HydrophobicContact CB-CE1 4.49Å; V560-F697 HydrophobicContact CG1-CE1 3.8Å
561	F	53.7	Low	64.4	Low	34 Å²	34	39 Å²	39	15%	0.149	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-107.9	23.5	-179.7	-68.4	-80.7	0	0	0	114	C559 W694 F697 F698	C559-F561 PolarHBondContact O-N 3.49Å; F561-W694 HydrophobicContact CD1-CZ2 4.22Å; F561-W694 AromaticContact CE1-CD1 3.95Å; F561-W694 HydrophobicContact CE1-CD2 4.1Å; F561-W694 AromaticContact CE1-CE2 3.38Å; F561-W694 HydrophobicContact CE1-CG 4.38Å; F561-W694 HydrophobicContact CE1-CH2 4.45Å; F561-W694 AromaticContact CE1-CZ2 3.58Å; F561-W694 HydrophobicContact CE1-CZ2 3.58Å; F561-W694 AromaticContact CE1-NE1 3.36Å; F561-W694 HydrophobicContact CZ-CD2 4.27Å; F561-W694 AromaticContact CZ-CE2 3.89Å; F561-W694 HydrophobicContact CZ-CH2 4.4Å; F561-W694 AromaticContact CZ-CZ2 3.95Å; F561-W694 HydrophobicContact CZ-CZ2 3.95Å; F561-F697 HydrophobicContact CD2-CD1 4.48Å; F561-F697 HydrophobicContact CD2-CE1 4.29Å; F561-F697 HydrophobicContact CE1-CD1 4.48Å; F561-F697 AromaticContact CE2-CD1 3.21Å; F561-F697 HydrophobicContact CE2-CD1 3.21Å; F561-F697 AromaticContact CE2-CE1 3.32Å; F561-F697 HydrophobicContact CE2-CE1 3.32Å; F561-F697 HydrophobicContact CE2-CG 4.03Å; F561-F697 HydrophobicContact CE2-CZ 4.26Å; F561-F697 HydrophobicContact CZ-CB 4.26Å; F561-F697 AromaticContact CZ-CD1 3.23Å; F561-F697 HydrophobicContact CZ-CD1 3.23Å; F561-F697 AromaticContact CZ-CE1 3.77Å; F561-F697 HydrophobicContact CZ-CE1 3.77Å; F561-F697 HydrophobicContact CZ-CG 4.06Å; F561-F698 HydrophobicContact CB-CD2 3.89Å; F561-F698 HydrophobicContact CB-CE2 4.06Å; F561-F698 HydrophobicContact CD1-CB 4.35Å; F561-F698 AromaticContact CD1-CD2 3.64Å; F561-F698 HydrophobicContact CD1-CD2 3.64Å; F561-F698 HydrophobicContact CD1-CE2 4.47Å; F561-F698 HydrophobicContact CD1-CG 4.45Å; F561-F698 AromaticContact CD2-CD2 4Å; F561-F698 HydrophobicContact CD2-CD2 4Å; F561-F698 HydrophobicContact CE1-CB 3.8Å; F561-F698 AromaticContact CE1-CD2 3.97Å; F561-F698 HydrophobicContact CE1-CD2 3.97Å; F561-F698 HydrophobicContact CE1-CG 4.36Å; F561-F698 HydrophobicContact CE2-CB 4.1Å; F561-F698 HydrophobicContact CE2-CD2 4.32Å; F561-F698 AromaticContact CG-CD2 3.6Å; F561-F698 HydrophobicContact CG-CD2 3.6Å; F561-F698 HydrophobicContact CG-CE2 4.28Å; F561-F698 HydrophobicContact CZ-CB 3.65Å; F561-F698 HydrophobicContact CZ-CD2 4.29Å; F561-F698 HydrophobicContact CZ-CG 4.5Å
562	L	58.2	Low	65.8	Low	25 Å²	25	38.1 Å²	38.1	13%	0.131	19%	0.188	C	C	.	.			trans	-53	133	169	-82.8	158.8	0	0	0	109.7	C23 Y24 C559 D564 N565	C23-L562 HydrophobicContact CB-CD1 4.31Å; Y24-L562 HydrophobicContact CE1-CD2 4.44Å; Y24-L562 HydrophobicContact CE2-CD2 4.4Å; C559-L562 HydrophobicContact CB-CD1 4.21Å; C559-L562 WeakPolarHBondContact O-CD1 3.2Å; C559-L562 WeakPolarHBondContact O-CG 3.36Å; C559-L562 PolarHBondContact O-N 2.92Å; L562-D564 PolarHBondContact O-N 3.17Å; L562-N565 WeakPolarHBondContact O-CB 3.36Å; L562-N565 PolarHBondContact O-N 3.34Å
563	P	56.7	Low	67.6	Low	18 Å²	18	33 Å²	33	12%	0.117	16%	0.164	C	C	.	.	H	α-helix	trans	-46.7	-30.9	175.3	-35.4	39.2	0	0	0	115.8	L183 F190 A196 N565 G566 A567	L183-P563 HydrophobicContact CD1-CG 4.43Å; F190-P563 HydrophobicContact CD1-CB 4.46Å; F190-P563 WeakPolarHBondContact CD1-O 3.43Å; F190-P563 WeakPolarHBondContact CE1-O 3.46Å; A196-P563 HydrophobicContact CB-CG 3.88Å; P563-N565 PolarHBondContact O-N 3.18Å; P563-G566 WeakPolarHBondContact O-CA 3.41Å; P563-G566 PolarHBondContact O-N 3.31Å; P563-A567 PolarHBondContact O-N 3.47Å
564	D	62.3	Low	69.1	Low	64 Å²	64	32.7 Å²	32.7	34%	0.342	16%	0.162	S	C	.	.	H	α-helix	trans	-60.7	-27.5	178.9	-59.2	-26	0	0	0	113	L562 G566 A567 F568	L562-D564 PolarHBondContact O-N 3.17Å; D564-G566 VanDerWaalsContact C-N 3.33Å; D564-A567 PolarHBondContact O-N 3.09Å; D564-F568 PolarHBondContact O-N 2.79Å; D564-F568 VanDerWaalsContact O-N 3.12Å
565	N	68.6	Low	70.7	Confident	17 Å²	17	32.6 Å²	32.6	9%	0.091	16%	0.161	C	C	.	.	H	α-helix	trans	-66.9	-35.9	172.1	-81	-12.8	0	0	0	111.9	R27 V560 L562 P563 A567 F568 F569	R27-N565 PolarHBondContact NH1-ND2 3.14Å; R27-N565 PolarHBondContact NH1-OD1 2.75Å; R27-N565 PolarHBondContact NH2-ND2 2.89Å; R27-N565 PolarHBondContact NH2-OD1 3.21Å; R27-N565 VanDerWaalsContact NH2-OD1 3.15Å; V560-N565 PolarHBondContact O-ND2 3.15Å; L562-N565 WeakPolarHBondContact O-CB 3.36Å; L562-N565 PolarHBondContact O-N 3.34Å; P563-N565 PolarHBondContact O-N 3.18Å; N565-A567 VanDerWaalsContact C-N 3.35Å; N565-F568 PolarHBondContact O-N 3.33Å; N565-F569 WeakPolarHBondContact O-CD2 3.26Å; N565-F569 PolarHBondContact O-N 3.45Å
566	G	77.1	Confident	72.3	Confident	7 Å²	7	29.8 Å²	29.8	7%	0.072	15%	0.148	C	C	.	.	H	α-helix	trans	-63.8	-41.9	174.4	0	0	0	0	0	111.5	P563 D564 F568 F569 V570	P563-G566 WeakPolarHBondContact O-CA 3.41Å; P563-G566 PolarHBondContact O-N 3.31Å; D564-G566 VanDerWaalsContact C-N 3.33Å; G566-F568 VanDerWaalsContact C-N 3.35Å; G566-F568 PolarHBondContact O-N 2.84Å; G566-F569 PolarHBondContact O-N 3.24Å; G566-V570 WeakPolarHBondContact O-CG2 3.43Å; G566-V570 PolarHBondContact O-N 3.49Å
567	A	78.8	Confident	74	Confident	3 Å²	3	25.4 Å²	25.4	3%	0.025	13%	0.132	C	C	.	.	H	α-helix	trans	-63.3	-40.1	178.1	0	0	0	0	0	111.9	F190 P563 D564 N565 F569 V570 N571	F190-A567 HydrophobicContact CD1-CB 3.85Å; F190-A567 HydrophobicContact CD2-CB 4.19Å; F190-A567 HydrophobicContact CE1-CB 3.86Å; F190-A567 HydrophobicContact CE2-CB 4.18Å; F190-A567 HydrophobicContact CG-CB 4.02Å; F190-A567 HydrophobicContact CZ-CB 4.01Å; P563-A567 PolarHBondContact O-N 3.47Å; D564-A567 PolarHBondContact O-N 3.09Å; N565-A567 VanDerWaalsContact C-N 3.35Å; A567-F569 PolarHBondContact O-N 2.86Å; A567-V570 PolarHBondContact O-N 3.48Å; A567-N571 WeakPolarHBondContact O-CB 3.45Å; A567-N571 VanDerWaalsContact O-CG 3.28Å; A567-N571 PolarHBondContact O-N 3.09Å; A567-N571 PolarHBondContact O-ND2 3.42Å
568	F	80.3	Confident	75.5	Confident	95 Å²	95	25.2 Å²	25.2	42%	0.417	13%	0.131	S	C	.	.	H	α-helix	trans	-56.2	-49.2	173.6	171.5	-96.7	0	0	0	112.4	P530 D564 N565 G566 N571 Y572	P530-F568 HydrophobicContact CB-CE1 4.29Å; D564-F568 PolarHBondContact O-N 2.79Å; D564-F568 VanDerWaalsContact O-N 3.12Å; N565-F568 PolarHBondContact O-N 3.33Å; G566-F568 VanDerWaalsContact C-N 3.35Å; G566-F568 PolarHBondContact O-N 2.84Å; F568-N571 PolarHBondContact O-N 3.32Å; F568-Y572 PolarHBondContact O-N 2.92Å
569	F	84.8	Confident	77.1	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-69.6	-33.4	-179.6	-77.2	-67.1	0	0	0	113.2	V526 P530 S531 N565 G566 A567 Y572 V573 V633 Y637 I644	V526-F569 WeakPolarHBondContact O-CE1 3.47Å; V526-F569 WeakPolarHBondContact O-CZ 3.45Å; P530-F569 HydrophobicContact CB-CZ 4.37Å; S531-F569 WeakPolarHBondContact OG-CE2 3.14Å; S531-F569 WeakPolarHBondContact OG-CZ 3.5Å; N565-F569 WeakPolarHBondContact O-CD2 3.26Å; N565-F569 PolarHBondContact O-N 3.45Å; G566-F569 PolarHBondContact O-N 3.24Å; A567-F569 PolarHBondContact O-N 2.86Å; F569-Y572 PolarHBondContact O-N 3.09Å; F569-V573 WeakPolarHBondContact O-CG2 3.46Å; F569-V573 PolarHBondContact O-N 2.97Å; F569-V633 HydrophobicContact CB-CG1 4.39Å; F569-V633 HydrophobicContact CD1-CG1 3.75Å; F569-V633 HydrophobicContact CE1-CG1 4.45Å; F569-V633 HydrophobicContact CG-CG1 4.35Å; F569-Y637 HydrophobicContact CB-CD2 4.49Å; F569-Y637 HydrophobicContact CD1-CE2 4.44Å; F569-Y637 HydrophobicContact CD2-CD2 4.16Å; F569-Y637 HydrophobicContact CD2-CE1 4.01Å; F569-Y637 AromaticContact CD2-CE2 3.48Å; F569-Y637 HydrophobicContact CD2-CE2 3.48Å; F569-Y637 VanDerWaalsContact CD2-CE2 3.48Å; F569-Y637 AromaticContact CD2-CZ 3.4Å; F569-Y637 VanDerWaalsContact CD2-CZ 3.4Å; F569-Y637 HydrophobicContact CE2-CE1 4.46Å; F569-Y637 AromaticContact CE2-CE2 3.65Å; F569-Y637 HydrophobicContact CE2-CE2 3.65Å; F569-Y637 AromaticContact CE2-CZ 3.51Å; F569-Y637 WeakPolarHBondContact CE2-OH 3.18Å; F569-Y637 HydrophobicContact CG-CD2 4.24Å; F569-Y637 AromaticContact CG-CE2 3.93Å; F569-Y637 HydrophobicContact CG-CE2 3.93Å; F569-Y637 HydrophobicContact CZ-CE2 4.19Å; F569-I644 HydrophobicContact CB-CD1 4.04Å
570	V	88.8	Confident	78.7	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.9	-48.2	171.5	171.9	0	0	0	0	110.5	V41 F190 G566 A567 Y572 V573 I574 I644 F647	V41-V570 HydrophobicContact CG1-CG1 3.79Å; V41-V570 HydrophobicContact CG2-CB 4.39Å; V41-V570 HydrophobicContact CG2-CG1 3.93Å; F190-V570 HydrophobicContact CZ-CG2 4.13Å; G566-V570 WeakPolarHBondContact O-CG2 3.43Å; G566-V570 PolarHBondContact O-N 3.49Å; A567-V570 PolarHBondContact O-N 3.48Å; V570-Y572 VanDerWaalsContact C-N 3.33Å; V570-Y572 PolarHBondContact O-N 3.34Å; V570-V573 PolarHBondContact O-N 3.19Å; V570-I574 HydrophobicContact CG1-CD1 3.81Å; V570-I574 HydrophobicContact CG1-CG1 4.49Å; V570-I574 VanDerWaalsContact O-CG1 3.31Å; V570-I574 WeakPolarHBondContact O-CG1 3.39Å; V570-I574 PolarHBondContact O-N 2.96Å; V570-I644 HydrophobicContact CG2-CB 3.94Å; V570-I644 HydrophobicContact CG2-CG1 4.15Å; V570-F647 HydrophobicContact CG1-CD2 3.82Å; V570-F647 HydrophobicContact CG1-CE2 3.96Å
571	N	84.1	Confident	80.3	Confident	15 Å²	15	22.7 Å²	22.7	8%	0.08	13%	0.127	C	C	.	.	H	α-helix	trans	-60.5	-41.7	176.3	-70	-25.7	0	0	0	111.9	G39 V41 V44 A567 F568 V573 I574 A575	G39-N571 PolarHBondContact O-ND2 3.24Å; G39-N571 VanDerWaalsContact O-ND2 3.08Å; V41-N571 VanDerWaalsContact CA-OD1 3.29Å; V41-N571 WeakPolarHBondContact CA-OD1 3.45Å; V41-N571 WeakPolarHBondContact CG2-OD1 3.11Å; V44-N571 HydrophobicContact CG1-CB 4.19Å; A567-N571 WeakPolarHBondContact O-CB 3.45Å; A567-N571 VanDerWaalsContact O-CG 3.28Å; A567-N571 PolarHBondContact O-N 3.09Å; A567-N571 PolarHBondContact O-ND2 3.42Å; F568-N571 PolarHBondContact O-N 3.32Å; N571-V573 PolarHBondContact O-N 2.95Å; N571-I574 PolarHBondContact O-N 3.32Å; N571-A575 WeakPolarHBondContact O-CB 3.38Å; N571-A575 PolarHBondContact O-N 3.34Å
572	Y	86.6	Confident	82	Confident	49 Å²	49	21.1 Å²	21.1	19%	0.192	12%	0.12	C	C	.	.	H	α-helix	trans	-59.4	-44.7	174.8	168.5	-99.3	0	0	0	112.5	V526 F568 F569 V570 S576 V633	V526-Y572 HydrophobicContact CG1-CD1 4.26Å; V526-Y572 HydrophobicContact CG1-CE1 3.63Å; V526-Y572 HydrophobicContact CG1-CE2 4.07Å; F568-Y572 PolarHBondContact O-N 2.92Å; F569-Y572 PolarHBondContact O-N 3.09Å; V570-Y572 VanDerWaalsContact C-N 3.33Å; V570-Y572 PolarHBondContact O-N 3.34Å; Y572-S576 VanDerWaalsContact O-CB 3.3Å; Y572-S576 WeakPolarHBondContact O-CB 3.47Å; Y572-S576 PolarHBondContact O-N 2.69Å; Y572-S576 PolarHBondContact O-OG 2.96Å; Y572-V633 HydrophobicContact CE1-CG2 4.5Å
573	V	91.2	Very high	83.3	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-67.3	-39	178.5	172.1	0	0	0	0	111.2	F569 V570 N571 S576 A577 V630 V633 V634 I644 F647	F569-V573 WeakPolarHBondContact O-CG2 3.46Å; F569-V573 PolarHBondContact O-N 2.97Å; V570-V573 PolarHBondContact O-N 3.19Å; N571-V573 PolarHBondContact O-N 2.95Å; V573-S576 PolarHBondContact O-N 3.31Å; V573-A577 VanDerWaalsContact O-CB 3.32Å; V573-A577 WeakPolarHBondContact O-CB 3.23Å; V573-A577 PolarHBondContact O-N 3.41Å; V573-V630 HydrophobicContact CG2-CG1 4.48Å; V573-V633 HydrophobicContact CG2-CG1 4.21Å; V573-V634 HydrophobicContact CG1-CG2 4.17Å; V573-V634 HydrophobicContact CG2-CG2 4.01Å; V573-I644 HydrophobicContact CB-CG1 4.39Å; V573-I644 HydrophobicContact CG2-CD1 3.92Å; V573-I644 HydrophobicContact CG2-CG1 3.96Å; V573-F647 HydrophobicContact CG1-CB 4.03Å
574	I	89	Confident	84.7	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.8	-50.9	175.4	-69.6	167.6	0	0	0	110.8	V41 V44 L45 D48 V570 N571 S576 A577 F578 F647	V41-I574 HydrophobicContact CG1-CD1 3.7Å; V44-I574 HydrophobicContact CG1-CG2 4.38Å; L45-I574 HydrophobicContact CB-CD1 4.41Å; L45-I574 HydrophobicContact CB-CG2 4.29Å; L45-I574 HydrophobicContact CD1-CG2 3.81Å; D48-I574 HydrophobicContact CB-CG2 4.26Å; V570-I574 HydrophobicContact CG1-CD1 3.81Å; V570-I574 HydrophobicContact CG1-CG1 4.49Å; V570-I574 VanDerWaalsContact O-CG1 3.31Å; V570-I574 WeakPolarHBondContact O-CG1 3.39Å; V570-I574 PolarHBondContact O-N 2.96Å; N571-I574 PolarHBondContact O-N 3.32Å; I574-S576 VanDerWaalsContact C-N 3.28Å; I574-S576 PolarHBondContact O-N 3.09Å; I574-A577 WeakPolarHBondContact O-CB 3.33Å; I574-A577 PolarHBondContact O-N 2.69Å; I574-A577 VanDerWaalsContact O-N 3.09Å; I574-F578 HydrophobicContact CG2-CD2 4Å; I574-F578 HydrophobicContact CG2-CE2 4.23Å; I574-F578 WeakPolarHBondContact O-CD2 3.43Å; I574-F578 PolarHBondContact O-N 2.87Å; I574-F578 VanDerWaalsContact O-N 3.08Å; I574-F647 HydrophobicContact CD1-CD1 4Å; I574-F647 HydrophobicContact CD1-CD2 4.09Å; I574-F647 HydrophobicContact CD1-CE1 3.94Å; I574-F647 HydrophobicContact CD1-CE2 4.03Å; I574-F647 HydrophobicContact CD1-CG 4.08Å; I574-F647 HydrophobicContact CD1-CZ 3.96Å; I574-F647 HydrophobicContact CG1-CB 4.02Å; I574-F647 HydrophobicContact CG1-CD1 3.6Å; I574-F647 HydrophobicContact CG1-CD2 4.13Å; I574-F647 HydrophobicContact CG1-CE1 4.04Å; I574-F647 HydrophobicContact CG1-CG 3.65Å; I574-F647 HydrophobicContact CG1-CZ 4.47Å
575	A	87.1	Confident	85.8	Confident	31 Å²	31	22.5 Å²	22.5	26%	0.256	13%	0.125	S	C	.	.	H	α-helix	trans	-60.2	-40.8	177.4	0	0	0	0	0	111.5	D48 N571 A577 I579 G580	D48-A575 WeakPolarHBondContact OD2-CA 3.36Å; D48-A575 WeakPolarHBondContact OD2-CB 3.44Å; D48-A575 PolarHBondContact OD2-N 3.41Å; N571-A575 WeakPolarHBondContact O-CB 3.38Å; N571-A575 PolarHBondContact O-N 3.34Å; A575-A577 PolarHBondContact O-N 3.46Å; A575-I579 WeakPolarHBondContact O-CA 3.34Å; A575-I579 WeakPolarHBondContact O-CB 3.27Å; A575-I579 PolarHBondContact O-N 2.83Å; A575-G580 PolarHBondContact O-N 2.76Å; A575-G580 VanDerWaalsContact O-N 3.15Å
576	S	88.9	Confident	86.5	Confident	20 Å²	20	22.1 Å²	22.1	14%	0.14	12%	0.123	C	C	.	.	I	π-helix	trans	-66	-36.1	175.7	-58.4	0	0	0	0	112.4	Y572 V573 I574 G580 N581	Y572-S576 VanDerWaalsContact O-CB 3.3Å; Y572-S576 WeakPolarHBondContact O-CB 3.47Å; Y572-S576 PolarHBondContact O-N 2.69Å; Y572-S576 PolarHBondContact O-OG 2.96Å; V573-S576 PolarHBondContact O-N 3.31Å; I574-S576 VanDerWaalsContact C-N 3.28Å; I574-S576 PolarHBondContact O-N 3.09Å; S576-G580 WeakPolarHBondContact O-CA 3.08Å; S576-G580 PolarHBondContact O-N 2.9Å; S576-N581 PolarHBondContact O-N 3.15Å
577	A	92.9	Very high	86.7	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.008	13%	0.133	C	C	.	.	I	π-helix	trans	-64.9	-43.7	178.1	0	0	0	0	0	112.4	V573 I574 A575 N581 Y651 L654	V573-A577 VanDerWaalsContact O-CB 3.32Å; V573-A577 WeakPolarHBondContact O-CB 3.23Å; V573-A577 PolarHBondContact O-N 3.41Å; I574-A577 WeakPolarHBondContact O-CB 3.33Å; I574-A577 PolarHBondContact O-N 2.69Å; I574-A577 VanDerWaalsContact O-N 3.09Å; A575-A577 PolarHBondContact O-N 3.46Å; A577-N581 WeakPolarHBondContact O-CB 3.2Å; A577-N581 PolarHBondContact O-ND2 2.95Å; A577-Y651 HydrophobicContact CB-CD2 4.44Å; A577-L654 VanDerWaalsContact O-CD1 3.29Å; A577-L654 WeakPolarHBondContact O-CD1 3.33Å
578	F	91.9	Very high	86.5	Confident	15 Å²	15	28.2 Å²	28.2	7%	0.066	15%	0.147	C	C	.	.	I	π-helix	trans	-94.5	-67.9	-175	-71.7	-63.3	0	0	0	111.4	L45 D48 F49 F52 I574 G580 A582 M650 L654	L45-F578 HydrophobicContact CD1-CD2 4.45Å; L45-F578 HydrophobicContact CD1-CE2 3.58Å; L45-F578 HydrophobicContact CD1-CZ 4.29Å; D48-F578 HydrophobicContact CB-CB 4.13Å; D48-F578 HydrophobicContact CB-CD2 4.24Å; F49-F578 HydrophobicContact CD2-CD1 4.39Å; F49-F578 AromaticContact CD2-CE1 3.86Å; F49-F578 HydrophobicContact CD2-CE1 3.86Å; F49-F578 HydrophobicContact CD2-CZ 4.24Å; F52-F578 HydrophobicContact CB-CB 3.97Å; F52-F578 HydrophobicContact CB-CD1 4.06Å; F52-F578 HydrophobicContact CB-CG 4.39Å; F52-F578 AromaticContact CD1-CD1 4Å; F52-F578 HydrophobicContact CD1-CD1 4Å; F52-F578 HydrophobicContact CD2-CB 4.35Å; F52-F578 HydrophobicContact CD2-CD1 4.24Å; F52-F578 VanDerWaalsContact CD2-O 3.3Å; F52-F578 WeakPolarHBondContact CD2-O 3.28Å; F52-F578 HydrophobicContact CG-CB 4.32Å; F52-F578 AromaticContact CG-CD1 3.85Å; F52-F578 HydrophobicContact CG-CD1 3.85Å; I574-F578 HydrophobicContact CG2-CD2 4Å; I574-F578 HydrophobicContact CG2-CE2 4.23Å; I574-F578 WeakPolarHBondContact O-CD2 3.43Å; I574-F578 PolarHBondContact O-N 2.87Å; I574-F578 VanDerWaalsContact O-N 3.08Å; F578-G580 PolarHBondContact O-N 3.47Å; F578-A582 WeakPolarHBondContact O-CB 3.46Å; F578-A582 PolarHBondContact O-N 3.49Å; F578-M650 HydrophobicContact CZ-CG 4.32Å; F578-L654 HydrophobicContact CD1-CD1 4.12Å; F578-L654 HydrophobicContact CE1-CD1 4.09Å
579	I	88.1	Confident	85.9	Confident	55 Å²	55	28.2 Å²	28.2	28%	0.282	16%	0.156	S	C	.	.	I	π-helix	trans	-64.1	-46.4	-176.6	-58.9	174.1	0	0	0	110.4	D48 A575 N581 A582 M583	D48-I579 VanDerWaalsContact OD1-CD1 3.26Å; D48-I579 WeakPolarHBondContact OD1-CD1 3.25Å; A575-I579 WeakPolarHBondContact O-CA 3.34Å; A575-I579 WeakPolarHBondContact O-CB 3.27Å; A575-I579 PolarHBondContact O-N 2.83Å; I579-N581 PolarHBondContact O-N 3.49Å; I579-A582 PolarHBondContact O-N 3.41Å; I579-M583 HydrophobicContact CG2-CG 4.11Å; I579-M583 WeakPolarHBondContact O-CB 3.48Å; I579-M583 WeakPolarHBondContact O-CG 3.26Å; I579-M583 PolarHBondContact O-N 3.48Å
580	G	86.8	Confident	85.2	Confident	28 Å²	28	29.4 Å²	29.4	29%	0.289	17%	0.169	S	C	.	.	I	π-helix	trans	-57.4	-51.3	-179.3	0	0	0	0	0	113.1	A575 S576 F578 M583 D584	A575-G580 PolarHBondContact O-N 2.76Å; A575-G580 VanDerWaalsContact O-N 3.15Å; S576-G580 WeakPolarHBondContact O-CA 3.08Å; S576-G580 PolarHBondContact O-N 2.9Å; F578-G580 PolarHBondContact O-N 3.47Å; G580-M583 PolarHBondContact O-N 3.4Å; G580-D584 PolarHBondContact O-N 2.94Å
581	N	90.8	Very high	84.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68	-35.1	179	-73.8	-51.3	0	0	0	113.2	S576 A577 I579 D584 L585 Y651 L654 K655 V658	S576-N581 PolarHBondContact O-N 3.15Å; A577-N581 WeakPolarHBondContact O-CB 3.2Å; A577-N581 PolarHBondContact O-ND2 2.95Å; I579-N581 PolarHBondContact O-N 3.49Å; N581-D584 PolarHBondContact O-N 3.37Å; N581-L585 PolarHBondContact O-N 3.21Å; N581-Y651 PolarHBondContact ND2-O 3.26Å; N581-L654 HydrophobicContact CB-CB 4.33Å; N581-K655 VanDerWaalsContact OD1-CA 3.28Å; N581-K655 WeakPolarHBondContact OD1-CA 3.48Å; N581-K655 WeakPolarHBondContact OD1-CB 3.22Å; N581-K655 WeakPolarHBondContact OD1-CD 3.35Å; N581-V658 HydrophobicContact CB-CG2 4.26Å
582	A	89.8	Confident	83.8	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-65.3	-39.8	173.7	0	0	0	0	0	112.2	F52 L55 F578 I579 L585 L586	F52-A582 HydrophobicContact CD2-CB 3.72Å; F52-A582 HydrophobicContact CE2-CB 4.06Å; L55-A582 HydrophobicContact CB-CB 3.81Å; L55-A582 HydrophobicContact CD1-CB 3.65Å; L55-A582 HydrophobicContact CG-CB 4.39Å; F578-A582 WeakPolarHBondContact O-CB 3.46Å; F578-A582 PolarHBondContact O-N 3.49Å; I579-A582 PolarHBondContact O-N 3.41Å; A582-L585 WeakPolarHBondContact O-CB 3.33Å; A582-L585 PolarHBondContact O-N 3.48Å; A582-L586 WeakPolarHBondContact O-CB 3.28Å; A582-L586 WeakPolarHBondContact O-CD1 3.31Å; A582-L586 WeakPolarHBondContact O-CG 3.24Å; A582-L586 PolarHBondContact O-N 3.04Å
583	M	84.7	Confident	83.1	Confident	62 Å²	62	37.4 Å²	37.4	31%	0.305	21%	0.213	S	C	.	.	H	α-helix	trans	-64.4	-40.1	175.8	-70.8	-64.9	-62.8	0	0	112.2	I579 G580 L586 R587 I588	I579-M583 HydrophobicContact CG2-CG 4.11Å; I579-M583 WeakPolarHBondContact O-CB 3.48Å; I579-M583 WeakPolarHBondContact O-CG 3.26Å; I579-M583 PolarHBondContact O-N 3.48Å; G580-M583 PolarHBondContact O-N 3.4Å; M583-L586 PolarHBondContact O-N 3.34Å; M583-R587 PolarHBondContact O-N 2.96Å; M583-I588 HydrophobicContact CE-CB 3.64Å; M583-I588 HydrophobicContact CE-CD1 3.46Å; M583-I588 VanDerWaalsContact CE-CD1 3.46Å; M583-I588 HydrophobicContact CE-CG1 3.62Å; M583-I588 HydrophobicContact CE-CG2 4.16Å; M583-I588 HydrophobicContact SD-CD1 3.41Å; M583-I588 WeakPolarHBondContact SD-CD1 3.16Å; M583-I588 HydrophobicContact SD-CG1 3.97Å
584	D	85.6	Confident	82.3	Confident	70 Å²	70	38.5 Å²	38.5	37%	0.374	22%	0.217	S	C	.	.	H	α-helix	trans	-63.4	-40.6	173.3	-82.9	-2	0	0	0	111.8	G580 N581 R587 K655 V658 N662	G580-D584 PolarHBondContact O-N 2.94Å; N581-D584 PolarHBondContact O-N 3.37Å; D584-R587 WeakPolarHBondContact O-CG 3.45Å; D584-R587 PolarHBondContact O-N 2.87Å; D584-K655 IonicContact OD2-NZ 2.62Å; D584-K655 PolarHBondContact OD2-NZ 3.3Å; D584-V658 HydrophobicContact CB-CG1 4.14Å; D584-N662 PolarHBondContact O-ND2 2.77Å
