X5LPU4_CAEEL Loading...

PDZ domain-containing protein

AlphaFold DB , UniProt , Accession X5LPU4, Species CAEEL (Caenorhabditis elegans), Gene afd-1, Length 1,227 aa.

						>X5LPU4_CAEEL|X5LPU4|afd-1
MQTEILRDGDHIRIGADHSFKFSTSSSQANQINSTNISNSNQRHFQQQTFYPEMADSRASTARCAPSDYCSLPQQNDYYPPSMSGSSVSSSRQEDLMMHSNNNILPPYSTKSAQEPLQLPLSIQIGDYNVWDFLAEVMSNRAATSSEMSTFRLSPAYSLYLALRSFHTHNKPYSVQFFSRIESNFKQIAQECSSKDDLIFWLANASEFNHLVERDTELKASRYGKISVEIERIFRRLVAVLQSVIRPAARALLDIHLNDHDATGDVIHLLDTTMRQARICGLNAALTIQLCGHLLHMVNAFVFNSLVSVNLPAAQLNTRLGKCLQYRIESIHRFCERMGVEMAAECHLDRSRQAANLLATQKNDVAALGSTCYKLNSLQVVHILSGFEPDDGEIPCDDDVVDRICRLAEKQADKLTLEDGQRVTLEESDELNLPFLIPQDGYFVEQFRTVPDGLWQYLQQLQHRRLCHTVSLTPAPPAAMTHSMHAMHIGASDAHYHQHQHQQQQNPIVRSVSQTTLTSIPTTQFGDSFGSAVSDTISKVTLRKNGGGIGLSIVAAQGVGDRQMGIYVKKVVEGTPAAHDGRLETGDQLLSVNGHSLIGISQEDAARLMTQSGNEVHFDVRKRAAHRNGLSNWLGSQTPTTSNFIAPSPSTVPPPSYSHVGRTPSYDGQPPPSYNHRNGGASGAGGSSGRNSAFVAPLSNSSSNASSSHMQQHYAHHNMMHNGNLSAAPGAPAGDPKHYRSSSASDLQHDPNASFSQSSMTGSARSSVFDKLPSHYRHSTRPTVIQPTRPSAQSPSALRKAAAASPVSNLYRPTSASNLFAPPRNSGGLVGYSSNAARESTQDIHRALNDLELNSPLARSTPNEEYRIPPPRVPTVTSTSSNYAPLHSIRPASMYGYQSPSSSTTVIPAPKGVASSSNNTSPRVNVTLGGALSSSRSHNSLSQEPAIVIRPVDLNMPKATPPASIRGAVPTAITQALQLQPNGGGAVLRQVRPASGLRERLQDADVRNLEKTNTALMSYEAVNEELDRLDAKQNTMTIDEQRRYRELLNVVAEQSRARKLLSEIRSPPTSYQEREIPIHVQKEQQQHRRETVIDDIPHSSSSVENVSPVSPPESRKVQFIDEVVQYQTPTSGANHAFFDDVPVLDSPGIVGTNEIYRDPRQRRLNELQDRNRSSENGAADGAKLGFRDKQRLFARQIGEDTAPRQRMNESSAQRLIETDIAATPQKP
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	50.5	Low	242 Å²	242	137.2 Å²	137.2	100%	1.192	68%	0.682	S	S	*	*				0	140.1	0	-62.1	170.5	-177.4	0	0	108.1
2	Q	30.2	Very low	51.6	Low	186 Å²	186	130.8 Å²	130.8	87%	0.869	65%	0.651	S	S	*	*			trans	-100.4	150.2	164	-76.3	176.9	-29.5	0	0	108.2
3	T	41.8	Very low	51.2	Low	136 Å²	136	135.4 Å²	135.4	83%	0.834	66%	0.656	S	S	*	*			trans	-120.8	120.4	175.1	38.5	0	0	0	0	109.5
4	E	46.9	Very low	51.2	Low	188 Å²	188	133.9 Å²	133.9	88%	0.879	65%	0.651	S	S	*	*			trans	-85.5	159	167.8	-68.7	-169.1	113.3	0	0	110.7
5	I	58.4	Low	51.3	Low	154 Å²	154	129.4 Å²	129.4	79%	0.79	65%	0.653	S	S	*	*			trans	-112.4	108.9	179	-59.1	175.2	0	0	0	107.7
6	L	56.1	Low	51.2	Low	87 Å²	87	126.6 Å²	126.6	46%	0.455	66%	0.656	S	S	.	*			trans	-71.2	148.1	177.6	-68.6	146.6	0	0	0	110.9	D10 I12	L6-D10 WeakPolarHBondContact CA-OD2 3.49Å; L6-D10 HydrophobicContact CD2-CB 3.9Å; L6-I12 HydrophobicContact CD1-CD1 3.59Å; L6-I12 HydrophobicContact CD1-CG1 4.4Å; L6-I12 HydrophobicContact CD2-CD1 3.97Å; L6-I12 HydrophobicContact CD2-CG1 3.88Å; L6-I12 HydrophobicContact CG-CD1 4.39Å
7	R	57.8	Low	50.7	Low	190 Å²	190	127.7 Å²	127.7	72%	0.717	66%	0.663	S	S	*	*			trans	-119.5	165	-174.2	-53.7	-175.7	-169.6	-171.9	5.2	111.2	G9 D10 F22	R7-G9 PolarHBondContact O-N 3.24Å; R7-D10 PolarHBondContact N-OD2 3.15Å; R7-D10 WeakPolarHBondContact O-CB 3.44Å; R7-D10 PolarHBondContact O-N 3.48Å; R7-D10 VanDerWaalsContact O-N 3.12Å; R7-F22 WeakPolarHBondContact O-CD1 3.5Å
8	D	52.4	Low	50.3	Low	87 Å²	87	127 Å²	127	47%	0.465	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57	123.5	170.8	-158	-34.3	0	0	0	110.5	S23 T24	D8-S23 VanDerWaalsContact OD1-CA 3.25Å; D8-S23 WeakPolarHBondContact OD1-CA 3Å; D8-S23 WeakPolarHBondContact OD1-CB 3.32Å; D8-T24 WeakPolarHBondContact OD2-CA 3.39Å; D8-T24 PolarHBondContact OD2-N 3.11Å; D8-T24 PolarHBondContact OD2-OG1 3.48Å
9	G	57.9	Low	50.8	Low	26 Å²	26	123.6 Å²	123.6	27%	0.268	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	104.1	-17.2	-176.7	0	0	0	0	0	115.4	R7 H11 K21 F22	R7-G9 PolarHBondContact O-N 3.24Å; G9-H11 PolarHBondContact O-CD2 3.24Å; G9-K21 VanDerWaalsContact O-CE 3.27Å; G9-K21 WeakPolarHBondContact O-CE 3.39Å; G9-F22 PolarHBondContact N-O 3.28Å
10	D	62.9	Low	50.9	Low	60 Å²	60	123.6 Å²	123.6	32%	0.321	64%	0.639	S	S	.	*			trans	-68	137.5	-173.6	-75.2	-16.4	0	0	0	112.4	L6 R7 K21 F22	L6-D10 WeakPolarHBondContact CA-OD2 3.49Å; L6-D10 HydrophobicContact CD2-CB 3.9Å; R7-D10 PolarHBondContact N-OD2 3.15Å; R7-D10 WeakPolarHBondContact O-CB 3.44Å; R7-D10 PolarHBondContact O-N 3.48Å; R7-D10 VanDerWaalsContact O-N 3.12Å; D10-K21 WeakPolarHBondContact O-CA 3.33Å; D10-F22 PolarHBondContact O-N 3.39Å
11	H	53.5	Low	51.5	Low	153 Å²	153	123.3 Å²	123.3	71%	0.708	63%	0.633	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.9	119.3	179.3	-79	-95.7	0	0	0	111.3	G9 F20 K21	G9-H11 PolarHBondContact O-CD2 3.24Å; H11-F20 CarbonylContact C-O 3.45Å; H11-F20 VanDerWaalsContact CA-O 3.31Å; H11-F20 WeakPolarHBondContact CA-O 3.36Å; H11-K21 PolarHBondContact NE2-NZ 3.09Å
12	I	63.6	Low	51.9	Low	60 Å²	60	116.2 Å²	116.2	31%	0.308	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.8	125.1	-178.7	-47.6	171.8	0	0	0	108.6	L6 I14 S19 F20	L6-I12 HydrophobicContact CD1-CD1 3.59Å; L6-I12 HydrophobicContact CD1-CG1 4.4Å; L6-I12 HydrophobicContact CD2-CD1 3.97Å; L6-I12 HydrophobicContact CD2-CG1 3.88Å; L6-I12 HydrophobicContact CG-CD1 4.39Å; I12-I14 HydrophobicContact CG2-CD1 4.34Å; I12-I14 HydrophobicContact CG2-CG1 4.04Å; I12-S19 CarbonylContact O-C 3.55Å; I12-S19 WeakPolarHBondContact O-CA 3.44Å; I12-F20 PolarHBondContact N-O 3Å; I12-F20 PolarHBondContact O-N 3.24Å
13	R	46.8	Very low	52.8	Low	191 Å²	191	111.3 Å²	111.3	72%	0.721	58%	0.582	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-101.9	135.4	168.3	-89.3	-178	166.6	142.2	-0.9	110.8	H18	R13-H18 WeakPolarHBondContact CA-O 3.47Å
14	I	50.3	Low	52.8	Low	115 Å²	115	109 Å²	109	59%	0.59	57%	0.568	S	S	*	*			trans	-134.1	109	176.6	-54.1	-178.4	0	0	0	107.2	I12 H18	I12-I14 HydrophobicContact CG2-CD1 4.34Å; I12-I14 HydrophobicContact CG2-CG1 4.04Å; I14-H18 PolarHBondContact N-O 3.08Å; I14-H18 VanDerWaalsContact N-O 3.12Å
15	G	53.6	Low	52.2	Low	66 Å²	66	105.9 Å²	105.9	68%	0.68	57%	0.567	S	S	*	*	S	Bend	trans	76.1	-173.5	-165.6	0	0	0	0	0	112.8
16	A	49.3	Very low	50.9	Low	85 Å²	85	103.9 Å²	103.9	70%	0.702	57%	0.566	S	S	*	*	S	Bend	trans	-74.7	-43.9	-176.7	0	0	0	0	0	112.9
17	D	43.3	Very low	49.7	Very low	145 Å²	145	105.2 Å²	105.2	78%	0.775	58%	0.583	S	S	*	*	S	Bend	trans	-102.9	3.7	-161.6	-55.1	-52.1	0	0	0	114.5
18	H	43.6	Very low	48.4	Very low	115 Å²	115	106 Å²	106	53%	0.532	60%	0.595	S	S	.	*			trans	-126.9	119.2	-173.6	-56.1	-22.3	0	0	0	112	R13 I14 F20	R13-H18 WeakPolarHBondContact CA-O 3.47Å; I14-H18 PolarHBondContact N-O 3.08Å; I14-H18 VanDerWaalsContact N-O 3.12Å; H18-F20 HydrophobicContact CB-CE2 3.9Å; H18-F20 HydrophobicContact CB-CZ 4.21Å
19	S	59.7	Low	47.2	Very low	63 Å²	63	106 Å²	106	44%	0.441	61%	0.607	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.9	124.6	175	57.6	0	0	0	0	110.9	I12	I12-S19 CarbonylContact O-C 3.55Å; I12-S19 WeakPolarHBondContact O-CA 3.44Å
20	F	52.1	Low	45.8	Very low	122 Å²	122	111.7 Å²	111.7	54%	0.535	63%	0.632	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.3	144.6	-179.3	-57	-84.4	0	0	0	110.2	H11 I12 H18	H11-F20 CarbonylContact C-O 3.45Å; H11-F20 VanDerWaalsContact CA-O 3.31Å; H11-F20 WeakPolarHBondContact CA-O 3.36Å; I12-F20 PolarHBondContact N-O 3Å; I12-F20 PolarHBondContact O-N 3.24Å; H18-F20 HydrophobicContact CB-CE2 3.9Å; H18-F20 HydrophobicContact CB-CZ 4.21Å
21	K	62.8	Low	43.9	Very low	118 Å²	118	117.1 Å²	117.1	51%	0.513	66%	0.655	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.5	126.1	173.7	-169.3	175.3	-173.4	161.3	0	110.3	G9 D10 H11	G9-K21 VanDerWaalsContact O-CE 3.27Å; G9-K21 WeakPolarHBondContact O-CE 3.39Å; D10-K21 WeakPolarHBondContact O-CA 3.33Å; H11-K21 PolarHBondContact NE2-NZ 3.09Å
22	F	47	Very low	42.5	Very low	94 Å²	94	116 Å²	116	41%	0.412	65%	0.653	S	S	.	*			trans	-79.1	138	170.2	-162.2	-102.9	0	0	0	109.9	R7 G9 D10 T24	R7-F22 WeakPolarHBondContact O-CD1 3.5Å; G9-F22 PolarHBondContact N-O 3.28Å; D10-F22 PolarHBondContact O-N 3.39Å; F22-T24 HydrophobicContact CD1-CG2 4.36Å; F22-T24 HydrophobicContact CE1-CG2 3.64Å; F22-T24 HydrophobicContact CZ-CG2 4.25Å
23	S	49.5	Very low	40.6	Very low	83 Å²	83	119.7 Å²	119.7	58%	0.58	67%	0.673	S	S	*	*			trans	-154.4	153.6	171.1	56.5	0	0	0	0	111.2	D8	D8-S23 VanDerWaalsContact OD1-CA 3.25Å; D8-S23 WeakPolarHBondContact OD1-CA 3Å; D8-S23 WeakPolarHBondContact OD1-CB 3.32Å
24	T	41.6	Very low	39.4	Very low	87 Å²	87	115.4 Å²	115.4	53%	0.534	67%	0.673	S	S	.	*			trans	-130.2	126.8	-173.1	57	0	0	0	0	110.7	D8 F22	D8-T24 WeakPolarHBondContact OD2-CA 3.39Å; D8-T24 PolarHBondContact OD2-N 3.11Å; D8-T24 PolarHBondContact OD2-OG1 3.48Å; F22-T24 HydrophobicContact CD1-CG2 4.36Å; F22-T24 HydrophobicContact CE1-CG2 3.64Å; F22-T24 HydrophobicContact CZ-CG2 4.25Å
25	S	34.7	Very low	38.2	Very low	122 Å²	122	116.5 Å²	116.5	85%	0.853	68%	0.684	S	S	*	*			trans	-138.1	124	179.6	52.7	0	0	0	0	111.5
26	S	31.4	Very low	37	Very low	112 Å²	112	121 Å²	121	78%	0.783	69%	0.693	S	S	*	*			trans	-151.7	128.6	166.7	58	0	0	0	0	111.2
27	S	30.5	Very low	35.8	Very low	115 Å²	115	124.2 Å²	124.2	80%	0.804	70%	0.697	S	S	*	*			trans	66.3	97.2	155.6	-52	0	0	0	0	119.7
28	Q	30.1	Very low	35	Very low	206 Å²	206	121.8 Å²	121.8	96%	0.963	69%	0.691	S	S	*	*				-158.8	175.4	119.1	-111.2	176.7	33.7	0	0	112.7
29	A	27.8	Very low	34.2	Very low	87 Å²	87	123.7 Å²	123.7	72%	0.719	71%	0.705	S	S	*	*			trans	-104.3	159.4	-152.3	0	0	0	0	0	116