585	L	86.8	Confident	81.7	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-62.9	-43.8	175.6	-174.1	67.5	0	0	0	111.7	L56 F59 W128 N581 A582 R587 V658 Y661	L56-L585 HydrophobicContact CD2-CD2 3.63Å; F59-L585 HydrophobicContact CD1-CD2 3.85Å; F59-L585 HydrophobicContact CD1-CG 4.3Å; F59-L585 HydrophobicContact CD2-CD2 4.27Å; F59-L585 HydrophobicContact CD2-CG 3.95Å; F59-L585 HydrophobicContact CE1-CD1 4.4Å; F59-L585 HydrophobicContact CE1-CD2 4.02Å; F59-L585 HydrophobicContact CE1-CG 4.19Å; F59-L585 HydrophobicContact CE2-CD1 4.24Å; F59-L585 HydrophobicContact CE2-CD2 4.43Å; F59-L585 HydrophobicContact CE2-CG 3.83Å; F59-L585 HydrophobicContact CG-CD2 3.98Å; F59-L585 HydrophobicContact CG-CG 4.17Å; F59-L585 HydrophobicContact CZ-CD1 4.02Å; F59-L585 HydrophobicContact CZ-CD2 4.3Å; F59-L585 HydrophobicContact CZ-CG 3.96Å; W128-L585 HydrophobicContact CH2-CD2 3.73Å; W128-L585 HydrophobicContact CZ2-CD2 4.48Å; W128-L585 HydrophobicContact CZ3-CD2 4Å; N581-L585 PolarHBondContact O-N 3.21Å; A582-L585 WeakPolarHBondContact O-CB 3.33Å; A582-L585 PolarHBondContact O-N 3.48Å; L585-R587 VanDerWaalsContact C-N 3.33Å; L585-R587 PolarHBondContact O-N 2.9Å; L585-V658 HydrophobicContact CB-CG1 3.87Å; L585-V658 HydrophobicContact CB-CG2 4.3Å; L585-V658 HydrophobicContact CD1-CG1 4.16Å; L585-V658 HydrophobicContact CD1-CG2 4.46Å; L585-Y661 HydrophobicContact CD1-CD1 3.55Å; L585-Y661 HydrophobicContact CD1-CE1 3.97Å; L585-Y661 HydrophobicContact CD1-CG 4.36Å
586	L	82.4	Confident	81.2	Confident	10 Å²	10	46.5 Å²	46.5	5%	0.052	25%	0.252	C	S	.	.	H	α-helix	trans	-72.8	-22.7	178.8	-77.9	155.7	0	0	0	113.3	L55 L58 F59 L62 A582 M583 I588 L591	L55-L586 HydrophobicContact CB-CD1 3.95Å; L55-L586 HydrophobicContact CD2-CD1 3.79Å; L55-L586 HydrophobicContact CG-CD1 4.37Å; L58-L586 HydrophobicContact CG-CD2 4.47Å; F59-L586 HydrophobicContact CB-CD2 3.69Å; F59-L586 HydrophobicContact CB-CG 4.09Å; F59-L586 HydrophobicContact CD2-CD2 4.07Å; F59-L586 HydrophobicContact CD2-CG 4.31Å; F59-L586 HydrophobicContact CG-CD2 4.4Å; L62-L586 HydrophobicContact CD1-CD2 3.76Å; A582-L586 WeakPolarHBondContact O-CB 3.28Å; A582-L586 WeakPolarHBondContact O-CD1 3.31Å; A582-L586 WeakPolarHBondContact O-CG 3.24Å; A582-L586 PolarHBondContact O-N 3.04Å; M583-L586 PolarHBondContact O-N 3.34Å; L586-I588 VanDerWaalsContact C-N 3.26Å; L586-I588 HydrophobicContact CB-CD1 4.23Å; L586-I588 HydrophobicContact CB-CG1 3.64Å; L586-I588 HydrophobicContact CD1-CD1 4.21Å; L586-I588 PolarHBondContact O-N 2.92Å; L586-L591 WeakPolarHBondContact O-CD1 3.31Å
587	R	80.9	Confident	80.6	Confident	77 Å²	77	50.9 Å²	50.9	29%	0.291	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	40.8	-175.1	-57.4	-177.1	-69.1	167.3	-3.1	112.9	M583 D584 L585 P589 G590 L591 A666	M583-R587 PolarHBondContact O-N 2.96Å; D584-R587 WeakPolarHBondContact O-CG 3.45Å; D584-R587 PolarHBondContact O-N 2.87Å; L585-R587 VanDerWaalsContact C-N 3.33Å; L585-R587 PolarHBondContact O-N 2.9Å; R587-P589 VanDerWaalsContact C-CD 3.48Å; R587-G590 PolarHBondContact O-N 3.34Å; R587-L591 PolarHBondContact O-N 2.93Å; R587-A666 PolarHBondContact NH1-O 3.21Å; R587-A666 VanDerWaalsContact NH1-O 3.16Å
588	I	74.2	Confident	79.8	Confident	61 Å²	61	52.1 Å²	52.1	31%	0.313	27%	0.272	S	S	.	.	H	α-helix	trans	-52.5	-43.9	-174	-55.4	-155.9	0	0	0	113.4	M583 L586 G590 L591 L592	M583-I588 HydrophobicContact CE-CB 3.64Å; M583-I588 HydrophobicContact CE-CD1 3.46Å; M583-I588 VanDerWaalsContact CE-CD1 3.46Å; M583-I588 HydrophobicContact CE-CG1 3.62Å; M583-I588 HydrophobicContact CE-CG2 4.16Å; M583-I588 HydrophobicContact SD-CD1 3.41Å; M583-I588 WeakPolarHBondContact SD-CD1 3.16Å; M583-I588 HydrophobicContact SD-CG1 3.97Å; L586-I588 VanDerWaalsContact C-N 3.26Å; L586-I588 HydrophobicContact CB-CD1 4.23Å; L586-I588 HydrophobicContact CB-CG1 3.64Å; L586-I588 HydrophobicContact CD1-CD1 4.21Å; L586-I588 PolarHBondContact O-N 2.92Å; I588-G590 VanDerWaalsContact C-N 3.31Å; I588-G590 PolarHBondContact O-N 3.08Å; I588-L591 PolarHBondContact O-N 3.35Å; I588-L592 WeakPolarHBondContact O-CB 3.43Å; I588-L592 PolarHBondContact O-N 2.83Å
589	P	67.8	Low	79	Confident	94 Å²	94	55 Å²	55	61%	0.61	29%	0.294	S	S	*	.	H	α-helix	trans	-61.1	-39.5	178.5	-24	34.8	0	0	0	113.1	R587 M593	R587-P589 VanDerWaalsContact C-CD 3.48Å; P589-M593 PolarHBondContact O-N 3.45Å; P589-M593 VanDerWaalsContact O-N 3.08Å
590	G	69.9	Low	78.5	Confident	26 Å²	26	57 Å²	57	27%	0.268	30%	0.304	S	S	.	.	H	α-helix	trans	-68.3	-41.8	176.3	0	0	0	0	0	112.2	R587 I588 M593 Y594	R587-G590 PolarHBondContact O-N 3.34Å; I588-G590 VanDerWaalsContact C-N 3.31Å; I588-G590 PolarHBondContact O-N 3.08Å; G590-M593 PolarHBondContact O-N 3.45Å; G590-Y594 WeakPolarHBondContact O-CB 3.43Å; G590-Y594 PolarHBondContact O-N 3.29Å
591	L	73.7	Confident	77.8	Confident	60 Å²	60	55.9 Å²	55.9	31%	0.314	29%	0.293	S	S	.	.	H	α-helix	trans	-62.9	-41.9	174.7	-73	174	0	0	0	111.9	L586 R587 I588 Y594 M595	L586-L591 WeakPolarHBondContact O-CD1 3.31Å; R587-L591 PolarHBondContact O-N 2.93Å; I588-L591 PolarHBondContact O-N 3.35Å; L591-Y594 WeakPolarHBondContact O-CB 3.36Å; L591-Y594 PolarHBondContact O-N 3.45Å; L591-M595 VanDerWaalsContact O-CG 3.26Å; L591-M595 WeakPolarHBondContact O-CG 3.41Å; L591-M595 PolarHBondContact O-N 3.36Å
592	L	71.1	Confident	76.9	Confident	108 Å²	108	61 Å²	61	57%	0.565	31%	0.312	S	S	*	.	H	α-helix	trans	-62.9	-46.3	177.3	-175	70.3	0	0	0	111.2	I588 Y594 M595 I596	I588-L592 WeakPolarHBondContact O-CB 3.43Å; I588-L592 PolarHBondContact O-N 2.83Å; L592-Y594 VanDerWaalsContact C-N 3.28Å; L592-Y594 PolarHBondContact O-N 2.92Å; L592-M595 PolarHBondContact O-N 2.95Å; L592-I596 HydrophobicContact CG-CD1 4.07Å; L592-I596 VanDerWaalsContact O-CG1 3.3Å; L592-I596 WeakPolarHBondContact O-CG1 3.26Å; L592-I596 PolarHBondContact O-N 2.89Å
593	M	72.1	Confident	76.1	Confident	64 Å²	64	61.2 Å²	61.2	32%	0.315	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-40.2	176.2	-166.8	-176.6	-155.2	0	0	111.4	P589 G590 I596 R597	P589-M593 PolarHBondContact O-N 3.45Å; P589-M593 VanDerWaalsContact O-N 3.08Å; G590-M593 PolarHBondContact O-N 3.45Å; M593-I596 PolarHBondContact O-N 3.26Å; M593-R597 WeakPolarHBondContact O-CB 3.48Å; M593-R597 VanDerWaalsContact O-CG 3.31Å; M593-R597 WeakPolarHBondContact O-CG 3.19Å; M593-R597 PolarHBondContact O-N 2.89Å
594	Y	73.9	Confident	75.6	Confident	22 Å²	22	60.3 Å²	60.3	9%	0.086	32%	0.316	C	S	.	.	H	α-helix	trans	-61.6	-48	174	167.3	-104.3	0	0	0	112	G590 L591 L592 I596 R597 L598 V610 K611 Q614	G590-Y594 WeakPolarHBondContact O-CB 3.43Å; G590-Y594 PolarHBondContact O-N 3.29Å; L591-Y594 WeakPolarHBondContact O-CB 3.36Å; L591-Y594 PolarHBondContact O-N 3.45Å; L592-Y594 VanDerWaalsContact C-N 3.28Å; L592-Y594 PolarHBondContact O-N 2.92Å; Y594-I596 VanDerWaalsContact C-N 3.33Å; Y594-I596 PolarHBondContact O-N 2.92Å; Y594-R597 PolarHBondContact O-N 2.99Å; Y594-L598 HydrophobicContact CE2-CD1 4.17Å; Y594-L598 WeakPolarHBondContact O-CB 3.41Å; Y594-L598 PolarHBondContact O-N 3.3Å; Y594-V610 HydrophobicContact CD2-CG1 4.22Å; Y594-V610 HydrophobicContact CE2-CG1 4.18Å; Y594-K611 HydrophobicContact CE2-CG 4.37Å; Y594-K611 WeakPolarHBondContact OH-CG 3.32Å; Y594-Q614 VanDerWaalsContact CD2-CD 3.44Å; Y594-Q614 HydrophobicContact CD2-CG 3.96Å; Y594-Q614 HydrophobicContact CE2-CG 4.45Å; Y594-Q614 VanDerWaalsContact CE2-OE1 3.24Å; Y594-Q614 HydrophobicContact CG-CG 4.43Å
595	M	75.4	Confident	75	Confident	110 Å²	110	57.3 Å²	57.3	54%	0.542	30%	0.301	S	S	.	.	H	α-helix	trans	-60.8	-41.9	177.8	-67.8	-64.3	-99.9	0	0	111.6	L591 L592 L598 C599	L591-M595 VanDerWaalsContact O-CG 3.26Å; L591-M595 WeakPolarHBondContact O-CG 3.41Å; L591-M595 PolarHBondContact O-N 3.36Å; L592-M595 PolarHBondContact O-N 2.95Å; M595-L598 WeakPolarHBondContact O-CB 3.18Å; M595-L598 PolarHBondContact O-N 3.48Å; M595-C599 PolarHBondContact O-N 3.25Å; M595-C599 PolarHBondContact O-SG 3.47Å
596	I	77.4	Confident	74.4	Confident	89 Å²	89	58.5 Å²	58.5	46%	0.456	31%	0.306	S	S	.	.	H	α-helix	trans	-61.4	-47.2	174.8	-67.5	166.1	0	0	0	110.8	L592 M593 Y594 L598 C599 L600	L592-I596 HydrophobicContact CG-CD1 4.07Å; L592-I596 VanDerWaalsContact O-CG1 3.3Å; L592-I596 WeakPolarHBondContact O-CG1 3.26Å; L592-I596 PolarHBondContact O-N 2.89Å; M593-I596 PolarHBondContact O-N 3.26Å; Y594-I596 VanDerWaalsContact C-N 3.33Å; Y594-I596 PolarHBondContact O-N 2.92Å; I596-L598 VanDerWaalsContact C-N 3.27Å; I596-L598 PolarHBondContact O-N 2.88Å; I596-C599 PolarHBondContact O-N 3.48Å; I596-L600 HydrophobicContact CG2-CD1 3.87Å; I596-L600 HydrophobicContact CG2-CG 4.41Å; I596-L600 WeakPolarHBondContact O-CG 3.46Å; I596-L600 PolarHBondContact O-N 2.95Å
597	R	76.4	Confident	74	Confident	112 Å²	112	61.6 Å²	61.6	42%	0.423	32%	0.317	S	S	.	.	H	α-helix	trans	-61.5	-36.4	176.9	-74	175.8	179.8	-166.5	-0.9	112.1	M593 Y594 L600 A601 V610	M593-R597 WeakPolarHBondContact O-CB 3.48Å; M593-R597 VanDerWaalsContact O-CG 3.31Å; M593-R597 WeakPolarHBondContact O-CG 3.19Å; M593-R597 PolarHBondContact O-N 2.89Å; Y594-R597 PolarHBondContact O-N 2.99Å; R597-L600 PolarHBondContact O-N 3.48Å; R597-A601 PolarHBondContact O-N 2.97Å; R597-A601 VanDerWaalsContact O-N 3.16Å; R597-V610 HydrophobicContact CB-CG1 4.01Å
598	L	76.1	Confident	73.5	Confident	27 Å²	27	63.6 Å²	63.6	14%	0.141	33%	0.325	C	S	.	.	H	α-helix	trans	-66	-41.8	176.4	-155.3	78	0	0	0	111.7	Y594 M595 I596 L600 A601 R607	Y594-L598 HydrophobicContact CE2-CD1 4.17Å; Y594-L598 WeakPolarHBondContact O-CB 3.41Å; Y594-L598 PolarHBondContact O-N 3.3Å; M595-L598 WeakPolarHBondContact O-CB 3.18Å; M595-L598 PolarHBondContact O-N 3.48Å; I596-L598 VanDerWaalsContact C-N 3.27Å; I596-L598 PolarHBondContact O-N 2.88Å; L598-L600 VanDerWaalsContact C-N 3.35Å; L598-A601 WeakPolarHBondContact O-CB 3.19Å; L598-A601 PolarHBondContact O-N 2.84Å; L598-R607 HydrophobicContact CD1-CG 3.3Å; L598-R607 HydrophobicContact CG-CG 3.97Å
599	C	75.8	Confident	73.4	Confident	76 Å²	76	61.7 Å²	61.7	51%	0.514	32%	0.315	S	S	.	.	H	α-helix	trans	-67	-34.8	176.2	-68.6	0	0	0	0	112.4	M595 I596	M595-C599 PolarHBondContact O-N 3.25Å; M595-C599 PolarHBondContact O-SG 3.47Å; I596-C599 PolarHBondContact O-N 3.48Å
600	L	76.1	Confident	73.6	Confident	96 Å²	96	58.7 Å²	58.7	50%	0.503	30%	0.295	S	S	.	.	H	α-helix	trans	-80.5	-11.8	179.3	-67.5	174.3	0	0	0	114	I596 R597 L598	I596-L600 HydrophobicContact CG2-CD1 3.87Å; I596-L600 HydrophobicContact CG2-CG 4.41Å; I596-L600 WeakPolarHBondContact O-CG 3.46Å; I596-L600 PolarHBondContact O-N 2.95Å; R597-L600 PolarHBondContact O-N 3.48Å; L598-L600 VanDerWaalsContact C-N 3.35Å
601	A	74.1	Confident	73.6	Confident	6 Å²	6	60.3 Å²	60.3	5%	0.05	30%	0.295	C	S	.	.			trans	-63.3	136.3	-179.1	0	0	0	0	0	111.8	R597 L598 E606	R597-A601 PolarHBondContact O-N 2.97Å; R597-A601 VanDerWaalsContact O-N 3.16Å; L598-A601 WeakPolarHBondContact O-CB 3.19Å; L598-A601 PolarHBondContact O-N 2.84Å; A601-E606 HydrophobicContact CB-CB 4.37Å; A601-E606 HydrophobicContact CB-CG 4.14Å
602	R	71.1	Confident	73.1	Confident	107 Å²	107	62 Å²	62	40%	0.404	30%	0.297	S	S	.	.			trans	-79	-38.6	-173.5	-58.4	171.4	-178.2	172.8	5.2	112.5	P313 E606	P313-R602 WeakPolarHBondContact O-CD 3.35Å; R602-E606 WeakPolarHBondContact CB-OE2 3.45Å; R602-E606 VanDerWaalsContact CG-OE2 3.26Å; R602-E606 WeakPolarHBondContact CG-OE2 3.48Å; R602-E606 PolarHBondContact N-OE2 3.48Å
603	S	73.3	Confident	72.7	Confident	6 Å²	6	61.9 Å²	61.9	4%	0.042	29%	0.293	C	S	.	.	S	Bend	trans	-136.3	165.6	-171.3	75.6	0	0	0	0	112.9	Y336 A605 E606 R607	Y336-S603 PolarHBondContact OH-OG 3.16Å; S603-A605 VanDerWaalsContact C-N 3.26Å; S603-A605 PolarHBondContact O-N 2.94Å; S603-A605 PolarHBondContact OG-N 3.27Å; S603-E606 PolarHBondContact O-N 3.38Å; S603-E606 PolarHBondContact OG-N 2.96Å; S603-E606 VanDerWaalsContact OG-N 3.16Å; S603-R607 PolarHBondContact O-N 3.33Å
604	A	74.3	Confident	72.1	Confident	43 Å²	43	60.3 Å²	60.3	36%	0.355	29%	0.285	S	S	.	.	H	α-helix	trans	-58.3	-37.7	173.9	0	0	0	0	0	112.3	Y297 R607 R608	Y297-A604 HydrophobicContact CE1-CB 4.04Å; A604-R607 WeakPolarHBondContact O-CB 3.46Å; A604-R607 PolarHBondContact O-N 3.05Å; A604-R608 PolarHBondContact O-N 3.42Å; A604-R608 VanDerWaalsContact O-N 3.08Å
605	A	72.5	Confident	71.6	Confident	7 Å²	7	60.7 Å²	60.7	6%	0.058	29%	0.293	C	S	.	.	H	α-helix	trans	-67.3	-41.3	176.1	0	0	0	0	0	112.6	Y297 F298 S603 R607 R608 N609	Y297-A605 HydrophobicContact CD1-CB 3.66Å; Y297-A605 HydrophobicContact CE1-CB 4.38Å; Y297-A605 HydrophobicContact CG-CB 3.98Å; F298-A605 HydrophobicContact CD2-CB 4.13Å; F298-A605 HydrophobicContact CE2-CB 3.45Å; F298-A605 VanDerWaalsContact CE2-CB 3.45Å; F298-A605 HydrophobicContact CZ-CB 4.03Å; S603-A605 VanDerWaalsContact C-N 3.26Å; S603-A605 PolarHBondContact O-N 2.94Å; S603-A605 PolarHBondContact OG-N 3.27Å; A605-R607 VanDerWaalsContact C-N 3.28Å; A605-R607 PolarHBondContact O-N 3.33Å; A605-R608 PolarHBondContact O-N 3.41Å; A605-N609 PolarHBondContact O-N 2.9Å
606	E	74.6	Confident	71.2	Confident	27 Å²	27	58.9 Å²	58.9	13%	0.126	28%	0.281	C	S	.	.	H	α-helix	trans	-64.6	-36.1	175.9	-173.1	167.7	-151.5	0	0	111.3	K290 A601 R602 S603 N609 V610	K290-E606 WeakPolarHBondContact CE-OE1 3.39Å; K290-E606 IonicContact NZ-OE1 2.74Å; K290-E606 PolarHBondContact NZ-OE1 2.82Å; A601-E606 HydrophobicContact CB-CB 4.37Å; A601-E606 HydrophobicContact CB-CG 4.14Å; R602-E606 WeakPolarHBondContact CB-OE2 3.45Å; R602-E606 VanDerWaalsContact CG-OE2 3.26Å; R602-E606 WeakPolarHBondContact CG-OE2 3.48Å; R602-E606 PolarHBondContact N-OE2 3.48Å; S603-E606 PolarHBondContact O-N 3.38Å; S603-E606 PolarHBondContact OG-N 2.96Å; S603-E606 VanDerWaalsContact OG-N 3.16Å; E606-N609 PolarHBondContact O-N 3.35Å; E606-V610 VanDerWaalsContact O-CG2 3.3Å; E606-V610 WeakPolarHBondContact O-CG2 3.18Å; E606-V610 PolarHBondContact O-N 2.94Å
607	R	74.4	Confident	71.2	Confident	76 Å²	76	57.4 Å²	57.4	29%	0.287	27%	0.272	S	S	.	.	H	α-helix	trans	-60.7	-46.4	173	-165.9	-177.7	-70.3	-155.5	2.1	112.1	H318 L598 S603 A604 A605 N609 V610 K611	H318-R607 PolarHBondContact CD2-NH2 2.98Å; H318-R607 PolarHBondContact NE2-NH2 3.39Å; L598-R607 HydrophobicContact CD1-CG 3.3Å; L598-R607 HydrophobicContact CG-CG 3.97Å; S603-R607 PolarHBondContact O-N 3.33Å; A604-R607 WeakPolarHBondContact O-CB 3.46Å; A604-R607 PolarHBondContact O-N 3.05Å; A605-R607 VanDerWaalsContact C-N 3.28Å; A605-R607 PolarHBondContact O-N 3.33Å; R607-N609 VanDerWaalsContact C-N 3.28Å; R607-N609 PolarHBondContact O-N 3.19Å; R607-V610 PolarHBondContact O-N 3.07Å; R607-K611 WeakPolarHBondContact O-CG 3.44Å; R607-K611 PolarHBondContact O-N 3.21Å
608	R	70.6	Confident	71.5	Confident	119 Å²	119	52.7 Å²	52.7	45%	0.449	25%	0.254	S	S	.	.	H	α-helix	trans	-62.2	-38	175	-170.5	173.1	-178.3	170.4	-1.6	111.3	A604 A605 K611 R612	A604-R608 PolarHBondContact O-N 3.42Å; A604-R608 VanDerWaalsContact O-N 3.08Å; A605-R608 PolarHBondContact O-N 3.41Å; R608-K611 WeakPolarHBondContact O-CB 3.5Å; R608-K611 PolarHBondContact O-N 3.24Å; R608-R612 PolarHBondContact O-N 3.35Å
609	N	70.9	Confident	72	Confident	20 Å²	20	54.7 Å²	54.7	11%	0.107	26%	0.263	C	S	.	.	H	α-helix	trans	-68.4	-38.4	177.2	-160.4	38.9	0	0	0	113	K290 R293 A605 E606 R607 R612 H613	K290-N609 VanDerWaalsContact CG-ND2 3.31Å; K290-N609 WeakPolarHBondContact CG-ND2 3.42Å; R293-N609 PolarHBondContact NH1-OD1 2.98Å; A605-N609 PolarHBondContact O-N 2.9Å; E606-N609 PolarHBondContact O-N 3.35Å; R607-N609 VanDerWaalsContact C-N 3.28Å; R607-N609 PolarHBondContact O-N 3.19Å; N609-R612 PolarHBondContact O-N 3.3Å; N609-H613 PolarHBondContact O-N 3.07Å; N609-H613 PolarHBondContact O-ND1 3.01Å; N609-H613 PolarHBondContact OD1-CE1 3.4Å; N609-H613 PolarHBondContact OD1-ND1 3.42Å
610	V	72.9	Confident	72.7	Confident	32 Å²	32	51.3 Å²	51.3	19%	0.194	24%	0.24	C	C	.	.	H	α-helix	trans	-64.1	-41.1	173.2	170.6	0	0	0	0	110.8	Y594 R597 E606 R607 H613	Y594-V610 HydrophobicContact CD2-CG1 4.22Å; Y594-V610 HydrophobicContact CE2-CG1 4.18Å; R597-V610 HydrophobicContact CB-CG1 4.01Å; E606-V610 VanDerWaalsContact O-CG2 3.3Å; E606-V610 WeakPolarHBondContact O-CG2 3.18Å; E606-V610 PolarHBondContact O-N 2.94Å; R607-V610 PolarHBondContact O-N 3.07Å; V610-H613 PolarHBondContact O-N 3.24Å
611	K	69.1	Low	73.3	Confident	59 Å²	59	46.8 Å²	46.8	26%	0.257	22%	0.216	S	C	.	.	H	α-helix	trans	-59.7	-44	174.4	-73.9	175.7	176.3	-168.1	0	112.3	Y594 R607 R608 Q614	Y594-K611 HydrophobicContact CE2-CG 4.37Å; Y594-K611 WeakPolarHBondContact OH-CG 3.32Å; R607-K611 WeakPolarHBondContact O-CG 3.44Å; R607-K611 PolarHBondContact O-N 3.21Å; R608-K611 WeakPolarHBondContact O-CB 3.5Å; R608-K611 PolarHBondContact O-N 3.24Å; K611-Q614 WeakPolarHBondContact O-CB 3.32Å
612	R	64.3	Low	74	Confident	95 Å²	95	47.3 Å²	47.3	36%	0.358	22%	0.22	S	C	.	.	H	α-helix	trans	-69.6	-31.8	-177.6	-164.7	170.1	176.4	155.6	3.1	113.1	T76 R608 N609	T76-R612 HydrophobicContact CG2-CG 4.21Å; R608-R612 PolarHBondContact O-N 3.35Å; N609-R612 PolarHBondContact O-N 3.3Å
613	H	62.5	Low	74.9	Confident	106 Å²	106	42.8 Å²	42.8	49%	0.491	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	27.7	178.9	-61.1	98.4	0	0	0	113.9	R293 N609 V610	R293-H613 PolarHBondContact NH1-CE1 3.49Å; R293-H613 PolarHBondContact NH1-NE2 3.03Å; N609-H613 PolarHBondContact O-N 3.07Å; N609-H613 PolarHBondContact O-ND1 3.01Å; N609-H613 PolarHBondContact OD1-CE1 3.4Å; N609-H613 PolarHBondContact OD1-ND1 3.42Å; V610-H613 PolarHBondContact O-N 3.24Å
614	Q	59.5	Low	75.8	Confident	32 Å²	32	42.5 Å²	42.5	15%	0.15	20%	0.204	C	C	.	.			trans	-81.3	-16.2	-179.1	-172.6	175.9	-4	0	0	113.3	A73 Y594 K611 Y616	A73-Q614 HydrophobicContact CB-CB 4.44Å; Y594-Q614 VanDerWaalsContact CD2-CD 3.44Å; Y594-Q614 HydrophobicContact CD2-CG 3.96Å; Y594-Q614 HydrophobicContact CE2-CG 4.45Å; Y594-Q614 VanDerWaalsContact CE2-OE1 3.24Å; Y594-Q614 HydrophobicContact CG-CG 4.43Å; K611-Q614 WeakPolarHBondContact O-CB 3.32Å; Q614-Y616 WeakPolarHBondContact O-CD2 3.42Å; Q614-Y616 VanDerWaalsContact O-CE2 3.26Å; Q614-Y616 WeakPolarHBondContact O-CE2 3.37Å; Q614-Y616 PolarHBondContact O-N 3.13Å
615	A	62	Low	76.6	Confident	30 Å²	30	40.5 Å²	40.5	25%	0.248	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-68	122.7	-174.7	0	0	0	0	0	110.1	A73 L74 L668	A73-A615 HydrophobicContact CB-CB 4.2Å; L74-A615 HydrophobicContact CD2-CB 4.33Å; A615-L668 HydrophobicContact CB-CD1 3.3Å; A615-L668 HydrophobicContact CB-CG 4.26Å
616	Y	68.6	Low	77.4	Confident	72 Å²	72	44.5 Å²	44.5	28%	0.282	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	149.4	179.9	-71.4	-83.4	0	0	0	109.8	Q614 Y667 L668	Q614-Y616 WeakPolarHBondContact O-CD2 3.42Å; Q614-Y616 VanDerWaalsContact O-CE2 3.26Å; Q614-Y616 WeakPolarHBondContact O-CE2 3.37Å; Q614-Y616 PolarHBondContact O-N 3.13Å; Y616-Y667 WeakPolarHBondContact O-CA 3.42Å; Y616-Y667 VanDerWaalsContact O-CD1 3.32Å; Y616-Y667 WeakPolarHBondContact O-CD1 3.39Å; Y616-L668 VanDerWaalsContact O-CD1 3.27Å; Y616-L668 WeakPolarHBondContact O-CD1 3.29Å; Y616-L668 PolarHBondContact O-N 3.41Å
617	E	76.3	Confident	78.2	Confident	58 Å²	58	43.2 Å²	43.2	27%	0.271	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	147.4	167.9	-68	174.3	-179.8	0	0	110.3	R507 Q619 L668	R507-E617 VanDerWaalsContact CD-OE2 3.26Å; R507-E617 WeakPolarHBondContact CD-OE2 3.48Å; R507-E617 IonicContact CZ-OE1 3.07Å; R507-E617 IonicContact CZ-OE2 3.97Å; R507-E617 IonicContact NE-OE1 2.82Å; R507-E617 IonicContact NE-OE2 2.64Å; R507-E617 PolarHBondContact NE-OE2 2.78Å; R507-E617 IonicContact NH1-OE1 3.55Å; R507-E617 PolarHBondContact NH1-OE1 2.93Å; R507-E617 IonicContact NH1-OE2 2.78Å; R507-E617 PolarHBondContact NH1-OE2 3.35Å; R507-E617 VanDerWaalsContact NH1-OE2 3.12Å; R507-E617 IonicContact NH2-OE1 3.74Å; R507-E617 PolarHBondContact NH2-OE1 3.1Å; R507-E617 IonicContact NH2-OE2 2.6Å; R507-E617 PolarHBondContact NH2-OE2 3.27Å; R507-E617 VanDerWaalsContact NH2-OE2 3.07Å; E617-Q619 PolarHBondContact O-N 2.98Å; E617-L668 HydrophobicContact CG-CB 4.26Å
618	F	83.5	Confident	79.1	Confident	13 Å²	13	39.6 Å²	39.6	6%	0.057	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-69.8	122.9	176.3	-173.1	-108.7	0	0	0	110.6	Y151 F620 A623 L663 Y667	Y151-F618 HydrophobicContact CD1-CE1 4.27Å; Y151-F618 HydrophobicContact CE1-CE1 4.09Å; Y151-F618 HydrophobicContact CE1-CZ 4.02Å; Y151-F618 HydrophobicContact CE2-CE1 4.39Å; F618-F620 HydrophobicContact CB-CE2 4.2Å; F618-F620 AromaticContact CD1-CD1 3.7Å; F618-F620 HydrophobicContact CD1-CD1 3.7Å; F618-F620 AromaticContact CD1-CD2 3.78Å; F618-F620 HydrophobicContact CD1-CD2 3.78Å; F618-F620 AromaticContact CD1-CE1 3.73Å; F618-F620 HydrophobicContact CD1-CE1 3.73Å; F618-F620 AromaticContact CD1-CE2 3.83Å; F618-F620 HydrophobicContact CD1-CE2 3.83Å; F618-F620 AromaticContact CD1-CG 3.75Å; F618-F620 HydrophobicContact CD1-CG 3.75Å; F618-F620 AromaticContact CD1-CZ 3.81Å; F618-F620 HydrophobicContact CD1-CZ 3.81Å; F618-F620 AromaticContact CE1-CD1 3.86Å; F618-F620 HydrophobicContact CE1-CD1 3.86Å; F618-F620 HydrophobicContact CE1-CE1 4.07Å; F618-F620 HydrophobicContact CE1-CG 4.19Å; F618-F620 WeakPolarHBondContact O-CD2 3.45Å; F618-F620 PolarHBondContact O-N 3.06Å; F618-A623 HydrophobicContact CE1-CB 3.85Å; F618-A623 HydrophobicContact CE2-CB 4.37Å; F618-A623 HydrophobicContact CZ-CB 3.52Å; F618-L663 HydrophobicContact CB-CD2 3.78Å; F618-L663 HydrophobicContact CD1-CD2 3.63Å; F618-L663 HydrophobicContact CD2-CD2 3.84Å; F618-L663 HydrophobicContact CD2-CG 4.39Å; F618-L663 HydrophobicContact CE1-CD2 4.1Å; F618-L663 HydrophobicContact CE2-CD2 4.28Å; F618-L663 HydrophobicContact CE2-CG 4.44Å; F618-L663 HydrophobicContact CG-CD2 3.47Å; F618-L663 VanDerWaalsContact CG-CD2 3.47Å; F618-L663 HydrophobicContact CG-CG 4.44Å; F618-L663 HydrophobicContact CZ-CD2 4.39Å; F618-Y667 HydrophobicContact CB-CD1 4.04Å; F618-Y667 HydrophobicContact CB-CD2 4.21Å; F618-Y667 HydrophobicContact CB-CG 3.81Å; F618-Y667 HydrophobicContact CD2-CD1 4.26Å; F618-Y667 AromaticContact CD2-CD2 3.53Å; F618-Y667 HydrophobicContact CD2-CD2 3.53Å; F618-Y667 HydrophobicContact CD2-CE1 4.21Å; F618-Y667 AromaticContact CD2-CE2 3.44Å; F618-Y667 HydrophobicContact CD2-CE2 3.44Å; F618-Y667 VanDerWaalsContact CD2-CE2 3.44Å; F618-Y667 AromaticContact CD2-CG 3.97Å; F618-Y667 HydrophobicContact CD2-CG 3.97Å; F618-Y667 AromaticContact CD2-CZ 3.82Å; F618-Y667 HydrophobicContact CE2-CD2 4.35Å; F618-Y667 AromaticContact CE2-CE2 3.97Å; F618-Y667 HydrophobicContact CE2-CE2 3.97Å; F618-Y667 HydrophobicContact CG-CD2 4.3Å; F618-Y667 HydrophobicContact CG-CG 4.39Å
619	Q	86.1	Confident	80.1	Confident	69 Å²	69	34 Å²	34	32%	0.322	16%	0.16	S	C	.	.			trans	-85.8	81.4	-179.5	-64.3	-173.9	-4	0	0	111.1	Y496 E617 G621 A622 A623	Y496-Q619 VanDerWaalsContact CE2-CD 3.44Å; Y496-Q619 PolarHBondContact OH-NE2 2.98Å; E617-Q619 PolarHBondContact O-N 2.98Å; Q619-G621 PolarHBondContact O-N 2.96Å; Q619-G621 VanDerWaalsContact O-N 3.16Å; Q619-A622 HydrophobicContact CB-CB 4.44Å; Q619-A622 PolarHBondContact O-N 3.46Å; Q619-A623 PolarHBondContact O-N 2.99Å; Q619-A623 VanDerWaalsContact O-N 3.1Å
620	F	89.4	Confident	81.2	Confident	5 Å²	5	33.1 Å²	33.1	2%	0.022	16%	0.156	C	C	.	.	H	α-helix	trans	-51.9	-39.4	178.7	-70.3	-89	0	0	0	112.3	D147 Y151 F618 A622 A623 Y624 A670 L672	D147-F620 HydrophobicContact CB-CE1 4.47Å; D147-F620 HydrophobicContact CB-CZ 4.14Å; Y151-F620 AromaticContact CD2-CD1 3.98Å; Y151-F620 HydrophobicContact CD2-CD1 3.98Å; Y151-F620 HydrophobicContact CD2-CE1 4.48Å; Y151-F620 HydrophobicContact CG-CD1 4.11Å; Y151-F620 HydrophobicContact CG-CE1 4.14Å; F618-F620 HydrophobicContact CB-CE2 4.2Å; F618-F620 AromaticContact CD1-CD1 3.7Å; F618-F620 HydrophobicContact CD1-CD1 3.7Å; F618-F620 AromaticContact CD1-CD2 3.78Å; F618-F620 HydrophobicContact CD1-CD2 3.78Å; F618-F620 AromaticContact CD1-CE1 3.73Å; F618-F620 HydrophobicContact CD1-CE1 3.73Å; F618-F620 AromaticContact CD1-CE2 3.83Å; F618-F620 HydrophobicContact CD1-CE2 3.83Å; F618-F620 AromaticContact CD1-CG 3.75Å; F618-F620 HydrophobicContact CD1-CG 3.75Å; F618-F620 AromaticContact CD1-CZ 3.81Å; F618-F620 HydrophobicContact CD1-CZ 3.81Å; F618-F620 AromaticContact CE1-CD1 3.86Å; F618-F620 HydrophobicContact CE1-CD1 3.86Å; F618-F620 HydrophobicContact CE1-CE1 4.07Å; F618-F620 HydrophobicContact CE1-CG 4.19Å; F618-F620 WeakPolarHBondContact O-CD2 3.45Å; F618-F620 PolarHBondContact O-N 3.06Å; F620-A622 PolarHBondContact O-N 3.05Å; F620-A623 PolarHBondContact O-N 3.41Å; F620-Y624 HydrophobicContact CB-CD2 4.24Å; F620-Y624 HydrophobicContact CB-CE2 4.32Å; F620-Y624 HydrophobicContact CD1-CE2 4.37Å; F620-Y624 WeakPolarHBondContact O-CB 3.17Å; F620-Y624 WeakPolarHBondContact O-CD2 3.11Å; F620-Y624 PolarHBondContact O-N 3.37Å; F620-A670 HydrophobicContact CE2-CB 4.27Å; F620-L672 HydrophobicContact CB-CD1 3.98Å; F620-L672 HydrophobicContact CD2-CD1 3.19Å; F620-L672 HydrophobicContact CD2-CG 4.5Å; F620-L672 HydrophobicContact CE2-CD1 3.73Å; F620-L672 HydrophobicContact CG-CD1 3.69Å
621	G	89.5	Confident	82.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.1	-48.6	-177.6	0	0	0	0	0	113.8	N511 M515 Q619 A625	N511-G621 VanDerWaalsContact O-CA 3.31Å; N511-G621 WeakPolarHBondContact O-CA 3.09Å; N511-G621 PolarHBondContact OD1-N 3.49Å; M515-G621 WeakPolarHBondContact CA-O 3.27Å; M515-G621 WeakPolarHBondContact CB-O 3.48Å; Q619-G621 PolarHBondContact O-N 2.96Å; Q619-G621 VanDerWaalsContact O-N 3.16Å; G621-A625 PolarHBondContact O-N 3.12Å
622	A	87.9	Confident	83.4	Confident	17 Å²	17	28.9 Å²	28.9	14%	0.14	13%	0.134	C	C	.	.	H	α-helix	trans	-70.1	-43.6	178.3	0	0	0	0	0	111.4	T514 Q619 F620 Y624 A625 W626	T514-A622 HydrophobicContact CG2-CB 4.46Å; Q619-A622 HydrophobicContact CB-CB 4.44Å; Q619-A622 PolarHBondContact O-N 3.46Å; F620-A622 PolarHBondContact O-N 3.05Å; A622-Y624 VanDerWaalsContact C-N 3.34Å; A622-Y624 PolarHBondContact O-N 2.92Å; A622-A625 PolarHBondContact O-N 3.21Å; A622-W626 VanDerWaalsContact O-CD1 3.26Å; A622-W626 PolarHBondContact O-N 3.29Å; A622-W626 VanDerWaalsContact O-N 3.11Å
623	A	90.1	Very high	84.8	Confident	13 Å²	13	24.4 Å²	24.4	11%	0.107	12%	0.118	C	C	.	.	H	α-helix	trans	-61.7	-40.4	-180	0	0	0	0	0	112.3	Y151 F618 Q619 F620 M627	Y151-A623 HydrophobicContact CE2-CB 4.2Å; F618-A623 HydrophobicContact CE1-CB 3.85Å; F618-A623 HydrophobicContact CE2-CB 4.37Å; F618-A623 HydrophobicContact CZ-CB 3.52Å; Q619-A623 PolarHBondContact O-N 2.99Å; Q619-A623 VanDerWaalsContact O-N 3.1Å; F620-A623 PolarHBondContact O-N 3.41Å; A623-M627 WeakPolarHBondContact O-CB 3.39Å; A623-M627 PolarHBondContact O-N 2.78Å
624	Y	92.4	Very high	86.3	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.7	-50.6	171.9	-87.5	-60.6	0	0	0	111.5	Y151 F154 M515 F620 A622 W626 M627 M628 I676 H677 A680	Y151-Y624 WeakPolarHBondContact CA-OH 3.13Å; Y151-Y624 HydrophobicContact CD2-CD1 4.12Å; Y151-Y624 HydrophobicContact CD2-CD2 4.11Å; Y151-Y624 AromaticContact CD2-CE1 3.64Å; Y151-Y624 HydrophobicContact CD2-CE1 3.64Å; Y151-Y624 AromaticContact CD2-CE2 3.63Å; Y151-Y624 HydrophobicContact CD2-CE2 3.63Å; Y151-Y624 HydrophobicContact CD2-CG 4.32Å; Y151-Y624 AromaticContact CD2-CZ 3.38Å; Y151-Y624 AromaticContact CE2-CD1 3.93Å; Y151-Y624 HydrophobicContact CE2-CD1 3.93Å; Y151-Y624 HydrophobicContact CE2-CD2 4.23Å; Y151-Y624 AromaticContact CE2-CE1 3.9Å; Y151-Y624 HydrophobicContact CE2-CE1 3.9Å; Y151-Y624 HydrophobicContact CE2-CE2 4.21Å; Y151-Y624 HydrophobicContact CE2-CG 4.08Å; F154-Y624 HydrophobicContact CB-CE1 4.43Å; F154-Y624 HydrophobicContact CD1-CD1 4.13Å; F154-Y624 AromaticContact CD1-CE1 3.54Å; F154-Y624 HydrophobicContact CD1-CE1 3.54Å; F154-Y624 AromaticContact CE1-CD1 3.82Å; F154-Y624 HydrophobicContact CE1-CD1 3.82Å; F154-Y624 AromaticContact CE1-CE1 3.65Å; F154-Y624 HydrophobicContact CE1-CE1 3.65Å; F154-Y624 AromaticContact CG-CE1 3.94Å; F154-Y624 HydrophobicContact CG-CE1 3.94Å; F154-Y624 HydrophobicContact CZ-CD1 4.34Å; F154-Y624 HydrophobicContact CZ-CE1 4.18Å; M515-Y624 HydrophobicContact SD-CD2 4.24Å; M515-Y624 HydrophobicContact SD-CG 4.13Å; F620-Y624 HydrophobicContact CB-CD2 4.24Å; F620-Y624 HydrophobicContact CB-CE2 4.32Å; F620-Y624 HydrophobicContact CD1-CE2 4.37Å; F620-Y624 WeakPolarHBondContact O-CB 3.17Å; F620-Y624 WeakPolarHBondContact O-CD2 3.11Å; F620-Y624 PolarHBondContact O-N 3.37Å; A622-Y624 VanDerWaalsContact C-N 3.34Å; A622-Y624 PolarHBondContact O-N 2.92Å; Y624-W626 PolarHBondContact O-N 3.48Å; Y624-M627 HydrophobicContact CD1-CE 3.64Å; Y624-M627 HydrophobicContact CE1-CE 4.12Å; Y624-M627 PolarHBondContact O-N 3.23Å; Y624-M628 WeakPolarHBondContact O-CB 3.38Å; Y624-M628 WeakPolarHBondContact O-CE 3.29Å; Y624-M628 VanDerWaalsContact O-CG 3.23Å; Y624-M628 WeakPolarHBondContact O-CG 3.46Å; Y624-M628 PolarHBondContact O-N 3.1Å; Y624-I676 HydrophobicContact CD2-CG2 4.28Å; Y624-I676 HydrophobicContact CE2-CG2 4.16Å; Y624-H677 AromaticContact CE2-ND1 3.93Å; Y624-H677 AromaticContact CZ-ND1 3.74Å; Y624-H677 PolarHBondContact OH-CE1 3.4Å; Y624-H677 PolarHBondContact OH-ND1 3.05Å; Y624-A680 HydrophobicContact CD1-CB 3.69Å; Y624-A680 HydrophobicContact CD2-CB 4.47Å; Y624-A680 HydrophobicContact CE1-CB 3.78Å; Y624-A680 HydrophobicContact CG-CB 4.08Å
625	A	91.6	Very high	88	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-58.7	-45.9	-174.7	0	0	0	0	0	113.2	C518 G621 A622 C629	C518-A625 HydrophobicContact CB-CB 3.58Å; G621-A625 PolarHBondContact O-N 3.12Å; A622-A625 PolarHBondContact O-N 3.21Å; A625-C629 VanDerWaalsContact O-CB 3.31Å; A625-C629 WeakPolarHBondContact O-CB 3.3Å; A625-C629 PolarHBondContact O-N 3.12Å
626	W	88.6	Confident	89.4	Confident	92 Å²	92	16.5 Å²	16.5	35%	0.348	8%	0.076	S	C	.	.	H	α-helix	trans	-64.8	-48.9	179	-81.3	110.4	0	0	0	113	P492 L522 A622 Y624 M628 C629 V630	P492-W626 HydrophobicContact CB-CH2 3.9Å; P492-W626 HydrophobicContact CB-CZ2 3.17Å; P492-W626 HydrophobicContact CG-CH2 3.39Å; P492-W626 HydrophobicContact CG-CZ2 3.22Å; L522-W626 HydrophobicContact CD1-CD2 3.59Å; L522-W626 HydrophobicContact CD1-CE3 3.65Å; L522-W626 HydrophobicContact CD1-CG 4.09Å; L522-W626 HydrophobicContact CD1-CZ2 4.48Å; L522-W626 HydrophobicContact CD1-CZ3 4.1Å; L522-W626 HydrophobicContact CD2-CE3 4.26Å; L522-W626 HydrophobicContact CD2-CH2 3.86Å; L522-W626 HydrophobicContact CD2-CZ2 4.27Å; L522-W626 HydrophobicContact CD2-CZ3 3.82Å; A622-W626 VanDerWaalsContact O-CD1 3.26Å; A622-W626 PolarHBondContact O-N 3.29Å; A622-W626 VanDerWaalsContact O-N 3.11Å; Y624-W626 PolarHBondContact O-N 3.48Å; W626-M628 VanDerWaalsContact C-N 3.34Å; W626-M628 PolarHBondContact O-N 3.22Å; W626-C629 WeakPolarHBondContact O-CB 3.46Å; W626-C629 PolarHBondContact O-N 3.44Å; W626-V630 PolarHBondContact O-N 3.27Å; W626-V630 VanDerWaalsContact O-N 3.09Å
627	M	92.8	Very high	90.4	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-60.2	-45.6	178	174.3	-174	49.8	0	0	111.3	Y151 F154 Q155 A623 Y624 C629 V630 F631 M652	Y151-M627 HydrophobicContact CE2-CE 3.96Å; F154-M627 HydrophobicContact CD1-CE 3.67Å; F154-M627 HydrophobicContact CD1-SD 4.46Å; F154-M627 HydrophobicContact CE1-CE 3.44Å; F154-M627 VanDerWaalsContact CE1-CE 3.44Å; F154-M627 HydrophobicContact CE1-SD 4.43Å; Q155-M627 HydrophobicContact CG-CE 4.37Å; Q155-M627 HydrophobicContact CG-SD 3.49Å; Q155-M627 WeakPolarHBondContact CG-SD 3.47Å; A623-M627 WeakPolarHBondContact O-CB 3.39Å; A623-M627 PolarHBondContact O-N 2.78Å; Y624-M627 HydrophobicContact CD1-CE 3.64Å; Y624-M627 HydrophobicContact CE1-CE 4.12Å; Y624-M627 PolarHBondContact O-N 3.23Å; M627-C629 VanDerWaalsContact C-N 3.32Å; M627-C629 PolarHBondContact O-N 3.35Å; M627-V630 PolarHBondContact O-N 3.39Å; M627-F631 WeakPolarHBondContact O-CB 3.42Å; M627-F631 PolarHBondContact O-N 3.42Å; M627-M652 HydrophobicContact CG-CE 3.7Å; M627-M652 HydrophobicContact CG-SD 3.72Å; M627-M652 HydrophobicContact SD-CE 3.66Å; M627-M652 HydrophobicContact SD-SD 4.45Å
628	M	92.6	Very high	91.2	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-66.8	-34	177.5	-68.5	-175.6	-56.4	0	0	111.9	F154 M515 Y519 Y624 W626 F631 T632 A680 Q683 V684	F154-M628 HydrophobicContact CE1-CG 4.44Å; F154-M628 HydrophobicContact CZ-CG 4.36Å; F154-M628 HydrophobicContact CZ-SD 4.2Å; M515-M628 HydrophobicContact CG-CE 3.9Å; M515-M628 HydrophobicContact SD-CE 4.02Å; Y519-M628 HydrophobicContact CD2-CB 3.9Å; Y519-M628 HydrophobicContact CD2-CE 4.45Å; Y519-M628 HydrophobicContact CE2-CB 3.74Å; Y624-M628 WeakPolarHBondContact O-CB 3.38Å; Y624-M628 WeakPolarHBondContact O-CE 3.29Å; Y624-M628 VanDerWaalsContact O-CG 3.23Å; Y624-M628 WeakPolarHBondContact O-CG 3.46Å; Y624-M628 PolarHBondContact O-N 3.1Å; W626-M628 VanDerWaalsContact C-N 3.34Å; W626-M628 PolarHBondContact O-N 3.22Å; M628-F631 PolarHBondContact O-N 3.36Å; M628-T632 WeakPolarHBondContact O-CB 3.39Å; M628-T632 PolarHBondContact O-N 2.86Å; M628-T632 PolarHBondContact O-OG1 2.87Å; M628-A680 HydrophobicContact CE-CB 4.45Å; M628-A680 HydrophobicContact SD-CB 4Å; M628-A680 VanDerWaalsContact SD-O 3.41Å; M628-Q683 HydrophobicContact CE-CB 4.15Å; M628-Q683 HydrophobicContact SD-CB 4Å; M628-V684 HydrophobicContact CG-CG2 3.79Å; M628-V684 HydrophobicContact SD-CG2 3.73Å
629	C	91.9	Very high	91.6	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-61	-52.6	174.8	-178	0	0	0	0	111.4	L522 A625 W626 M627 F631 T632 V633	L522-C629 HydrophobicContact CB-CB 4.16Å; L522-C629 HydrophobicContact CD1-CB 4.27Å; A625-C629 VanDerWaalsContact O-CB 3.31Å; A625-C629 WeakPolarHBondContact O-CB 3.3Å; A625-C629 PolarHBondContact O-N 3.12Å; W626-C629 WeakPolarHBondContact O-CB 3.46Å; W626-C629 PolarHBondContact O-N 3.44Å; M627-C629 VanDerWaalsContact C-N 3.32Å; M627-C629 PolarHBondContact O-N 3.35Å; C629-F631 VanDerWaalsContact C-N 3.31Å; C629-F631 PolarHBondContact O-N 2.84Å; C629-T632 WeakPolarHBondContact O-CB 3.47Å; C629-T632 PolarHBondContact O-N 2.93Å; C629-T632 VanDerWaalsContact O-N 3.09Å; C629-V633 WeakPolarHBondContact O-CG2 3.47Å; C629-V633 PolarHBondContact O-N 3.5Å
630	V	93.1	Very high	91.7	Very high	3 Å²	3	7.2 Å²	7.2	2%	0.018	4%	0.036	C	C	.	.	H	α-helix	trans	-61.7	-42.1	178.3	178.1	0	0	0	0	110.7	V573 W626 M627 T632 V633 V634 Y651	V573-V630 HydrophobicContact CG2-CG1 4.48Å; W626-V630 PolarHBondContact O-N 3.27Å; W626-V630 VanDerWaalsContact O-N 3.09Å; M627-V630 PolarHBondContact O-N 3.39Å; V630-T632 VanDerWaalsContact C-N 3.34Å; V630-T632 PolarHBondContact O-N 2.96Å; V630-V633 PolarHBondContact O-N 2.85Å; V630-V634 HydrophobicContact CG1-CG2 4.4Å; V630-V634 VanDerWaalsContact O-CG2 3.28Å; V630-V634 WeakPolarHBondContact O-CG2 3.32Å; V630-V634 PolarHBondContact O-N 3.01Å; V630-Y651 HydrophobicContact CB-CD1 4.06Å; V630-Y651 HydrophobicContact CB-CE1 3.65Å; V630-Y651 HydrophobicContact CB-CE2 4.43Å; V630-Y651 HydrophobicContact CG1-CD1 3.52Å; V630-Y651 HydrophobicContact CG1-CD2 4.13Å; V630-Y651 HydrophobicContact CG1-CE1 3.67Å; V630-Y651 HydrophobicContact CG1-CE2 4.28Å; V630-Y651 HydrophobicContact CG1-CG 3.79Å; V630-Y651 HydrophobicContact CG2-CE1 4.11Å; V630-Y651 HydrophobicContact CG2-CE2 4.08Å
631	F	95.4	Very high	91.7	Very high	1 Å²	1	7 Å²	7	0%	0.004	4%	0.035	C	C	.	.	H	α-helix	trans	-57.8	-44.4	172.7	174.1	-99.9	0	0	0	112.2	I158 L161 L162 M627 M628 C629 V633 V634 M635 V684 A687	I158-F631 HydrophobicContact CG2-CD2 3.47Å; I158-F631 VanDerWaalsContact CG2-CD2 3.47Å; I158-F631 HydrophobicContact CG2-CE2 3.77Å; I158-F631 HydrophobicContact CG2-CG 4.18Å; L161-F631 HydrophobicContact CD2-CE2 4.02Å; L161-F631 HydrophobicContact CD2-CZ 3.62Å; L162-F631 HydrophobicContact CD1-CD2 4.25Å; L162-F631 HydrophobicContact CD2-CD2 4.12Å; L162-F631 HydrophobicContact CD2-CE2 3.98Å; L162-F631 HydrophobicContact CG-CD2 4.16Å; L162-F631 HydrophobicContact CG-CE2 4.07Å; M627-F631 WeakPolarHBondContact O-CB 3.42Å; M627-F631 PolarHBondContact O-N 3.42Å; M628-F631 PolarHBondContact O-N 3.36Å; C629-F631 VanDerWaalsContact C-N 3.31Å; C629-F631 PolarHBondContact O-N 2.84Å; F631-V633 PolarHBondContact O-N 3.48Å; F631-V634 PolarHBondContact O-N 2.97Å; F631-M635 HydrophobicContact CD1-CG 4.11Å; F631-M635 HydrophobicContact CD2-CG 4.05Å; F631-M635 HydrophobicContact CE1-CG 3.58Å; F631-M635 HydrophobicContact CE2-CG 3.53Å; F631-M635 HydrophobicContact CE2-SD 3.84Å; F631-M635 HydrophobicContact CG-CG 4.32Å; F631-M635 HydrophobicContact CZ-CG 3.27Å; F631-M635 HydrophobicContact CZ-SD 3.8Å; F631-M635 WeakPolarHBondContact O-CB 3.36Å; F631-M635 WeakPolarHBondContact O-CG 3.36Å; F631-M635 PolarHBondContact O-N 3.39Å; F631-V684 HydrophobicContact CD1-CG1 4.34Å; F631-V684 HydrophobicContact CE1-CG1 3.71Å; F631-V684 HydrophobicContact CZ-CG1 4.33Å; F631-A687 HydrophobicContact CD1-CB 4.02Å; F631-A687 HydrophobicContact CE1-CB 3.75Å
632	T	94.3	Very high	91.9	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-63	-40.2	176.9	-66.9	0	0	0	0	112.1	Y519 I523 M628 C629 V630 M635 T636 A687 L690	Y519-T632 PolarHBondContact OH-OG1 3.27Å; I523-T632 HydrophobicContact CD1-CG2 3.86Å; I523-T632 HydrophobicContact CG1-CG2 4.33Å; M628-T632 WeakPolarHBondContact O-CB 3.39Å; M628-T632 PolarHBondContact O-N 2.86Å; M628-T632 PolarHBondContact O-OG1 2.87Å; C629-T632 WeakPolarHBondContact O-CB 3.47Å; C629-T632 PolarHBondContact O-N 2.93Å; C629-T632 VanDerWaalsContact O-N 3.09Å; V630-T632 VanDerWaalsContact C-N 3.34Å; V630-T632 PolarHBondContact O-N 2.96Å; T632-M635 PolarHBondContact O-N 2.9Å; T632-T636 VanDerWaalsContact O-CB 3.26Å; T632-T636 WeakPolarHBondContact O-CB 3.33Å; T632-T636 PolarHBondContact O-N 3.35Å; T632-T636 PolarHBondContact O-OG1 2.94Å; T632-A687 HydrophobicContact CG2-CB 4.19Å; T632-A687 WeakPolarHBondContact OG1-CB 3.39Å; T632-L690 HydrophobicContact CG2-CD1 3.67Å
633	V	92	Very high	92	Very high	1 Å²	1	7.6 Å²	7.6	1%	0.006	4%	0.035	C	C	.	.	H	α-helix	trans	-60.7	-50.6	174.1	173.3	0	0	0	0	110.4	V526 L527 F569 Y572 V573 C629 V630 F631 M635 T636 Y637 I644	V526-V633 HydrophobicContact CG1-CG2 4.13Å; L527-V633 HydrophobicContact CB-CG2 4.41Å; L527-V633 HydrophobicContact CD1-CB 4.29Å; L527-V633 HydrophobicContact CD1-CG2 3.88Å; F569-V633 HydrophobicContact CB-CG1 4.39Å; F569-V633 HydrophobicContact CD1-CG1 3.75Å; F569-V633 HydrophobicContact CE1-CG1 4.45Å; F569-V633 HydrophobicContact CG-CG1 4.35Å; Y572-V633 HydrophobicContact CE1-CG2 4.5Å; V573-V633 HydrophobicContact CG2-CG1 4.21Å; C629-V633 WeakPolarHBondContact O-CG2 3.47Å; C629-V633 PolarHBondContact O-N 3.5Å; V630-V633 PolarHBondContact O-N 2.85Å; F631-V633 PolarHBondContact O-N 3.48Å; V633-M635 PolarHBondContact O-N 2.89Å; V633-T636 PolarHBondContact O-N 3.49Å; V633-Y637 PolarHBondContact O-N 3.47Å; V633-Y637 VanDerWaalsContact O-N 3.09Å; V633-I644 HydrophobicContact CG1-CD1 4.11Å
634	V	95.3	Very high	92.2	Very high	1 Å²	1	7 Å²	7	1%	0.006	3%	0.03	C	C	.	.	H	α-helix	trans	-59.7	-46.9	179.1	173.6	0	0	0	0	110.9	L162 V573 V630 F631 Y637 S638 I644 V645	L162-V634 HydrophobicContact CD2-CG1 3.82Å; V573-V634 HydrophobicContact CG1-CG2 4.17Å; V573-V634 HydrophobicContact CG2-CG2 4.01Å; V630-V634 HydrophobicContact CG1-CG2 4.4Å; V630-V634 VanDerWaalsContact O-CG2 3.28Å; V630-V634 WeakPolarHBondContact O-CG2 3.32Å; V630-V634 PolarHBondContact O-N 3.01Å; F631-V634 PolarHBondContact O-N 2.97Å; V634-Y637 PolarHBondContact O-N 2.97Å; V634-S638 WeakPolarHBondContact O-CA 3.29Å; V634-S638 VanDerWaalsContact O-CB 3.25Å; V634-S638 WeakPolarHBondContact O-CB 3.41Å; V634-S638 PolarHBondContact O-N 3.08Å; V634-I644 HydrophobicContact CG1-CG2 4.5Å; V634-I644 HydrophobicContact CG2-CG1 4.41Å; V634-V645 HydrophobicContact CG1-CG2 4.33Å
635	M	94.6	Very high	92.4	Very high	0 Å²	0	7 Å²	7	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-64.7	-42.9	178.7	-74.2	-56.2	-61.9	0	0	112.4	L162 V165 Y215 F631 T632 V633 Y637 S638 A687 C691	L162-M635 HydrophobicContact CD2-SD 4.29Å; V165-M635 HydrophobicContact CG1-SD 4.27Å; V165-M635 HydrophobicContact CG2-CE 4.29Å; V165-M635 HydrophobicContact CG2-SD 4.33Å; Y215-M635 HydrophobicContact CD2-CE 4.08Å; Y215-M635 HydrophobicContact CG-CE 4.32Å; F631-M635 HydrophobicContact CD1-CG 4.11Å; F631-M635 HydrophobicContact CD2-CG 4.05Å; F631-M635 HydrophobicContact CE1-CG 3.58Å; F631-M635 HydrophobicContact CE2-CG 3.53Å; F631-M635 HydrophobicContact CE2-SD 3.84Å; F631-M635 HydrophobicContact CG-CG 4.32Å; F631-M635 HydrophobicContact CZ-CG 3.27Å; F631-M635 HydrophobicContact CZ-SD 3.8Å; F631-M635 WeakPolarHBondContact O-CB 3.36Å; F631-M635 WeakPolarHBondContact O-CG 3.36Å; F631-M635 PolarHBondContact O-N 3.39Å; T632-M635 PolarHBondContact O-N 2.9Å; V633-M635 PolarHBondContact O-N 2.89Å; M635-Y637 VanDerWaalsContact C-N 3.31Å; M635-Y637 PolarHBondContact O-N 3.39Å; M635-S638 WeakPolarHBondContact O-CB 3.36Å; M635-S638 PolarHBondContact O-N 2.98Å; M635-S638 PolarHBondContact O-OG 3Å; M635-A687 HydrophobicContact CB-CB 4.15Å; M635-A687 HydrophobicContact CG-CB 4.38Å; M635-C691 PolarHBondContact O-SG 2.84Å; M635-C691 VanDerWaalsContact O-SG 3.34Å