30	N	27.8	Very low	32.7	Very low	147 Å²	147	124.9 Å²	124.9	79%	0.786	71%	0.714	S	S	*	*			trans	34.7	140.5	141.5	-81.5	-8.2	0	0	0	122.5
31	Q	23.2	Very low	31.4	Very low	173 Å²	173	125.8 Å²	125.8	81%	0.808	72%	0.724	S	S	*	*			trans	76	148.1	157.9	-68.8	-175.9	10.1	0	0	117.6
32	I	23.9	Very low	29.8	Very low	130 Å²	130	127.9 Å²	127.9	67%	0.667	74%	0.736	S	S	*	*			cis	-166.1	162.8	-25.1	-120.2	172.7	0	0	0	108.3
33	N	24.1	Very low	28.8	Very low	138 Å²	138	134.1 Å²	134.1	74%	0.738	76%	0.757	S	S	*	*			trans	67.2	123.8	168	-74.1	-8.1	0	0	0	118.2
34	S	22	Very low	27.9	Very low	101 Å²	101	137.8 Å²	137.8	71%	0.706	76%	0.764	S	S	*	*				101.4	152.9	77.6	-61.1	0	0	0	0	111.2
35	T	25	Very low	27	Very low	137 Å²	137	141.5 Å²	141.5	84%	0.84	77%	0.773	S	S	*	*			cis	-137.3	171.5	20	49.4	0	0	0	0	113.5
36	N	26.8	Very low	26.6	Very low	160 Å²	160	142.4 Å²	142.4	86%	0.856	76%	0.764	S	S	*	*			trans	-120.1	128.4	-179.8	-135.5	-8.7	0	0	0	110.8
37	I	25.8	Very low	26.4	Very low	153 Å²	153	144.7 Å²	144.7	79%	0.785	76%	0.763	S	S	*	*			trans	-153.7	133	156.5	-30.7	177.4	0	0	0	104.5
38	S	24.7	Very low	26.2	Very low	95 Å²	95	147.8 Å²	147.8	66%	0.664	76%	0.764	S	S	*	*			cis	-158.5	152.3	38.7	-42.9	0	0	0	0	114
39	N	27.3	Very low	25.9	Very low	154 Å²	154	143.7 Å²	143.7	82%	0.824	75%	0.753	S	S	*	*			trans	37.4	145	138.2	-61.9	-10.2	0	0	0	122.6
40	S	28.1	Very low	25.6	Very low	89 Å²	89	149.2 Å²	149.2	62%	0.622	76%	0.762	S	S	*	*			cis	-168.8	140.5	-10.6	49.6	0	0	0	0	109.2
41	N	24.3	Very low	25.3	Very low	140 Å²	140	152.6 Å²	152.6	75%	0.749	77%	0.765	S	S	*	*				162.6	155.4	92	-91.8	-33	0	0	0	108.3
42	Q	30.4	Very low	26.5	Very low	162 Å²	162	149.1 Å²	149.1	76%	0.757	76%	0.757	S	S	*	*			cis	-169	171.9	-27.8	-140.6	-166.4	25.2	0	0	110.8
43	R	25.9	Very low	26.5	Very low	225 Å²	225	150.4 Å²	150.4	85%	0.849	76%	0.76	S	S	*	*			trans	80	116.1	179.4	-46.4	-178.2	-167.5	-167.3	5.1	114.5
44	H	29.7	Very low	26.5	Very low	161 Å²	161	151.1 Å²	151.1	75%	0.745	76%	0.761	S	S	*	*			cis	75.4	141.5	47	-72.2	-31.6	0	0	0	114.6
45	F	24.1	Very low	26.7	Very low	165 Å²	165	150.7 Å²	150.7	72%	0.724	76%	0.764	S	S	*	*			cis	-124	137.5	15.3	-100	-109.1	0	0	0	111.6
46	Q	26.4	Very low	26.6	Very low	141 Å²	141	151.3 Å²	151.3	66%	0.659	76%	0.762	S	S	*	*				65.9	160.6	94.6	-69.1	-166.7	-11.3	0	0	118.7
47	Q	27.5	Very low	26.5	Very low	160 Å²	160	148.1 Å²	148.1	75%	0.748	75%	0.752	S	S	*	*			cis	176.7	146.9	-44.3	-152.7	173	13.8	0	0	109.6
48	Q	24.3	Very low	26.4	Very low	180 Å²	180	152.3 Å²	152.3	84%	0.841	76%	0.758	S	S	*	*				168.2	165.3	129	-92.9	-177.6	13.3	0	0	113.9
49	T	24.4	Very low	26.5	Very low	120 Å²	120	152 Å²	152	74%	0.736	76%	0.762	S	S	*	*			trans	-156.2	148.3	-166	49.8	0	0	0	0	111.1
50	F	22	Very low	26.4	Very low	203 Å²	203	149.6 Å²	149.6	89%	0.89	76%	0.756	S	S	*	*			trans	-158.2	167.7	157.1	-105.2	-70.7	0	0	0	113.7
51	Y	22.4	Very low	26.2	Very low	218 Å²	218	151.9 Å²	151.9	86%	0.855	77%	0.767	S	S	*	*			trans	-157.1	174.3	-172.3	-95	-72.4	0	0	0	107
52	P	47.9	Very low	26.3	Very low	99 Å²	99	148.7 Å²	148.7	64%	0.643	76%	0.76	S	S	*	*			cis	-137.9	-172.2	-16.2	33.2	-10.4	0	0	0	115.2
53	E	24.5	Very low	25.9	Very low	158 Å²	158	152.2 Å²	152.2	74%	0.738	77%	0.766	S	S	*	*			trans	86.2	146	135.5	-107.6	-175.6	152.3	0	0	126.9
54	M	23.5	Very low	25.8	Very low	152 Å²	152	147.1 Å²	147.1	75%	0.749	76%	0.764	S	S	*	*			trans	69.3	110.8	153.9	-60.5	-149.1	-171.1	0	0	125.1
55	A	25.3	Very low	25.8	Very low	92 Å²	92	143.9 Å²	143.9	76%	0.76	77%	0.765	S	S	*	*				83.5	130.2	119.9	0	0	0	0	0	124.6
56	D	24.1	Very low	26.8	Very low	151 Å²	151	141.3 Å²	141.3	81%	0.807	77%	0.765	S	S	*	*			trans	99.7	135.6	130.5	-115.6	46.3	0	0	0	125.8
57	S	24.5	Very low	26.8	Very low	92 Å²	92	139.1 Å²	139.1	64%	0.643	77%	0.765	S	S	*	*			trans	71.4	103.6	144.4	-76.1	0	0	0	0	125
58	R	23.4	Very low	26.7	Very low	241 Å²	241	138.3 Å²	138.3	91%	0.909	77%	0.766	S	S	*	*				51.3	114.5	126.6	-84	-179.9	165.9	146.4	-4.2	123.3
59	A	26	Very low	26.7	Very low	90 Å²	90	140.7 Å²	140.7	74%	0.744	77%	0.769	S	S	*	*				100.6	149.7	113.5	0	0	0	0	0	123.1
60	S	25.7	Very low	26.7	Very low	102 Å²	102	140.3 Å²	140.3	71%	0.713	77%	0.77	S	S	*	*			trans	100.7	116.9	148.1	-57.8	0	0	0	0	121.9
61	T	23.8	Very low	26.8	Very low	138 Å²	138	136.3 Å²	136.3	85%	0.847	77%	0.767	S	S	*	*			trans	66.5	153.4	139.1	54.8	0	0	0	0	121.7
62	A	25.8	Very low	27.2	Very low	73 Å²	73	133.9 Å²	133.9	60%	0.603	77%	0.768	S	S	*	*			cis	-177	152.7	-24.4	0	0	0	0	0	111.8
63	R	23.6	Very low	26.9	Very low	236 Å²	236	134 Å²	134	89%	0.891	77%	0.769	S	S	*	*			trans	64.1	162.9	158.7	-65.7	174.1	-167.1	-177.4	4.4	116.6
64	C	22.3	Very low	27.2	Very low	118 Å²	118	134.9 Å²	134.9	80%	0.797	77%	0.773	S	S	*	*			cis	-157.5	167.1	-19.1	-109.1	0	0	0	0	109.5
65	A	30.4	Very low	27.2	Very low	93 Å²	93	135.3 Å²	135.3	77%	0.769	77%	0.773	S	S	*	*			trans	-89.5	-177.3	166.8	0	0	0	0	0	111.4
66	P	44.8	Very low	27.3	Very low	111 Å²	111	137 Å²	137	72%	0.721	77%	0.769	S	S	*	*				-157	-171.9	70.8	43.2	-22	0	0	0	118.1
67	S	25.7	Very low	27.3	Very low	95 Å²	95	135.8 Å²	135.8	66%	0.664	76%	0.763	S	S	*	*			trans	79.6	147.9	151.8	72.6	0	0	0	0	121.6
68	D	26.6	Very low	27.7	Very low	143 Å²	143	141.8 Å²	141.8	77%	0.765	77%	0.773	S	S	*	*			cis	-169.2	175.3	-27.2	-99.2	-39.8	0	0	0	112.6
69	Y	24.3	Very low	27.7	Very low	229 Å²	229	140.4 Å²	140.4	90%	0.898	77%	0.769	S	S	*	*			trans	88.4	163	160.3	-80.5	-74.9	0	0	0	122.4
70	C	24.9	Very low	28.7	Very low	113 Å²	113	141 Å²	141	76%	0.764	77%	0.766	S	S	*	*			trans	-161.1	158.7	-147.6	179.7	0	0	0	0	112.5
71	S	24.5	Very low	29.5	Very low	119 Å²	119	141.5 Å²	141.5	83%	0.832	77%	0.767	S	S	*	*			trans	-167.1	153.1	165.7	-82.9	0	0	0	0	116.4
72	L	29.8	Very low	29.7	Very low	167 Å²	167	139.9 Å²	139.9	87%	0.874	76%	0.761	S	S	*	*			trans	-152.7	151.4	168	-91.9	171.5	0	0	0	107.2
73	P	42.3	Very low	29.7	Very low	102 Å²	102	144.7 Å²	144.7	66%	0.662	77%	0.773	S	S	*	*				-166.9	178.8	100.1	43.5	-22.2	0	0	0	119.9
74	Q	29	Very low	29.8	Very low	175 Å²	175	139.3 Å²	139.3	82%	0.818	77%	0.771	S	S	*	*			trans	70	173.3	142.7	-80.5	161.2	-9.1	0	0	123.6
75	Q	24.5	Very low	30	Very low	161 Å²	161	137.2 Å²	137.2	75%	0.752	77%	0.77	S	S	*	*				-176.1	135.1	-77.2	178.9	171.9	15.3	0	0	114.5
76	N	26.6	Very low	29.7	Very low	128 Å²	128	139 Å²	139	68%	0.684	78%	0.777	S	S	*	*			trans	59.3	170.9	163.4	-74.6	50.7	0	0	0	119.1
77	D	24.5	Very low	28.8	Very low	126 Å²	126	139.4 Å²	139.4	67%	0.674	78%	0.782	S	S	*	*			cis	-156.7	171.8	-3.6	-137.3	-53.3	0	0	0	113.3
78	Y	33.2	Very low	29	Very low	217 Å²	217	141.3 Å²	141.3	85%	0.851	79%	0.79	S	S	*	*			trans	149.9	144.9	145.7	-101.8	-85.3	0	0	0	117
79	Y	24.2	Very low	29.4	Very low	212 Å²	212	140 Å²	140	83%	0.831	79%	0.792	S	S	*	*			trans	-162.7	-179	179.9	-106.9	-75.9	0	0	0	108.3
80	P	47.3	Very low	29.3	Very low	104 Å²	104	134.4 Å²	134.4	68%	0.675	79%	0.786	S	S	*	*			cis	-126.8	-154.1	-19.2	44	-26.5	0	0	0	110.9
81	P	42.3	Very low	29.3	Very low	112 Å²	112	134 Å²	134	73%	0.727	78%	0.784	S	S	*	*			cis	-119.7	-134.2	-11.8	31.8	-6.5	0	0	0	110.5
82	S	26.3	Very low	29.3	Very low	103 Å²	103	138.9 Å²	138.9	72%	0.72	78%	0.784	S	S	*	*			cis	-169.5	151.7	-0.8	29.3	0	0	0	0	110.5
83	M	26	Very low	28.9	Very low	174 Å²	174	137.8 Å²	137.8	86%	0.857	78%	0.775	S	S	*	*			cis	-165.5	56.6	-28.4	-136.6	-47	109.7	0	0	113.4
84	S	26.1	Very low	28.1	Very low	123 Å²	123	140.2 Å²	140.2	86%	0.86	78%	0.777	S	S	*	*			trans	-141.9	133.9	167.4	53.3	0	0	0	0	110.5
85	G	26.7	Very low	27.9	Very low	74 Å²	74	138.1 Å²	138.1	76%	0.763	77%	0.772	S	S	*	*			cis	122.8	113.3	9.7	0	0	0	0	0	108.3
86	S	24.5	Very low	28	Very low	132 Å²	132	138 Å²	138	92%	0.923	78%	0.776	S	S	*	*			cis	-122.1	154.3	27	-57.1	0	0	0	0	114.8
87	S	26.2	Very low	27.9	Very low	118 Å²	118	137.7 Å²	137.7	83%	0.825	77%	0.771	S	S	*	*			trans	-100.8	151.4	-177.5	51.9	0	0	0	0	114.1
88	V	29	Very low	27.9	Very low	136 Å²	136	140.9 Å²	140.9	82%	0.824	79%	0.785	S	S	*	*			trans	-103.1	149.1	171.2	179.3	0	0	0	0	110.1
89	S	35.7	Very low	27.8	Very low	116 Å²	116	136.1 Å²	136.1	81%	0.811	77%	0.77	S	S	*	*			trans	111.6	99	161.8	-46.4	0	0	0	0	118.1
90	S	22.6	Very low	27.8	Very low	110 Å²	110	131.6 Å²	131.6	77%	0.769	77%	0.769	S	S	*	*			trans	-165.4	131.3	144.7	-170.1	0	0	0	0	106.3
91	S	24.5	Very low	26.7	Very low	104 Å²	104	131.6 Å²	131.6	73%	0.727	76%	0.763	S	S	*	*			cis	90.4	129	32.3	-60.5	0	0	0	0	114.4
92	R	23.6	Very low	25.9	Very low	222 Å²	222	134.4 Å²	134.4	84%	0.838	77%	0.772	S	S	*	*			trans	78.9	118.9	177.8	-64.5	178	165.7	168.3	-1.2	115.6
93	Q	23.1	Very low	25.9	Very low	145 Å²	145	136.4 Å²	136.4	68%	0.678	78%	0.775	S	S	*	*				103.9	149.9	91.5	-89.3	170.6	-117.6	0	0	109.4
94	E	25	Very low	26	Very low	152 Å²	152	135.9 Å²	135.9	71%	0.71	77%	0.774	S	S	*	*			cis	-119.9	164.6	-11.9	-85.3	109.9	-149.7	0	0	108.2
95	D	23.5	Very low	26.2	Very low	132 Å²	132	137.4 Å²	137.4	71%	0.706	77%	0.772	S	S	*	*			cis	80.5	87.9	31	-137	0.7	0	0	0	115.7
96	L	26.7	Very low	26.2	Very low	159 Å²	159	138.9 Å²	138.9	83%	0.832	77%	0.768	S	S	*	*			trans	-178.3	74.7	164.4	-103.5	161.3	0	0	0	109.2
97	M	25.4	Very low	26.4	Very low	120 Å²	120	138.3 Å²	138.3	59%	0.591	76%	0.761	S	S	*	*				57.3	112.6	94.3	-69.8	-160.2	-78.1	0	0	116.9