636	T	91.8	Very high	92.6	Very high	1 Å²	1	9.8 Å²	9.8	1%	0.006	5%	0.049	C	C	.	.	H	α-helix	trans	-61.7	-40.9	-179.6	-58.4	0	0	0	0	111.5	L527 T632 V633 W694	L527-T636 HydrophobicContact CD1-CG2 4.09Å; T632-T636 VanDerWaalsContact O-CB 3.26Å; T632-T636 WeakPolarHBondContact O-CB 3.33Å; T632-T636 PolarHBondContact O-N 3.35Å; T632-T636 PolarHBondContact O-OG1 2.94Å; V633-T636 PolarHBondContact O-N 3.49Å; T636-W694 HydrophobicContact CG2-CB 3.81Å; T636-W694 HydrophobicContact CG2-CG 3.84Å
637	Y	90.4	Very high	92.9	Very high	8 Å²	8	7.4 Å²	7.4	3%	0.031	4%	0.041	C	C	.	.	H	α-helix	trans	-92.8	-4.9	-179.8	-77.3	-86.1	0	0	0	114.6	L527 S531 F569 V633 V634 M635 I639 T640 C641 W694	L527-Y637 HydrophobicContact CD1-CE2 4.26Å; S531-Y637 PolarHBondContact OG-OH 2.96Å; F569-Y637 HydrophobicContact CB-CD2 4.49Å; F569-Y637 HydrophobicContact CD1-CE2 4.44Å; F569-Y637 HydrophobicContact CD2-CD2 4.16Å; F569-Y637 HydrophobicContact CD2-CE1 4.01Å; F569-Y637 AromaticContact CD2-CE2 3.48Å; F569-Y637 HydrophobicContact CD2-CE2 3.48Å; F569-Y637 VanDerWaalsContact CD2-CE2 3.48Å; F569-Y637 AromaticContact CD2-CZ 3.4Å; F569-Y637 VanDerWaalsContact CD2-CZ 3.4Å; F569-Y637 HydrophobicContact CE2-CE1 4.46Å; F569-Y637 AromaticContact CE2-CE2 3.65Å; F569-Y637 HydrophobicContact CE2-CE2 3.65Å; F569-Y637 AromaticContact CE2-CZ 3.51Å; F569-Y637 WeakPolarHBondContact CE2-OH 3.18Å; F569-Y637 HydrophobicContact CG-CD2 4.24Å; F569-Y637 AromaticContact CG-CE2 3.93Å; F569-Y637 HydrophobicContact CG-CE2 3.93Å; F569-Y637 HydrophobicContact CZ-CE2 4.19Å; V633-Y637 PolarHBondContact O-N 3.47Å; V633-Y637 VanDerWaalsContact O-N 3.09Å; V634-Y637 PolarHBondContact O-N 2.97Å; M635-Y637 VanDerWaalsContact C-N 3.31Å; M635-Y637 PolarHBondContact O-N 3.39Å; Y637-I639 PolarHBondContact O-N 3.19Å; Y637-T640 WeakPolarHBondContact CA-OG1 3.36Å; Y637-T640 WeakPolarHBondContact CD1-OG1 3.42Å; Y637-T640 PolarHBondContact O-N 2.97Å; Y637-T640 PolarHBondContact O-OG1 3.34Å; Y637-C641 CarbonylContact O-C 3.45Å; Y637-C641 VanDerWaalsContact O-C 3.23Å; Y637-C641 WeakPolarHBondContact O-CA 3.34Å; Y637-C641 PolarHBondContact O-N 3.17Å; Y637-C641 VanDerWaalsContact O-O 3.04Å; Y637-W694 AromaticContact CE1-NE1 3.83Å; Y637-W694 AromaticContact CZ-NE1 3.77Å
638	S	93.1	Very high	93.1	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-27.5	-175.7	62.5	0	0	0	0	114.9	S169 Y215 V634 M635 P642 V645	S169-S638 PolarHBondContact OG-O 3.28Å; Y215-S638 WeakPolarHBondContact CE2-OG 3.44Å; V634-S638 WeakPolarHBondContact O-CA 3.29Å; V634-S638 VanDerWaalsContact O-CB 3.25Å; V634-S638 WeakPolarHBondContact O-CB 3.41Å; V634-S638 PolarHBondContact O-N 3.08Å; M635-S638 WeakPolarHBondContact O-CB 3.36Å; M635-S638 PolarHBondContact O-N 2.98Å; M635-S638 PolarHBondContact O-OG 3Å; S638-P642 WeakPolarHBondContact O-CA 3.49Å; S638-V645 VanDerWaalsContact CB-CG2 3.48Å
639	I	90.9	Very high	93.3	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-40.3	-179.7	-65.5	174	0	0	0	111	H208 F211 A212 Y215 Y637 L695	H208-I639 HydrophobicContact CB-CG2 3.69Å; F211-I639 HydrophobicContact CB-CD1 4.45Å; A212-I639 HydrophobicContact CB-CD1 3.49Å; A212-I639 VanDerWaalsContact CB-CD1 3.49Å; Y215-I639 HydrophobicContact CD2-CD1 3.9Å; Y215-I639 HydrophobicContact CD2-CG1 4.05Å; Y215-I639 HydrophobicContact CE2-CD1 4.04Å; Y215-I639 HydrophobicContact CE2-CG1 3.71Å; Y637-I639 PolarHBondContact O-N 3.19Å; I639-L695 HydrophobicContact CB-CD1 4.23Å; I639-L695 HydrophobicContact CB-CD2 4.39Å; I639-L695 HydrophobicContact CD1-CD1 3.81Å; I639-L695 HydrophobicContact CG2-CD1 3.99Å; I639-L695 HydrophobicContact CG2-CD2 3.88Å
640	T	87.8	Confident	93.5	Very high	9 Å²	9	13.6 Å²	13.6	6%	0.055	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-37.4	-178.9	55.2	0	0	0	0	112.2	T194 I195 Y637 L695	T194-T640 CarbonylContact C-O 3.56Å; T194-T640 WeakPolarHBondContact CA-O 3.34Å; T194-T640 WeakPolarHBondContact CB-O 3.29Å; I195-T640 HydrophobicContact CG2-CG2 4.1Å; I195-T640 PolarHBondContact N-O 3.42Å; Y637-T640 WeakPolarHBondContact CA-OG1 3.36Å; Y637-T640 WeakPolarHBondContact CD1-OG1 3.42Å; Y637-T640 PolarHBondContact O-N 2.97Å; Y637-T640 PolarHBondContact O-OG1 3.34Å; T640-L695 HydrophobicContact CG2-CD2 3.73Å
641	C	89.4	Confident	93.6	Very high	2 Å²	2	14 Å²	14	1%	0.014	7%	0.073	C	C	.	.			trans	-136.1	84.4	176.2	-177.9	0	0	0	0	110.2	F190 T194 Y637 I643 I644	F190-C641 WeakPolarHBondContact CZ-SG 3.49Å; T194-C641 HydrophobicContact CG2-CB 4.15Å; Y637-C641 CarbonylContact O-C 3.45Å; Y637-C641 VanDerWaalsContact O-C 3.23Å; Y637-C641 WeakPolarHBondContact O-CA 3.34Å; Y637-C641 PolarHBondContact O-N 3.17Å; Y637-C641 VanDerWaalsContact O-O 3.04Å; C641-I643 PolarHBondContact O-N 3.46Å; C641-I644 WeakPolarHBondContact O-CG2 3.45Å; C641-I644 PolarHBondContact O-N 2.91Å
642	P	93	Very high	93.7	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-25.2	-176.3	-30.6	38.7	0	0	0	116.1	V173 L174 S638 I644 V645	V173-P642 HydrophobicContact CB-CG 4Å; V173-P642 HydrophobicContact CG1-CG 3.67Å; L174-P642 HydrophobicContact CB-CB 3.95Å; L174-P642 HydrophobicContact CB-CG 4.26Å; L174-P642 HydrophobicContact CD1-CB 4.45Å; S638-P642 WeakPolarHBondContact O-CA 3.49Å; P642-I644 PolarHBondContact O-N 2.93Å; P642-V645 PolarHBondContact O-N 3.32Å; P642-V645 VanDerWaalsContact O-N 3.17Å
643	I	91.6	Very high	93.8	Very high	28 Å²	28	17.6 Å²	17.6	14%	0.144	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.4	-179.4	-67.3	-178.4	0	0	0	112.5	F38 L174 T193 C641 V645 P646 F647	F38-I643 HydrophobicContact CE1-CD1 4.48Å; F38-I643 HydrophobicContact CZ-CD1 3.89Å; L174-I643 HydrophobicContact CD1-CD1 4.36Å; L174-I643 HydrophobicContact CD1-CG1 4.08Å; L174-I643 HydrophobicContact CD2-CG1 4.36Å; T193-I643 VanDerWaalsContact CB-CD1 3.5Å; T193-I643 HydrophobicContact CG2-CD1 3.46Å; T193-I643 VanDerWaalsContact CG2-CD1 3.46Å; C641-I643 PolarHBondContact O-N 3.46Å; I643-V645 VanDerWaalsContact C-N 3.25Å; I643-V645 PolarHBondContact O-N 3.49Å; I643-P646 WeakPolarHBondContact O-CD 3.45Å; I643-F647 HydrophobicContact CG2-CD2 4.3Å; I643-F647 HydrophobicContact CG2-CE2 3.8Å; I643-F647 VanDerWaalsContact O-CD2 3.24Å; I643-F647 WeakPolarHBondContact O-CD2 3.37Å
644	I	93.9	Very high	93.9	Very high	1 Å²	1	19 Å²	19	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-66	-27.1	177	-159	171.1	0	0	0	112.9	F569 V570 V573 V633 V634 C641 P642 F647 G648	F569-I644 HydrophobicContact CB-CD1 4.04Å; V570-I644 HydrophobicContact CG2-CB 3.94Å; V570-I644 HydrophobicContact CG2-CG1 4.15Å; V573-I644 HydrophobicContact CB-CG1 4.39Å; V573-I644 HydrophobicContact CG2-CD1 3.92Å; V573-I644 HydrophobicContact CG2-CG1 3.96Å; V633-I644 HydrophobicContact CG1-CD1 4.11Å; V634-I644 HydrophobicContact CG1-CG2 4.5Å; V634-I644 HydrophobicContact CG2-CG1 4.41Å; C641-I644 WeakPolarHBondContact O-CG2 3.45Å; C641-I644 PolarHBondContact O-N 2.91Å; P642-I644 PolarHBondContact O-N 2.93Å; I644-F647 PolarHBondContact O-N 3.08Å; I644-G648 PolarHBondContact O-N 3.15Å
645	V	95.8	Very high	93.8	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-69.3	-46.2	-170.6	-173.8	0	0	0	0	113.1	L162 V165 G166 V634 S638 P642 I643 F647 G648 L649	L162-V645 HydrophobicContact CD2-CG1 4.42Å; V165-V645 HydrophobicContact CG1-CG1 4.1Å; V165-V645 HydrophobicContact CG1-CG2 4.37Å; G166-V645 VanDerWaalsContact CA-CG1 3.46Å; V634-V645 HydrophobicContact CG1-CG2 4.33Å; S638-V645 VanDerWaalsContact CB-CG2 3.48Å; P642-V645 PolarHBondContact O-N 3.32Å; P642-V645 VanDerWaalsContact O-N 3.17Å; I643-V645 VanDerWaalsContact C-N 3.25Å; I643-V645 PolarHBondContact O-N 3.49Å; V645-F647 VanDerWaalsContact C-N 3.31Å; V645-F647 PolarHBondContact O-N 3.31Å; V645-G648 CarbonylContact O-C 3.59Å; V645-G648 PolarHBondContact O-N 3.05Å; V645-G648 VanDerWaalsContact O-N 3.14Å; V645-L649 PolarHBondContact O-N 3.35Å
646	P	95.9	Very high	93.8	Very high	59 Å²	59	20.2 Å²	20.2	38%	0.383	11%	0.105	S	C	.	.	H	α-helix	trans	-55.6	-42	173.2	-28.5	35.4	0	0	0	113.9	V170 I643 L649 M650	V170-P646 HydrophobicContact CG2-CG 3.66Å; I643-P646 WeakPolarHBondContact O-CD 3.45Å; P646-L649 PolarHBondContact O-N 3.26Å; P646-M650 PolarHBondContact O-N 2.95Å
647	F	95.4	Very high	93.9	Very high	42 Å²	42	22.5 Å²	22.5	18%	0.184	12%	0.117	C	C	.	.	H	α-helix	trans	-70.3	-34.8	176.8	-62.1	-64.2	0	0	0	111.9	V41 L45 V570 V573 I574 I643 I644 V645 M650 Y651	V41-F647 HydrophobicContact CG1-CE2 4.37Å; V41-F647 HydrophobicContact CG1-CZ 4.45Å; L45-F647 HydrophobicContact CD1-CE1 3.99Å; L45-F647 HydrophobicContact CD2-CE1 4.04Å; L45-F647 HydrophobicContact CD2-CZ 4.36Å; V570-F647 HydrophobicContact CG1-CD2 3.82Å; V570-F647 HydrophobicContact CG1-CE2 3.96Å; V573-F647 HydrophobicContact CG1-CB 4.03Å; I574-F647 HydrophobicContact CD1-CD1 4Å; I574-F647 HydrophobicContact CD1-CD2 4.09Å; I574-F647 HydrophobicContact CD1-CE1 3.94Å; I574-F647 HydrophobicContact CD1-CE2 4.03Å; I574-F647 HydrophobicContact CD1-CG 4.08Å; I574-F647 HydrophobicContact CD1-CZ 3.96Å; I574-F647 HydrophobicContact CG1-CB 4.02Å; I574-F647 HydrophobicContact CG1-CD1 3.6Å; I574-F647 HydrophobicContact CG1-CD2 4.13Å; I574-F647 HydrophobicContact CG1-CE1 4.04Å; I574-F647 HydrophobicContact CG1-CG 3.65Å; I574-F647 HydrophobicContact CG1-CZ 4.47Å; I643-F647 HydrophobicContact CG2-CD2 4.3Å; I643-F647 HydrophobicContact CG2-CE2 3.8Å; I643-F647 VanDerWaalsContact O-CD2 3.24Å; I643-F647 WeakPolarHBondContact O-CD2 3.37Å; I644-F647 PolarHBondContact O-N 3.08Å; V645-F647 VanDerWaalsContact C-N 3.31Å; V645-F647 PolarHBondContact O-N 3.31Å; F647-M650 WeakPolarHBondContact O-CB 3.49Å; F647-M650 PolarHBondContact O-N 3.44Å; F647-Y651 PolarHBondContact O-N 3.46Å
648	G	96.1	Very high	94	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-64.1	-38.1	170.6	0	0	0	0	0	113.5	I644 V645 Y651 M652	I644-G648 PolarHBondContact O-N 3.15Å; V645-G648 CarbonylContact O-C 3.59Å; V645-G648 PolarHBondContact O-N 3.05Å; V645-G648 VanDerWaalsContact O-N 3.14Å; G648-Y651 WeakPolarHBondContact O-CB 3.34Å; G648-Y651 PolarHBondContact O-N 3.47Å; G648-M652 PolarHBondContact O-N 2.69Å
649	L	97.1	Very high	93.9	Very high	40 Å²	40	22.9 Å²	22.9	21%	0.209	12%	0.12	C	C	.	.	H	α-helix	trans	-64.9	-43.8	173	179.4	64.4	0	0	0	110.7	I159 L162 V163 V645 P646 Y651 M652 L653	I159-L649 HydrophobicContact CG2-CD1 4.05Å; L162-L649 HydrophobicContact CB-CD1 4.07Å; V163-L649 HydrophobicContact CG2-CD1 3.71Å; V163-L649 HydrophobicContact CG2-CD2 4Å; V645-L649 PolarHBondContact O-N 3.35Å; P646-L649 PolarHBondContact O-N 3.26Å; L649-Y651 VanDerWaalsContact C-N 3.34Å; L649-Y651 PolarHBondContact O-N 3.33Å; L649-M652 PolarHBondContact O-N 3.32Å; L649-L653 HydrophobicContact CD1-CD1 4.38Å; L649-L653 HydrophobicContact CD1-CG 4.36Å; L649-L653 HydrophobicContact CG-CD1 4.06Å; L649-L653 HydrophobicContact CG-CG 4.48Å; L649-L653 WeakPolarHBondContact O-CG 3.33Å; L649-L653 PolarHBondContact O-N 2.96Å
650	M	96.1	Very high	93.9	Very high	88 Å²	88	24.5 Å²	24.5	43%	0.433	13%	0.126	S	C	.	.	H	α-helix	trans	-57.1	-46.6	173.6	-172.1	70.7	73.7	0	0	111.5	F578 P646 F647 M652 L653 L654	F578-M650 HydrophobicContact CZ-CG 4.32Å; P646-M650 PolarHBondContact O-N 2.95Å; F647-M650 WeakPolarHBondContact O-CB 3.49Å; F647-M650 PolarHBondContact O-N 3.44Å; M650-M652 PolarHBondContact O-N 3.12Å; M650-L653 PolarHBondContact O-N 3.47Å; M650-L654 HydrophobicContact CG-CD1 4.09Å; M650-L654 WeakPolarHBondContact O-CG 3.24Å; M650-L654 PolarHBondContact O-N 3.29Å; M650-L654 HydrophobicContact SD-CD1 4.5Å
651	Y	96.4	Very high	93.9	Very high	12 Å²	12	24.1 Å²	24.1	5%	0.047	12%	0.124	C	C	.	.	H	α-helix	trans	-54.5	-51.6	174.6	168.5	-93.4	0	0	0	111.5	A577 N581 V630 F647 G648 L649 L653 L654 K655	A577-Y651 HydrophobicContact CB-CD2 4.44Å; N581-Y651 PolarHBondContact ND2-O 3.26Å; V630-Y651 HydrophobicContact CB-CD1 4.06Å; V630-Y651 HydrophobicContact CB-CE1 3.65Å; V630-Y651 HydrophobicContact CB-CE2 4.43Å; V630-Y651 HydrophobicContact CG1-CD1 3.52Å; V630-Y651 HydrophobicContact CG1-CD2 4.13Å; V630-Y651 HydrophobicContact CG1-CE1 3.67Å; V630-Y651 HydrophobicContact CG1-CE2 4.28Å; V630-Y651 HydrophobicContact CG1-CG 3.79Å; V630-Y651 HydrophobicContact CG2-CE1 4.11Å; V630-Y651 HydrophobicContact CG2-CE2 4.08Å; F647-Y651 PolarHBondContact O-N 3.46Å; G648-Y651 WeakPolarHBondContact O-CB 3.34Å; G648-Y651 PolarHBondContact O-N 3.47Å; L649-Y651 VanDerWaalsContact C-N 3.34Å; L649-Y651 PolarHBondContact O-N 3.33Å; Y651-L653 PolarHBondContact O-N 2.83Å; Y651-L654 PolarHBondContact O-N 2.98Å; Y651-K655 HydrophobicContact CE1-CB 4.48Å; Y651-K655 WeakPolarHBondContact O-CB 3.35Å; Y651-K655 PolarHBondContact O-N 2.63Å
652	M	96.4	Very high	93.8	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-67.4	-34.9	-176.5	-72.1	-60.1	-58.1	0	0	112.9	I158 I159 L162 M627 G648 L649 M650 H656	I158-M652 HydrophobicContact CB-CE 3.9Å; I158-M652 HydrophobicContact CD1-CE 4.41Å; I158-M652 HydrophobicContact CG2-CE 3.53Å; I158-M652 HydrophobicContact CG2-CG 4.26Å; I158-M652 HydrophobicContact CG2-SD 4.2Å; I159-M652 HydrophobicContact CG1-CB 3.83Å; L162-M652 HydrophobicContact CD1-CB 4.12Å; L162-M652 HydrophobicContact CD1-CG 3.44Å; L162-M652 VanDerWaalsContact CD1-CG 3.44Å; M627-M652 HydrophobicContact CG-CE 3.7Å; M627-M652 HydrophobicContact CG-SD 3.72Å; M627-M652 HydrophobicContact SD-CE 3.66Å; M627-M652 HydrophobicContact SD-SD 4.45Å; G648-M652 PolarHBondContact O-N 2.69Å; L649-M652 PolarHBondContact O-N 3.32Å; M650-M652 PolarHBondContact O-N 3.12Å; M652-H656 WeakPolarHBondContact O-CB 3.45Å; M652-H656 PolarHBondContact O-N 3.29Å
653	L	96	Very high	93.4	Very high	76 Å²	76	24.5 Å²	24.5	40%	0.398	13%	0.125	S	C	.	.	H	α-helix	trans	-65.6	-51	174.9	-72.9	170.5	0	0	0	111.3	I159 L649 M650 Y651 K655 H656 L657	I159-L653 HydrophobicContact CD1-CD2 4.25Å; I159-L653 HydrophobicContact CG2-CD2 3.84Å; L649-L653 HydrophobicContact CD1-CD1 4.38Å; L649-L653 HydrophobicContact CD1-CG 4.36Å; L649-L653 HydrophobicContact CG-CD1 4.06Å; L649-L653 HydrophobicContact CG-CG 4.48Å; L649-L653 WeakPolarHBondContact O-CG 3.33Å; L649-L653 PolarHBondContact O-N 2.96Å; M650-L653 PolarHBondContact O-N 3.47Å; Y651-L653 PolarHBondContact O-N 2.83Å; L653-K655 VanDerWaalsContact C-N 3.31Å; L653-K655 PolarHBondContact O-N 3.43Å; L653-H656 PolarHBondContact O-N 3.23Å; L653-L657 WeakPolarHBondContact O-CG 3.15Å; L653-L657 PolarHBondContact O-N 2.98Å; L653-L657 VanDerWaalsContact O-N 3.12Å
654	L	94.4	Very high	93	Very high	30 Å²	30	24.2 Å²	24.2	16%	0.157	12%	0.122	C	C	.	.	H	α-helix	trans	-61	-42.5	176.8	-72.7	173.1	0	0	0	111.2	F52 A577 F578 N581 M650 Y651 H656 L657 V658	F52-L654 HydrophobicContact CZ-CD2 4.28Å; A577-L654 VanDerWaalsContact O-CD1 3.29Å; A577-L654 WeakPolarHBondContact O-CD1 3.33Å; F578-L654 HydrophobicContact CD1-CD1 4.12Å; F578-L654 HydrophobicContact CE1-CD1 4.09Å; N581-L654 HydrophobicContact CB-CB 4.33Å; M650-L654 HydrophobicContact CG-CD1 4.09Å; M650-L654 WeakPolarHBondContact O-CG 3.24Å; M650-L654 PolarHBondContact O-N 3.29Å; M650-L654 HydrophobicContact SD-CD1 4.5Å; Y651-L654 PolarHBondContact O-N 2.98Å; L654-H656 VanDerWaalsContact C-N 3.34Å; L654-H656 PolarHBondContact O-N 3.38Å; L654-L657 PolarHBondContact O-N 3.45Å; L654-V658 WeakPolarHBondContact O-CG2 3.34Å; L654-V658 PolarHBondContact O-N 3.1Å
655	K	94.8	Very high	92.3	Very high	6 Å²	6	25.8 Å²	25.8	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-59.4	-44.2	176.9	-174.5	58.9	176.1	151.5	0	111.8	N581 D584 Y651 L653 L657 V658 D659	N581-K655 VanDerWaalsContact OD1-CA 3.28Å; N581-K655 WeakPolarHBondContact OD1-CA 3.48Å; N581-K655 WeakPolarHBondContact OD1-CB 3.22Å; N581-K655 WeakPolarHBondContact OD1-CD 3.35Å; D584-K655 IonicContact OD2-NZ 2.62Å; D584-K655 PolarHBondContact OD2-NZ 3.3Å; Y651-K655 HydrophobicContact CE1-CB 4.48Å; Y651-K655 WeakPolarHBondContact O-CB 3.35Å; Y651-K655 PolarHBondContact O-N 2.63Å; L653-K655 VanDerWaalsContact C-N 3.31Å; L653-K655 PolarHBondContact O-N 3.43Å; K655-L657 VanDerWaalsContact C-N 3.35Å; K655-L657 PolarHBondContact O-N 2.91Å; K655-V658 PolarHBondContact O-N 2.99Å; K655-D659 WeakPolarHBondContact CD-OD2 3.33Å; K655-D659 WeakPolarHBondContact CE-OD2 3.12Å; K655-D659 VanDerWaalsContact NZ-CG 3.3Å; K655-D659 IonicContact NZ-OD1 2.79Å; K655-D659 PolarHBondContact NZ-OD1 2.98Å; K655-D659 IonicContact NZ-OD2 2.51Å; K655-D659 PolarHBondContact NZ-OD2 2.94Å; K655-D659 VanDerWaalsContact NZ-OD2 3.16Å; K655-D659 WeakPolarHBondContact O-CB 3.21Å; K655-D659 VanDerWaalsContact O-CG 3.3Å; K655-D659 PolarHBondContact O-N 3.07Å
656	H	94.6	Very high	91.3	Very high	21 Å²	21	26 Å²	26	10%	0.097	13%	0.131	C	C	.	.	H	α-helix	trans	-61.9	-40.6	176.7	-177.1	61.4	0	0	0	113	Q155 I159 M652 L653 L654 R660	Q155-H656 PolarHBondContact OE1-ND1 3.22Å; I159-H656 HydrophobicContact CD1-CB 3.8Å; M652-H656 WeakPolarHBondContact O-CB 3.45Å; M652-H656 PolarHBondContact O-N 3.29Å; L653-H656 PolarHBondContact O-N 3.23Å; L654-H656 VanDerWaalsContact C-N 3.34Å; L654-H656 PolarHBondContact O-N 3.38Å; H656-R660 WeakPolarHBondContact O-CB 3.12Å; H656-R660 PolarHBondContact O-N 3.28Å
657	L	92.7	Very high	90.5	Very high	48 Å²	48	25.6 Å²	25.6	25%	0.251	12%	0.122	S	C	.	.	H	α-helix	trans	-67.9	-46.5	178	-64.8	173.4	0	0	0	111.8	I132 F133 L653 L654 K655 Y661	I132-L657 HydrophobicContact CG2-CB 4.23Å; I132-L657 HydrophobicContact CG2-CD2 3.8Å; F133-L657 HydrophobicContact CD1-CD2 4.4Å; F133-L657 HydrophobicContact CE1-CD2 3.67Å; F133-L657 HydrophobicContact CZ-CD1 4.16Å; F133-L657 HydrophobicContact CZ-CD2 3.91Å; L653-L657 WeakPolarHBondContact O-CG 3.15Å; L653-L657 PolarHBondContact O-N 2.98Å; L653-L657 VanDerWaalsContact O-N 3.12Å; L654-L657 PolarHBondContact O-N 3.45Å; K655-L657 VanDerWaalsContact C-N 3.35Å; K655-L657 PolarHBondContact O-N 2.91Å; L657-Y661 WeakPolarHBondContact O-CB 3.47Å; L657-Y661 PolarHBondContact O-N 3.2Å; L657-Y661 VanDerWaalsContact O-N 3.1Å
658	V	92	Very high	89.6	Confident	13 Å²	13	25.2 Å²	25.2	8%	0.079	12%	0.121	C	C	.	.	H	α-helix	trans	-64.3	-45.1	179.6	170.2	0	0	0	0	111.1	N581 D584 L585 L654 K655 Y661 N662	N581-V658 HydrophobicContact CB-CG2 4.26Å; D584-V658 HydrophobicContact CB-CG1 4.14Å; L585-V658 HydrophobicContact CB-CG1 3.87Å; L585-V658 HydrophobicContact CB-CG2 4.3Å; L585-V658 HydrophobicContact CD1-CG1 4.16Å; L585-V658 HydrophobicContact CD1-CG2 4.46Å; L654-V658 WeakPolarHBondContact O-CG2 3.34Å; L654-V658 PolarHBondContact O-N 3.1Å; K655-V658 PolarHBondContact O-N 2.99Å; V658-Y661 PolarHBondContact O-N 3.29Å; V658-N662 WeakPolarHBondContact O-CB 3.38Å; V658-N662 PolarHBondContact O-N 3.22Å
659	D	91.8	Very high	88.6	Confident	3 Å²	3	28 Å²	28	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-68.8	-39.5	-179.8	-71	-21.6	0	0	0	112.1	Y151 Q155 K655 Y661 N662 L663	Y151-D659 HydrophobicContact CE1-CB 4.08Å; Y151-D659 PolarHBondContact OH-OD2 2.73Å; Y151-D659 VanDerWaalsContact OH-OD2 3.08Å; Q155-D659 PolarHBondContact NE2-OD2 3.28Å; K655-D659 WeakPolarHBondContact CD-OD2 3.33Å; K655-D659 WeakPolarHBondContact CE-OD2 3.12Å; K655-D659 VanDerWaalsContact NZ-CG 3.3Å; K655-D659 IonicContact NZ-OD1 2.79Å; K655-D659 PolarHBondContact NZ-OD1 2.98Å; K655-D659 IonicContact NZ-OD2 2.51Å; K655-D659 PolarHBondContact NZ-OD2 2.94Å; K655-D659 VanDerWaalsContact NZ-OD2 3.16Å; K655-D659 WeakPolarHBondContact O-CB 3.21Å; K655-D659 VanDerWaalsContact O-CG 3.3Å; K655-D659 PolarHBondContact O-N 3.07Å; D659-Y661 VanDerWaalsContact C-N 3.3Å; D659-Y661 PolarHBondContact O-N 2.93Å; D659-N662 PolarHBondContact O-N 3.37Å; D659-L663 WeakPolarHBondContact O-CB 3.4Å; D659-L663 WeakPolarHBondContact O-CD1 3.38Å; D659-L663 VanDerWaalsContact O-CG 3.28Å; D659-L663 WeakPolarHBondContact O-CG 3.47Å; D659-L663 PolarHBondContact O-N 3.46Å
660	R	90.7	Very high	87.5	Confident	34 Å²	34	26.5 Å²	26.5	13%	0.128	13%	0.133	C	C	.	.	H	α-helix	trans	-57.7	-45.5	174.3	-174.3	-172.1	-169.1	111.5	12.3	111.1	I135 D137 I140 L152 H656 Y664	I135-R660 PolarHBondContact O-NH2 3Å; D137-R660 IonicContact OD1-CZ 2.72Å; D137-R660 IonicContact OD1-NH1 2.6Å; D137-R660 IonicContact OD1-NH2 3.35Å; D137-R660 PolarHBondContact OD1-NH2 2.85Å; I140-R660 HydrophobicContact CD1-CG 3.89Å; L152-R660 HydrophobicContact CD1-CG 4.37Å; L152-R660 HydrophobicContact CD2-CB 4.17Å; H656-R660 WeakPolarHBondContact O-CB 3.12Å; H656-R660 PolarHBondContact O-N 3.28Å; R660-Y664 WeakPolarHBondContact O-CB 3.24Å; R660-Y664 PolarHBondContact O-N 3.17Å