98	M	24.6	Very low	26.4	Very low	194 Å²	194	143.4 Å²	143.4	96%	0.956	76%	0.764	S	S	*	*				-134.8	113.5	126	-109.8	-61.4	-170.3	0	0	108.9
99	H	30	Very low	26.2	Very low	117 Å²	117	142.1 Å²	142.1	54%	0.542	76%	0.761	S	S	.	*			trans	-96.3	145	-178.4	-82.1	94.2	0	0	0	111.5
100	S	24	Very low	25.8	Very low	117 Å²	117	142.5 Å²	142.5	82%	0.818	76%	0.758	S	S	*	*			trans	-170.1	94.2	130.1	-81.5	0	0	0	0	108.5
101	N	24.4	Very low	26.1	Very low	103 Å²	103	146.7 Å²	146.7	55%	0.551	76%	0.763	S	S	*	*				60	110.3	78.1	-68.1	-13	0	0	0	114.2
102	N	26.6	Very low	26.4	Very low	172 Å²	172	146.5 Å²	146.5	92%	0.92	76%	0.762	S	S	*	*				-147.4	121.3	126.4	-106.8	-37.3	0	0	0	109.2
103	N	24.8	Very low	27	Very low	144 Å²	144	140.4 Å²	140.4	77%	0.77	76%	0.758	S	S	*	*			trans	-90.8	120	-171.2	-77.5	-37.4	0	0	0	111.7
104	I	29.9	Very low	28.2	Very low	164 Å²	164	140.9 Å²	140.9	84%	0.841	76%	0.761	S	S	*	*			trans	-132.1	122.9	145.2	-58.9	-177.6	0	0	0	106.5
105	L	28.5	Very low	29.4	Very low	155 Å²	155	142.3 Å²	142.3	81%	0.812	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-64	133.7	178.3	-78.4	151.1	0	0	0	110.1
106	P	28	Very low	31.2	Very low	104 Å²	104	140.2 Å²	140.2	68%	0.675	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-65.3	139.4	167.6	29	-33.1	0	0	0	108.9	Y108	P106-Y108 PolarHBondContact O-N 2.99Å
107	P	28.4	Very low	33.1	Very low	121 Å²	121	134 Å²	134	79%	0.786	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-60	140.4	166.7	27.9	-33.6	0	0	0	108.5	S109	P107-S109 PolarHBondContact O-N 3.47Å
108	Y	25.4	Very low	35	Very low	224 Å²	224	134.8 Å²	134.8	88%	0.878	73%	0.731	S	S	*	*			trans	-59.7	99.7	-179.2	-81.7	-94.3	0	0	0	110.5	P106 T110	P106-Y108 PolarHBondContact O-N 2.99Å; Y108-T110 VanDerWaalsContact C-N 3.3Å; Y108-T110 PolarHBondContact O-N 3.12Å
109	S	25.2	Very low	37.4	Very low	109 Å²	109	127.1 Å²	127.1	76%	0.762	69%	0.694	S	S	*	*			trans	-68	95.8	163	-175.7	0	0	0	0	107.3	P107 K111	P107-S109 PolarHBondContact O-N 3.47Å; S109-K111 VanDerWaalsContact C-N 3.33Å; S109-K111 PolarHBondContact O-N 2.99Å
110	T	27.1	Very low	39.4	Very low	124 Å²	124	123.8 Å²	123.8	76%	0.761	68%	0.682	S	S	*	*			trans	-58.5	101.4	163.3	47.9	0	0	0	0	107	Y108 S112	Y108-T110 VanDerWaalsContact C-N 3.3Å; Y108-T110 PolarHBondContact O-N 3.12Å; T110-S112 PolarHBondContact O-N 3.38Å
111	K	30.5	Very low	42.1	Very low	198 Å²	198	118.7 Å²	118.7	86%	0.861	65%	0.646	S	S	*	*			trans	-53.3	107	161.9	-73	-176.5	177.4	-178.6	0	106.1	S109 A113	S109-K111 VanDerWaalsContact C-N 3.33Å; S109-K111 PolarHBondContact O-N 2.99Å; K111-A113 PolarHBondContact O-N 3.09Å
112	S	29.7	Very low	44.8	Very low	101 Å²	101	116 Å²	116	71%	0.706	64%	0.635	S	S	*	*			trans	-59.4	115.1	168.1	35.7	0	0	0	0	106.6	T110 Q114	T110-S112 PolarHBondContact O-N 3.38Å; S112-Q114 PolarHBondContact O-N 2.91Å
113	A	35.3	Very low	47.7	Very low	93 Å²	93	107.8 Å²	107.8	77%	0.769	59%	0.591	S	S	*	*			trans	-60.1	109	163.7	0	0	0	0	0	105.7	K111 E115	K111-A113 PolarHBondContact O-N 3.09Å; A113-E115 PolarHBondContact O-N 3.39Å
114	Q	48.7	Very low	50.5	Low	156 Å²	156	105.9 Å²	105.9	73%	0.729	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-60.8	122	172.4	-72.1	179.2	-27.3	0	0	106.8	S112	S112-Q114 PolarHBondContact O-N 2.91Å
115	E	51.3	Low	53.1	Low	181 Å²	181	98.9 Å²	98.9	85%	0.846	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-58.2	140.9	176	-66.4	-176.4	132.2	0	0	109.2	A113	A113-E115 PolarHBondContact O-N 3.39Å
116	P	60.8	Low	55.3	Low	89 Å²	89	92.4 Å²	92.4	58%	0.578	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-59.3	143	179.6	25.7	-34.2	0	0	0	110.2	Q118	P116-Q118 PolarHBondContact O-N 3.42Å
117	L	66.6	Low	57.4	Low	29 Å²	29	92.8 Å²	92.8	15%	0.152	51%	0.509	C	S	.	.			trans	-72.6	66.2	-172.6	-168.5	97.9	0	0	0	112.9	L119 Y160 L211 R214 V444	L117-L119 PolarHBondContact O-N 3.39Å; L117-Y160 PolarHBondContact O-OH 3.18Å; L117-Y160 VanDerWaalsContact O-OH 3.13Å; L117-L211 HydrophobicContact CD2-CD2 3.83Å; L117-R214 HydrophobicContact CB-CB 4.29Å; L117-R214 HydrophobicContact CD1-CB 4.48Å; L117-R214 HydrophobicContact CD2-CB 4.05Å; L117-V444 HydrophobicContact CD1-CG1 4.12Å; L117-V444 HydrophobicContact CD1-CG2 3.98Å; L117-V444 HydrophobicContact CD2-CG2 4.23Å; L117-V444 HydrophobicContact CG-CG2 4.42Å
118	Q	66.1	Low	59.4	Low	135 Å²	135	97 Å²	97	63%	0.631	51%	0.511	S	S	*	.			trans	-91.4	96.8	179.2	-166	166.8	22.3	0	0	110.4	P116	P116-Q118 PolarHBondContact O-N 3.42Å
119	L	73.8	Confident	62.1	Low	34 Å²	34	88.5 Å²	88.5	18%	0.178	48%	0.48	C	S	.	.			trans	-56.8	137.5	165.2	-66.7	-179.6	0	0	0	109.1	L117 L121 Y157 Y160 L161 V444	L117-L119 PolarHBondContact O-N 3.39Å; L119-L121 PolarHBondContact O-N 3.38Å; L119-Y157 HydrophobicContact CD1-CD1 3.81Å; L119-Y157 HydrophobicContact CD1-CE1 4.14Å; L119-Y157 HydrophobicContact CD2-CE1 4.45Å; L119-Y160 HydrophobicContact CD1-CD1 3.84Å; L119-Y160 HydrophobicContact CD1-CE1 3.75Å; L119-Y160 HydrophobicContact CG-CE1 4.17Å; L119-L161 HydrophobicContact CB-CD2 4.47Å; L119-L161 HydrophobicContact CD1-CD2 4.21Å; L119-V444 HydrophobicContact CD2-CG2 3.97Å
120	P	72.4	Confident	65	Low	47 Å²	47	83.3 Å²	83.3	31%	0.305	44%	0.444	S	S	.	.	S	Bend	trans	-77.4	42	178	33.8	-36.9	0	0	0	111.7	V450 L472 T473	P120-V450 HydrophobicContact CG-CG2 4.02Å; P120-L472 VanDerWaalsContact O-CA 3.31Å; P120-L472 WeakPolarHBondContact O-CA 3.29Å; P120-T473 PolarHBondContact O-N 2.76Å
121	L	79.8	Confident	67.9	Low	10 Å²	10	82.6 Å²	82.6	5%	0.052	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	142.5	177.9	-74.3	176.4	0	0	0	109.9	L119 L161 V450 L454 W455 L458 V470 S471 L472 T473	L119-L121 PolarHBondContact O-N 3.38Å; L121-L161 HydrophobicContact CB-CD1 4Å; L121-L161 HydrophobicContact CB-CD2 3.9Å; L121-L161 HydrophobicContact CD1-CD1 3.89Å; L121-L161 WeakPolarHBondContact O-CD2 3.41Å; L121-V450 HydrophobicContact CD1-CG1 3.8Å; L121-V450 HydrophobicContact CD1-CG2 3.91Å; L121-V450 HydrophobicContact CD2-CG1 4.45Å; L121-V450 HydrophobicContact CD2-CG2 3.92Å; L121-V450 HydrophobicContact CG-CG1 4.37Å; L121-V450 HydrophobicContact CG-CG2 3.65Å; L121-L454 HydrophobicContact CD1-CD2 4.03Å; L121-W455 HydrophobicContact CD2-CE3 3.8Å; L121-W455 HydrophobicContact CD2-CZ3 3.65Å; L121-L458 HydrophobicContact CD1-CD1 4.01Å; L121-V470 HydrophobicContact CD2-CG1 4.17Å; L121-S471 WeakPolarHBondContact CA-O 3.19Å; L121-L472 HydrophobicContact CD2-CD2 4.02Å; L121-T473 PolarHBondContact N-OG1 3.44Å
122	S	81.5	Confident	70.7	Confident	46 Å²	46	77.9 Å²	77.9	32%	0.322	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	144.4	158.6	65.7	0	0	0	0	110.3	S471	S122-S471 PolarHBondContact N-O 3.09Å; S122-S471 PolarHBondContact O-N 2.9Å; S122-S471 PolarHBondContact OG-OG 3.39Å
123	I	87.8	Confident	73.6	Confident	0 Å²	0	73 Å²	73	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.1	174.2	71.4	-178.9	0	0	0	110.8	I125 F133 L161 A162 S165 L458 T469 V470	I123-I125 HydrophobicContact CD1-CD1 4.09Å; I123-I125 HydrophobicContact CD1-CG1 4.37Å; I123-I125 HydrophobicContact CG1-CD1 4.48Å; I123-I125 HydrophobicContact CG1-CG1 4.42Å; I123-F133 HydrophobicContact CD1-CE2 4.18Å; I123-F133 HydrophobicContact CD1-CZ 3.84Å; I123-L161 HydrophobicContact CD1-CB 3.85Å; I123-L161 HydrophobicContact CG1-CB 3.95Å; I123-L161 HydrophobicContact CG2-CB 4.34Å; I123-L161 HydrophobicContact CG2-CD1 4.35Å; I123-A162 HydrophobicContact CD1-CB 4.13Å; I123-S165 WeakPolarHBondContact O-CB 3.3Å; I123-S165 PolarHBondContact O-OG 3.18Å; I123-L458 HydrophobicContact CG2-CD1 4.44Å; I123-L458 HydrophobicContact CG2-CD2 4.32Å; I123-T469 WeakPolarHBondContact CA-O 3.45Å; I123-V470 HydrophobicContact CG2-CG1 4.23Å; I123-V470 HydrophobicContact CG2-CG2 4.23Å
124	Q	84.2	Confident	76.3	Confident	103 Å²	103	68.9 Å²	68.9	48%	0.481	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	125.6	169.5	-69.4	-175.6	-11.6	0	0	109.7	C467 H468 T469	Q124-C467 CarbonylContact O-C 3.41Å; Q124-C467 WeakPolarHBondContact O-CA 3.48Å; Q124-C467 WeakPolarHBondContact O-CB 3.33Å; Q124-H468 PolarHBondContact O-N 2.99Å; Q124-T469 PolarHBondContact N-O 3.24Å
125	I	84.3	Confident	78.2	Confident	17 Å²	17	64.3 Å²	64.3	9%	0.087	33%	0.332	C	S	.	.			trans	-114.3	133.5	176.5	-57.4	170.4	0	0	0	106	I123 V130 F133 A162 F166 C467	I123-I125 HydrophobicContact CD1-CD1 4.09Å; I123-I125 HydrophobicContact CD1-CG1 4.37Å; I123-I125 HydrophobicContact CG1-CD1 4.48Å; I123-I125 HydrophobicContact CG1-CG1 4.42Å; I125-V130 HydrophobicContact CG2-CB 4.26Å; I125-V130 HydrophobicContact CG2-CG2 3.77Å; I125-F133 HydrophobicContact CD1-CD1 3.68Å; I125-F133 HydrophobicContact CD1-CD2 3.99Å; I125-F133 HydrophobicContact CD1-CE1 3.65Å; I125-F133 HydrophobicContact CD1-CE2 3.93Å; I125-F133 HydrophobicContact CD1-CG 3.87Å; I125-F133 HydrophobicContact CD1-CZ 3.77Å; I125-F133 HydrophobicContact CG1-CD2 4.31Å; I125-F133 HydrophobicContact CG1-CE2 4.38Å; I125-F133 HydrophobicContact CG2-CB 4.41Å; I125-A162 HydrophobicContact CD1-CB 3.49Å; I125-A162 VanDerWaalsContact CD1-CB 3.49Å; I125-F166 HydrophobicContact CB-CE1 4.35Å; I125-F166 HydrophobicContact CB-CZ 3.95Å; I125-F166 HydrophobicContact CD1-CE2 4.2Å; I125-F166 HydrophobicContact CD1-CZ 3.91Å; I125-F166 HydrophobicContact CG1-CZ 4.48Å; I125-F166 HydrophobicContact CG2-CZ 4.21Å; I125-C467 HydrophobicContact CG1-CB 4.28Å