661	Y	87.4	Confident	86.6	Confident	2 Å²	2	24.7 Å²	24.7	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-63.9	-51.8	177.6	177.6	-93.2	0	0	0	111.9	F59 R63 W67 W128 I132 L585 L657 V658 D659 L663 Y664 Y665	F59-Y661 HydrophobicContact CE1-CE1 4.48Å; F59-Y661 AromaticContact CZ-CE1 3.67Å; F59-Y661 HydrophobicContact CZ-CE1 3.67Å; F59-Y661 AromaticContact CZ-CZ 3.9Å; R63-Y661 PolarHBondContact NH1-OH 3.24Å; W67-Y661 WeakPolarHBondContact CH2-OH 3.21Å; W67-Y661 WeakPolarHBondContact CZ3-OH 3.04Å; W128-Y661 HydrophobicContact CB-CE2 4.28Å; W128-Y661 HydrophobicContact CE3-CD2 4.48Å; W128-Y661 HydrophobicContact CE3-CE2 4.31Å; I132-Y661 HydrophobicContact CD1-CD2 4.03Å; I132-Y661 HydrophobicContact CD1-CG 4.18Å; I132-Y661 HydrophobicContact CG1-CD2 3.65Å; I132-Y661 HydrophobicContact CG1-CG 4.13Å; L585-Y661 HydrophobicContact CD1-CD1 3.55Å; L585-Y661 HydrophobicContact CD1-CE1 3.97Å; L585-Y661 HydrophobicContact CD1-CG 4.36Å; L657-Y661 WeakPolarHBondContact O-CB 3.47Å; L657-Y661 PolarHBondContact O-N 3.2Å; L657-Y661 VanDerWaalsContact O-N 3.1Å; V658-Y661 PolarHBondContact O-N 3.29Å; D659-Y661 VanDerWaalsContact C-N 3.3Å; D659-Y661 PolarHBondContact O-N 2.93Å; Y661-L663 PolarHBondContact O-N 2.56Å; Y661-Y664 PolarHBondContact O-N 3.42Å; Y661-Y665 AromaticContact CD2-CD2 3.58Å; Y661-Y665 HydrophobicContact CD2-CD2 3.58Å; Y661-Y665 AromaticContact CD2-CE2 3.84Å; Y661-Y665 HydrophobicContact CD2-CE2 3.84Å; Y661-Y665 AromaticContact CE2-CD2 3.45Å; Y661-Y665 HydrophobicContact CE2-CD2 3.45Å; Y661-Y665 VanDerWaalsContact CE2-CD2 3.45Å; Y661-Y665 AromaticContact CE2-CE2 3.73Å; Y661-Y665 HydrophobicContact CE2-CE2 3.73Å; Y661-Y665 HydrophobicContact CE2-CG 4.36Å; Y661-Y665 HydrophobicContact CG-CD2 4.22Å; Y661-Y665 AromaticContact CZ-CD2 3.95Å; Y661-Y665 WeakPolarHBondContact O-CD2 3.24Å; Y661-Y665 PolarHBondContact O-N 3.28Å
662	N	87.1	Confident	85.8	Confident	4 Å²	4	24.3 Å²	24.3	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-66.3	-40.9	-175.9	-81.3	-16.2	0	0	0	112.2	D584 V658 D659 Y664 Y665 A666 Y667	D584-N662 PolarHBondContact O-ND2 2.77Å; V658-N662 WeakPolarHBondContact O-CB 3.38Å; V658-N662 PolarHBondContact O-N 3.22Å; D659-N662 PolarHBondContact O-N 3.37Å; N662-Y664 VanDerWaalsContact C-N 3.3Å; N662-Y664 PolarHBondContact O-N 3.25Å; N662-Y665 PolarHBondContact O-N 3.24Å; N662-A666 WeakPolarHBondContact O-CA 3.26Å; N662-A666 WeakPolarHBondContact O-CB 3.14Å; N662-A666 PolarHBondContact O-N 3.41Å; N662-Y667 HydrophobicContact CB-CD2 4.19Å; N662-Y667 HydrophobicContact CB-CE2 3.81Å; N662-Y667 VanDerWaalsContact O-CD2 3.28Å; N662-Y667 WeakPolarHBondContact O-CD2 3.33Å; N662-Y667 PolarHBondContact O-N 2.89Å
663	L	85.4	Confident	84.9	Confident	5 Å²	5	26 Å²	26	3%	0.026	13%	0.13	C	C	.	.	H	α-helix	trans	-58.5	-43.6	175.9	-81.1	165.8	0	0	0	111.5	C144 A148 Y151 L152 F618 D659 Y661	C144-L663 PolarHBondContact SG-O 3.46Å; A148-L663 HydrophobicContact CB-CD1 4.49Å; A148-L663 HydrophobicContact CB-CD2 4.38Å; Y151-L663 HydrophobicContact CD1-CD1 3.99Å; Y151-L663 HydrophobicContact CE1-CD1 4.49Å; L152-L663 HydrophobicContact CD1-CD1 4.39Å; L152-L663 HydrophobicContact CD2-CD1 4.07Å; L152-L663 HydrophobicContact CG-CD1 4.12Å; F618-L663 HydrophobicContact CB-CD2 3.78Å; F618-L663 HydrophobicContact CD1-CD2 3.63Å; F618-L663 HydrophobicContact CD2-CD2 3.84Å; F618-L663 HydrophobicContact CD2-CG 4.39Å; F618-L663 HydrophobicContact CE1-CD2 4.1Å; F618-L663 HydrophobicContact CE2-CD2 4.28Å; F618-L663 HydrophobicContact CE2-CG 4.44Å; F618-L663 HydrophobicContact CG-CD2 3.47Å; F618-L663 VanDerWaalsContact CG-CD2 3.47Å; F618-L663 HydrophobicContact CG-CG 4.44Å; F618-L663 HydrophobicContact CZ-CD2 4.39Å; D659-L663 WeakPolarHBondContact O-CB 3.4Å; D659-L663 WeakPolarHBondContact O-CD1 3.38Å; D659-L663 VanDerWaalsContact O-CG 3.28Å; D659-L663 WeakPolarHBondContact O-CG 3.47Å; D659-L663 PolarHBondContact O-N 3.46Å; Y661-L663 PolarHBondContact O-N 2.56Å
664	Y	83.5	Confident	84	Confident	22 Å²	22	27.1 Å²	27.1	9%	0.086	13%	0.132	C	C	.	.	H	α-helix	trans	-73	-38.3	-177.3	-171.9	-96.2	0	0	0	113.2	I135 E139 I140 K143 R660 Y661 N662	I135-Y664 HydrophobicContact CD1-CD1 3.91Å; I135-Y664 HydrophobicContact CD1-CG 4.02Å; I135-Y664 HydrophobicContact CG1-CD1 4.29Å; I135-Y664 HydrophobicContact CG1-CE1 4.43Å; I135-Y664 HydrophobicContact CG1-CG 4.44Å; I135-Y664 HydrophobicContact CG2-CD2 3.86Å; I135-Y664 HydrophobicContact CG2-CE2 4.12Å; I135-Y664 HydrophobicContact CG2-CG 4.19Å; E139-Y664 HydrophobicContact CB-CE2 4.26Å; I140-Y664 HydrophobicContact CG1-CD2 3.94Å; K143-Y664 HydrophobicContact CD-CD2 4.06Å; K143-Y664 HydrophobicContact CD-CE2 3.79Å; K143-Y664 WeakPolarHBondContact CE-O 3.4Å; K143-Y664 PolarHBondContact NZ-O 2.81Å; R660-Y664 WeakPolarHBondContact O-CB 3.24Å; R660-Y664 PolarHBondContact O-N 3.17Å; Y661-Y664 PolarHBondContact O-N 3.42Å; N662-Y664 VanDerWaalsContact C-N 3.3Å; N662-Y664 PolarHBondContact O-N 3.25Å
665	Y	79.1	Confident	83.3	Confident	35 Å²	35	30.7 Å²	30.7	14%	0.137	15%	0.146	C	C	.	.	H	α-helix	trans	-106.3	-15.6	-170.5	-73.8	-68.6	0	0	0	116	W67 L74 I135 Y661 N662	W67-Y665 AromaticContact CH2-CD1 3.88Å; W67-Y665 HydrophobicContact CH2-CD1 3.88Å; W67-Y665 AromaticContact CH2-CG 3.81Å; W67-Y665 HydrophobicContact CH2-CG 3.81Å; W67-Y665 AromaticContact CZ2-CD1 3.8Å; W67-Y665 HydrophobicContact CZ2-CD1 3.8Å; W67-Y665 HydrophobicContact CZ2-CE1 4.42Å; W67-Y665 HydrophobicContact CZ2-CG 4.22Å; L74-Y665 WeakPolarHBondContact CD1-O 3.46Å; I135-Y665 HydrophobicContact CD1-CE2 3.74Å; Y661-Y665 AromaticContact CD2-CD2 3.58Å; Y661-Y665 HydrophobicContact CD2-CD2 3.58Å; Y661-Y665 AromaticContact CD2-CE2 3.84Å; Y661-Y665 HydrophobicContact CD2-CE2 3.84Å; Y661-Y665 AromaticContact CE2-CD2 3.45Å; Y661-Y665 HydrophobicContact CE2-CD2 3.45Å; Y661-Y665 VanDerWaalsContact CE2-CD2 3.45Å; Y661-Y665 AromaticContact CE2-CE2 3.73Å; Y661-Y665 HydrophobicContact CE2-CE2 3.73Å; Y661-Y665 HydrophobicContact CE2-CG 4.36Å; Y661-Y665 HydrophobicContact CG-CD2 4.22Å; Y661-Y665 AromaticContact CZ-CD2 3.95Å; Y661-Y665 WeakPolarHBondContact O-CD2 3.24Å; Y661-Y665 PolarHBondContact O-N 3.28Å; N662-Y665 PolarHBondContact O-N 3.24Å
666	A	75.3	Confident	82.8	Confident	5 Å²	5	30.5 Å²	30.5	4%	0.041	15%	0.145	C	C	.	.	H	α-helix	trans	-129.2	-15.5	-161.7	0	0	0	0	0	114.9	R587 N662	R587-A666 PolarHBondContact NH1-O 3.21Å; R587-A666 VanDerWaalsContact NH1-O 3.16Å; N662-A666 WeakPolarHBondContact O-CA 3.26Å; N662-A666 WeakPolarHBondContact O-CB 3.14Å; N662-A666 PolarHBondContact O-N 3.41Å
667	Y	78.5	Confident	82.3	Confident	50 Å²	50	29.7 Å²	29.7	20%	0.196	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	150.3	-174.4	-68.3	-71.2	0	0	0	112.2	Y616 F618 N662	Y616-Y667 WeakPolarHBondContact O-CA 3.42Å; Y616-Y667 VanDerWaalsContact O-CD1 3.32Å; Y616-Y667 WeakPolarHBondContact O-CD1 3.39Å; F618-Y667 HydrophobicContact CB-CD1 4.04Å; F618-Y667 HydrophobicContact CB-CD2 4.21Å; F618-Y667 HydrophobicContact CB-CG 3.81Å; F618-Y667 HydrophobicContact CD2-CD1 4.26Å; F618-Y667 AromaticContact CD2-CD2 3.53Å; F618-Y667 HydrophobicContact CD2-CD2 3.53Å; F618-Y667 HydrophobicContact CD2-CE1 4.21Å; F618-Y667 AromaticContact CD2-CE2 3.44Å; F618-Y667 HydrophobicContact CD2-CE2 3.44Å; F618-Y667 VanDerWaalsContact CD2-CE2 3.44Å; F618-Y667 AromaticContact CD2-CG 3.97Å; F618-Y667 HydrophobicContact CD2-CG 3.97Å; F618-Y667 AromaticContact CD2-CZ 3.82Å; F618-Y667 HydrophobicContact CE2-CD2 4.35Å; F618-Y667 AromaticContact CE2-CE2 3.97Å; F618-Y667 HydrophobicContact CE2-CE2 3.97Å; F618-Y667 HydrophobicContact CG-CD2 4.3Å; F618-Y667 HydrophobicContact CG-CG 4.39Å; N662-Y667 HydrophobicContact CB-CD2 4.19Å; N662-Y667 HydrophobicContact CB-CE2 3.81Å; N662-Y667 VanDerWaalsContact O-CD2 3.28Å; N662-Y667 WeakPolarHBondContact O-CD2 3.33Å; N662-Y667 PolarHBondContact O-N 2.89Å
668	L	75.8	Confident	81.8	Confident	33 Å²	33	30 Å²	30	17%	0.173	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	152.9	170.6	-68.3	89.1	0	0	0	111.6	D77 A615 Y616 E617 A670	D77-L668 WeakPolarHBondContact OD2-CD2 3.06Å; A615-L668 HydrophobicContact CB-CD1 3.3Å; A615-L668 HydrophobicContact CB-CG 4.26Å; Y616-L668 VanDerWaalsContact O-CD1 3.27Å; Y616-L668 WeakPolarHBondContact O-CD1 3.29Å; Y616-L668 PolarHBondContact O-N 3.41Å; E617-L668 HydrophobicContact CG-CB 4.26Å; L668-A670 PolarHBondContact O-N 3.25Å
669	P	75.6	Confident	81.3	Confident	59 Å²	59	29.6 Å²	29.6	38%	0.383	15%	0.147	S	C	.	.			trans	-59.8	135.1	167.3	26.7	-34	0	0	0	110.1
670	A	74.3	Confident	81.1	Confident	9 Å²	9	29.5 Å²	29.5	7%	0.074	15%	0.146	C	C	.	.			trans	-125.2	136.9	172.7	0	0	0	0	0	109	F620 L668	F620-A670 HydrophobicContact CE2-CB 4.27Å; L668-A670 PolarHBondContact O-N 3.25Å
671	K	76.7	Confident	80.9	Confident	51 Å²	51	28.3 Å²	28.3	22%	0.222	14%	0.142	C	C	.	.			trans	-105.2	112.8	178.7	-161.9	168.2	-178.2	-171.5	0	110.2	D235 D414	D235-K671 IonicContact OD1-NZ 3.29Å; D235-K671 PolarHBondContact OD1-NZ 3.08Å; D235-K671 IonicContact OD2-NZ 3.04Å; D235-K671 PolarHBondContact OD2-NZ 2.73Å; D414-K671 HydrophobicContact CB-CD 4.36Å; D414-K671 WeakPolarHBondContact OD2-CD 3.49Å; D414-K671 WeakPolarHBondContact OD2-CE 3.3Å; D414-K671 IonicContact OD2-NZ 2.6Å; D414-K671 PolarHBondContact OD2-NZ 3.23Å
672	L	79.2	Confident	80.7	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.016	17%	0.165	C	C	.	.			trans	-120.6	157.8	-171.5	-66.1	172.3	0	0	0	111.6	D147 Y232 R507 S508 F620 I676	D147-L672 PolarHBondContact OD2-N 2.73Å; Y232-L672 PolarHBondContact OH-O 3.3Å; R507-L672 HydrophobicContact CG-CD2 4.15Å; S508-L672 WeakPolarHBondContact OG-CA 3.41Å; F620-L672 HydrophobicContact CB-CD1 3.98Å; F620-L672 HydrophobicContact CD2-CD1 3.19Å; F620-L672 HydrophobicContact CD2-CG 4.5Å; F620-L672 HydrophobicContact CE2-CD1 3.73Å; F620-L672 HydrophobicContact CG-CD1 3.69Å; L672-I676 HydrophobicContact CB-CD1 4.05Å; L672-I676 HydrophobicContact CD1-CD1 4.07Å; L672-I676 HydrophobicContact CD2-CD1 3.93Å; L672-I676 HydrophobicContact CG-CD1 4.25Å
673	D	77.6	Confident	80.7	Confident	37 Å²	37	33.2 Å²	33.2	20%	0.198	17%	0.168	C	C	.	.			trans	-76.3	140.2	175.8	-172.4	-8.1	0	0	0	110.8	S508 K675 I676	S508-D673 PolarHBondContact OG-N 3.04Å; D673-K675 PolarHBondContact O-N 3.34Å; D673-K675 PolarHBondContact OD1-N 2.72Å; D673-K675 VanDerWaalsContact OD2-CD 3.32Å; D673-K675 WeakPolarHBondContact OD2-CD 2.97Å; D673-K675 WeakPolarHBondContact OD2-CE 3.41Å; D673-K675 IonicContact OD2-NZ 2.78Å; D673-K675 PolarHBondContact OD2-NZ 3.49Å; D673-I676 PolarHBondContact O-N 3.45Å; D673-I676 VanDerWaalsContact O-N 3.08Å
674	K	78.2	Confident	80.9	Confident	99 Å²	99	33 Å²	33	43%	0.43	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-25.2	175.8	72.1	-169.6	173.5	-156.2	0	113.9	Y232 E234 I676 H677 S678	Y232-K674 HydrophobicContact CD1-CB 4.21Å; Y232-K674 HydrophobicContact CD1-CD 4.15Å; Y232-K674 HydrophobicContact CD2-CB 4.06Å; Y232-K674 HydrophobicContact CE1-CB 4.41Å; Y232-K674 HydrophobicContact CE2-CB 4.28Å; Y232-K674 HydrophobicContact CG-CB 4.04Å; E234-K674 IonicContact OE1-NZ 3.28Å; E234-K674 PolarHBondContact OE1-NZ 2.9Å; K674-I676 PolarHBondContact O-N 2.71Å; K674-H677 PolarHBondContact O-N 3.43Å; K674-S678 PolarHBondContact O-N 3.07Å; K674-S678 VanDerWaalsContact O-N 3.14Å
675	K	79.6	Confident	81.1	Confident	106 Å²	106	33.2 Å²	33.2	46%	0.461	17%	0.171	S	C	.	.	H	α-helix	trans	-56	-34	178.4	-67.1	-179.5	-167.4	123.7	0	113	D673 S678 G679	D673-K675 PolarHBondContact O-N 3.34Å; D673-K675 PolarHBondContact OD1-N 2.72Å; D673-K675 VanDerWaalsContact OD2-CD 3.32Å; D673-K675 WeakPolarHBondContact OD2-CD 2.97Å; D673-K675 WeakPolarHBondContact OD2-CE 3.41Å; D673-K675 IonicContact OD2-NZ 2.78Å; D673-K675 PolarHBondContact OD2-NZ 3.49Å; K675-S678 WeakPolarHBondContact CA-OG 3.24Å; K675-S678 PolarHBondContact O-OG 3.49Å; K675-G679 PolarHBondContact O-N 3.11Å
676	I	83.7	Confident	81.5	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-63.5	-50.9	179	-71.4	164.4	0	0	0	110.5	S508 N511 R512 Y624 L672 D673 K674 S678 G679 A680	S508-I676 WeakPolarHBondContact O-CD1 3.27Å; N511-I676 HydrophobicContact CB-CD1 3.9Å; R512-I676 HydrophobicContact CB-CG1 4.06Å; Y624-I676 HydrophobicContact CD2-CG2 4.28Å; Y624-I676 HydrophobicContact CE2-CG2 4.16Å; L672-I676 HydrophobicContact CB-CD1 4.05Å; L672-I676 HydrophobicContact CD1-CD1 4.07Å; L672-I676 HydrophobicContact CD2-CD1 3.93Å; L672-I676 HydrophobicContact CG-CD1 4.25Å; D673-I676 PolarHBondContact O-N 3.45Å; D673-I676 VanDerWaalsContact O-N 3.08Å; K674-I676 PolarHBondContact O-N 2.71Å; I676-S678 VanDerWaalsContact C-N 3.35Å; I676-S678 PolarHBondContact O-N 2.9Å; I676-G679 WeakPolarHBondContact O-CA 3.45Å; I676-G679 PolarHBondContact O-N 3.41Å; I676-A680 PolarHBondContact O-N 3.41Å
677	H	84.5	Confident	82.3	Confident	4 Å²	4	32.9 Å²	32.9	2%	0.019	18%	0.175	C	C	.	.	H	α-helix	trans	-60.9	-43	179.4	-62.7	-57.6	0	0	0	112.1	D147 M230 Y624 K674 G679 A680 V681	D147-H677 IonicContact OD1-CD2 2.81Å; D147-H677 IonicContact OD1-NE2 2.7Å; D147-H677 PolarHBondContact OD1-NE2 3.12Å; M230-H677 HydrophobicContact CE-CB 3.51Å; M230-H677 HydrophobicContact SD-CB 4.23Å; Y624-H677 AromaticContact CE2-ND1 3.93Å; Y624-H677 AromaticContact CZ-ND1 3.74Å; Y624-H677 PolarHBondContact OH-CE1 3.4Å; Y624-H677 PolarHBondContact OH-ND1 3.05Å; K674-H677 PolarHBondContact O-N 3.43Å; H677-G679 VanDerWaalsContact C-N 3.29Å; H677-G679 PolarHBondContact O-N 3.49Å; H677-A680 PolarHBondContact O-N 2.91Å; H677-V681 WeakPolarHBondContact O-CG2 3.37Å; H677-V681 PolarHBondContact O-N 3.14Å; H677-V681 VanDerWaalsContact O-N 3.16Å
678	S	81	Confident	82.9	Confident	55 Å²	55	30.6 Å²	30.6	39%	0.385	17%	0.167	S	C	.	.	H	α-helix	trans	-64	-34.3	174.4	73.6	0	0	0	0	113	K674 K675 I676 V681 N682	K674-S678 PolarHBondContact O-N 3.07Å; K674-S678 VanDerWaalsContact O-N 3.14Å; K675-S678 WeakPolarHBondContact CA-OG 3.24Å; K675-S678 PolarHBondContact O-OG 3.49Å; I676-S678 VanDerWaalsContact C-N 3.35Å; I676-S678 PolarHBondContact O-N 2.9Å; S678-V681 PolarHBondContact O-N 3.07Å; S678-N682 PolarHBondContact O-N 3.18Å; S678-N682 VanDerWaalsContact O-N 3.13Å; S678-N682 PolarHBondContact O-ND2 3.36Å
679	G	82.9	Confident	83.6	Confident	5 Å²	5	30.5 Å²	30.5	5%	0.052	17%	0.166	C	C	.	.	H	α-helix	trans	-66.3	-41.3	176.3	0	0	0	0	0	112.1	K675 I676 H677 N682 Q683	K675-G679 PolarHBondContact O-N 3.11Å; I676-G679 WeakPolarHBondContact O-CA 3.45Å; I676-G679 PolarHBondContact O-N 3.41Å; H677-G679 VanDerWaalsContact C-N 3.29Å; H677-G679 PolarHBondContact O-N 3.49Å; G679-N682 PolarHBondContact O-N 3.19Å; G679-Q683 WeakPolarHBondContact O-CG 3.18Å; G679-Q683 PolarHBondContact O-N 2.95Å; G679-Q683 VanDerWaalsContact O-N 3.08Å
680	A	86.9	Confident	84.3	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62	-43.7	175.3	0	0	0	0	0	111.6	F154 M515 Y624 M628 I676 H677 N682 Q683 V684	F154-A680 HydrophobicContact CE2-CB 4.31Å; F154-A680 HydrophobicContact CZ-CB 4.15Å; M515-A680 HydrophobicContact SD-CB 3.94Å; Y624-A680 HydrophobicContact CD1-CB 3.69Å; Y624-A680 HydrophobicContact CD2-CB 4.47Å; Y624-A680 HydrophobicContact CE1-CB 3.78Å; Y624-A680 HydrophobicContact CG-CB 4.08Å; M628-A680 HydrophobicContact CE-CB 4.45Å; M628-A680 HydrophobicContact SD-CB 4Å; M628-A680 VanDerWaalsContact SD-O 3.41Å; I676-A680 PolarHBondContact O-N 3.41Å; H677-A680 PolarHBondContact O-N 2.91Å; A680-N682 VanDerWaalsContact C-N 3.34Å; A680-N682 PolarHBondContact O-N 2.74Å; A680-Q683 PolarHBondContact O-N 2.86Å; A680-Q683 VanDerWaalsContact O-N 3.17Å; A680-V684 PolarHBondContact O-N 3.22Å
681	V	85.9	Confident	85.1	Confident	9 Å²	9	29.3 Å²	29.3	6%	0.055	16%	0.155	C	C	.	.	H	α-helix	trans	-58.1	-45.8	175.7	172.1	0	0	0	0	111.7	F154 M223 H677 S678 Q683 V684 V685	F154-V681 HydrophobicContact CD2-CG2 4.32Å; F154-V681 HydrophobicContact CE2-CG2 4.12Å; M223-V681 HydrophobicContact CB-CG1 3.8Å; M223-V681 HydrophobicContact CG-CG1 4.15Å; M223-V681 HydrophobicContact SD-CG1 4.2Å; M223-V681 HydrophobicContact SD-CG2 4.35Å; H677-V681 WeakPolarHBondContact O-CG2 3.37Å; H677-V681 PolarHBondContact O-N 3.14Å; H677-V681 VanDerWaalsContact O-N 3.16Å; S678-V681 PolarHBondContact O-N 3.07Å; V681-Q683 VanDerWaalsContact C-N 3.31Å; V681-Q683 PolarHBondContact O-N 2.97Å; V681-V684 PolarHBondContact O-N 2.84Å; V681-V685 PolarHBondContact O-N 3.12Å
682	N	83.7	Confident	85.8	Confident	92 Å²	92	27 Å²	27	49%	0.492	15%	0.145	S	C	.	.	H	α-helix	trans	-63.3	-36.3	177.9	-70.1	-22.5	0	0	0	112.4	S678 G679 A680	S678-N682 PolarHBondContact O-N 3.18Å; S678-N682 VanDerWaalsContact O-N 3.13Å; S678-N682 PolarHBondContact O-ND2 3.36Å; G679-N682 PolarHBondContact O-N 3.19Å; A680-N682 VanDerWaalsContact C-N 3.34Å; A680-N682 PolarHBondContact O-N 2.74Å
683	Q	88.4	Confident	86.2	Confident	17 Å²	17	31 Å²	31	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-71	-36.8	178.2	-73.1	180	6.1	0	0	112.9	H516 Y519 M628 G679 A680 V681 V685 A686	H516-Q683 PolarHBondContact CD2-NE2 3.22Å; H516-Q683 PolarHBondContact CE1-NE2 3.26Å; H516-Q683 VanDerWaalsContact CE1-NE2 3.31Å; H516-Q683 PolarHBondContact ND1-NE2 3.24Å; H516-Q683 PolarHBondContact NE2-NE2 3.46Å; H516-Q683 VanDerWaalsContact NE2-NE2 3.13Å; Y519-Q683 HydrophobicContact CD1-CB 4.32Å; Y519-Q683 HydrophobicContact CD1-CG 4.22Å; Y519-Q683 HydrophobicContact CE1-CB 4.04Å; Y519-Q683 HydrophobicContact CE1-CG 4.28Å; Y519-Q683 PolarHBondContact OH-O 3.44Å; M628-Q683 HydrophobicContact CE-CB 4.15Å; M628-Q683 HydrophobicContact SD-CB 4Å; G679-Q683 WeakPolarHBondContact O-CG 3.18Å; G679-Q683 PolarHBondContact O-N 2.95Å; G679-Q683 VanDerWaalsContact O-N 3.08Å; A680-Q683 PolarHBondContact O-N 2.86Å; A680-Q683 VanDerWaalsContact O-N 3.17Å; V681-Q683 VanDerWaalsContact C-N 3.31Å; V681-Q683 PolarHBondContact O-N 2.97Å; Q683-V685 VanDerWaalsContact C-N 3.26Å; Q683-V685 PolarHBondContact O-N 3.22Å; Q683-A686 WeakPolarHBondContact O-CB 3.47Å; Q683-A686 PolarHBondContact O-N 3.44Å
684	V	89.2	Confident	86.6	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.8	-36.2	175.3	164.7	0	0	0	0	112	F154 I158 T219 M223 M628 F631 A680 V681 A686 A687 P688	F154-V684 HydrophobicContact CE1-CG2 4.41Å; F154-V684 HydrophobicContact CE2-CG2 4.07Å; F154-V684 HydrophobicContact CZ-CG2 3.46Å; F154-V684 VanDerWaalsContact CZ-CG2 3.46Å; I158-V684 HydrophobicContact CD1-CG2 4.26Å; T219-V684 HydrophobicContact CG2-CG1 3.99Å; M223-V684 HydrophobicContact CE-CG1 4.3Å; M223-V684 HydrophobicContact CG-CG1 3.99Å; M223-V684 HydrophobicContact SD-CB 4.16Å; M223-V684 HydrophobicContact SD-CG1 3.79Å; M628-V684 HydrophobicContact CG-CG2 3.79Å; M628-V684 HydrophobicContact SD-CG2 3.73Å; F631-V684 HydrophobicContact CD1-CG1 4.34Å; F631-V684 HydrophobicContact CE1-CG1 3.71Å; F631-V684 HydrophobicContact CZ-CG1 4.33Å; A680-V684 PolarHBondContact O-N 3.22Å; V681-V684 PolarHBondContact O-N 2.84Å; V684-A686 PolarHBondContact O-N 3.42Å; V684-A687 VanDerWaalsContact O-CB 3.3Å; V684-A687 WeakPolarHBondContact O-CB 3.3Å; V684-A687 PolarHBondContact O-N 3.35Å; V684-P688 WeakPolarHBondContact O-CD 3.43Å
685	V	87.6	Confident	87	Confident	27 Å²	27	25.2 Å²	25.2	16%	0.164	14%	0.136	C	C	.	.	H	α-helix	trans	-64	-21.4	176.2	177.2	0	0	0	0	112	V220 M223 V681 Q683 A687 P688 I689	V220-V685 HydrophobicContact CG2-CG1 4.29Å; M223-V685 HydrophobicContact CG-CG2 4.35Å; V681-V685 PolarHBondContact O-N 3.12Å; Q683-V685 VanDerWaalsContact C-N 3.26Å; Q683-V685 PolarHBondContact O-N 3.22Å; V685-A687 VanDerWaalsContact C-N 3.29Å; V685-A687 PolarHBondContact O-N 3.49Å; V685-P688 VanDerWaalsContact O-CD 3.3Å; V685-P688 WeakPolarHBondContact O-CD 3.17Å; V685-P688 WeakPolarHBondContact O-CG 2.98Å; V685-I689 HydrophobicContact CG1-CD1 4.5Å; V685-I689 WeakPolarHBondContact O-CG1 3.13Å
686	A	87.3	Confident	87.3	Confident	34 Å²	34	20.5 Å²	20.5	28%	0.281	12%	0.116	S	C	.	.	H	α-helix	trans	-69	-24.8	174.1	0	0	0	0	0	113.2	Q683 V684 I689 L690	Q683-A686 WeakPolarHBondContact O-CB 3.47Å; Q683-A686 PolarHBondContact O-N 3.44Å; V684-A686 PolarHBondContact O-N 3.42Å; A686-I689 WeakPolarHBondContact O-CB 3.28Å; A686-I689 PolarHBondContact O-N 2.88Å; A686-L690 WeakPolarHBondContact O-CG 3.37Å; A686-L690 PolarHBondContact O-N 3.05Å
687	A	91.7	Very high	87.2	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-59.6	-54	-179.2	0	0	0	0	0	113.9	F631 T632 M635 V684 V685 I689 L690 C691	F631-A687 HydrophobicContact CD1-CB 4.02Å; F631-A687 HydrophobicContact CE1-CB 3.75Å; T632-A687 HydrophobicContact CG2-CB 4.19Å; T632-A687 WeakPolarHBondContact OG1-CB 3.39Å; M635-A687 HydrophobicContact CB-CB 4.15Å; M635-A687 HydrophobicContact CG-CB 4.38Å; V684-A687 VanDerWaalsContact O-CB 3.3Å; V684-A687 WeakPolarHBondContact O-CB 3.3Å; V684-A687 PolarHBondContact O-N 3.35Å; V685-A687 VanDerWaalsContact C-N 3.29Å; V685-A687 PolarHBondContact O-N 3.49Å; A687-I689 VanDerWaalsContact C-N 3.26Å; A687-I689 PolarHBondContact O-N 3.15Å; A687-L690 PolarHBondContact O-N 3.49Å; A687-C691 PolarHBondContact O-N 3.24Å