126	G	74.9	Confident	80	Confident	19 Å²	19	57 Å²	57	20%	0.196	30%	0.297	C	S	.	.			trans	-85	144.5	178.4	0	0	0	0	0	110.8	Y128 N129 H468	G126-Y128 PolarHBondContact O-N 2.92Å; G126-N129 PolarHBondContact O-N 3.34Å; G126-H468 PolarHBondContact N-ND1 3.23Å
127	D	71.9	Confident	81.4	Confident	112 Å²	112	52.8 Å²	52.8	60%	0.599	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-32.6	-166.9	-54	-64.6	0	0	0	114.3
128	Y	71.1	Confident	82.5	Confident	211 Å²	211	52 Å²	52	83%	0.827	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-25.3	178.6	-58.1	-71.6	0	0	0	114.1	G126	G126-Y128 PolarHBondContact O-N 2.92Å
129	N	81.4	Confident	83.4	Confident	45 Å²	45	46.8 Å²	46.8	24%	0.241	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	1.2	-168.2	-59.1	8.9	0	0	0	112.7	G126 W131 D132 F133 R465	G126-N129 PolarHBondContact O-N 3.34Å; N129-W131 PolarHBondContact O-N 3.32Å; N129-D132 PolarHBondContact O-N 3.26Å; N129-F133 WeakPolarHBondContact O-CB 3.4Å; N129-F133 PolarHBondContact O-N 3.3Å; N129-R465 PolarHBondContact ND2-O 2.9Å
130	V	85.9	Confident	83	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.6	-42.1	-172.1	-177.2	0	0	0	0	112.5	I125 F133 L134 F166 Y173 F177	I125-V130 HydrophobicContact CG2-CB 4.26Å; I125-V130 HydrophobicContact CG2-CG2 3.77Å; V130-F133 PolarHBondContact O-N 3.42Å; V130-L134 WeakPolarHBondContact O-CB 3.13Å; V130-L134 PolarHBondContact O-N 3.36Å; V130-F166 HydrophobicContact CB-CZ 4.27Å; V130-F166 HydrophobicContact CG1-CE2 3.76Å; V130-F166 HydrophobicContact CG1-CZ 3.55Å; V130-F166 HydrophobicContact CG2-CE1 4.13Å; V130-F166 HydrophobicContact CG2-CZ 3.76Å; V130-Y173 HydrophobicContact CB-CE1 4.2Å; V130-Y173 WeakPolarHBondContact CB-OH 3.44Å; V130-Y173 HydrophobicContact CG1-CE1 3.84Å; V130-Y173 WeakPolarHBondContact CG1-OH 3.48Å; V130-Y173 HydrophobicContact CG2-CE1 3.81Å; V130-Y173 WeakPolarHBondContact CG2-OH 3.47Å; V130-F177 HydrophobicContact CG1-CD2 3.68Å; V130-F177 HydrophobicContact CG1-CE2 3.69Å
131	W	88.9	Confident	82.6	Confident	109 Å²	109	54.2 Å²	54.2	41%	0.413	27%	0.27	S	S	.	.	H	α-helix	trans	-74.6	-30.1	-178.8	-57	123.5	0	0	0	112	N129 L134 A135 Y173 F177 R180	N129-W131 PolarHBondContact O-N 3.32Å; W131-L134 HydrophobicContact CE3-CD2 3.89Å; W131-L134 HydrophobicContact CZ3-CD2 3.91Å; W131-L134 PolarHBondContact O-N 3.25Å; W131-A135 WeakPolarHBondContact O-CB 3.5Å; W131-A135 PolarHBondContact O-N 3.19Å; W131-Y173 HydrophobicContact CZ2-CE2 4.08Å; W131-F177 HydrophobicContact CZ3-CD2 4.29Å; W131-R180 HydrophobicContact CE3-CG 4.29Å; W131-R180 HydrophobicContact CH2-CB 4.33Å; W131-R180 HydrophobicContact CZ3-CB 3.75Å; W131-R180 HydrophobicContact CZ3-CG 3.83Å
132	D	89	Confident	81.5	Confident	98 Å²	98	53.9 Å²	53.9	52%	0.524	27%	0.269	S	S	.	.	H	α-helix	trans	-71.4	-39.5	171.6	-63.6	-34.3	0	0	0	111.6	N129 A135 E136 L466	N129-D132 PolarHBondContact O-N 3.26Å; D132-A135 PolarHBondContact O-N 2.88Å; D132-E136 WeakPolarHBondContact O-CB 3.25Å; D132-E136 PolarHBondContact O-N 3.25Å; D132-L466 HydrophobicContact CB-CD2 3.82Å
133	F	90	Very high	80.4	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.1	-49.9	170.1	172.7	-84.4	0	0	0	110.6	I123 I125 N129 V130 A135 E136 V137 A162 F177 L461 L466	I123-F133 HydrophobicContact CD1-CE2 4.18Å; I123-F133 HydrophobicContact CD1-CZ 3.84Å; I125-F133 HydrophobicContact CD1-CD1 3.68Å; I125-F133 HydrophobicContact CD1-CD2 3.99Å; I125-F133 HydrophobicContact CD1-CE1 3.65Å; I125-F133 HydrophobicContact CD1-CE2 3.93Å; I125-F133 HydrophobicContact CD1-CG 3.87Å; I125-F133 HydrophobicContact CD1-CZ 3.77Å; I125-F133 HydrophobicContact CG1-CD2 4.31Å; I125-F133 HydrophobicContact CG1-CE2 4.38Å; I125-F133 HydrophobicContact CG2-CB 4.41Å; N129-F133 WeakPolarHBondContact O-CB 3.4Å; N129-F133 PolarHBondContact O-N 3.3Å; V130-F133 PolarHBondContact O-N 3.42Å; F133-A135 PolarHBondContact O-N 3.03Å; F133-E136 PolarHBondContact O-N 3.17Å; F133-V137 HydrophobicContact CD1-CG2 4.32Å; F133-V137 HydrophobicContact CD2-CG2 4.45Å; F133-V137 HydrophobicContact CE1-CG2 4.07Å; F133-V137 HydrophobicContact CE2-CG2 4.22Å; F133-V137 HydrophobicContact CZ-CG2 4.02Å; F133-V137 WeakPolarHBondContact O-CB 3.44Å; F133-V137 VanDerWaalsContact O-CG2 3.23Å; F133-V137 WeakPolarHBondContact O-CG2 3.36Å; F133-V137 PolarHBondContact O-N 3.3Å; F133-A162 HydrophobicContact CE1-CB 3.69Å; F133-A162 HydrophobicContact CZ-CB 4.11Å; F133-F177 HydrophobicContact CD1-CZ 4.48Å; F133-F177 HydrophobicContact CE1-CZ 4.4Å; F133-L461 HydrophobicContact CD2-CD1 4.33Å; F133-L461 HydrophobicContact CE2-CD1 3.77Å; F133-L461 HydrophobicContact CZ-CD1 4.46Å; F133-L466 HydrophobicContact CB-CB 4.23Å; F133-L466 HydrophobicContact CD2-CB 4.14Å
134	L	91.3	Very high	78.7	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-43.5	178.4	-178.1	62.2	0	0	0	111.6	V130 W131 M138 L159 F177 R180 I181	V130-L134 WeakPolarHBondContact O-CB 3.13Å; V130-L134 PolarHBondContact O-N 3.36Å; W131-L134 HydrophobicContact CE3-CD2 3.89Å; W131-L134 HydrophobicContact CZ3-CD2 3.91Å; W131-L134 PolarHBondContact O-N 3.25Å; L134-M138 HydrophobicContact CD1-CG 3.73Å; L134-M138 HydrophobicContact CG-CG 4.37Å; L134-M138 VanDerWaalsContact O-CB 3.25Å; L134-M138 WeakPolarHBondContact O-CB 3.45Å; L134-M138 WeakPolarHBondContact O-CG 3.28Å; L134-M138 PolarHBondContact O-N 3.17Å; L134-L159 HydrophobicContact CD1-CD2 3.6Å; L134-F177 HydrophobicContact CB-CE2 4.12Å; L134-F177 HydrophobicContact CD1-CE2 4.25Å; L134-F177 HydrophobicContact CD1-CZ 4.33Å; L134-F177 HydrophobicContact CD2-CE2 4.38Å; L134-F177 HydrophobicContact CG-CE2 4.48Å; L134-R180 HydrophobicContact CD2-CB 3.87Å; L134-R180 HydrophobicContact CD2-CG 3.55Å; L134-I181 HydrophobicContact CD1-CG1 3.68Å
135	A	89.9	Confident	77.1	Confident	61 Å²	61	52.6 Å²	52.6	50%	0.504	27%	0.268	S	S	.	.	H	α-helix	trans	-65.4	-39.4	179.8	0	0	0	0	0	112.5	W131 D132 F133 S139	W131-A135 WeakPolarHBondContact O-CB 3.5Å; W131-A135 PolarHBondContact O-N 3.19Å; D132-A135 PolarHBondContact O-N 2.88Å; F133-A135 PolarHBondContact O-N 3.03Å; A135-S139 VanDerWaalsContact O-CB 3.31Å; A135-S139 WeakPolarHBondContact O-CB 3.3Å; A135-S139 PolarHBondContact O-N 2.81Å; A135-S139 VanDerWaalsContact O-N 3.12Å
136	E	88.8	Confident	75.6	Confident	28 Å²	28	56.4 Å²	56.4	13%	0.131	30%	0.296	C	S	.	.	H	α-helix	trans	-70.2	-45.9	176.1	-171.7	66.7	-153.9	0	0	111.4	D132 F133 M138 S139 L461 R464 L466	D132-E136 WeakPolarHBondContact O-CB 3.25Å; D132-E136 PolarHBondContact O-N 3.25Å; F133-E136 PolarHBondContact O-N 3.17Å; E136-M138 VanDerWaalsContact C-N 3.35Å; E136-M138 PolarHBondContact O-N 2.82Å; E136-S139 WeakPolarHBondContact O-CB 3.46Å; E136-S139 PolarHBondContact O-N 2.98Å; E136-S139 VanDerWaalsContact O-N 3.13Å; E136-S139 PolarHBondContact O-OG 3.42Å; E136-L461 HydrophobicContact CG-CD2 4.25Å; E136-R464 VanDerWaalsContact CD-CZ 3.48Å; E136-R464 IonicContact OE1-CZ 3.37Å; E136-R464 IonicContact OE1-NH1 2.67Å; E136-R464 PolarHBondContact OE1-NH1 3Å; E136-R464 IonicContact OE1-NH2 2.82Å; E136-R464 IonicContact OE2-CZ 2.79Å; E136-R464 IonicContact OE2-NH1 2.79Å; E136-R464 PolarHBondContact OE2-NH1 3.24Å; E136-R464 IonicContact OE2-NH2 3.19Å; E136-R464 PolarHBondContact OE2-NH2 3.21Å; E136-L466 HydrophobicContact CB-CD1 3.73Å; E136-L466 HydrophobicContact CG-CD1 3.88Å
137	V	89.9	Confident	74.3	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-65.1	-36.9	-179.6	172.8	0	0	0	0	111.9	F133 S139 P155 L159 W201 L461	F133-V137 HydrophobicContact CD1-CG2 4.32Å; F133-V137 HydrophobicContact CD2-CG2 4.45Å; F133-V137 HydrophobicContact CE1-CG2 4.07Å; F133-V137 HydrophobicContact CE2-CG2 4.22Å; F133-V137 HydrophobicContact CZ-CG2 4.02Å; F133-V137 WeakPolarHBondContact O-CB 3.44Å; F133-V137 VanDerWaalsContact O-CG2 3.23Å; F133-V137 WeakPolarHBondContact O-CG2 3.36Å; F133-V137 PolarHBondContact O-N 3.3Å; V137-S139 VanDerWaalsContact C-N 3.34Å; V137-P155 HydrophobicContact CG1-CB 3.86Å; V137-L159 HydrophobicContact CG1-CD2 3.81Å; V137-L159 HydrophobicContact CG1-CG 3.87Å; V137-W201 WeakPolarHBondContact O-CH2 3.48Å; V137-L461 HydrophobicContact CG2-CD1 3.78Å; V137-L461 HydrophobicContact CG2-CD2 4.42Å
138	M	89.8	Confident	73.3	Confident	11 Å²	11	61.1 Å²	61.1	5%	0.054	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	4.4	174.7	-64.3	-59.5	-68.5	0	0	113.9	L134 E136 L159 N184 F185 I188 W201	L134-M138 HydrophobicContact CD1-CG 3.73Å; L134-M138 HydrophobicContact CG-CG 4.37Å; L134-M138 VanDerWaalsContact O-CB 3.25Å; L134-M138 WeakPolarHBondContact O-CB 3.45Å; L134-M138 WeakPolarHBondContact O-CG 3.28Å; L134-M138 PolarHBondContact O-N 3.17Å; E136-M138 VanDerWaalsContact C-N 3.35Å; E136-M138 PolarHBondContact O-N 2.82Å; M138-L159 HydrophobicContact SD-CD1 3.58Å; M138-L159 VanDerWaalsContact SD-CD1 3.58Å; M138-L159 HydrophobicContact SD-CD2 4.34Å; M138-N184 HydrophobicContact CB-CB 4.5Å; M138-N184 HydrophobicContact CE-CB 3.66Å; M138-N184 HydrophobicContact CG-CB 4.29Å; M138-F185 HydrophobicContact CE-CD1 4.01Å; M138-F185 HydrophobicContact CE-CD2 3.98Å; M138-F185 HydrophobicContact CE-CE1 3.85Å; M138-F185 HydrophobicContact CE-CE2 3.87Å; M138-F185 HydrophobicContact CE-CG 4.1Å; M138-F185 HydrophobicContact CE-CZ 3.8Å; M138-F185 HydrophobicContact SD-CE2 4.41Å; M138-F185 HydrophobicContact SD-CZ 4.29Å; M138-I188 HydrophobicContact CE-CD1 3.73Å; M138-W201 HydrophobicContact CE-CE3 4.43Å; M138-W201 HydrophobicContact CE-CZ3 4.13Å; M138-W201 WeakPolarHBondContact O-CZ2 3.41Å; M138-W201 HydrophobicContact SD-CH2 4.32Å; M138-W201 HydrophobicContact SD-CZ3 3.99Å