688	P	91.3	Very high	87	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.013	12%	0.121	C	C	.	.	H	α-helix	trans	-66.2	-25.8	175.8	25.8	-36	0	0	0	113.3	L216 T219 V684 V685 C691 L692	L216-P688 HydrophobicContact CB-CB 4.14Å; L216-P688 HydrophobicContact CD1-CB 3.95Å; L216-P688 HydrophobicContact CD1-CG 3.71Å; T219-P688 HydrophobicContact CG2-CG 4.07Å; V684-P688 WeakPolarHBondContact O-CD 3.43Å; V685-P688 VanDerWaalsContact O-CD 3.3Å; V685-P688 WeakPolarHBondContact O-CD 3.17Å; V685-P688 WeakPolarHBondContact O-CG 2.98Å; P688-C691 WeakPolarHBondContact O-CB 3.2Å; P688-C691 PolarHBondContact O-N 2.94Å; P688-L692 WeakPolarHBondContact O-CG 3.43Å; P688-L692 PolarHBondContact O-N 3.28Å
689	I	90.8	Very high	86.9	Confident	30 Å²	30	19.5 Å²	19.5	15%	0.154	11%	0.105	C	C	.	.	H	α-helix	trans	-66.7	-43.3	173.1	-59.9	173.9	0	0	0	110.1	L216 V685 A686 A687 C691 L692 F693 L717 T720 I721 C724	L216-I689 HydrophobicContact CD1-CG1 4.3Å; V685-I689 HydrophobicContact CG1-CD1 4.5Å; V685-I689 WeakPolarHBondContact O-CG1 3.13Å; A686-I689 WeakPolarHBondContact O-CB 3.28Å; A686-I689 PolarHBondContact O-N 2.88Å; A687-I689 VanDerWaalsContact C-N 3.26Å; A687-I689 PolarHBondContact O-N 3.15Å; I689-C691 VanDerWaalsContact C-N 3.33Å; I689-L692 PolarHBondContact O-N 2.69Å; I689-F693 PolarHBondContact O-N 3.01Å; I689-L717 HydrophobicContact CG2-CD1 3.89Å; I689-T720 HydrophobicContact CD1-CG2 4.02Å; I689-T720 HydrophobicContact CG1-CG2 3.8Å; I689-I721 HydrophobicContact CG2-CG1 4.44Å; I689-C724 VanDerWaalsContact CD1-SG 3.59Å
690	L	89.7	Confident	86.7	Confident	41 Å²	41	20.1 Å²	20.1	22%	0.215	11%	0.108	C	C	.	.	H	α-helix	trans	-63.6	-38.3	173	-71.6	173.2	0	0	0	111.7	I523 T632 A686 A687 F693 W694	I523-L690 HydrophobicContact CD1-CD1 4.06Å; I523-L690 HydrophobicContact CG2-CD1 4.25Å; T632-L690 HydrophobicContact CG2-CD1 3.67Å; A686-L690 WeakPolarHBondContact O-CG 3.37Å; A686-L690 PolarHBondContact O-N 3.05Å; A687-L690 PolarHBondContact O-N 3.49Å; L690-F693 PolarHBondContact O-N 2.82Å; L690-W694 WeakPolarHBondContact O-CB 3.14Å; L690-W694 PolarHBondContact O-N 3.4Å
691	C	90.9	Very high	86.1	Confident	3 Å²	3	22.7 Å²	22.7	2%	0.02	12%	0.121	C	C	.	.	H	α-helix	trans	-58.7	-47.8	172	-174.7	0	0	0	0	112	M635 A687 P688 I689 F693 W694 L695	M635-C691 PolarHBondContact O-SG 2.84Å; M635-C691 VanDerWaalsContact O-SG 3.34Å; A687-C691 PolarHBondContact O-N 3.24Å; P688-C691 WeakPolarHBondContact O-CB 3.2Å; P688-C691 PolarHBondContact O-N 2.94Å; I689-C691 VanDerWaalsContact C-N 3.33Å; C691-F693 PolarHBondContact O-N 2.98Å; C691-W694 PolarHBondContact O-N 3.15Å; C691-L695 WeakPolarHBondContact O-CG 3.47Å; C691-L695 PolarHBondContact O-N 3.04Å
692	L	91.1	Very high	85.5	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-61.8	-42.3	176.4	-75.4	168	0	0	0	112.2	A212 L216 P688 I689 W694 L695 L696 V716 L717	A212-L692 HydrophobicContact CB-CD2 3.56Å; A212-L692 HydrophobicContact CB-CG 4.42Å; L216-L692 HydrophobicContact CD2-CD1 4.09Å; P688-L692 WeakPolarHBondContact O-CG 3.43Å; P688-L692 PolarHBondContact O-N 3.28Å; I689-L692 PolarHBondContact O-N 2.69Å; L692-W694 VanDerWaalsContact C-N 3.33Å; L692-W694 PolarHBondContact O-N 2.83Å; L692-L695 PolarHBondContact O-N 3.29Å; L692-L696 WeakPolarHBondContact O-CB 3.4Å; L692-L696 PolarHBondContact O-N 3.03Å; L692-V716 HydrophobicContact CD1-CG1 4.13Å; L692-V716 HydrophobicContact CD2-CG1 4.33Å; L692-L717 HydrophobicContact CB-CD1 3.99Å
693	F	88.9	Confident	85	Confident	88 Å²	88	22.7 Å²	22.7	39%	0.386	12%	0.118	S	C	.	.	H	α-helix	trans	-60.7	-43.1	174.3	174.1	-98.8	0	0	0	111.7	I689 L690 C691 L696 F697 L717	I689-F693 PolarHBondContact O-N 3.01Å; L690-F693 PolarHBondContact O-N 2.82Å; C691-F693 PolarHBondContact O-N 2.98Å; F693-L696 PolarHBondContact O-N 3.17Å; F693-F697 WeakPolarHBondContact O-CB 3.39Å; F693-F697 PolarHBondContact O-N 3.29Å; F693-L717 HydrophobicContact CB-CD2 4.28Å; F693-L717 HydrophobicContact CD2-CD2 4.29Å
694	W	84.9	Confident	84.6	Confident	5 Å²	5	23.4 Å²	23.4	2%	0.019	13%	0.13	C	C	.	.	H	α-helix	trans	-66.7	-40.5	179.1	-160.5	-117.2	0	0	0	112.4	V560 F561 T636 Y637 L690 C691 L692 F697 F698	V560-W694 HydrophobicContact CG1-CH2 3.9Å; V560-W694 HydrophobicContact CG1-CZ2 4.21Å; F561-W694 HydrophobicContact CD1-CZ2 4.22Å; F561-W694 AromaticContact CE1-CD1 3.95Å; F561-W694 HydrophobicContact CE1-CD2 4.1Å; F561-W694 AromaticContact CE1-CE2 3.38Å; F561-W694 HydrophobicContact CE1-CG 4.38Å; F561-W694 HydrophobicContact CE1-CH2 4.45Å; F561-W694 AromaticContact CE1-CZ2 3.58Å; F561-W694 HydrophobicContact CE1-CZ2 3.58Å; F561-W694 AromaticContact CE1-NE1 3.36Å; F561-W694 HydrophobicContact CZ-CD2 4.27Å; F561-W694 AromaticContact CZ-CE2 3.89Å; F561-W694 HydrophobicContact CZ-CH2 4.4Å; F561-W694 AromaticContact CZ-CZ2 3.95Å; F561-W694 HydrophobicContact CZ-CZ2 3.95Å; T636-W694 HydrophobicContact CG2-CB 3.81Å; T636-W694 HydrophobicContact CG2-CG 3.84Å; Y637-W694 AromaticContact CE1-NE1 3.83Å; Y637-W694 AromaticContact CZ-NE1 3.77Å; L690-W694 WeakPolarHBondContact O-CB 3.14Å; L690-W694 PolarHBondContact O-N 3.4Å; C691-W694 PolarHBondContact O-N 3.15Å; L692-W694 VanDerWaalsContact C-N 3.33Å; L692-W694 PolarHBondContact O-N 2.83Å; W694-F697 HydrophobicContact CE3-CD1 4.31Å; W694-F697 HydrophobicContact CH2-CD1 4.24Å; W694-F697 HydrophobicContact CH2-CE1 4.4Å; W694-F697 AromaticContact CZ3-CD1 3.99Å; W694-F697 HydrophobicContact CZ3-CD1 3.99Å; W694-F697 HydrophobicContact CZ3-CE1 4.45Å; W694-F697 PolarHBondContact O-N 3.49Å; W694-F698 PolarHBondContact O-N 3.41Å
695	L	86.6	Confident	84.1	Confident	8 Å²	8	25.4 Å²	25.4	4%	0.042	14%	0.139	C	C	.	.	H	α-helix	trans	-67.9	-38.2	174.4	-74.7	172.5	0	0	0	112.8	A212 I639 T640 C691 L692 F697 F698 S699	A212-L695 HydrophobicContact CB-CD1 3.4Å; A212-L695 VanDerWaalsContact CB-CD1 3.4Å; I639-L695 HydrophobicContact CB-CD1 4.23Å; I639-L695 HydrophobicContact CB-CD2 4.39Å; I639-L695 HydrophobicContact CD1-CD1 3.81Å; I639-L695 HydrophobicContact CG2-CD1 3.99Å; I639-L695 HydrophobicContact CG2-CD2 3.88Å; T640-L695 HydrophobicContact CG2-CD2 3.73Å; C691-L695 WeakPolarHBondContact O-CG 3.47Å; C691-L695 PolarHBondContact O-N 3.04Å; L692-L695 PolarHBondContact O-N 3.29Å; L695-F697 VanDerWaalsContact C-N 3.33Å; L695-F698 PolarHBondContact O-N 2.67Å; L695-S699 WeakPolarHBondContact O-CB 3.43Å; L695-S699 PolarHBondContact O-N 3.46Å
696	L	86.9	Confident	83.7	Confident	7 Å²	7	31.6 Å²	31.6	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-44.9	172.4	172.3	65	0	0	0	110.6	L692 F693 F698 S699 T700 S710 T713 F714 L717	L692-L696 WeakPolarHBondContact O-CB 3.4Å; L692-L696 PolarHBondContact O-N 3.03Å; F693-L696 PolarHBondContact O-N 3.17Å; L696-F698 VanDerWaalsContact C-N 3.34Å; L696-F698 PolarHBondContact O-N 2.94Å; L696-S699 PolarHBondContact O-N 3.29Å; L696-T700 VanDerWaalsContact O-CB 3.29Å; L696-T700 WeakPolarHBondContact O-CB 3.33Å; L696-T700 PolarHBondContact O-N 3.44Å; L696-T700 PolarHBondContact O-OG1 3.48Å; L696-S710 WeakPolarHBondContact CD1-O 3.42Å; L696-T713 WeakPolarHBondContact CD1-OG1 3.33Å; L696-F714 HydrophobicContact CD1-CB 3.93Å; L696-F714 HydrophobicContact CD2-CB 4.32Å; L696-F714 HydrophobicContact CD2-CD2 3.93Å; L696-L717 HydrophobicContact CD2-CD2 3.76Å
697	F	82.1	Confident	83.5	Confident	20 Å²	20	30.8 Å²	30.8	9%	0.088	16%	0.163	C	C	.	.	H	α-helix	trans	-59.7	-46.1	176.5	-177.2	-124.4	0	0	0	110.7	F557 V560 F561 F693 W694 L695 T700 M701	F557-F697 HydrophobicContact CB-CZ 4.2Å; F557-F697 AromaticContact CD1-CZ 3.86Å; F557-F697 HydrophobicContact CD1-CZ 3.86Å; F557-F697 HydrophobicContact CG-CZ 4.24Å; V560-F697 HydrophobicContact CB-CE1 4.49Å; V560-F697 HydrophobicContact CG1-CE1 3.8Å; F561-F697 HydrophobicContact CD2-CD1 4.48Å; F561-F697 HydrophobicContact CD2-CE1 4.29Å; F561-F697 HydrophobicContact CE1-CD1 4.48Å; F561-F697 AromaticContact CE2-CD1 3.21Å; F561-F697 HydrophobicContact CE2-CD1 3.21Å; F561-F697 AromaticContact CE2-CE1 3.32Å; F561-F697 HydrophobicContact CE2-CE1 3.32Å; F561-F697 HydrophobicContact CE2-CG 4.03Å; F561-F697 HydrophobicContact CE2-CZ 4.26Å; F561-F697 HydrophobicContact CZ-CB 4.26Å; F561-F697 AromaticContact CZ-CD1 3.23Å; F561-F697 HydrophobicContact CZ-CD1 3.23Å; F561-F697 AromaticContact CZ-CE1 3.77Å; F561-F697 HydrophobicContact CZ-CE1 3.77Å; F561-F697 HydrophobicContact CZ-CG 4.06Å; F693-F697 WeakPolarHBondContact O-CB 3.39Å; F693-F697 PolarHBondContact O-N 3.29Å; W694-F697 HydrophobicContact CE3-CD1 4.31Å; W694-F697 HydrophobicContact CH2-CD1 4.24Å; W694-F697 HydrophobicContact CH2-CE1 4.4Å; W694-F697 AromaticContact CZ3-CD1 3.99Å; W694-F697 HydrophobicContact CZ3-CD1 3.99Å; W694-F697 HydrophobicContact CZ3-CE1 4.45Å; W694-F697 PolarHBondContact O-N 3.49Å; L695-F697 VanDerWaalsContact C-N 3.33Å; F697-T700 PolarHBondContact O-N 3.2Å; F697-M701 HydrophobicContact CD2-CG 4.33Å; F697-M701 HydrophobicContact CE2-CG 3.98Å; F697-M701 HydrophobicContact CE2-SD 4.2Å; F697-M701 HydrophobicContact CZ-CG 4.19Å; F697-M701 WeakPolarHBondContact O-CG 3.44Å; F697-M701 PolarHBondContact O-N 3.1Å; F697-M701 VanDerWaalsContact O-N 3.11Å
698	F	78.6	Confident	83.2	Confident	13 Å²	13	35 Å²	35	6%	0.057	19%	0.19	C	C	.	.	H	α-helix	trans	-59.7	-50.4	174.9	180	-99.4	0	0	0	113.2	I195 F561 W694 L695 L696 T700 M701 R702	I195-F698 HydrophobicContact CB-CE1 4.37Å; I195-F698 HydrophobicContact CB-CZ 4.33Å; I195-F698 HydrophobicContact CD1-CD1 3.92Å; I195-F698 HydrophobicContact CD1-CE1 3.54Å; I195-F698 HydrophobicContact CD1-CZ 4.34Å; I195-F698 HydrophobicContact CG1-CE1 3.69Å; I195-F698 HydrophobicContact CG1-CZ 4.05Å; I195-F698 HydrophobicContact CG2-CD1 4.4Å; I195-F698 HydrophobicContact CG2-CE1 3.83Å; I195-F698 HydrophobicContact CG2-CE2 3.94Å; I195-F698 HydrophobicContact CG2-CZ 3.56Å; F561-F698 HydrophobicContact CB-CD2 3.89Å; F561-F698 HydrophobicContact CB-CE2 4.06Å; F561-F698 HydrophobicContact CD1-CB 4.35Å; F561-F698 AromaticContact CD1-CD2 3.64Å; F561-F698 HydrophobicContact CD1-CD2 3.64Å; F561-F698 HydrophobicContact CD1-CE2 4.47Å; F561-F698 HydrophobicContact CD1-CG 4.45Å; F561-F698 AromaticContact CD2-CD2 4Å; F561-F698 HydrophobicContact CD2-CD2 4Å; F561-F698 HydrophobicContact CE1-CB 3.8Å; F561-F698 AromaticContact CE1-CD2 3.97Å; F561-F698 HydrophobicContact CE1-CD2 3.97Å; F561-F698 HydrophobicContact CE1-CG 4.36Å; F561-F698 HydrophobicContact CE2-CB 4.1Å; F561-F698 HydrophobicContact CE2-CD2 4.32Å; F561-F698 AromaticContact CG-CD2 3.6Å; F561-F698 HydrophobicContact CG-CD2 3.6Å; F561-F698 HydrophobicContact CG-CE2 4.28Å; F561-F698 HydrophobicContact CZ-CB 3.65Å; F561-F698 HydrophobicContact CZ-CD2 4.29Å; F561-F698 HydrophobicContact CZ-CG 4.5Å; W694-F698 PolarHBondContact O-N 3.41Å; L695-F698 PolarHBondContact O-N 2.67Å; L696-F698 VanDerWaalsContact C-N 3.34Å; L696-F698 PolarHBondContact O-N 2.94Å; F698-T700 VanDerWaalsContact C-N 3.33Å; F698-T700 PolarHBondContact O-N 3.17Å; F698-M701 PolarHBondContact O-N 3.29Å; F698-R702 WeakPolarHBondContact O-CB 3.27Å; F698-R702 PolarHBondContact O-N 3.09Å; F698-R702 VanDerWaalsContact O-N 3.07Å
699	S	79.6	Confident	82.8	Confident	7 Å²	7	35.5 Å²	35.5	5%	0.049	19%	0.193	C	C	.	.	H	α-helix	trans	-63.1	-40.5	-178.2	-170.7	0	0	0	0	111.5	L695 L696 R702 T703 T709 S710	L695-S699 WeakPolarHBondContact O-CB 3.43Å; L695-S699 PolarHBondContact O-N 3.46Å; L696-S699 PolarHBondContact O-N 3.29Å; S699-R702 PolarHBondContact O-N 3.31Å; S699-T703 PolarHBondContact O-N 3.45Å; S699-T703 PolarHBondContact O-OG1 3.08Å; S699-T703 PolarHBondContact OG-OG1 2.85Å; S699-T709 PolarHBondContact OG-OG1 3.43Å; S699-S710 WeakPolarHBondContact CB-OG 3.19Å; S699-S710 PolarHBondContact O-OG 3.25Å; S699-S710 PolarHBondContact OG-OG 3.44Å
700	T	79.4	Confident	82.5	Confident	18 Å²	18	34 Å²	34	11%	0.11	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-44.6	178.7	-57.8	0	0	0	0	111.5	L696 F697 F698 G704 F705	L696-T700 VanDerWaalsContact O-CB 3.29Å; L696-T700 WeakPolarHBondContact O-CB 3.33Å; L696-T700 PolarHBondContact O-N 3.44Å; L696-T700 PolarHBondContact O-OG1 3.48Å; F697-T700 PolarHBondContact O-N 3.2Å; F698-T700 VanDerWaalsContact C-N 3.33Å; F698-T700 PolarHBondContact O-N 3.17Å; T700-G704 CarbonylContact O-C 3.53Å; T700-G704 WeakPolarHBondContact O-CA 2.87Å; T700-G704 PolarHBondContact O-N 3.35Å; T700-F705 HydrophobicContact CG2-CB 4.05Å; T700-F705 HydrophobicContact CG2-CD2 4.35Å
701	M	74.4	Confident	82.5	Confident	54 Å²	54	34.8 Å²	34.8	27%	0.266	19%	0.189	S	C	.	.	H	α-helix	trans	-66.2	-37.6	178.6	-69.9	-60.1	-57.4	0	0	112.3	F557 E558 F697 F698	F557-M701 VanDerWaalsContact C-CE 3.5Å; F557-M701 HydrophobicContact CB-CE 3.72Å; F557-M701 HydrophobicContact CB-SD 4.1Å; E558-M701 HydrophobicContact CB-CE 4.12Å; F697-M701 HydrophobicContact CD2-CG 4.33Å; F697-M701 HydrophobicContact CE2-CG 3.98Å; F697-M701 HydrophobicContact CE2-SD 4.2Å; F697-M701 HydrophobicContact CZ-CG 4.19Å; F697-M701 WeakPolarHBondContact O-CG 3.44Å; F697-M701 PolarHBondContact O-N 3.1Å; F697-M701 VanDerWaalsContact O-N 3.11Å; F698-M701 PolarHBondContact O-N 3.29Å
702	R	73.2	Confident	82.4	Confident	55 Å²	55	38.6 Å²	38.6	21%	0.208	21%	0.205	C	C	.	.	H	α-helix	trans	-87.8	-38.4	-172.6	-171.5	177.1	-165	156.4	24.4	115	I195 A196 L198 S200 F698 S699	I195-R702 PolarHBondContact O-NH1 3.08Å; A196-R702 PolarHBondContact O-NH1 3.06Å; A196-R702 PolarHBondContact O-NH2 3.3Å; L198-R702 PolarHBondContact O-NH1 3.42Å; L198-R702 PolarHBondContact O-NH2 3.03Å; S200-R702 WeakPolarHBondContact OG-CG 3.42Å; S200-R702 PolarHBondContact OG-NE 3.21Å; F698-R702 WeakPolarHBondContact O-CB 3.27Å; F698-R702 PolarHBondContact O-N 3.09Å; F698-R702 VanDerWaalsContact O-N 3.07Å; S699-R702 PolarHBondContact O-N 3.31Å
703	T	73.5	Confident	82.1	Confident	45 Å²	45	38.5 Å²	38.5	28%	0.276	21%	0.205	S	C	.	.	H	α-helix	trans	-118.7	-5.8	-171.9	60.4	0	0	0	0	113.3	L205 S699 A707 S710	L205-T703 HydrophobicContact CD2-CG2 4.34Å; S699-T703 PolarHBondContact O-N 3.45Å; S699-T703 PolarHBondContact O-OG1 3.08Å; S699-T703 PolarHBondContact OG-OG1 2.85Å; T703-A707 WeakPolarHBondContact OG1-CB 2.97Å; T703-S710 PolarHBondContact OG1-OG 3.38Å
704	G	78.2	Confident	82.2	Confident	32 Å²	32	38.2 Å²	38.2	33%	0.33	20%	0.204	S	C	.	.			trans	86.4	160.8	-172.1	0	0	0	0	0	112.8	T700 S710	T700-G704 CarbonylContact O-C 3.53Å; T700-G704 WeakPolarHBondContact O-CA 2.87Å; T700-G704 PolarHBondContact O-N 3.35Å; G704-S710 WeakPolarHBondContact O-CB 3.45Å; G704-S710 PolarHBondContact O-OG 3.26Å
705	F	78.7	Confident	82.4	Confident	43 Å²	43	41.6 Å²	41.6	19%	0.189	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-38.1	179.8	-175.5	-112.9	0	0	0	112.2	A7 T700 A707 S710 M711 F714	A7-F705 HydrophobicContact CB-CB 4.17Å; T700-F705 HydrophobicContact CG2-CB 4.05Å; T700-F705 HydrophobicContact CG2-CD2 4.35Å; F705-A707 PolarHBondContact O-N 3.3Å; F705-S710 VanDerWaalsContact O-CB 3.3Å; F705-S710 WeakPolarHBondContact O-CB 3.41Å; F705-M711 HydrophobicContact CD1-CE 3.55Å; F705-M711 HydrophobicContact CD2-CE 3.7Å; F705-M711 HydrophobicContact CE1-CE 3.28Å; F705-M711 HydrophobicContact CE1-SD 4.35Å; F705-M711 HydrophobicContact CE2-CE 3.44Å; F705-M711 VanDerWaalsContact CE2-CE 3.44Å; F705-M711 HydrophobicContact CG-CE 3.75Å; F705-M711 HydrophobicContact CZ-CE 3.23Å; F705-M711 WeakPolarHBondContact O-CE 3.23Å; F705-F714 HydrophobicContact CE2-CD2 4.34Å; F705-F714 HydrophobicContact CE2-CG 4.33Å; F705-F714 HydrophobicContact CZ-CD1 4.41Å; F705-F714 HydrophobicContact CZ-CG 4.42Å
706	L	80.4	Confident	82.6	Confident	157 Å²	157	41.9 Å²	41.9	82%	0.822	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-4.8	-177.5	-68.5	166.7	0	0	0	114
707	A	82.3	Confident	82.7	Confident	16 Å²	16	42.1 Å²	42.1	13%	0.132	23%	0.228	C	C	.	.	S	Bend	trans	-63.5	141.8	176.2	0	0	0	0	0	111	T703 F705 T709 S710 M711	T703-A707 WeakPolarHBondContact OG1-CB 2.97Å; F705-A707 PolarHBondContact O-N 3.3Å; A707-T709 VanDerWaalsContact C-N 3.27Å; A707-T709 PolarHBondContact O-N 3.43Å; A707-S710 WeakPolarHBondContact O-CB 2.86Å; A707-S710 PolarHBondContact O-N 2.84Å; A707-S710 VanDerWaalsContact O-N 3.08Å; A707-M711 PolarHBondContact O-N 3.46Å
708	P	85.3	Confident	83.1	Confident	89 Å²	89	44 Å²	44	58%	0.578	24%	0.241	S	C	*	.	H	α-helix	trans	-54.1	-38.2	-179.7	-29.9	36.5	0	0	0	114.5	W206 F712	W206-P708 HydrophobicContact CH2-CB 4.2Å; W206-P708 HydrophobicContact CZ2-CB 3.61Å; P708-F712 WeakPolarHBondContact O-CB 3.37Å; P708-F712 PolarHBondContact O-N 3.49Å
709	T	83.6	Confident	83.5	Confident	12 Å²	12	47.8 Å²	47.8	7%	0.074	26%	0.261	C	S	.	.	H	α-helix	trans	-67.4	-41.7	177.5	50.1	0	0	0	0	112.4	L205 W206 S699 A707 T713	L205-T709 HydrophobicContact CB-CG2 4.47Å; W206-T709 HydrophobicContact CD2-CG2 3.75Å; W206-T709 HydrophobicContact CE3-CG2 4.35Å; W206-T709 HydrophobicContact CG-CG2 3.94Å; W206-T709 HydrophobicContact CZ2-CG2 4.17Å; S699-T709 PolarHBondContact OG-OG1 3.43Å; A707-T709 VanDerWaalsContact C-N 3.27Å; A707-T709 PolarHBondContact O-N 3.43Å; T709-T713 WeakPolarHBondContact O-CG2 3.28Å; T709-T713 PolarHBondContact O-N 3.43Å; T709-T713 PolarHBondContact O-OG1 3.1Å
710	S	85.2	Confident	83.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.6	-41.8	175.9	-59.7	0	0	0	0	111.3	L696 S699 T703 G704 F705 A707 T713 F714	L696-S710 WeakPolarHBondContact CD1-O 3.42Å; S699-S710 WeakPolarHBondContact CB-OG 3.19Å; S699-S710 PolarHBondContact O-OG 3.25Å; S699-S710 PolarHBondContact OG-OG 3.44Å; T703-S710 PolarHBondContact OG1-OG 3.38Å; G704-S710 WeakPolarHBondContact O-CB 3.45Å; G704-S710 PolarHBondContact O-OG 3.26Å; F705-S710 VanDerWaalsContact O-CB 3.3Å; F705-S710 WeakPolarHBondContact O-CB 3.41Å; A707-S710 WeakPolarHBondContact O-CB 2.86Å; A707-S710 PolarHBondContact O-N 2.84Å; A707-S710 VanDerWaalsContact O-N 3.08Å; S710-T713 WeakPolarHBondContact CA-OG1 3.34Å; S710-T713 PolarHBondContact O-OG1 3.24Å; S710-F714 VanDerWaalsContact O-CB 3.29Å; S710-F714 WeakPolarHBondContact O-CB 3.37Å; S710-F714 PolarHBondContact O-N 3.02Å
711	M	88.4	Confident	84.2	Confident	57 Å²	57	50.4 Å²	50.4	28%	0.281	27%	0.274	S	S	.	.	H	α-helix	trans	-64.8	-44.7	175.8	-73.3	-65.3	92.1	0	0	112.5	F705 A707 F714 V715	F705-M711 HydrophobicContact CD1-CE 3.55Å; F705-M711 HydrophobicContact CD2-CE 3.7Å; F705-M711 HydrophobicContact CE1-CE 3.28Å; F705-M711 HydrophobicContact CE1-SD 4.35Å; F705-M711 HydrophobicContact CE2-CE 3.44Å; F705-M711 VanDerWaalsContact CE2-CE 3.44Å; F705-M711 HydrophobicContact CG-CE 3.75Å; F705-M711 HydrophobicContact CZ-CE 3.23Å; F705-M711 WeakPolarHBondContact O-CE 3.23Å; A707-M711 PolarHBondContact O-N 3.46Å; M711-F714 PolarHBondContact O-N 3.31Å; M711-V715 WeakPolarHBondContact O-CG2 3.37Å; M711-V715 PolarHBondContact O-N 2.88Å
712	F	88.1	Confident	84.7	Confident	82 Å²	82	51.4 Å²	51.4	36%	0.36	28%	0.282	S	S	.	.	H	α-helix	trans	-62.7	-48.5	177.2	-179.8	-87.5	0	0	0	112	W206 T209 P708 F714 V715 V716	W206-F712 HydrophobicContact CH2-CB 4.17Å; W206-F712 HydrophobicContact CZ3-CB 3.94Å; W206-F712 HydrophobicContact CZ3-CD1 4.41Å; W206-F712 HydrophobicContact CZ3-CD2 4.29Å; W206-F712 AromaticContact CZ3-CG 3.96Å; W206-F712 HydrophobicContact CZ3-CG 3.96Å; T209-F712 HydrophobicContact CG2-CD1 3.23Å; T209-F712 HydrophobicContact CG2-CE1 3.62Å; T209-F712 HydrophobicContact CG2-CG 4.34Å; P708-F712 WeakPolarHBondContact O-CB 3.37Å; P708-F712 PolarHBondContact O-N 3.49Å; F712-F714 VanDerWaalsContact C-N 3.28Å; F712-F714 PolarHBondContact O-N 3.45Å; F712-V715 PolarHBondContact O-N 2.88Å; F712-V716 HydrophobicContact CD1-CG2 3.99Å; F712-V716 HydrophobicContact CE1-CG2 3.61Å; F712-V716 HydrophobicContact CE2-CG2 4.32Å; F712-V716 HydrophobicContact CZ-CG2 3.79Å; F712-V716 WeakPolarHBondContact O-CG2 3.42Å; F712-V716 PolarHBondContact O-N 3.29Å
713	T	86.8	Confident	85.1	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-39.5	176.9	48.7	0	0	0	0	112	T209 L696 T709 S710 L717	T209-T713 HydrophobicContact CG2-CG2 3.35Å; T209-T713 WeakPolarHBondContact OG1-CG2 3.37Å; L696-T713 WeakPolarHBondContact CD1-OG1 3.33Å; T709-T713 WeakPolarHBondContact O-CG2 3.28Å; T709-T713 PolarHBondContact O-N 3.43Å; T709-T713 PolarHBondContact O-OG1 3.1Å; S710-T713 WeakPolarHBondContact CA-OG1 3.34Å; S710-T713 PolarHBondContact O-OG1 3.24Å; T713-L717 VanDerWaalsContact O-CB 3.27Å; T713-L717 WeakPolarHBondContact O-CB 3.03Å; T713-L717 PolarHBondContact O-N 3.4Å