139	S	84.1	Confident	72.6	Confident	26 Å²	26	51.3 Å²	51.3	18%	0.182	27%	0.272	C	S	.	.	S	Bend	trans	-75.2	147.9	-178.4	73.1	0	0	0	0	112.4	A135 E136 V137 R141 A142	A135-S139 VanDerWaalsContact O-CB 3.31Å; A135-S139 WeakPolarHBondContact O-CB 3.3Å; A135-S139 PolarHBondContact O-N 2.81Å; A135-S139 VanDerWaalsContact O-N 3.12Å; E136-S139 WeakPolarHBondContact O-CB 3.46Å; E136-S139 PolarHBondContact O-N 2.98Å; E136-S139 VanDerWaalsContact O-N 3.13Å; E136-S139 PolarHBondContact O-OG 3.42Å; V137-S139 VanDerWaalsContact C-N 3.34Å; S139-R141 PolarHBondContact O-N 3.24Å; S139-R141 WeakPolarHBondContact OG-CB 3.36Å; S139-R141 PolarHBondContact OG-N 3.2Å; S139-A142 WeakPolarHBondContact O-CB 3.23Å; S139-A142 PolarHBondContact O-N 3.12Å
140	N	66.9	Low	72.2	Confident	86 Å²	86	54.4 Å²	54.4	46%	0.46	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-9.1	171.8	-72.7	-12.3	0	0	0	113.6	A142 A143 T144 W201	N140-A142 VanDerWaalsContact C-N 3.31Å; N140-A143 PolarHBondContact O-N 3.36Å; N140-T144 WeakPolarHBondContact O-CB 3.34Å; N140-T144 WeakPolarHBondContact O-CG2 3.5Å; N140-T144 PolarHBondContact O-N 3.31Å; N140-T144 PolarHBondContact O-OG1 2.9Å; N140-W201 PolarHBondContact OD1-NE1 2.83Å
141	R	62.1	Low	72.2	Confident	152 Å²	152	55.3 Å²	55.3	57%	0.574	30%	0.297	S	S	*	.	H	α-helix	trans	-65.7	-34.3	168.9	-63.6	178.3	171.3	173.6	-3.8	111.6	S139 A143 S145	S139-R141 PolarHBondContact O-N 3.24Å; S139-R141 WeakPolarHBondContact OG-CB 3.36Å; S139-R141 PolarHBondContact OG-N 3.2Å; R141-A143 VanDerWaalsContact C-N 3.3Å; R141-A143 PolarHBondContact O-N 2.89Å; R141-S145 VanDerWaalsContact O-CB 3.3Å; R141-S145 WeakPolarHBondContact O-CB 3.36Å; R141-S145 PolarHBondContact O-N 3.11Å; R141-S145 PolarHBondContact O-OG 2.88Å
142	A	58.6	Low	72.2	Confident	3 Å²	3	52.6 Å²	52.6	3%	0.025	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-34.7	175.5	0	0	0	0	0	112.3	S139 N140 P155 F200	S139-A142 WeakPolarHBondContact O-CB 3.23Å; S139-A142 PolarHBondContact O-N 3.12Å; N140-A142 VanDerWaalsContact C-N 3.31Å; A142-P155 HydrophobicContact CB-CG 4.03Å; A142-F200 HydrophobicContact CB-CE1 4.38Å; A142-F200 HydrophobicContact CB-CZ 4.21Å; A142-F200 VanDerWaalsContact O-CZ 3.24Å; A142-F200 WeakPolarHBondContact O-CZ 3.41Å
143	A	57	Low	72.3	Confident	7 Å²	7	48 Å²	48	6%	0.058	26%	0.262	C	S	.	.	H	α-helix	trans	-76	-46.1	176.5	0	0	0	0	0	112.6	N140 R141 R152 D197 F200	N140-A143 PolarHBondContact O-N 3.36Å; R141-A143 VanDerWaalsContact C-N 3.3Å; R141-A143 PolarHBondContact O-N 2.89Å; A143-R152 PolarHBondContact O-NH1 3.24Å; A143-D197 HydrophobicContact CB-CB 4.46Å; A143-D197 WeakPolarHBondContact CB-OD1 3.44Å; A143-F200 HydrophobicContact CB-CB 4.28Å; A143-F200 HydrophobicContact CB-CD1 3.38Å; A143-F200 HydrophobicContact CB-CD2 4.45Å; A143-F200 HydrophobicContact CB-CE1 3.71Å; A143-F200 HydrophobicContact CB-CG 3.79Å; A143-F200 HydrophobicContact CB-CZ 4.37Å
144	T	51.6	Low	72.3	Confident	93 Å²	93	48 Å²	48	57%	0.571	26%	0.262	S	S	*	.	H	α-helix	trans	-85.8	-26.1	-169.7	52.6	0	0	0	0	115.1	N140	N140-T144 WeakPolarHBondContact O-CB 3.34Å; N140-T144 WeakPolarHBondContact O-CG2 3.5Å; N140-T144 PolarHBondContact O-N 3.31Å; N140-T144 PolarHBondContact O-OG1 2.9Å
145	S	52.3	Low	72.3	Confident	22 Å²	22	47.8 Å²	47.8	15%	0.154	26%	0.261	C	S	.	.			trans	-83	126.1	-177.3	62.8	0	0	0	0	112.9	R141 E147 M148	R141-S145 VanDerWaalsContact O-CB 3.3Å; R141-S145 WeakPolarHBondContact O-CB 3.36Å; R141-S145 PolarHBondContact O-N 3.11Å; R141-S145 PolarHBondContact O-OG 2.88Å; S145-E147 VanDerWaalsContact C-N 3.26Å; S145-M148 WeakPolarHBondContact OG-CB 3.23Å
146	S	51.3	Low	72.5	Confident	97 Å²	97	44.9 Å²	44.9	68%	0.678	24%	0.237	S	C	*	.	S	Bend	trans	-76.1	-17.4	164.1	51.9	0	0	0	0	112.6
147	E	48	Very low	72.6	Confident	176 Å²	176	43.8 Å²	43.8	82%	0.822	23%	0.231	S	C	*	.	S	Bend	trans	-86.1	-29.1	-172.1	-57.3	-179	149.3	0	0	113.6	S145	S145-E147 VanDerWaalsContact C-N 3.26Å
148	M	50.8	Low	72.7	Confident	53 Å²	53	43.8 Å²	43.8	26%	0.261	23%	0.231	S	C	.	.	S	Bend	trans	-86.6	-30.6	-170.5	-154.6	85.7	69.8	0	0	113.1	S145 Y457 Q460	S145-M148 WeakPolarHBondContact OG-CB 3.23Å; M148-Y457 HydrophobicContact CG-CD2 4.3Å; M148-Y457 HydrophobicContact CG-CE2 4.15Å; M148-Q460 VanDerWaalsContact CG-OE1 3.3Å; M148-Q460 PolarHBondContact O-NE2 2.97Å; M148-Q460 PolarHBondContact O-OE1 3.5Å; M148-Q460 VanDerWaalsContact O-OE1 3.11Å; M148-Q460 PolarHBondContact SD-OE1 3.48Å
149	S	57.6	Low	72.9	Confident	5 Å²	5	43.3 Å²	43.3	4%	0.035	23%	0.229	C	C	.	.			trans	-143.8	121.4	176.2	68.3	0	0	0	0	113.1	F151	S149-F151 PolarHBondContact OG-O 3.45Å
150	T	71.5	Confident	73.3	Confident	110 Å²	110	42.3 Å²	42.3	68%	0.675	22%	0.221	S	C	*	.	S	Bend	trans	-71	-20.6	164.8	46.7	0	0	0	0	111.7	G453 Q456	T150-G453 WeakPolarHBondContact OG1-CA 3.5Å; T150-Q456 PolarHBondContact OG1-OE1 3.23Å
151	F	86.6	Confident	74.4	Confident	20 Å²	20	38.5 Å²	38.5	9%	0.088	20%	0.201	C	C	.	.	S	Bend	trans	-110.2	105.8	177.1	176.3	-124.6	0	0	0	111.3	S149 L153 S154 Y157 F443 L454	S149-F151 PolarHBondContact OG-O 3.45Å; F151-L153 VanDerWaalsContact C-N 3.29Å; F151-L153 HydrophobicContact CE1-CB 4.01Å; F151-L153 HydrophobicContact CE2-CB 3.98Å; F151-L153 HydrophobicContact CE2-CD1 4.29Å; F151-L153 HydrophobicContact CE2-CG 4.42Å; F151-L153 HydrophobicContact CZ-CB 3.61Å; F151-L153 HydrophobicContact CZ-CD1 4.31Å; F151-L153 HydrophobicContact CZ-CG 4.43Å; F151-L153 PolarHBondContact O-N 3.08Å; F151-S154 WeakPolarHBondContact CD1-OG 3.35Å; F151-S154 WeakPolarHBondContact O-CB 3.31Å; F151-S154 PolarHBondContact O-N 3.24Å; F151-S154 VanDerWaalsContact O-N 3.1Å; F151-S154 PolarHBondContact O-OG 3.4Å; F151-Y157 AromaticContact CE1-CD2 3.86Å; F151-Y157 HydrophobicContact CE1-CD2 3.86Å; F151-Y157 HydrophobicContact CE1-CE2 4.09Å; F151-Y157 HydrophobicContact CE1-CG 4.27Å; F151-Y157 HydrophobicContact CZ-CD2 4.07Å; F151-Y157 AromaticContact CZ-CE2 3.82Å; F151-Y157 HydrophobicContact CZ-CE2 3.82Å; F151-F443 HydrophobicContact CD2-CE1 4.15Å; F151-F443 HydrophobicContact CD2-CZ 4.04Å; F151-F443 AromaticContact CE2-CD1 3.59Å; F151-F443 HydrophobicContact CE2-CD1 3.59Å; F151-F443 HydrophobicContact CE2-CD2 4.24Å; F151-F443 AromaticContact CE2-CE1 3.19Å; F151-F443 HydrophobicContact CE2-CE1 3.19Å; F151-F443 AromaticContact CE2-CE2 3.91Å; F151-F443 HydrophobicContact CE2-CE2 3.91Å; F151-F443 HydrophobicContact CE2-CG 4.09Å; F151-F443 AromaticContact CE2-CZ 3.36Å; F151-F443 HydrophobicContact CE2-CZ 3.36Å; F151-F443 AromaticContact CZ-CD1 3.56Å; F151-F443 HydrophobicContact CZ-CD1 3.56Å; F151-F443 AromaticContact CZ-CE1 3.47Å; F151-F443 HydrophobicContact CZ-CE1 3.47Å; F151-F443 VanDerWaalsContact CZ-CE1 3.47Å; F151-F443 HydrophobicContact CZ-CG 4.28Å; F151-F443 HydrophobicContact CZ-CZ 4.14Å; F151-L454 HydrophobicContact CD1-CB 3.71Å; F151-L454 HydrophobicContact CD1-CD1 4.34Å; F151-L454 HydrophobicContact CE1-CB 4.1Å; F151-L454 HydrophobicContact CE1-CD1 4.42Å
152	R	88.2	Confident	75.8	Confident	51 Å²	51	31.3 Å²	31.3	19%	0.192	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-17.1	-170.4	-68.2	-57.3	-158	141.6	5.3	116.1	A143 S154 F200 N204 I279	A143-R152 PolarHBondContact O-NH1 3.24Å; R152-S154 VanDerWaalsContact C-N 3.31Å; R152-F200 HydrophobicContact CB-CE2 4.36Å; R152-F200 WeakPolarHBondContact O-CE2 3.37Å; R152-N204 PolarHBondContact O-ND2 3.11Å; R152-I279 WeakPolarHBondContact CG-O 3.09Å
153	L	91.2	Very high	77.4	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.01	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	8.6	175.1	-59.2	169.9	0	0	0	112.9	F151 P155 A156 Y157 A203 N204 E207 F443	F151-L153 VanDerWaalsContact C-N 3.29Å; F151-L153 HydrophobicContact CE1-CB 4.01Å; F151-L153 HydrophobicContact CE2-CB 3.98Å; F151-L153 HydrophobicContact CE2-CD1 4.29Å; F151-L153 HydrophobicContact CE2-CG 4.42Å; F151-L153 HydrophobicContact CZ-CB 3.61Å; F151-L153 HydrophobicContact CZ-CD1 4.31Å; F151-L153 HydrophobicContact CZ-CG 4.43Å; F151-L153 PolarHBondContact O-N 3.08Å; L153-P155 VanDerWaalsContact C-CD 3.48Å; L153-P155 VanDerWaalsContact C-N 3.31Å; L153-A156 PolarHBondContact O-N 3.44Å; L153-A156 VanDerWaalsContact O-N 3.1Å; L153-Y157 HydrophobicContact CB-CD2 4.21Å; L153-Y157 HydrophobicContact CB-CE2 4.15Å; L153-Y157 WeakPolarHBondContact O-CD2 3.4Å; L153-Y157 PolarHBondContact O-N 2.98Å; L153-A203 HydrophobicContact CD2-CB 3.89Å; L153-N204 WeakPolarHBondContact CA-OD1 3.28Å; L153-N204 PolarHBondContact O-OD1 3Å; L153-E207 HydrophobicContact CD1-CG 4.17Å; L153-E207 HydrophobicContact CD2-CB 4.29Å; L153-F443 HydrophobicContact CD1-CB 3.59Å; L153-F443 HydrophobicContact CD1-CD2 4.28Å; L153-F443 HydrophobicContact CD1-CG 3.97Å
154	S	90	Very high	78.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-52.8	-37.9	-177.5	-63	0	0	0	0	114.8	F151 R152 S158 Y457	F151-S154 WeakPolarHBondContact CD1-OG 3.35Å; F151-S154 WeakPolarHBondContact O-CB 3.31Å; F151-S154 PolarHBondContact O-N 3.24Å; F151-S154 VanDerWaalsContact O-N 3.1Å; F151-S154 PolarHBondContact O-OG 3.4Å; R152-S154 VanDerWaalsContact C-N 3.31Å; S154-S158 VanDerWaalsContact O-CB 3.31Å; S154-S158 WeakPolarHBondContact O-CB 3.36Å; S154-S158 PolarHBondContact O-N 3.12Å; S154-S158 PolarHBondContact O-OG 2.95Å; S154-Y457 VanDerWaalsContact CB-CD1 3.47Å
155	P	92.6	Very high	80.6	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.4	-50.5	172.6	-27	35.5	0	0	0	113.7	V137 A142 L153 Y157 S158 L159 F200 W201 N204	V137-P155 HydrophobicContact CG1-CB 3.86Å; A142-P155 HydrophobicContact CB-CG 4.03Å; L153-P155 VanDerWaalsContact C-CD 3.48Å; L153-P155 VanDerWaalsContact C-N 3.31Å; P155-Y157 VanDerWaalsContact C-N 3.31Å; P155-Y157 PolarHBondContact O-N 2.9Å; P155-S158 PolarHBondContact O-N 3.31Å; P155-L159 VanDerWaalsContact O-CG 3.26Å; P155-L159 WeakPolarHBondContact O-CG 3.17Å; P155-L159 PolarHBondContact O-N 3.17Å; P155-F200 HydrophobicContact CG-CE1 4.32Å; P155-F200 HydrophobicContact CG-CZ 3.9Å; P155-W201 HydrophobicContact CB-CZ3 4.18Å; P155-N204 WeakPolarHBondContact CB-OD1 3.42Å; P155-N204 VanDerWaalsContact CD-OD1 3.32Å; P155-N204 WeakPolarHBondContact CD-OD1 3.39Å
156	A	93.1	Very high	82.3	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-53.9	-46.5	-179.2	0	0	0	0	0	112.6	L153 Y160 N204 E207 F208	L153-A156 PolarHBondContact O-N 3.44Å; L153-A156 VanDerWaalsContact O-N 3.1Å; A156-Y160 WeakPolarHBondContact O-CB 3.4Å; A156-Y160 PolarHBondContact O-N 2.95Å; A156-N204 HydrophobicContact CB-CB 4.25Å; A156-N204 VanDerWaalsContact CB-O 3.29Å; A156-N204 WeakPolarHBondContact CB-O 3.23Å; A156-N204 PolarHBondContact N-OD1 2.82Å; A156-E207 HydrophobicContact CB-CB 4.14Å; A156-E207 HydrophobicContact CB-CG 4.21Å; A156-F208 HydrophobicContact CB-CB 4.08Å
157	Y	91.8	Very high	84	Confident	5 Å²	5	24.9 Å²	24.9	2%	0.02	12%	0.122	C	C	.	.	H	α-helix	trans	-68.5	-38.6	178	-76.8	-106.4	0	0	0	112.1	L119 F151 L153 P155 Y160 L161 E207 L211 V444 L454	L119-Y157 HydrophobicContact CD1-CD1 3.81Å; L119-Y157 HydrophobicContact CD1-CE1 4.14Å; L119-Y157 HydrophobicContact CD2-CE1 4.45Å; F151-Y157 AromaticContact CE1-CD2 3.86Å; F151-Y157 HydrophobicContact CE1-CD2 3.86Å; F151-Y157 HydrophobicContact CE1-CE2 4.09Å; F151-Y157 HydrophobicContact CE1-CG 4.27Å; F151-Y157 HydrophobicContact CZ-CD2 4.07Å; F151-Y157 AromaticContact CZ-CE2 3.82Å; F151-Y157 HydrophobicContact CZ-CE2 3.82Å; L153-Y157 HydrophobicContact CB-CD2 4.21Å; L153-Y157 HydrophobicContact CB-CE2 4.15Å; L153-Y157 WeakPolarHBondContact O-CD2 3.4Å; L153-Y157 PolarHBondContact O-N 2.98Å; P155-Y157 VanDerWaalsContact C-N 3.31Å; P155-Y157 PolarHBondContact O-N 2.9Å; Y157-Y160 PolarHBondContact O-N 2.8Å; Y157-L161 WeakPolarHBondContact O-CB 3.42Å; Y157-L161 VanDerWaalsContact O-CG 3.24Å; Y157-L161 WeakPolarHBondContact O-CG 3.47Å; Y157-L161 PolarHBondContact O-N 2.76Å; Y157-E207 HydrophobicContact CD2-CG 4.41Å; Y157-E207 HydrophobicContact CE2-CG 3.67Å; Y157-E207 WeakPolarHBondContact CE2-OE1 3.3Å; Y157-E207 PolarHBondContact OH-OE1 2.89Å; Y157-L211 HydrophobicContact CD1-CD1 4.48Å; Y157-L211 HydrophobicContact CD2-CD1 4.26Å; Y157-L211 HydrophobicContact CE1-CD2 4.48Å; Y157-L211 HydrophobicContact CE2-CD1 4.33Å; Y157-L211 HydrophobicContact CG-CD1 4.32Å; Y157-V444 HydrophobicContact CE1-CG2 4.29Å; Y157-V444 WeakPolarHBondContact OH-CA 3.46Å; Y157-V444 VanDerWaalsContact OH-CB 3.27Å; Y157-V444 WeakPolarHBondContact OH-CB 3.48Å; Y157-V444 PolarHBondContact OH-N 2.74Å; Y157-L454 HydrophobicContact CD1-CD2 3.75Å; Y157-L454 HydrophobicContact CG-CD1 4.44Å; Y157-L454 HydrophobicContact CG-CD2 3.98Å
158	S	91.6	Very high	85.8	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-67	-39.8	178.4	-57.9	0	0	0	0	112	S154 P155 A162 Y457 L458	S154-S158 VanDerWaalsContact O-CB 3.31Å; S154-S158 WeakPolarHBondContact O-CB 3.36Å; S154-S158 PolarHBondContact O-N 3.12Å; S154-S158 PolarHBondContact O-OG 2.95Å; P155-S158 PolarHBondContact O-N 3.31Å; S158-A162 VanDerWaalsContact O-CB 3.3Å; S158-A162 WeakPolarHBondContact O-CB 3.43Å; S158-A162 PolarHBondContact O-N 2.9Å; S158-Y457 WeakPolarHBondContact OG-CE1 3.34Å; S158-L458 WeakPolarHBondContact OG-CD2 3.49Å
159	L	93.4	Very high	87.3	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-66.6	-42.1	174.3	-64.9	171.3	0	0	0	111.8	L134 V137 M138 P155 A162 L163 I181 F185 F208	L134-L159 HydrophobicContact CD1-CD2 3.6Å; V137-L159 HydrophobicContact CG1-CD2 3.81Å; V137-L159 HydrophobicContact CG1-CG 3.87Å; M138-L159 HydrophobicContact SD-CD1 3.58Å; M138-L159 VanDerWaalsContact SD-CD1 3.58Å; M138-L159 HydrophobicContact SD-CD2 4.34Å; P155-L159 VanDerWaalsContact O-CG 3.26Å; P155-L159 WeakPolarHBondContact O-CG 3.17Å; P155-L159 PolarHBondContact O-N 3.17Å; L159-A162 PolarHBondContact O-N 3.24Å; L159-L163 VanDerWaalsContact O-CB 3.27Å; L159-L163 WeakPolarHBondContact O-CB 3.3Å; L159-L163 PolarHBondContact O-N 3.23Å; L159-I181 HydrophobicContact CB-CD1 4.22Å; L159-I181 HydrophobicContact CD1-CG2 4.44Å; L159-I181 HydrophobicContact CD2-CD1 4.03Å; L159-I181 HydrophobicContact CD2-CG1 4.12Å; L159-F185 HydrophobicContact CD1-CE2 4.39Å; L159-F185 HydrophobicContact CD1-CZ 4.41Å; L159-F208 HydrophobicContact CB-CD2 3.83Å; L159-F208 HydrophobicContact CB-CE2 3.75Å
160	Y	92.7	Very high	88.5	Confident	5 Å²	5	27.1 Å²	27.1	2%	0.02	14%	0.139	C	C	.	.	H	α-helix	trans	-61.4	-49.7	174.9	170.8	-103.1	0	0	0	111.8	L117 L119 A156 Y157 A162 L163 R164 L211 V212 D215 L218	L117-Y160 PolarHBondContact O-OH 3.18Å; L117-Y160 VanDerWaalsContact O-OH 3.13Å; L119-Y160 HydrophobicContact CD1-CD1 3.84Å; L119-Y160 HydrophobicContact CD1-CE1 3.75Å; L119-Y160 HydrophobicContact CG-CE1 4.17Å; A156-Y160 WeakPolarHBondContact O-CB 3.4Å; A156-Y160 PolarHBondContact O-N 2.95Å; Y157-Y160 PolarHBondContact O-N 2.8Å; Y160-A162 VanDerWaalsContact C-N 3.31Å; Y160-A162 PolarHBondContact O-N 3.01Å; Y160-L163 PolarHBondContact O-N 2.97Å; Y160-R164 VanDerWaalsContact O-CB 3.3Å; Y160-R164 WeakPolarHBondContact O-CB 3.45Å; Y160-R164 PolarHBondContact O-N 3.34Å; Y160-L211 HydrophobicContact CD1-CD1 4.44Å; Y160-L211 HydrophobicContact CD2-CB 3.59Å; Y160-L211 HydrophobicContact CE2-CB 3.99Å; Y160-L211 HydrophobicContact CG-CB 3.92Å; Y160-L211 HydrophobicContact CG-CD1 4.05Å; Y160-L211 HydrophobicContact CG-CG 4.44Å; Y160-V212 HydrophobicContact CD2-CG2 4.45Å; Y160-D215 HydrophobicContact CE2-CB 4.05Å; Y160-D215 PolarHBondContact OH-OD2 3.05Å; Y160-L218 HydrophobicContact CD2-CD1 3.98Å; Y160-L218 HydrophobicContact CE2-CD1 3.69Å
161	L	91.1	Very high	88.9	Confident	7 Å²	7	27.4 Å²	27.4	4%	0.037	13%	0.13	C	C	.	.	H	α-helix	trans	-62.7	-37.4	178.8	-70	170.8	0	0	0	112	L119 L121 I123 Y157 S165 L458	L119-L161 HydrophobicContact CB-CD2 4.47Å; L119-L161 HydrophobicContact CD1-CD2 4.21Å; L121-L161 HydrophobicContact CB-CD1 4Å; L121-L161 HydrophobicContact CB-CD2 3.9Å; L121-L161 HydrophobicContact CD1-CD1 3.89Å; L121-L161 WeakPolarHBondContact O-CD2 3.41Å; I123-L161 HydrophobicContact CD1-CB 3.85Å; I123-L161 HydrophobicContact CG1-CB 3.95Å; I123-L161 HydrophobicContact CG2-CB 4.34Å; I123-L161 HydrophobicContact CG2-CD1 4.35Å; Y157-L161 WeakPolarHBondContact O-CB 3.42Å; Y157-L161 VanDerWaalsContact O-CG 3.24Å; Y157-L161 WeakPolarHBondContact O-CG 3.47Å; Y157-L161 PolarHBondContact O-N 2.76Å; L161-S165 WeakPolarHBondContact O-CB 3.37Å; L161-S165 PolarHBondContact O-N 3.35Å; L161-L458 HydrophobicContact CD1-CD1 4Å
162	A	91.2	Very high	88.6	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.9	-53.3	173.1	0	0	0	0	0	111.7	I123 I125 F133 S158 L159 Y160 R164 S165 F166 F177	I123-A162 HydrophobicContact CD1-CB 4.13Å; I125-A162 HydrophobicContact CD1-CB 3.49Å; I125-A162 VanDerWaalsContact CD1-CB 3.49Å; F133-A162 HydrophobicContact CE1-CB 3.69Å; F133-A162 HydrophobicContact CZ-CB 4.11Å; S158-A162 VanDerWaalsContact O-CB 3.3Å; S158-A162 WeakPolarHBondContact O-CB 3.43Å; S158-A162 PolarHBondContact O-N 2.9Å; L159-A162 PolarHBondContact O-N 3.24Å; Y160-A162 VanDerWaalsContact C-N 3.31Å; Y160-A162 PolarHBondContact O-N 3.01Å; A162-R164 VanDerWaalsContact C-N 3.28Å; A162-R164 PolarHBondContact O-N 2.85Å; A162-S165 WeakPolarHBondContact O-CB 3.28Å; A162-S165 PolarHBondContact O-N 3.38Å; A162-S165 VanDerWaalsContact O-N 3.17Å; A162-F166 HydrophobicContact CB-CE2 4.18Å; A162-F166 WeakPolarHBondContact O-CD2 3.24Å; A162-F166 WeakPolarHBondContact O-CG 3.32Å; A162-F166 PolarHBondContact O-N 2.91Å; A162-F177 HydrophobicContact CB-CE1 3.59Å; A162-F177 HydrophobicContact CB-CZ 3.58Å