714	F	89.6	Confident	85.3	Confident	82 Å²	82	53.4 Å²	53.4	36%	0.36	30%	0.297	S	S	.	.	H	α-helix	trans	-62.6	-48.3	175.4	178.4	-107.6	0	0	0	112.3	L696 F705 S710 M711 F712 V716 L717 V718	L696-F714 HydrophobicContact CD1-CB 3.93Å; L696-F714 HydrophobicContact CD2-CB 4.32Å; L696-F714 HydrophobicContact CD2-CD2 3.93Å; F705-F714 HydrophobicContact CE2-CD2 4.34Å; F705-F714 HydrophobicContact CE2-CG 4.33Å; F705-F714 HydrophobicContact CZ-CD1 4.41Å; F705-F714 HydrophobicContact CZ-CG 4.42Å; S710-F714 VanDerWaalsContact O-CB 3.29Å; S710-F714 WeakPolarHBondContact O-CB 3.37Å; S710-F714 PolarHBondContact O-N 3.02Å; M711-F714 PolarHBondContact O-N 3.31Å; F712-F714 VanDerWaalsContact C-N 3.28Å; F712-F714 PolarHBondContact O-N 3.45Å; F714-V716 PolarHBondContact O-N 2.79Å; F714-L717 PolarHBondContact O-N 3.2Å; F714-V718 HydrophobicContact CD1-CG2 4.43Å; F714-V718 HydrophobicContact CD2-CG2 4.27Å; F714-V718 HydrophobicContact CE1-CG2 4.05Å; F714-V718 HydrophobicContact CE2-CG2 3.88Å; F714-V718 HydrophobicContact CZ-CG2 3.76Å; F714-V718 WeakPolarHBondContact O-CG2 3.49Å; F714-V718 PolarHBondContact O-N 2.97Å
715	V	90.5	Very high	85.3	Confident	76 Å²	76	56.5 Å²	56.5	46%	0.461	31%	0.305	S	S	.	.	H	α-helix	trans	-60.6	-46.4	178	170.9	0	0	0	0	110.9	M711 F712 L717 V718 I719	M711-V715 WeakPolarHBondContact O-CG2 3.37Å; M711-V715 PolarHBondContact O-N 2.88Å; F712-V715 PolarHBondContact O-N 2.88Å; V715-L717 VanDerWaalsContact C-N 3.34Å; V715-L717 PolarHBondContact O-N 3.31Å; V715-V718 PolarHBondContact O-N 3.13Å; V715-I719 HydrophobicContact CG1-CD1 3.68Å; V715-I719 HydrophobicContact CG1-CG1 4.37Å; V715-I719 WeakPolarHBondContact O-CB 3.41Å; V715-I719 VanDerWaalsContact O-CG1 3.29Å; V715-I719 WeakPolarHBondContact O-CG1 3.32Å; V715-I719 PolarHBondContact O-N 2.95Å
716	V	88.8	Confident	85.1	Confident	14 Å²	14	56.8 Å²	56.8	9%	0.085	31%	0.312	C	S	.	.	H	α-helix	trans	-60.4	-43.5	176.9	171.1	0	0	0	0	111.3	F213 L692 F712 F714 I719 T720	F213-V716 HydrophobicContact CD2-CG1 3.56Å; F213-V716 HydrophobicContact CE2-CG1 4.2Å; F213-V716 HydrophobicContact CG-CG1 4.38Å; L692-V716 HydrophobicContact CD1-CG1 4.13Å; L692-V716 HydrophobicContact CD2-CG1 4.33Å; F712-V716 HydrophobicContact CD1-CG2 3.99Å; F712-V716 HydrophobicContact CE1-CG2 3.61Å; F712-V716 HydrophobicContact CE2-CG2 4.32Å; F712-V716 HydrophobicContact CZ-CG2 3.79Å; F712-V716 WeakPolarHBondContact O-CG2 3.42Å; F712-V716 PolarHBondContact O-N 3.29Å; F714-V716 PolarHBondContact O-N 2.79Å; V716-I719 PolarHBondContact O-N 3.01Å; V716-T720 WeakPolarHBondContact O-CB 3.34Å; V716-T720 PolarHBondContact O-N 3.33Å; V716-T720 PolarHBondContact O-OG1 3.25Å
717	L	89.9	Confident	84.7	Confident	11 Å²	11	55.3 Å²	55.3	6%	0.058	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-46.1	177.7	-179.1	65.4	0	0	0	111.3	I689 L692 F693 L696 T713 F714 V715 T720 I721	I689-L717 HydrophobicContact CG2-CD1 3.89Å; L692-L717 HydrophobicContact CB-CD1 3.99Å; F693-L717 HydrophobicContact CB-CD2 4.28Å; F693-L717 HydrophobicContact CD2-CD2 4.29Å; L696-L717 HydrophobicContact CD2-CD2 3.76Å; T713-L717 VanDerWaalsContact O-CB 3.27Å; T713-L717 WeakPolarHBondContact O-CB 3.03Å; T713-L717 PolarHBondContact O-N 3.4Å; F714-L717 PolarHBondContact O-N 3.2Å; V715-L717 VanDerWaalsContact C-N 3.34Å; V715-L717 PolarHBondContact O-N 3.31Å; L717-T720 PolarHBondContact O-N 3.3Å; L717-I721 HydrophobicContact CD1-CD1 4.05Å; L717-I721 HydrophobicContact CD1-CG1 4.39Å; L717-I721 HydrophobicContact CG-CD1 3.9Å; L717-I721 WeakPolarHBondContact O-CB 3.37Å; L717-I721 VanDerWaalsContact O-CG1 3.28Å; L717-I721 WeakPolarHBondContact O-CG1 3.18Å; L717-I721 PolarHBondContact O-N 3.41Å
718	V	89.6	Confident	84	Confident	61 Å²	61	58.7 Å²	58.7	37%	0.37	32%	0.32	S	S	.	.	H	α-helix	trans	-62.2	-47.8	178	171.4	0	0	0	0	110.9	F714 V715 T720 I721 V722	F714-V718 HydrophobicContact CD1-CG2 4.43Å; F714-V718 HydrophobicContact CD2-CG2 4.27Å; F714-V718 HydrophobicContact CE1-CG2 4.05Å; F714-V718 HydrophobicContact CE2-CG2 3.88Å; F714-V718 HydrophobicContact CZ-CG2 3.76Å; F714-V718 WeakPolarHBondContact O-CG2 3.49Å; F714-V718 PolarHBondContact O-N 2.97Å; V715-V718 PolarHBondContact O-N 3.13Å; V718-T720 VanDerWaalsContact C-N 3.29Å; V718-T720 PolarHBondContact O-N 3.5Å; V718-I721 PolarHBondContact O-N 3.33Å; V718-V722 HydrophobicContact CG1-CG2 4.35Å; V718-V722 WeakPolarHBondContact O-CB 3.1Å; V718-V722 VanDerWaalsContact O-CG2 3.3Å; V718-V722 WeakPolarHBondContact O-CG2 3.17Å; V718-V722 PolarHBondContact O-N 3.17Å
719	I	88.4	Confident	82.9	Confident	91 Å²	91	57.4 Å²	57.4	47%	0.467	31%	0.312	S	S	.	.	H	α-helix	trans	-57.9	-44.7	176.6	-69.7	169.1	0	0	0	110.3	V715 V716 V722 I723	V715-I719 HydrophobicContact CG1-CD1 3.68Å; V715-I719 HydrophobicContact CG1-CG1 4.37Å; V715-I719 WeakPolarHBondContact O-CB 3.41Å; V715-I719 VanDerWaalsContact O-CG1 3.29Å; V715-I719 WeakPolarHBondContact O-CG1 3.32Å; V715-I719 PolarHBondContact O-N 2.95Å; V716-I719 PolarHBondContact O-N 3.01Å; I719-V722 PolarHBondContact O-N 3.26Å; I719-I723 HydrophobicContact CG2-CD1 3.69Å; I719-I723 HydrophobicContact CG2-CG1 4.35Å; I719-I723 WeakPolarHBondContact O-CB 3.25Å; I719-I723 VanDerWaalsContact O-CG1 3.27Å; I719-I723 WeakPolarHBondContact O-CG1 3.39Å; I719-I723 PolarHBondContact O-N 2.89Å
720	T	86.3	Confident	81.6	Confident	10 Å²	10	63.7 Å²	63.7	6%	0.061	34%	0.339	C	S	.	.	H	α-helix	trans	-64.1	-43.3	179.9	-55.6	0	0	0	0	111.7	L216 I689 V716 L717 V718 I723 C724	L216-T720 HydrophobicContact CD1-CG2 3.96Å; L216-T720 HydrophobicContact CD2-CG2 3.6Å; L216-T720 VanDerWaalsContact CD2-OG1 3.32Å; L216-T720 WeakPolarHBondContact CD2-OG1 3.47Å; L216-T720 HydrophobicContact CG-CG2 4.41Å; I689-T720 HydrophobicContact CD1-CG2 4.02Å; I689-T720 HydrophobicContact CG1-CG2 3.8Å; V716-T720 WeakPolarHBondContact O-CB 3.34Å; V716-T720 PolarHBondContact O-N 3.33Å; V716-T720 PolarHBondContact O-OG1 3.25Å; L717-T720 PolarHBondContact O-N 3.3Å; V718-T720 VanDerWaalsContact C-N 3.29Å; V718-T720 PolarHBondContact O-N 3.5Å; T720-I723 PolarHBondContact O-N 2.88Å; T720-C724 WeakPolarHBondContact O-CB 3.12Å; T720-C724 PolarHBondContact O-N 3.35Å; T720-C724 PolarHBondContact O-SG 3.27Å
721	I	86.5	Confident	80	Confident	71 Å²	71	65.3 Å²	65.3	36%	0.364	36%	0.356	S	S	.	.	H	α-helix	trans	-63.5	-44.2	176.1	-70.1	168.5	0	0	0	110.3	I689 L717 V718 C724 L725	I689-I721 HydrophobicContact CG2-CG1 4.44Å; L717-I721 HydrophobicContact CD1-CD1 4.05Å; L717-I721 HydrophobicContact CD1-CG1 4.39Å; L717-I721 HydrophobicContact CG-CD1 3.9Å; L717-I721 WeakPolarHBondContact O-CB 3.37Å; L717-I721 VanDerWaalsContact O-CG1 3.28Å; L717-I721 WeakPolarHBondContact O-CG1 3.18Å; L717-I721 PolarHBondContact O-N 3.41Å; V718-I721 PolarHBondContact O-N 3.33Å; I721-C724 PolarHBondContact O-N 2.72Å; I721-L725 HydrophobicContact CG2-CD1 3.8Å; I721-L725 HydrophobicContact CG2-CG 4.17Å; I721-L725 WeakPolarHBondContact O-CB 3.29Å; I721-L725 VanDerWaalsContact O-CG 3.29Å; I721-L725 WeakPolarHBondContact O-CG 3.03Å; I721-L725 PolarHBondContact O-N 2.03Å
722	V	85.7	Confident	78	Confident	74 Å²	74	69.1 Å²	69.1	45%	0.448	37%	0.373	S	S	.	.	H	α-helix	trans	-61.5	-45.9	176.4	171.6	0	0	0	0	110.5	V718 I719 C724 L725 C726	V718-V722 HydrophobicContact CG1-CG2 4.35Å; V718-V722 WeakPolarHBondContact O-CB 3.1Å; V718-V722 VanDerWaalsContact O-CG2 3.3Å; V718-V722 WeakPolarHBondContact O-CG2 3.17Å; V718-V722 PolarHBondContact O-N 3.17Å; I719-V722 PolarHBondContact O-N 3.26Å; V722-C724 VanDerWaalsContact C-N 3.32Å; V722-C724 PolarHBondContact O-N 2.9Å; V722-L725 PolarHBondContact O-N 3.5Å; V722-C726 VanDerWaalsContact O-CB 3.26Å; V722-C726 WeakPolarHBondContact O-CB 3.35Å; V722-C726 PolarHBondContact O-N 2.62Å; V722-C726 PolarHBondContact O-SG 3.25Å
723	I	82.1	Confident	75.6	Confident	105 Å²	105	71 Å²	71	54%	0.538	38%	0.381	S	S	.	.	H	α-helix	trans	-60.7	-41.9	175.8	-69.2	168.2	0	0	0	111	I719 T720 C726 H727	I719-I723 HydrophobicContact CG2-CD1 3.69Å; I719-I723 HydrophobicContact CG2-CG1 4.35Å; I719-I723 WeakPolarHBondContact O-CB 3.25Å; I719-I723 VanDerWaalsContact O-CG1 3.27Å; I719-I723 WeakPolarHBondContact O-CG1 3.39Å; I719-I723 PolarHBondContact O-N 2.89Å; T720-I723 PolarHBondContact O-N 2.88Å; I723-C726 PolarHBondContact O-N 2.79Å; I723-H727 WeakPolarHBondContact O-CB 3.32Å; I723-H727 PolarHBondContact O-N 3.2Å
724	C	77.3	Confident	73.4	Confident	37 Å²	37	76.2 Å²	76.2	25%	0.25	40%	0.403	C	S	.	.	H	α-helix	trans	-66.2	-44.4	177.4	-70	0	0	0	0	111.7	I689 T720 I721 V722 C726 H727 V728	I689-C724 VanDerWaalsContact CD1-SG 3.59Å; T720-C724 WeakPolarHBondContact O-CB 3.12Å; T720-C724 PolarHBondContact O-N 3.35Å; T720-C724 PolarHBondContact O-SG 3.27Å; I721-C724 PolarHBondContact O-N 2.72Å; V722-C724 VanDerWaalsContact C-N 3.32Å; V722-C724 PolarHBondContact O-N 2.9Å; C724-C726 VanDerWaalsContact C-N 3.34Å; C724-H727 PolarHBondContact O-N 3.5Å; C724-V728 WeakPolarHBondContact O-CB 3.32Å; C724-V728 VanDerWaalsContact O-CG2 3.24Å; C724-V728 WeakPolarHBondContact O-CG2 3.29Å; C724-V728 PolarHBondContact O-N 2.72Å
725	L	77.6	Confident	71	Confident	97 Å²	97	81.1 Å²	81.1	51%	0.508	42%	0.421	S	S	.	.	H	α-helix	trans	-64.1	-40.6	174.7	-72.1	174.9	0	0	0	110.8	I721 V722 V728 C729	I721-L725 HydrophobicContact CG2-CD1 3.8Å; I721-L725 HydrophobicContact CG2-CG 4.17Å; I721-L725 WeakPolarHBondContact O-CB 3.29Å; I721-L725 VanDerWaalsContact O-CG 3.29Å; I721-L725 WeakPolarHBondContact O-CG 3.03Å; I721-L725 PolarHBondContact O-N 2.03Å; V722-L725 PolarHBondContact O-N 3.5Å; L725-V728 PolarHBondContact O-N 3.03Å; L725-C729 WeakPolarHBondContact O-CA 3.35Å; L725-C729 WeakPolarHBondContact O-CB 3.41Å; L725-C729 PolarHBondContact O-N 3.35Å; L725-C729 PolarHBondContact O-SG 3.22Å
726	C	75.5	Confident	68.4	Low	50 Å²	50	83.8 Å²	83.8	34%	0.338	43%	0.432	S	S	.	.	H	α-helix	trans	-61.6	-46.1	172.2	-72.6	0	0	0	0	110.4	V722 I723 C724 V728 F730	V722-C726 VanDerWaalsContact O-CB 3.26Å; V722-C726 WeakPolarHBondContact O-CB 3.35Å; V722-C726 PolarHBondContact O-N 2.62Å; V722-C726 PolarHBondContact O-SG 3.25Å; I723-C726 PolarHBondContact O-N 2.79Å; C724-C726 VanDerWaalsContact C-N 3.34Å; C726-V728 PolarHBondContact O-N 3.11Å; C726-F730 HydrophobicContact CB-CD2 3.8Å; C726-F730 HydrophobicContact CB-CE2 4.11Å; C726-F730 VanDerWaalsContact O-CA 3.3Å; C726-F730 WeakPolarHBondContact O-CA 3.41Å; C726-F730 WeakPolarHBondContact O-CB 3.31Å; C726-F730 VanDerWaalsContact O-CD2 3.22Å; C726-F730 WeakPolarHBondContact O-CD2 3.35Å; C726-F730 PolarHBondContact O-N 3.4Å
727	H	71.4	Confident	65.7	Low	126 Å²	126	86.2 Å²	86.2	58%	0.583	45%	0.449	S	S	*	.	H	α-helix	trans	-66	-37.2	178.2	-172.1	-93.2	0	0	0	112.7	I723 C724 G731	I723-H727 WeakPolarHBondContact O-CB 3.32Å; I723-H727 PolarHBondContact O-N 3.2Å; C724-H727 PolarHBondContact O-N 3.5Å; H727-G731 WeakPolarHBondContact O-CA 3.2Å; H727-G731 PolarHBondContact O-N 3.03Å
728	V	68	Low	63.1	Low	86 Å²	86	89.6 Å²	89.6	52%	0.521	48%	0.479	S	S	.	.	H	α-helix	trans	-73.4	-51.6	177.6	172	0	0	0	0	110.5	C724 L725 C726 G731 H732	C724-V728 WeakPolarHBondContact O-CB 3.32Å; C724-V728 VanDerWaalsContact O-CG2 3.24Å; C724-V728 WeakPolarHBondContact O-CG2 3.29Å; C724-V728 PolarHBondContact O-N 2.72Å; L725-V728 PolarHBondContact O-N 3.03Å; C726-V728 PolarHBondContact O-N 3.11Å; V728-G731 PolarHBondContact O-N 3.45Å; V728-H732 WeakPolarHBondContact O-CB 3.15Å; V728-H732 PolarHBondContact O-N 3.42Å
729	C	60.9	Low	60.3	Low	62 Å²	62	94 Å²	94	42%	0.419	50%	0.495	S	S	.	.	H	α-helix	trans	-67.2	-53.6	179.3	-64	0	0	0	0	111.3	L725 G731 H732 F733	L725-C729 WeakPolarHBondContact O-CA 3.35Å; L725-C729 WeakPolarHBondContact O-CB 3.41Å; L725-C729 PolarHBondContact O-N 3.35Å; L725-C729 PolarHBondContact O-SG 3.22Å; C729-G731 VanDerWaalsContact C-N 3.27Å; C729-G731 PolarHBondContact O-N 2.81Å; C729-H732 CarbonylContact O-C 3.56Å; C729-H732 WeakPolarHBondContact O-CA 3.28Å; C729-H732 WeakPolarHBondContact O-CB 3.08Å; C729-H732 PolarHBondContact O-N 2.83Å; C729-H732 VanDerWaalsContact O-N 3.11Å; C729-F733 WeakPolarHBondContact O-CD2 3.33Å; C729-F733 PolarHBondContact O-N 2.99Å
730	F	57.4	Low	57.6	Low	144 Å²	144	94.7 Å²	94.7	63%	0.632	50%	0.5	S	S	*	.	H	α-helix	trans	-68	-24.9	174.5	-67.3	-74.6	0	0	0	112.5	C726 F733 K734	C726-F730 HydrophobicContact CB-CD2 3.8Å; C726-F730 HydrophobicContact CB-CE2 4.11Å; C726-F730 VanDerWaalsContact O-CA 3.3Å; C726-F730 WeakPolarHBondContact O-CA 3.41Å; C726-F730 WeakPolarHBondContact O-CB 3.31Å; C726-F730 VanDerWaalsContact O-CD2 3.22Å; C726-F730 WeakPolarHBondContact O-CD2 3.35Å; C726-F730 PolarHBondContact O-N 3.4Å; F730-F733 CarbonylContact O-C 3.23Å; F730-F733 PolarHBondContact O-N 3.36Å; F730-K734 WeakPolarHBondContact O-CA 3.44Å; F730-K734 WeakPolarHBondContact O-CB 3.18Å; F730-K734 PolarHBondContact O-N 3.17Å
731	G	51.9	Low	55.3	Low	35 Å²	35	100 Å²	100	36%	0.361	52%	0.52	S	S	.	.	H	α-helix	trans	-68.7	-37.4	168.1	0	0	0	0	0	112.4	H727 V728 C729 K734 Y735	H727-G731 WeakPolarHBondContact O-CA 3.2Å; H727-G731 PolarHBondContact O-N 3.03Å; V728-G731 PolarHBondContact O-N 3.45Å; C729-G731 VanDerWaalsContact C-N 3.27Å; C729-G731 PolarHBondContact O-N 2.81Å; G731-K734 WeakPolarHBondContact O-CB 3.43Å; G731-K734 PolarHBondContact O-N 3.17Å; G731-Y735 PolarHBondContact O-N 3.18Å
732	H	45.6	Very low	52.6	Low	137 Å²	137	106.3 Å²	106.3	63%	0.634	54%	0.544	S	S	*	.	H	α-helix	trans	-68.1	-34.9	169.9	-128.9	-79.1	0	0	0	111.9	V728 C729 Y735	V728-H732 WeakPolarHBondContact O-CB 3.15Å; V728-H732 PolarHBondContact O-N 3.42Å; C729-H732 CarbonylContact O-C 3.56Å; C729-H732 WeakPolarHBondContact O-CA 3.28Å; C729-H732 WeakPolarHBondContact O-CB 3.08Å; C729-H732 PolarHBondContact O-N 2.83Å; C729-H732 VanDerWaalsContact O-N 3.11Å; H732-Y735 WeakPolarHBondContact O-CB 3.05Å; H732-Y735 PolarHBondContact O-N 3.37Å
733	F	38.1	Very low	50.3	Low	122 Å²	122	106 Å²	106	54%	0.535	54%	0.539	S	S	.	.	H	α-helix	trans	-79	-17.1	169.9	-68.6	-69.3	0	0	0	112.7	C729 F730 Y735 L736 S737	C729-F733 WeakPolarHBondContact O-CD2 3.33Å; C729-F733 PolarHBondContact O-N 2.99Å; F730-F733 CarbonylContact O-C 3.23Å; F730-F733 PolarHBondContact O-N 3.36Å; F733-Y735 VanDerWaalsContact C-N 3.28Å; F733-L736 HydrophobicContact CD1-CD1 3.69Å; F733-L736 HydrophobicContact CE1-CD1 4.14Å; F733-L736 CarbonylContact O-C 3.39Å; F733-L736 VanDerWaalsContact O-C 3.3Å; F733-L736 WeakPolarHBondContact O-CA 3.38Å; F733-L736 WeakPolarHBondContact O-CB 3.42Å; F733-L736 PolarHBondContact O-N 2.94Å; F733-S737 WeakPolarHBondContact O-CB 3.23Å; F733-S737 PolarHBondContact O-N 3.25Å
734	K	39.5	Very low	47.7	Very low	110 Å²	110	109.7 Å²	109.7	48%	0.478	55%	0.554	S	S	.	*	H	α-helix	trans	-74.9	-22.8	171.1	-158.7	177.9	-176.3	-175.8	0	111.1	F730 G731 L736 S737	F730-K734 WeakPolarHBondContact O-CA 3.44Å; F730-K734 WeakPolarHBondContact O-CB 3.18Å; F730-K734 PolarHBondContact O-N 3.17Å; G731-K734 WeakPolarHBondContact O-CB 3.43Å; G731-K734 PolarHBondContact O-N 3.17Å; K734-L736 VanDerWaalsContact C-N 3.27Å; K734-S737 PolarHBondContact O-N 3.48Å; K734-S737 VanDerWaalsContact O-O 3.04Å
735	Y	40.2	Very low	45.6	Very low	185 Å²	185	115.6 Å²	115.6	73%	0.725	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-27.8	163	-176.2	-94.4	0	0	0	112	G731 H732 F733	G731-Y735 PolarHBondContact O-N 3.18Å; H732-Y735 WeakPolarHBondContact O-CB 3.05Å; H732-Y735 PolarHBondContact O-N 3.37Å; F733-Y735 VanDerWaalsContact C-N 3.28Å
736	L	36.4	Very low	43.4	Very low	132 Å²	132	117.4 Å²	117.4	69%	0.691	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-14.3	173	-70.8	159.8	0	0	0	113.3	F733 K734	F733-L736 HydrophobicContact CD1-CD1 3.69Å; F733-L736 HydrophobicContact CE1-CD1 4.14Å; F733-L736 CarbonylContact O-C 3.39Å; F733-L736 VanDerWaalsContact O-C 3.3Å; F733-L736 WeakPolarHBondContact O-CA 3.38Å; F733-L736 WeakPolarHBondContact O-CB 3.42Å; F733-L736 PolarHBondContact O-N 2.94Å; K734-L736 VanDerWaalsContact C-N 3.27Å
737	S	31.6	Very low	41.1	Very low	64 Å²	64	123.5 Å²	123.5	45%	0.448	62%	0.617	S	S	.	*	S	Bend	trans	-91.6	126.3	179.2	-169.9	0	0	0	0	109.5	F733 K734 H739	F733-S737 WeakPolarHBondContact O-CB 3.23Å; F733-S737 PolarHBondContact O-N 3.25Å; K734-S737 PolarHBondContact O-N 3.48Å; K734-S737 VanDerWaalsContact O-O 3.04Å; S737-H739 PolarHBondContact O-N 3.49Å
738	A	34.5	Very low	39.2	Very low	82 Å²	82	123.5 Å²	123.5	68%	0.678	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	19.6	-172.8	0	0	0	0	0	116.5
739	H	32.4	Very low	37.4	Very low	155 Å²	155	125.9 Å²	125.9	72%	0.718	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	10.9	-168.1	-108.3	75.6	0	0	0	115.9	S737	S737-H739 PolarHBondContact O-N 3.49Å
740	N	31.4	Very low	35.8	Very low	105 Å²	105	130.1 Å²	130.1	56%	0.561	66%	0.66	S	S	*	*			trans	-97.8	10.9	177.9	-105.5	4.5	0	0	0	115.6
741	Y	37.3	Very low	34.6	Very low	122 Å²	122	128.6 Å²	128.6	48%	0.478	66%	0.662	S	S	.	*			trans	-107.5	38.3	171	-65.7	-75.8	0	0	0	113	L376 Y411 I743	L376-Y741 WeakPolarHBondContact CD2-OH 3.04Å; Y411-Y741 AromaticContact CE2-CE1 3.96Å; Y411-Y741 HydrophobicContact CE2-CE1 3.96Å; Y741-I743 PolarHBondContact O-N 2.81Å
742	K	29.3	Very low	33.4	Very low	203 Å²	203	133.8 Å²	133.8	88%	0.883	68%	0.681	S	S	*	*			trans	-79.2	73.4	155.6	-141.9	176.7	-173.2	-176.9	0	107.3	E744	K742-E744 PolarHBondContact O-N 2.97Å
743	I	38.2	Very low	32.6	Very low	67 Å²	67	132.9 Å²	132.9	34%	0.344	69%	0.687	S	S	.	*			trans	-56.9	123.1	154.4	-63.1	163.1	0	0	0	103.7	Y741 H745	Y741-I743 PolarHBondContact O-N 2.81Å; I743-H745 PolarHBondContact O-N 3.47Å
744	E	27.5	Very low	32.2	Very low	182 Å²	182	138.6 Å²	138.6	85%	0.85	71%	0.705	S	S	*	*			trans	-57.9	100.1	163.8	-112.4	173.1	176.2	0	0	105.6	K742 T746	K742-E744 PolarHBondContact O-N 2.97Å; E744-T746 VanDerWaalsContact C-N 3.32Å; E744-T746 PolarHBondContact O-N 2.86Å
745	H	33.8	Very low	31.6	Very low	161 Å²	161	139.1 Å²	139.1	75%	0.745	72%	0.723	S	S	*	*			trans	-55.7	108.3	160.3	-73.8	-81.5	0	0	0	104.6	I743 E747	I743-H745 PolarHBondContact O-N 3.47Å; H745-E747 VanDerWaalsContact C-N 3.29Å; H745-E747 PolarHBondContact O-N 3.15Å
746	T	29.8	Very low	31.1	Very low	135 Å²	135	138.3 Å²	138.3	83%	0.828	73%	0.731	S	S	*	*			trans	-58.5	110.2	156.8	-53.9	0	0	0	0	103.8	E744 T748	E744-T746 VanDerWaalsContact C-N 3.32Å; E744-T746 PolarHBondContact O-N 2.86Å; T746-T748 PolarHBondContact O-N 3.15Å
747	E	28.4	Very low	31	Very low	179 Å²	179	135.6 Å²	135.6	84%	0.836	74%	0.735	S	S	*	*			trans	-47.6	117.5	176.5	-69.8	175.2	156.6	0	0	107.7	H745 D749	H745-E747 VanDerWaalsContact C-N 3.29Å; H745-E747 PolarHBondContact O-N 3.15Å; E747-D749 PolarHBondContact O-N 3.49Å
748	T	30.8	Very low	30.6	Very low	125 Å²	125	144 Å²	144	77%	0.767	76%	0.757	S	S	*	*			trans	-49.1	119.4	160.4	35.5	0	0	0	0	108.9	T746 T750	T746-T748 PolarHBondContact O-N 3.15Å; T748-T750 PolarHBondContact O-N 2.95Å
749	D	30.6	Very low	30.2	Very low	137 Å²	137	145.8 Å²	145.8	73%	0.733	76%	0.762	S	S	*	*			trans	33	89.7	135.1	-68.5	-28.8	0	0	0	116.2	E747 V751	E747-D749 PolarHBondContact O-N 3.49Å; D749-V751 HydrophobicContact CB-CG2 3.91Å; D749-V751 PolarHBondContact O-N 3.05Å
750	T	26.9	Very low	29.8	Very low	151 Å²	151	144.4 Å²	144.4	93%	0.926	77%	0.769	S	S	*	*			trans	-85.9	76.5	141	40.6	0	0	0	0	107.5	T748 D752	T748-T750 PolarHBondContact O-N 2.95Å; T750-D752 PolarHBondContact O-N 3.34Å
751	V	32.5	Very low	29.4	Very low	111 Å²	111	145.9 Å²	145.9	67%	0.673	78%	0.782	S	S	*	*			trans	-72.1	118.9	166.8	169.2	0	0	0	0	107.8	D749	D749-V751 HydrophobicContact CB-CG2 3.91Å; D749-V751 PolarHBondContact O-N 3.05Å
752	D	26.3	Very low	28.9	Very low	145 Å²	145	144.4 Å²	144.4	78%	0.775	80%	0.795	S	S	*	*			trans	-47.3	129.7	165.1	-113	-34.5	0	0	0	110.5	T750 R754	T750-D752 PolarHBondContact O-N 3.34Å; D752-R754 VanDerWaalsContact C-N 3.32Å; D752-R754 PolarHBondContact O-N 3.44Å
753	P	29	Very low	28.8	Very low	117 Å²	117	139.2 Å²	139.2	76%	0.76	79%	0.79	S	S	*	*	S	Bend	trans	-80.8	79.2	-177	32.8	-32.4	0	0	0	109.6
754	R	30.6	Very low	28.2	Very low	243 Å²	243	140.5 Å²	140.5	92%	0.917	81%	0.811	S	S	*	*			trans	-168.4	76.6	167	-108.4	162.3	-168.6	-174	4.4	113.7	D752	D752-R754 VanDerWaalsContact C-N 3.32Å; D752-R754 PolarHBondContact O-N 3.44Å
755	S	26.5	Very low	28.4	Very low	120 Å²	120	135.7 Å²	135.7	84%	0.839	79%	0.794	S	S	*	*			trans	-169.9	115.1	141.7	56.9	0	0	0	0	112.7