163	L	91.8	Very high	88.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-57.7	-41.4	178.8	179	67.7	0	0	0	111.7	L159 Y160 F166 H167 S174 F177 F178 F208 V212 L218 Y223	L159-L163 VanDerWaalsContact O-CB 3.27Å; L159-L163 WeakPolarHBondContact O-CB 3.3Å; L159-L163 PolarHBondContact O-N 3.23Å; Y160-L163 PolarHBondContact O-N 2.97Å; L163-F166 PolarHBondContact O-N 3.23Å; L163-H167 WeakPolarHBondContact O-CB 3.39Å; L163-H167 PolarHBondContact O-N 3.34Å; L163-S174 WeakPolarHBondContact CD1-O 3.29Å; L163-F177 HydrophobicContact CB-CD1 4.21Å; L163-F177 HydrophobicContact CB-CE1 4.3Å; L163-F177 HydrophobicContact CD1-CD1 4.22Å; L163-F178 HydrophobicContact CD1-CB 4.08Å; L163-F178 HydrophobicContact CD1-CD2 4.4Å; L163-F178 HydrophobicContact CD2-CD2 3.83Å; L163-F178 HydrophobicContact CD2-CE2 4.47Å; L163-F208 HydrophobicContact CD2-CE2 4.34Å; L163-F208 HydrophobicContact CD2-CZ 4.06Å; L163-V212 HydrophobicContact CD2-CG2 3.83Å; L163-L218 HydrophobicContact CD2-CD1 4.11Å; L163-L218 HydrophobicContact CD2-CD2 4.41Å; L163-L218 HydrophobicContact CG-CD1 4.41Å; L163-L218 HydrophobicContact CG-CD2 4.15Å; L163-Y223 HydrophobicContact CD1-CE1 4.32Å; L163-Y223 HydrophobicContact CD2-CE2 4.44Å
164	R	89.5	Confident	88.2	Confident	51 Å²	51	29.9 Å²	29.9	19%	0.192	15%	0.151	C	C	.	.	H	α-helix	trans	-66.3	-42.5	177.5	-169.1	53.2	157.2	115.7	-13.6	112	Y160 A162 H167 T168 D215 E217	Y160-R164 VanDerWaalsContact O-CB 3.3Å; Y160-R164 WeakPolarHBondContact O-CB 3.45Å; Y160-R164 PolarHBondContact O-N 3.34Å; A162-R164 VanDerWaalsContact C-N 3.28Å; A162-R164 PolarHBondContact O-N 2.85Å; R164-H167 PolarHBondContact O-N 2.59Å; R164-T168 PolarHBondContact O-N 2.87Å; R164-T168 PolarHBondContact O-OG1 3.02Å; R164-D215 IonicContact CZ-OD1 2.86Å; R164-D215 IonicContact CZ-OD2 3.64Å; R164-D215 VanDerWaalsContact CZ-OD2 3.25Å; R164-D215 IonicContact NE-OD1 2.7Å; R164-D215 IonicContact NE-OD2 3.76Å; R164-D215 PolarHBondContact NE-OD2 2.89Å; R164-D215 IonicContact NH2-OD1 3.25Å; R164-D215 IonicContact NH2-OD2 3.74Å; R164-D215 PolarHBondContact NH2-OD2 3.19Å; R164-E217 IonicContact CZ-OE1 2.74Å; R164-E217 IonicContact CZ-OE2 3.16Å; R164-E217 IonicContact NH1-OE1 3.52Å; R164-E217 PolarHBondContact NH1-OE1 3.01Å; R164-E217 VanDerWaalsContact NH1-OE1 3.16Å; R164-E217 IonicContact NH1-OE2 2.9Å; R164-E217 PolarHBondContact NH1-OE2 3.4Å; R164-E217 IonicContact NH2-OE1 3.83Å; R164-E217 PolarHBondContact NH2-OE1 3.44Å; R164-E217 IonicContact NH2-OE2 3.25Å
165	S	87.3	Confident	88.2	Confident	16 Å²	16	33.7 Å²	33.7	11%	0.112	18%	0.175	C	C	.	.	H	α-helix	trans	-60.9	-45.1	174.7	-163.6	0	0	0	0	111.7	I123 L161 A162 T168 H169	I123-S165 WeakPolarHBondContact O-CB 3.3Å; I123-S165 PolarHBondContact O-OG 3.18Å; L161-S165 WeakPolarHBondContact O-CB 3.37Å; L161-S165 PolarHBondContact O-N 3.35Å; A162-S165 WeakPolarHBondContact O-CB 3.28Å; A162-S165 PolarHBondContact O-N 3.38Å; A162-S165 VanDerWaalsContact O-N 3.17Å; S165-T168 PolarHBondContact O-N 3.2Å; S165-H169 PolarHBondContact O-N 3.22Å; S165-H169 VanDerWaalsContact O-N 3.15Å; S165-H169 PolarHBondContact O-ND1 3.36Å
166	F	87.7	Confident	87.9	Confident	12 Å²	12	39.2 Å²	39.2	5%	0.053	20%	0.2	C	C	.	.	H	α-helix	trans	-66.9	-34.8	173.6	-59.8	-47.7	0	0	0	112.7	I125 V130 A162 L163 T168 H169 N170 K171 Y173 F177	I125-F166 HydrophobicContact CB-CE1 4.35Å; I125-F166 HydrophobicContact CB-CZ 3.95Å; I125-F166 HydrophobicContact CD1-CE2 4.2Å; I125-F166 HydrophobicContact CD1-CZ 3.91Å; I125-F166 HydrophobicContact CG1-CZ 4.48Å; I125-F166 HydrophobicContact CG2-CZ 4.21Å; V130-F166 HydrophobicContact CB-CZ 4.27Å; V130-F166 HydrophobicContact CG1-CE2 3.76Å; V130-F166 HydrophobicContact CG1-CZ 3.55Å; V130-F166 HydrophobicContact CG2-CE1 4.13Å; V130-F166 HydrophobicContact CG2-CZ 3.76Å; A162-F166 HydrophobicContact CB-CE2 4.18Å; A162-F166 WeakPolarHBondContact O-CD2 3.24Å; A162-F166 WeakPolarHBondContact O-CG 3.32Å; A162-F166 PolarHBondContact O-N 2.91Å; L163-F166 PolarHBondContact O-N 3.23Å; F166-T168 VanDerWaalsContact C-N 3.34Å; F166-T168 PolarHBondContact O-N 2.92Å; F166-H169 PolarHBondContact O-N 2.68Å; F166-N170 CarbonylContact O-C 3.1Å; F166-N170 VanDerWaalsContact O-CA 3.31Å; F166-N170 WeakPolarHBondContact O-CA 3.39Å; F166-N170 PolarHBondContact O-N 2.85Å; F166-N170 VanDerWaalsContact O-O 3.04Å; F166-K171 PolarHBondContact O-N 2.73Å; F166-Y173 AromaticContact CD1-CD1 3.79Å; F166-Y173 HydrophobicContact CD1-CD1 3.79Å; F166-Y173 HydrophobicContact CD1-CE1 4.12Å; F166-Y173 HydrophobicContact CD2-CD1 4.43Å; F166-Y173 HydrophobicContact CE1-CD1 4.06Å; F166-Y173 AromaticContact CE1-CE1 3.9Å; F166-Y173 HydrophobicContact CE1-CE1 3.9Å; F166-Y173 HydrophobicContact CE2-CE1 4.39Å; F166-Y173 HydrophobicContact CG-CD1 4.01Å; F166-Y173 HydrophobicContact CG-CE1 4.48Å; F166-Y173 HydrophobicContact CZ-CD1 4.5Å; F166-Y173 HydrophobicContact CZ-CE1 4.06Å; F166-F177 HydrophobicContact CD2-CB 4.24Å; F166-F177 AromaticContact CD2-CD1 3.82Å; F166-F177 HydrophobicContact CD2-CD1 3.82Å; F166-F177 HydrophobicContact CD2-CD2 4.22Å; F166-F177 HydrophobicContact CD2-CE1 4.18Å; F166-F177 AromaticContact CD2-CG 3.84Å; F166-F177 HydrophobicContact CD2-CG 3.84Å; F166-F177 HydrophobicContact CE2-CD1 4.04Å; F166-F177 AromaticContact CE2-CD2 3.8Å; F166-F177 HydrophobicContact CE2-CD2 3.8Å; F166-F177 HydrophobicContact CE2-CE1 4.07Å; F166-F177 AromaticContact CE2-CE2 3.83Å; F166-F177 HydrophobicContact CE2-CE2 3.83Å; F166-F177 AromaticContact CE2-CG 3.91Å; F166-F177 HydrophobicContact CE2-CG 3.91Å; F166-F177 AromaticContact CE2-CZ 3.98Å; F166-F177 HydrophobicContact CE2-CZ 3.98Å
167	H	87.2	Confident	87.9	Confident	8 Å²	8	39.2 Å²	39.2	4%	0.037	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-38.5	176.7	-169	74.7	0	0	0	112.3	L163 R164 K171 E217 L218 S221 Y223	L163-H167 WeakPolarHBondContact O-CB 3.39Å; L163-H167 PolarHBondContact O-N 3.34Å; R164-H167 PolarHBondContact O-N 2.59Å; H167-K171 WeakPolarHBondContact NE2-CE 3.25Å; H167-K171 PolarHBondContact NE2-NZ 2.79Å; H167-K171 VanDerWaalsContact O-CE 3.32Å; H167-K171 WeakPolarHBondContact O-CE 3.41Å; H167-K171 WeakPolarHBondContact O-CG 3.25Å; H167-E217 IonicContact CD2-OE2 2.72Å; H167-L218 HydrophobicContact CB-CD2 3.61Å; H167-S221 PolarHBondContact CE1-OG 3.34Å; H167-S221 PolarHBondContact ND1-OG 2.92Å; H167-Y223 PolarHBondContact ND1-OH 3.38Å; H167-Y223 VanDerWaalsContact ND1-OH 3.09Å
168	T	85.8	Confident	87.9	Confident	81 Å²	81	39.3 Å²	39.3	50%	0.497	20%	0.201	S	C	.	.	H	α-helix	trans	-70.6	-40.3	178.2	-57.6	0	0	0	0	112.3	R164 S165 F166	R164-T168 PolarHBondContact O-N 2.87Å; R164-T168 PolarHBondContact O-OG1 3.02Å; S165-T168 PolarHBondContact O-N 3.2Å; F166-T168 VanDerWaalsContact C-N 3.34Å; F166-T168 PolarHBondContact O-N 2.92Å
169	H	81	Confident	88	Confident	137 Å²	137	42.4 Å²	42.4	63%	0.634	22%	0.222	S	C	*	.	H	α-helix	trans	-103.1	-28.7	-170.9	-55.9	96.1	0	0	0	115.1	S165 F166	S165-H169 PolarHBondContact O-N 3.22Å; S165-H169 VanDerWaalsContact O-N 3.15Å; S165-H169 PolarHBondContact O-ND1 3.36Å; F166-H169 PolarHBondContact O-N 2.68Å
170	N	82.7	Confident	87.9	Confident	64 Å²	64	47.6 Å²	47.6	34%	0.342	24%	0.242	S	C	.	.			trans	-152.4	73.1	-171.8	-168.4	-12	0	0	0	112.2	F166 P172 Y173 S174	F166-N170 CarbonylContact O-C 3.1Å; F166-N170 VanDerWaalsContact O-CA 3.31Å; F166-N170 WeakPolarHBondContact O-CA 3.39Å; F166-N170 PolarHBondContact O-N 2.85Å; F166-N170 VanDerWaalsContact O-O 3.04Å; N170-P172 WeakPolarHBondContact OD1-CD 3.38Å; N170-P172 WeakPolarHBondContact OD1-CG 3.26Å; N170-Y173 VanDerWaalsContact CG-CB 3.44Å; N170-Y173 WeakPolarHBondContact O-CB 3.22Å; N170-Y173 PolarHBondContact O-N 3.33Å; N170-Y173 WeakPolarHBondContact OD1-CB 3.44Å; N170-S174 PolarHBondContact O-N 3.43Å; N170-S174 VanDerWaalsContact O-N 3.13Å
171	K	80.3	Confident	88	Confident	115 Å²	115	47.4 Å²	47.4	50%	0.5	24%	0.241	S	C	.	.	H	α-helix	trans	-50.7	-46.8	-176	-67	-168.3	-175	-143.8	0	116.1	F166 H167 Y173 S174	F166-K171 PolarHBondContact O-N 2.73Å; H167-K171 WeakPolarHBondContact NE2-CE 3.25Å; H167-K171 PolarHBondContact NE2-NZ 2.79Å; H167-K171 VanDerWaalsContact O-CE 3.32Å; H167-K171 WeakPolarHBondContact O-CE 3.41Å; H167-K171 WeakPolarHBondContact O-CG 3.25Å; K171-Y173 PolarHBondContact O-N 3.38Å; K171-S174 PolarHBondContact O-N 2.7Å; K171-S174 PolarHBondContact O-OG 3.47Å
172	P	81.2	Confident	88.2	Confident	91 Å²	91	49.4 Å²	49.4	59%	0.591	25%	0.251	S	S	*	.	H	α-helix	trans	-63.8	-30.5	179.3	25.4	-33.9	0	0	0	112.4	N170	N170-P172 WeakPolarHBondContact OD1-CD 3.38Å; N170-P172 WeakPolarHBondContact OD1-CG 3.26Å
173	Y	83	Confident	88.3	Confident	33 Å²	33	51.7 Å²	51.7	13%	0.129	27%	0.266	C	S	.	.	H	α-helix	trans	-73.6	-34	177	-164.3	-113.1	0	0	0	112.6	V130 W131 F166 N170 K171 V175 Q176 F177	V130-Y173 HydrophobicContact CB-CE1 4.2Å; V130-Y173 WeakPolarHBondContact CB-OH 3.44Å; V130-Y173 HydrophobicContact CG1-CE1 3.84Å; V130-Y173 WeakPolarHBondContact CG1-OH 3.48Å; V130-Y173 HydrophobicContact CG2-CE1 3.81Å; V130-Y173 WeakPolarHBondContact CG2-OH 3.47Å; W131-Y173 HydrophobicContact CZ2-CE2 4.08Å; F166-Y173 AromaticContact CD1-CD1 3.79Å; F166-Y173 HydrophobicContact CD1-CD1 3.79Å; F166-Y173 HydrophobicContact CD1-CE1 4.12Å; F166-Y173 HydrophobicContact CD2-CD1 4.43Å; F166-Y173 HydrophobicContact CE1-CD1 4.06Å; F166-Y173 AromaticContact CE1-CE1 3.9Å; F166-Y173 HydrophobicContact CE1-CE1 3.9Å; F166-Y173 HydrophobicContact CE2-CE1 4.39Å; F166-Y173 HydrophobicContact CG-CD1 4.01Å; F166-Y173 HydrophobicContact CG-CE1 4.48Å; F166-Y173 HydrophobicContact CZ-CD1 4.5Å; F166-Y173 HydrophobicContact CZ-CE1 4.06Å; N170-Y173 VanDerWaalsContact CG-CB 3.44Å; N170-Y173 WeakPolarHBondContact O-CB 3.22Å; N170-Y173 PolarHBondContact O-N 3.33Å; N170-Y173 WeakPolarHBondContact OD1-CB 3.44Å; K171-Y173 PolarHBondContact O-N 3.38Å; Y173-V175 VanDerWaalsContact C-N 3.26Å; Y173-V175 PolarHBondContact O-N 2.92Å; Y173-Q176 PolarHBondContact O-N 2.7Å; Y173-F177 WeakPolarHBondContact O-CB 3.3Å; Y173-F177 PolarHBondContact O-N 3.08Å