756	N	28.8	Very low	28.4	Very low	169 Å²	169	132 Å²	132	90%	0.904	78%	0.784	S	S	*	*			trans	-14.2	123.6	165.7	-64.5	-18.5	0	0	0	119.9
757	G	35.1	Very low	28.8	Very low	75 Å²	75	134 Å²	134	77%	0.773	78%	0.781	S	S	*	*				66.8	81.4	115.6	0	0	0	0	0	119.5
758	R	24.1	Very low	29.6	Very low	241 Å²	241	127.8 Å²	127.8	91%	0.909	76%	0.758	S	S	*	*			trans	-164.7	139.5	143.2	-110.3	172.9	-177.9	-178.2	-0.5	109.5
759	P	25.5	Very low	30.7	Very low	119 Å²	119	123.9 Å²	123.9	77%	0.773	74%	0.738	S	S	*	*			trans	-67.6	138.4	178.2	27.3	-31.5	0	0	0	110.5	T761	P759-T761 PolarHBondContact O-N 3.08Å; P759-T761 VanDerWaalsContact O-N 3.13Å
760	S	22.8	Very low	32.4	Very low	125 Å²	125	121 Å²	121	87%	0.874	72%	0.719	S	S	*	*			trans	-58.9	110.9	-179.6	-45.8	0	0	0	0	111	A762	S760-A762 PolarHBondContact O-N 3.21Å
761	T	24.1	Very low	35.2	Very low	136 Å²	136	114 Å²	114	83%	0.834	68%	0.676	S	S	*	*			trans	-61.8	128	166.9	1.8	0	0	0	0	108.5	P759 A763	P759-T761 PolarHBondContact O-N 3.08Å; P759-T761 VanDerWaalsContact O-N 3.13Å; T761-A763 PolarHBondContact O-N 3.26Å
762	A	26.6	Very low	37.6	Very low	92 Å²	92	110.2 Å²	110.2	76%	0.76	65%	0.651	S	S	*	*			trans	-47.7	128.5	173.9	0	0	0	0	0	110	S760 A764	S760-A762 PolarHBondContact O-N 3.21Å; A762-A764 PolarHBondContact O-N 3.11Å
763	A	26.6	Very low	40.3	Very low	93 Å²	93	103.4 Å²	103.4	77%	0.769	62%	0.615	S	S	*	*			trans	-53.6	113.1	173.2	0	0	0	0	0	108.5	T761 V765	T761-A763 PolarHBondContact O-N 3.26Å; A763-V765 PolarHBondContact O-N 3.4Å; A763-V765 VanDerWaalsContact O-N 3.16Å
764	A	25.1	Very low	42.7	Very low	94 Å²	94	102.8 Å²	102.8	78%	0.777	60%	0.602	S	S	*	*			trans	-56.1	121.4	174.5	0	0	0	0	0	108	A762 P766	A762-A764 PolarHBondContact O-N 3.11Å; A764-P766 VanDerWaalsContact O-CD 3.24Å; A764-P766 WeakPolarHBondContact O-CD 3.45Å
765	V	32.7	Very low	45.1	Very low	81 Å²	81	91.5 Å²	91.5	49%	0.491	56%	0.56	S	S	.	*			trans	-64.6	114.1	170.3	176.7	0	0	0	0	106	A763 K767	A763-V765 PolarHBondContact O-N 3.4Å; A763-V765 VanDerWaalsContact O-N 3.16Å; V765-K767 PolarHBondContact O-N 3.39Å
766	P	33.4	Very low	47.7	Very low	83 Å²	83	87.3 Å²	87.3	54%	0.539	53%	0.528	S	S	.	.			trans	-61.3	130.5	172.2	20.9	-23	0	0	0	106.7	A764 S768	A764-P766 VanDerWaalsContact O-CD 3.24Å; A764-P766 WeakPolarHBondContact O-CD 3.45Å; P766-S768 VanDerWaalsContact C-N 3.28Å; P766-S768 VanDerWaalsContact O-CA 3.3Å; P766-S768 WeakPolarHBondContact O-CA 3.49Å; P766-S768 WeakPolarHBondContact O-CB 3.33Å; P766-S768 PolarHBondContact O-N 2.97Å
767	K	37.8	Very low	49.7	Very low	177 Å²	177	82.5 Å²	82.5	77%	0.77	50%	0.5	S	S	*	.			trans	-56.2	96.3	176.9	-79.5	179.3	179.4	174.3	0	107.8	V765	V765-K767 PolarHBondContact O-N 3.39Å
768	S	46.3	Very low	50.7	Low	50 Å²	50	82.5 Å²	82.5	35%	0.35	48%	0.482	S	S	.	.			trans	-78.1	154.3	-154.1	58.5	0	0	0	0	112	P766 K770	P766-S768 VanDerWaalsContact C-N 3.28Å; P766-S768 VanDerWaalsContact O-CA 3.3Å; P766-S768 WeakPolarHBondContact O-CA 3.49Å; P766-S768 WeakPolarHBondContact O-CB 3.33Å; P766-S768 PolarHBondContact O-N 2.97Å; S768-K770 PolarHBondContact O-N 3.31Å
769	A	52.8	Low	51.5	Low	42 Å²	42	72.9 Å²	72.9	35%	0.347	45%	0.452	S	S	.	.			trans	-46.6	112.2	158.8	0	0	0	0	0	109.6	L237	L237-A769 HydrophobicContact CD2-CB 3.9Å; L237-A769 WeakPolarHBondContact CD2-O 3.41Å
770	K	68.1	Low	52	Low	76 Å²	76	72.7 Å²	72.7	33%	0.33	44%	0.441	S	S	.	.			trans	-85.8	138.8	-174.7	-78.7	164	163.1	-175.4	0	110	S768 I772 E780	S768-K770 PolarHBondContact O-N 3.31Å; K770-I772 HydrophobicContact CB-CG2 3.75Å; K770-I772 PolarHBondContact O-N 3.38Å; K770-E780 IonicContact NZ-OE2 3.89Å; K770-E780 PolarHBondContact NZ-OE2 3.35Å
771	Y	84	Confident	52.4	Low	6 Å²	6	72.7 Å²	72.7	2%	0.024	44%	0.435	C	S	.	.	S	Bend	trans	-73.8	68.5	172.9	-83.2	-84.9	0	0	0	111.5	L237 T241 R273 F363 A412 P413 P415 I418	L237-Y771 HydrophobicContact CD1-CE2 4.36Å; L237-Y771 HydrophobicContact CD2-CE2 4.07Å; L237-Y771 HydrophobicContact CG-CE2 3.96Å; T241-Y771 HydrophobicContact CG2-CD2 3.7Å; T241-Y771 HydrophobicContact CG2-CE2 3.52Å; T241-Y771 HydrophobicContact CG2-CG 4.36Å; T241-Y771 WeakPolarHBondContact OG1-CE2 3.2Å; R273-Y771 WeakPolarHBondContact CD-O 3.44Å; F363-Y771 HydrophobicContact CB-CD1 4.3Å; F363-Y771 HydrophobicContact CB-CG 3.97Å; F363-Y771 AromaticContact CD1-CD1 3.48Å; F363-Y771 HydrophobicContact CD1-CD1 3.48Å; F363-Y771 VanDerWaalsContact CD1-CD1 3.48Å; F363-Y771 AromaticContact CD1-CE1 3.87Å; F363-Y771 HydrophobicContact CD1-CE1 3.87Å; F363-Y771 HydrophobicContact CD1-CG 4.01Å; F363-Y771 HydrophobicContact CD2-CD1 4.19Å; F363-Y771 HydrophobicContact CD2-CG 4.47Å; F363-Y771 AromaticContact CE1-CD1 3.76Å; F363-Y771 HydrophobicContact CE1-CD1 3.76Å; F363-Y771 AromaticContact CE1-CE1 3.96Å; F363-Y771 HydrophobicContact CE1-CE1 3.96Å; F363-Y771 HydrophobicContact CE2-CD1 4.43Å; F363-Y771 AromaticContact CG-CD1 3.73Å; F363-Y771 HydrophobicContact CG-CD1 3.73Å; F363-Y771 AromaticContact CG-CG 3.9Å; F363-Y771 HydrophobicContact CG-CG 3.9Å; F363-Y771 HydrophobicContact CZ-CD1 4.24Å; A412-Y771 HydrophobicContact CB-CE1 3.76Å; A412-Y771 HydrophobicContact CB-CE2 4.42Å; A412-Y771 WeakPolarHBondContact CB-OH 3.35Å; P413-Y771 WeakPolarHBondContact O-CE1 3.32Å; P413-Y771 VanDerWaalsContact O-CZ 3.32Å; P413-Y771 PolarHBondContact O-OH 3.04Å; P415-Y771 HydrophobicContact CG-CD1 4.06Å; P415-Y771 HydrophobicContact CG-CD2 4.35Å; P415-Y771 HydrophobicContact CG-CE1 3.78Å; P415-Y771 HydrophobicContact CG-CE2 4.1Å; P415-Y771 HydrophobicContact CG-CG 4.34Å; I418-Y771 HydrophobicContact CD1-CD1 4Å; I418-Y771 HydrophobicContact CD1-CE1 3.99Å
772	I	84.6	Confident	52.6	Low	31 Å²	31	73.2 Å²	73.2	16%	0.159	43%	0.433	C	S	.	.	S	Bend	trans	-148.9	148.2	-179.2	-172.3	166.2	0	0	0	109.9	K770 L776 Q777	K770-I772 HydrophobicContact CB-CG2 3.75Å; K770-I772 PolarHBondContact O-N 3.38Å; I772-L776 HydrophobicContact CD1-CB 3.67Å; I772-L776 HydrophobicContact CD1-CD1 4.47Å; I772-L776 HydrophobicContact CG1-CB 3.77Å; I772-L776 HydrophobicContact CG1-CD1 4.23Å; I772-Q777 HydrophobicContact CB-CG 4.49Å; I772-Q777 HydrophobicContact CG2-CG 3.25Å
773	A	80.9	Confident	52.6	Low	2 Å²	2	71.5 Å²	71.5	2%	0.017	42%	0.424	C	S	.	.			trans	-64.7	138.6	172.8	0	0	0	0	0	110.5	V278 W420 V775 L776 Q777	V278-A773 HydrophobicContact CB-CB 4.49Å; V278-A773 HydrophobicContact CG1-CB 4.39Å; V278-A773 HydrophobicContact CG2-CB 3.98Å; W420-A773 HydrophobicContact CB-CB 4.32Å; W420-A773 HydrophobicContact CD2-CB 4.07Å; W420-A773 HydrophobicContact CE3-CB 4.25Å; W420-A773 HydrophobicContact CG-CB 4.1Å; A773-V775 HydrophobicContact CB-CG2 4.11Å; A773-V775 PolarHBondContact O-N 3.49Å; A773-L776 PolarHBondContact O-N 2.98Å; A773-Q777 PolarHBondContact O-N 2.96Å
774	Q	79.8	Confident	52.6	Low	104 Å²	104	75.4 Å²	75.4	49%	0.486	43%	0.432	S	S	.	.	H	α-helix	trans	-51.8	-42	-179	-71.8	179.1	-13.3	0	0	112.5	L776 Q777 D778	Q774-L776 PolarHBondContact O-N 2.95Å; Q774-Q777 WeakPolarHBondContact O-CB 3.34Å; Q774-Q777 PolarHBondContact O-N 3.47Å; Q774-D778 PolarHBondContact O-N 2.84Å
775	V	81	Confident	52.8	Low	6 Å²	6	74.5 Å²	74.5	4%	0.036	43%	0.432	C	S	.	.	H	α-helix	trans	-60.9	-15.3	178.8	-64.5	0	0	0	0	115.1	V278 L281 M282 D285 Y347 A773	V278-V775 HydrophobicContact CB-CG2 4.46Å; L281-V775 HydrophobicContact CD2-CB 4.15Å; L281-V775 HydrophobicContact CD2-CG2 3.82Å; L281-V775 HydrophobicContact CG-CB 4.41Å; L281-V775 HydrophobicContact CG-CG2 4.24Å; M282-V775 HydrophobicContact CG-CG1 4.03Å; M282-V775 HydrophobicContact CG-CG2 3.74Å; D285-V775 HydrophobicContact CB-CG1 3.75Å; Y347-V775 PolarHBondContact OH-O 3.26Å; A773-V775 HydrophobicContact CB-CG2 4.11Å; A773-V775 PolarHBondContact O-N 3.49Å
776	L	80.9	Confident	52.4	Low	32 Å²	32	79 Å²	79	17%	0.168	45%	0.453	C	S	.	.	H	α-helix	trans	-100.2	-19.4	174.2	-59.9	177.5	0	0	0	112.3	V278 L281 V354 I772 A773 Q774 S779	V278-L776 HydrophobicContact CG1-CD1 3.69Å; V278-L776 HydrophobicContact CG1-CG 4.14Å; L281-L776 HydrophobicContact CD2-CD2 4.01Å; V354-L776 HydrophobicContact CG1-CD2 4.31Å; I772-L776 HydrophobicContact CD1-CB 3.67Å; I772-L776 HydrophobicContact CD1-CD1 4.47Å; I772-L776 HydrophobicContact CG1-CB 3.77Å; I772-L776 HydrophobicContact CG1-CD1 4.23Å; A773-L776 PolarHBondContact O-N 2.98Å; Q774-L776 PolarHBondContact O-N 2.95Å; L776-S779 WeakPolarHBondContact O-CB 3.41Å; L776-S779 PolarHBondContact O-OG 3.44Å
777	Q	72.3	Confident	52.1	Low	68 Å²	68	78.8 Å²	78.8	32%	0.318	47%	0.466	S	S	.	.	H	α-helix	trans	-69.3	-40.7	176.5	-67.3	178.8	-7.4	0	0	112.1	I772 A773 Q774 S779 E780	I772-Q777 HydrophobicContact CB-CG 4.49Å; I772-Q777 HydrophobicContact CG2-CG 3.25Å; A773-Q777 PolarHBondContact O-N 2.96Å; Q774-Q777 WeakPolarHBondContact O-CB 3.34Å; Q774-Q777 PolarHBondContact O-N 3.47Å; Q777-S779 PolarHBondContact O-N 2.85Å; Q777-E780 PolarHBondContact O-N 3.15Å
778	D	55.2	Low	51.4	Low	74 Å²	74	75 Å²	75	40%	0.396	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-10.5	179.3	-59.1	-15.6	0	0	0	112.8	Q774	Q774-D778 PolarHBondContact O-N 2.84Å
779	S	41	Very low	50.9	Low	39 Å²	39	78.7 Å²	78.7	27%	0.273	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-23.3	178	-26.9	0	0	0	0	114.4	K351 L776 Q777 V781	K351-S779 WeakPolarHBondContact CE-OG 3.44Å; K351-S779 PolarHBondContact NZ-OG 3.16Å; L776-S779 WeakPolarHBondContact O-CB 3.41Å; L776-S779 PolarHBondContact O-OG 3.44Å; Q777-S779 PolarHBondContact O-N 2.85Å; S779-V781 VanDerWaalsContact C-N 3.28Å
780	E	35.7	Very low	49.4	Very low	115 Å²	115	80.3 Å²	80.3	54%	0.537	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-14.2	-176.7	-75.7	179.4	-174.4	0	0	112	R273 K770 Q777	R273-E780 IonicContact NH2-OE1 3.04Å; K770-E780 IonicContact NZ-OE2 3.89Å; K770-E780 PolarHBondContact NZ-OE2 3.35Å; Q777-E780 PolarHBondContact O-N 3.15Å
781	V	31.4	Very low	47.3	Very low	126 Å²	126	82 Å²	82	76%	0.764	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-28.9	-178.6	-176.2	0	0	0	0	112.3	S779	S779-V781 VanDerWaalsContact C-N 3.28Å
782	D	29	Very low	44.4	Very low	147 Å²	147	87.1 Å²	87.1	79%	0.786	57%	0.569	S	S	*	*	S	Bend	trans	-91.6	7.9	-178.6	-71.3	-22.2	0	0	0	114
783	G	26.2	Very low	41.5	Very low	55 Å²	55	89.4 Å²	89.4	57%	0.567	60%	0.601	S	S	*	*			trans	-100.7	-11.7	-160.1	0	0	0	0	0	118.6
784	D	26.8	Very low	38.7	Very low	176 Å²	176	97.1 Å²	97.1	94%	0.941	64%	0.641	S	S	*	*	S	Bend	trans	-116.6	88.7	-178	-98.5	-7.3	0	0	0	110.7
785	G	28.8	Very low	36.1	Very low	75 Å²	75	101 Å²	101	77%	0.773	66%	0.66	S	S	*	*			trans	-178.4	45.6	177.9	0	0	0	0	0	113.6
786	D	25.5	Very low	33.5	Very low	175 Å²	175	105.9 Å²	105.9	94%	0.936	69%	0.691	S	S	*	*			trans	-126.5	105	171.9	-125.4	-1.6	0	0	0	110.6
787	G	26	Very low	30.9	Very low	78 Å²	78	110.6 Å²	110.6	80%	0.804	72%	0.724	S	S	*	*			trans	-148.8	99.3	172.7	0	0	0	0	0	109.7
788	A	23.3	Very low	28.5	Very low	97 Å²	97	113 Å²	113	80%	0.802	75%	0.749	S	S	*	*			trans	-84.4	178.9	175.6	0	0	0	0	0	112.2
789	P	34.6	Very low	26.9	Very low	129 Å²	129	115.1 Å²	115.1	84%	0.838	77%	0.769	S	S	*	*				-127.5	160.6	-54.2	34.8	-20	0	0	0	112.2
790	G	23.3	Very low	26	Very low	75 Å²	75	119.1 Å²	119.1	77%	0.773	80%	0.797	S	S	*	*			trans	-158.4	101	174.7	0	0	0	0	0	115.3
791	S	22.7	Very low	25.5	Very low	111 Å²	111	118.3 Å²	118.3	78%	0.776	80%	0.804	S	S	*	*			trans	38.5	127.3	141	-174.2	0	0	0	0	122.6
792	S	23.1	Very low	25.1	Very low	114 Å²	114	121.2 Å²	121.2	80%	0.797	81%	0.809	S	S	*	*			trans	78.7	124.6	138.3	60.7	0	0	0	0	121.6
793	G	24.1	Very low	24.9	Very low	80 Å²	80	120.8 Å²	120.8	83%	0.825	81%	0.807	S	S	*	*			trans	147.5	105.1	149.9	0	0	0	0	0	114.8
794	D	22.7	Very low	24.8	Very low	163 Å²	163	126.3 Å²	126.3	87%	0.872	82%	0.818	S	S	*	*			trans	-69.4	158.8	177.9	-73.9	-57.8	0	0	0	115.3
795	E	24.4	Very low	24.7	Very low	186 Å²	186	126.5 Å²	126.5	87%	0.869	81%	0.813	S	S	*	*			trans	94.5	153.2	146.3	-94.3	-165.6	-178.3	0	0	121.9
796	P	25.8	Very low	24.5	Very low	109 Å²	109	130 Å²	130	71%	0.708	81%	0.813	S	S	*	*				-121.9	-171.4	-111.4	45.8	-30.2	0	0	0	114.1
797	P	26.6	Very low	24.3	Very low	130 Å²	130	128.4 Å²	128.4	84%	0.844	80%	0.804	S	S	*	*			trans	-89.6	148.3	-156	36.4	-32.9	0	0	0	113.9
798	S	22	Very low	24.2	Very low	120 Å²	120	132.7 Å²	132.7	84%	0.839	81%	0.805	S	S	*	*			trans	-117.3	125.1	167.6	56.8	0	0	0	0	111.4
799	S	22.2	Very low	24.7	Very low	117 Å²	117	132.7 Å²	132.7	82%	0.818	80%	0.797	S	S	*	*			trans	-66.2	144.7	168.7	50.7	0	0	0	0	112.4
800	S	22.6	Very low	24.5	Very low	123 Å²	123	132 Å²	132	86%	0.86	79%	0.792	S	S	*	*			trans	-157.5	124.4	139.8	49.9	0	0	0	0	112.1
801	S	23.5	Very low	24.6	Very low	98 Å²	98	136.1 Å²	136.1	69%	0.685	80%	0.797	S	S	*	*			trans	-84.9	151.2	166.3	46.4	0	0	0	0	110.9
802	Q	24	Very low	25.1	Very low	187 Å²	187	134.4 Å²	134.4	87%	0.874	80%	0.797	S	S	*	*			trans	-172.2	105.2	150.7	-101.3	164.3	15.4	0	0	105.3
803	D	23.9	Very low	25.2	Very low	139 Å²	139	136 Å²	136	74%	0.743	80%	0.795	S	S	*	*				54	135.7	73.7	-61.8	-22	0	0	0	111.6
804	E	25.6	Very low	25.5	Very low	171 Å²	171	137 Å²	137	80%	0.799	79%	0.786	S	S	*	*			cis	-177.3	159.9	1.1	-120.7	-163.3	144.6	0	0	105.9
805	E	24.3	Very low	25.8	Very low	180 Å²	180	136 Å²	136	84%	0.841	78%	0.781	S	S	*	*			trans	148.3	136.8	148.2	-90	-163.9	138.5	0	0	110.5
806	L	23.7	Very low	26.1	Very low	147 Å²	147	131.5 Å²	131.5	77%	0.77	77%	0.765	S	S	*	*			cis	-163.2	162.1	-2.1	-160.1	89.3	0	0	0	108.1
807	L	22.6	Very low	26.3	Very low	143 Å²	143	130 Å²	130	75%	0.749	75%	0.751	S	S	*	*			trans	-77.1	150.7	-163.1	-84.9	105	0	0	0	120.3
808	M	23.6	Very low	26.8	Very low	167 Å²	167	128.9 Å²	128.9	82%	0.823	73%	0.734	S	S	*	*			trans	99.2	149	130.4	-74.4	-93.1	-80.1	0	0	123.2
809	P	32.9	Very low	27.4	Very low	98 Å²	98	128.4 Å²	128.4	64%	0.636	72%	0.718	S	S	*	*			trans	-109.2	-177.8	-148.1	45.6	-37.4	0	0	0	114
810	P	31.3	Very low	27.7	Very low	113 Å²	113	126.5 Å²	126.5	73%	0.734	71%	0.705	S	S	*	*				-148.9	151.7	90.4	35.5	-15.7	0	0	0	117.3
811	D	25.7	Very low	28.1	Very low	163 Å²	163	123.8 Å²	123.8	87%	0.872	69%	0.685	S	S	*	*			trans	48.4	120.4	140.6	-63.2	-24.1	0	0	0	123
812	G	31.7	Very low	28.7	Very low	75 Å²	75	122.8 Å²	122.8	77%	0.773	67%	0.67	S	S	*	*			trans	115.6	73	151.7	0	0	0	0	0	114.7
813	L	26.7	Very low	29	Very low	146 Å²	146	118.9 Å²	118.9	76%	0.764	66%	0.655	S	S	*	*			trans	-110.7	115.9	-178.6	-68.8	158.3	0	0	0	111.3	D817	L813-D817 HydrophobicContact CD2-CB 3.88Å; L813-D817 WeakPolarHBondContact CD2-OD2 3.28Å
814	T	28.7	Very low	29.2	Very low	102 Å²	102	115 Å²	115	63%	0.626	64%	0.638	S	S	*	*			trans	-83.4	164.9	167.5	42.7	0	0	0	0	110.7	T816 D817	T814-T816 PolarHBondContact O-N 2.99Å; T814-T816 PolarHBondContact O-OG1 3.08Å; T814-T816 PolarHBondContact OG1-OG1 2.87Å; T814-T816 VanDerWaalsContact OG1-OG1 3.11Å; T814-D817 PolarHBondContact O-N 3.35Å
815	D	30.6	Very low	29.6	Very low	143 Å²	143	111.7 Å²	111.7	77%	0.765	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.1	-8	-177.8	-81.8	-38.1	0	0	0	116.5
816	T	31	Very low	30.1	Very low	90 Å²	90	106 Å²	106	55%	0.552	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-31.4	179.3	41.5	0	0	0	0	114.2	T814 F818 Q819	T814-T816 PolarHBondContact O-N 2.99Å; T814-T816 PolarHBondContact O-OG1 3.08Å; T814-T816 PolarHBondContact OG1-OG1 2.87Å; T814-T816 VanDerWaalsContact OG1-OG1 3.11Å; T816-F818 VanDerWaalsContact C-N 3.29Å; T816-F818 PolarHBondContact O-N 2.72Å; T816-Q819 PolarHBondContact O-N 3.13Å
817	D	29.7	Very low	30.3	Very low	77 Å²	77	105.7 Å²	105.7	41%	0.412	60%	0.595	S	S	.	*	H	α-helix	trans	-81.2	-10.8	-176.3	-61.3	-65.9	0	0	0	113.5	L813 T814 Q819 S820	L813-D817 HydrophobicContact CD2-CB 3.88Å; L813-D817 WeakPolarHBondContact CD2-OD2 3.28Å; T814-D817 PolarHBondContact O-N 3.35Å; D817-Q819 VanDerWaalsContact C-N 3.27Å; D817-Q819 PolarHBondContact O-N 3.41Å; D817-S820 PolarHBondContact O-OG 2.79Å
818	F	37.3	Very low	30.6	Very low	108 Å²	108	104.9 Å²	104.9	47%	0.474	59%	0.591	S	S	.	*	H	α-helix	trans	-71.3	-20.3	172.6	-84.9	-92.1	0	0	0	113.6	T816	T816-F818 VanDerWaalsContact C-N 3.29Å; T816-F818 PolarHBondContact O-N 2.72Å
819	Q	33.5	Very low	30.9	Very low	110 Å²	110	104 Å²	104	51%	0.514	59%	0.585	S	S	.	*	H	α-helix	trans	-76.1	-34.5	178.5	-128.7	152.2	-10.5	0	0	111.6	T816 D817 C821 E822 D823	T816-Q819 PolarHBondContact O-N 3.13Å; D817-Q819 VanDerWaalsContact C-N 3.27Å; D817-Q819 PolarHBondContact O-N 3.41Å; Q819-C821 VanDerWaalsContact C-N 3.28Å; Q819-C821 PolarHBondContact O-N 3.48Å; Q819-E822 WeakPolarHBondContact O-CB 3.05Å; Q819-E822 PolarHBondContact O-N 2.98Å; Q819-E822 VanDerWaalsContact O-N 3.11Å; Q819-D823 PolarHBondContact O-N 3.43Å; Q819-D823 VanDerWaalsContact O-N 3.15Å
820	S	28.7	Very low	30.8	Very low	77 Å²	77	105.1 Å²	105.1	54%	0.538	58%	0.584	S	S	.	*	H	α-helix	trans	-63.9	-31.8	176.8	75.3	0	0	0	0	113.3	D817 E822 D823 S824	D817-S820 PolarHBondContact O-OG 2.79Å; S820-E822 VanDerWaalsContact C-N 3.34Å; S820-D823 PolarHBondContact O-N 3.36Å; S820-S824 PolarHBondContact O-N 2.98Å
821	C	31.7	Very low	30.5	Very low	66 Å²	66	107.8 Å²	107.8	45%	0.446	59%	0.587	S	S	.	*	H	α-helix	trans	-76.9	-23.9	178	-153.8	0	0	0	0	111.9	Q819 S824 L825	Q819-C821 VanDerWaalsContact C-N 3.28Å; Q819-C821 PolarHBondContact O-N 3.48Å; C821-S824 PolarHBondContact O-OG 3.48Å; C821-L825 PolarHBondContact O-N 2.88Å
822	E	35.6	Very low	30.6	Very low	77 Å²	77	111.6 Å²	111.6	36%	0.36	60%	0.599	S	S	.	*	H	α-helix	trans	-78.1	-31.8	174.6	-147.6	164.5	-177.8	0	0	110.7	Q819 S820 L825 I826	Q819-E822 WeakPolarHBondContact O-CB 3.05Å; Q819-E822 PolarHBondContact O-N 2.98Å; Q819-E822 VanDerWaalsContact O-N 3.11Å; S820-E822 VanDerWaalsContact C-N 3.34Å; E822-L825 PolarHBondContact O-N 3.14Å; E822-I826 WeakPolarHBondContact O-CG1 3.22Å; E822-I826 PolarHBondContact O-N 3Å
823	D	30.2	Very low	30.6	Very low	105 Å²	105	113.4 Å²	113.4	56%	0.561	59%	0.591	S	S	*	*	H	α-helix	trans	-67.2	-37.6	171.8	-69.2	-28.9	0	0	0	112.1	Q819 S820 L825 I826 E827	Q819-D823 PolarHBondContact O-N 3.43Å; Q819-D823 VanDerWaalsContact O-N 3.15Å; S820-D823 PolarHBondContact O-N 3.36Å; D823-L825 VanDerWaalsContact C-N 3.27Å; D823-L825 PolarHBondContact O-N 3.05Å; D823-I826 PolarHBondContact O-N 3.22Å; D823-E827 PolarHBondContact O-N 3.36Å
824	S	28.7	Very low	30.8	Very low	56 Å²	56	111.7 Å²	111.7	39%	0.392	58%	0.582	S	S	.	*	H	α-helix	trans	-68.8	-21.1	174.5	65.2	0	0	0	0	114.5	S820 C821	S820-S824 PolarHBondContact O-N 2.98Å; C821-S824 PolarHBondContact O-OG 3.48Å
825	L	33.4	Very low	30.9	Very low	102 Å²	102	112.2 Å²	112.2	53%	0.534	58%	0.579	S	S	.	*	H	α-helix	trans	-78.3	-29.1	173.7	-88.7	159.1	0	0	0	111.9	C821 E822 D823	C821-L825 PolarHBondContact O-N 2.88Å; E822-L825 PolarHBondContact O-N 3.14Å; D823-L825 VanDerWaalsContact C-N 3.27Å; D823-L825 PolarHBondContact O-N 3.05Å
826	I	33.8	Very low	30.9	Very low	60 Å²	60	110.4 Å²	110.4	31%	0.308	57%	0.568	S	S	.	*	H	α-helix	trans	-73	-32.6	175.8	-62.9	167.2	0	0	0	110.3	E822 D823 N828 E829 I830	E822-I826 WeakPolarHBondContact O-CG1 3.22Å; E822-I826 PolarHBondContact O-N 3Å; D823-I826 PolarHBondContact O-N 3.22Å; I826-N828 VanDerWaalsContact C-N 3.32Å; I826-N828 PolarHBondContact O-N 3.29Å; I826-E829 PolarHBondContact O-N 2.92Å; I826-I830 WeakPolarHBondContact O-CG1 3.44Å
827	E	28.6	Very low	30.9	Very low	141 Å²	141	111.7 Å²	111.7	66%	0.659	57%	0.569	S	S	*	*	H	α-helix	trans	-70.4	-27	178.7	-132.1	163.9	-167.7	0	0	113.2	D823	D823-E827 PolarHBondContact O-N 3.36Å
828	N	28.6	Very low	31	Very low	127 Å²	127	114 Å²	114	68%	0.679	58%	0.58	S	S	*	*	H	α-helix	trans	-85.6	-17.3	176.7	-84.3	-21.9	0	0	0	114.4	I826 I830	I826-N828 VanDerWaalsContact C-N 3.32Å; I826-N828 PolarHBondContact O-N 3.29Å; N828-I830 VanDerWaalsContact C-N 3.27Å
829	E	31.1	Very low	30.5	Very low	148 Å²	148	114.4 Å²	114.4	69%	0.692	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-5	170.8	-82.9	-177.3	162	0	0	112.8	I826	I826-E829 PolarHBondContact O-N 2.92Å
830	I	29.2	Very low	30.3	Very low	121 Å²	121	114.8 Å²	114.8	62%	0.621	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-10.3	177.4	-65.2	168.5	0	0	0	111.8	I826 N828	I826-I830 WeakPolarHBondContact O-CG1 3.44Å; N828-I830 VanDerWaalsContact C-N 3.27Å
831	H	27	Very low	30.4	Very low	169 Å²	169	117.9 Å²	117.9	78%	0.782	60%	0.597	S	S	*	*			trans	-124.4	22.4	-174.5	-87.2	-46.5	0	0	0	116.6
832	Q	27.3	Very low	30.3	Very low	243 Å²	243	122.6 Å²	122.6	100%	1.136	61%	0.611	S	S	*	*			trans	-134.4	0	159.6	-78.8	-173.5	-15.9	0	0	109.6

Retrieved 832 of 832 residues in 145.3 ms (Link to these results)

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