174	S	88.3	Confident	88.4	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.007	27%	0.273	C	S	.	.	H	α-helix	trans	-59.2	-34.1	174.4	73.2	0	0	0	0	113.3	L163 N170 K171 F178 Y223	L163-S174 WeakPolarHBondContact CD1-O 3.29Å; N170-S174 PolarHBondContact O-N 3.43Å; N170-S174 VanDerWaalsContact O-N 3.13Å; K171-S174 PolarHBondContact O-N 2.7Å; K171-S174 PolarHBondContact O-OG 3.47Å; S174-F178 WeakPolarHBondContact O-CB 3.38Å; S174-F178 PolarHBondContact O-N 3.11Å; S174-Y223 PolarHBondContact OG-OH 3.43Å; S174-Y223 VanDerWaalsContact OG-OH 3.1Å
175	V	88.2	Confident	88.6	Confident	81 Å²	81	50.5 Å²	50.5	49%	0.491	26%	0.264	S	S	.	.	H	α-helix	trans	-69.7	-42.7	175.8	-178.7	0	0	0	0	111.5	Y173 F178 S179 Y223	Y173-V175 VanDerWaalsContact C-N 3.26Å; Y173-V175 PolarHBondContact O-N 2.92Å; V175-F178 PolarHBondContact O-N 3.1Å; V175-S179 PolarHBondContact O-N 2.81Å; V175-Y223 HydrophobicContact CG2-CD1 4.46Å; V175-Y223 HydrophobicContact CG2-CE1 4.03Å
176	Q	88.3	Confident	89	Confident	116 Å²	116	54 Å²	54	54%	0.542	28%	0.277	S	S	.	.	H	α-helix	trans	-64.3	-41.9	176	-64.6	-178.4	5.6	0	0	111.5	Y173 S179 R180	Y173-Q176 PolarHBondContact O-N 2.7Å; Q176-S179 PolarHBondContact O-N 2.99Å; Q176-R180 PolarHBondContact O-N 2.98Å
177	F	91.5	Very high	89.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.4	-46.8	175.6	-171.5	-108.2	0	0	0	111.5	V130 W131 F133 L134 A162 L163 F166 Y173 R180 I181	V130-F177 HydrophobicContact CG1-CD2 3.68Å; V130-F177 HydrophobicContact CG1-CE2 3.69Å; W131-F177 HydrophobicContact CZ3-CD2 4.29Å; F133-F177 HydrophobicContact CD1-CZ 4.48Å; F133-F177 HydrophobicContact CE1-CZ 4.4Å; L134-F177 HydrophobicContact CB-CE2 4.12Å; L134-F177 HydrophobicContact CD1-CE2 4.25Å; L134-F177 HydrophobicContact CD1-CZ 4.33Å; L134-F177 HydrophobicContact CD2-CE2 4.38Å; L134-F177 HydrophobicContact CG-CE2 4.48Å; A162-F177 HydrophobicContact CB-CE1 3.59Å; A162-F177 HydrophobicContact CB-CZ 3.58Å; L163-F177 HydrophobicContact CB-CD1 4.21Å; L163-F177 HydrophobicContact CB-CE1 4.3Å; L163-F177 HydrophobicContact CD1-CD1 4.22Å; F166-F177 HydrophobicContact CD2-CB 4.24Å; F166-F177 AromaticContact CD2-CD1 3.82Å; F166-F177 HydrophobicContact CD2-CD1 3.82Å; F166-F177 HydrophobicContact CD2-CD2 4.22Å; F166-F177 HydrophobicContact CD2-CE1 4.18Å; F166-F177 AromaticContact CD2-CG 3.84Å; F166-F177 HydrophobicContact CD2-CG 3.84Å; F166-F177 HydrophobicContact CE2-CD1 4.04Å; F166-F177 AromaticContact CE2-CD2 3.8Å; F166-F177 HydrophobicContact CE2-CD2 3.8Å; F166-F177 HydrophobicContact CE2-CE1 4.07Å; F166-F177 AromaticContact CE2-CE2 3.83Å; F166-F177 HydrophobicContact CE2-CE2 3.83Å; F166-F177 AromaticContact CE2-CG 3.91Å; F166-F177 HydrophobicContact CE2-CG 3.91Å; F166-F177 AromaticContact CE2-CZ 3.98Å; F166-F177 HydrophobicContact CE2-CZ 3.98Å; Y173-F177 WeakPolarHBondContact O-CB 3.3Å; Y173-F177 PolarHBondContact O-N 3.08Å; F177-R180 PolarHBondContact O-N 3.26Å; F177-I181 HydrophobicContact CD1-CD1 3.72Å; F177-I181 HydrophobicContact CE1-CD1 3.53Å; F177-I181 HydrophobicContact CE1-CG1 4.48Å; F177-I181 HydrophobicContact CZ-CD1 4.17Å; F177-I181 WeakPolarHBondContact O-CG1 3.34Å; F177-I181 PolarHBondContact O-N 3.08Å
178	F	93.3	Very high	89.5	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-59.7	-48.7	175.4	-171.5	-80	0	0	0	112.4	L163 S174 V175 R180 I181 E182 F208 V212 Y223 G224 I226	L163-F178 HydrophobicContact CD1-CB 4.08Å; L163-F178 HydrophobicContact CD1-CD2 4.4Å; L163-F178 HydrophobicContact CD2-CD2 3.83Å; L163-F178 HydrophobicContact CD2-CE2 4.47Å; S174-F178 WeakPolarHBondContact O-CB 3.38Å; S174-F178 PolarHBondContact O-N 3.11Å; V175-F178 PolarHBondContact O-N 3.1Å; F178-R180 PolarHBondContact O-N 2.65Å; F178-I181 WeakPolarHBondContact O-CA 3.44Å; F178-I181 WeakPolarHBondContact O-CB 3.49Å; F178-I181 PolarHBondContact O-N 3.15Å; F178-E182 HydrophobicContact CE1-CB 4.48Å; F178-E182 PolarHBondContact O-N 3.21Å; F178-F208 HydrophobicContact CD2-CE1 4.47Å; F178-F208 HydrophobicContact CD2-CZ 4.26Å; F178-F208 AromaticContact CE2-CE1 3.93Å; F178-F208 HydrophobicContact CE2-CE1 3.93Å; F178-F208 HydrophobicContact CE2-CZ 4.11Å; F178-V212 HydrophobicContact CE2-CG1 4.29Å; F178-Y223 HydrophobicContact CB-CD1 3.82Å; F178-Y223 HydrophobicContact CB-CE1 4.23Å; F178-Y223 HydrophobicContact CB-CG 4.4Å; F178-Y223 HydrophobicContact CD1-CD1 4.42Å; F178-Y223 HydrophobicContact CD1-CG 4.4Å; F178-Y223 HydrophobicContact CD2-CD1 4.13Å; F178-Y223 HydrophobicContact CD2-CD2 4.27Å; F178-Y223 AromaticContact CD2-CG 3.85Å; F178-Y223 HydrophobicContact CD2-CG 3.85Å; F178-Y223 HydrophobicContact CE2-CG 4.24Å; F178-Y223 AromaticContact CG-CD1 3.85Å; F178-Y223 HydrophobicContact CG-CD1 3.85Å; F178-Y223 AromaticContact CG-CG 3.94Å; F178-Y223 HydrophobicContact CG-CG 3.94Å; F178-G224 WeakPolarHBondContact CE1-O 3.47Å; F178-G224 WeakPolarHBondContact CZ-O 3.46Å; F178-I226 HydrophobicContact CZ-CB 4.35Å; F178-I226 HydrophobicContact CZ-CG2 4.39Å
179	S	91.8	Very high	89.9	Confident	65 Å²	65	53.8 Å²	53.8	46%	0.455	27%	0.272	S	S	.	.	H	α-helix	trans	-61.4	-32.9	179.3	-175.6	0	0	0	0	112	V175 Q176 S183	V175-S179 PolarHBondContact O-N 2.81Å; Q176-S179 PolarHBondContact O-N 2.99Å; S179-S183 WeakPolarHBondContact O-CB 3.46Å; S179-S183 PolarHBondContact O-N 3.14Å
180	R	92.4	Very high	90.4	Very high	111 Å²	111	52.8 Å²	52.8	42%	0.419	27%	0.268	S	S	.	.	H	α-helix	trans	-73.1	-33.8	173.3	-162.9	63.2	178	112.8	7.6	112.6	W131 L134 Q176 F177 F178 S183 N184	W131-R180 HydrophobicContact CE3-CG 4.29Å; W131-R180 HydrophobicContact CH2-CB 4.33Å; W131-R180 HydrophobicContact CZ3-CB 3.75Å; W131-R180 HydrophobicContact CZ3-CG 3.83Å; L134-R180 HydrophobicContact CD2-CB 3.87Å; L134-R180 HydrophobicContact CD2-CG 3.55Å; Q176-R180 PolarHBondContact O-N 2.98Å; F177-R180 PolarHBondContact O-N 3.26Å; F178-R180 PolarHBondContact O-N 2.65Å; R180-S183 PolarHBondContact NH1-OG 2.79Å; R180-S183 PolarHBondContact O-N 2.96Å; R180-N184 PolarHBondContact O-N 3.14Å; R180-N184 VanDerWaalsContact O-N 3.08Å; R180-N184 PolarHBondContact O-ND2 2.91Å
181	I	94.6	Very high	90.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61.4	-51.9	170.9	-70.6	165.6	0	0	0	110.4	L134 L159 F177 F178 S183 N184 F185 F208 I226	L134-I181 HydrophobicContact CD1-CG1 3.68Å; L159-I181 HydrophobicContact CB-CD1 4.22Å; L159-I181 HydrophobicContact CD1-CG2 4.44Å; L159-I181 HydrophobicContact CD2-CD1 4.03Å; L159-I181 HydrophobicContact CD2-CG1 4.12Å; F177-I181 HydrophobicContact CD1-CD1 3.72Å; F177-I181 HydrophobicContact CE1-CD1 3.53Å; F177-I181 HydrophobicContact CE1-CG1 4.48Å; F177-I181 HydrophobicContact CZ-CD1 4.17Å; F177-I181 WeakPolarHBondContact O-CG1 3.34Å; F177-I181 PolarHBondContact O-N 3.08Å; F178-I181 WeakPolarHBondContact O-CA 3.44Å; F178-I181 WeakPolarHBondContact O-CB 3.49Å; F178-I181 PolarHBondContact O-N 3.15Å; I181-S183 VanDerWaalsContact C-N 3.29Å; I181-S183 PolarHBondContact O-N 3.15Å; I181-N184 PolarHBondContact O-N 3.16Å; I181-F185 HydrophobicContact CG2-CD2 3.63Å; I181-F185 HydrophobicContact CG2-CE2 3.45Å; I181-F185 VanDerWaalsContact CG2-CE2 3.45Å; I181-F185 WeakPolarHBondContact O-CD2 3.5Å; I181-F185 PolarHBondContact O-N 2.77Å; I181-F208 HydrophobicContact CD1-CE2 4.39Å; I181-F208 HydrophobicContact CD1-CZ 3.99Å; I181-F208 HydrophobicContact CG2-CD1 4.48Å; I181-F208 HydrophobicContact CG2-CE1 3.88Å; I181-F208 HydrophobicContact CG2-CZ 4.12Å; I181-I226 HydrophobicContact CG2-CD1 4.39Å
182	E	94.3	Very high	91.2	Very high	50 Å²	50	51.1 Å²	51.1	23%	0.234	26%	0.261	C	S	.	.	H	α-helix	trans	-53.8	-45.6	175.5	-178.2	179	-154.7	0	0	111.4	F178 N184 F185 K186 E229	F178-E182 HydrophobicContact CE1-CB 4.48Å; F178-E182 PolarHBondContact O-N 3.21Å; E182-N184 VanDerWaalsContact C-N 3.31Å; E182-N184 PolarHBondContact O-N 2.81Å; E182-F185 PolarHBondContact O-N 3.04Å; E182-K186 WeakPolarHBondContact O-CB 3.5Å; E182-K186 PolarHBondContact O-N 3.43Å; E182-E229 HydrophobicContact CG-CG 4.19Å
183	S	93.5	Very high	91.6	Very high	47 Å²	47	51.1 Å²	51.1	33%	0.329	26%	0.264	S	S	.	.	H	α-helix	trans	-59.7	-33.4	174.2	168.1	0	0	0	0	114.2	S179 R180 I181 Q187	S179-S183 WeakPolarHBondContact O-CB 3.46Å; S179-S183 PolarHBondContact O-N 3.14Å; R180-S183 PolarHBondContact NH1-OG 2.79Å; R180-S183 PolarHBondContact O-N 2.96Å; I181-S183 VanDerWaalsContact C-N 3.29Å; I181-S183 PolarHBondContact O-N 3.15Å; S183-Q187 WeakPolarHBondContact O-CB 3.34Å; S183-Q187 PolarHBondContact O-N 3.26Å; S183-Q187 VanDerWaalsContact O-N 3.15Å
184	N	93.9	Very high	92.1	Very high	26 Å²	26	51.4 Å²	51.4	14%	0.139	27%	0.27	C	S	.	.	H	α-helix	trans	-76.5	-41.6	177	-81.2	-89.5	0	0	0	111.3	M138 R180 I181 E182 K186 Q187 I188	M138-N184 HydrophobicContact CB-CB 4.5Å; M138-N184 HydrophobicContact CE-CB 3.66Å; M138-N184 HydrophobicContact CG-CB 4.29Å; R180-N184 PolarHBondContact O-N 3.14Å; R180-N184 VanDerWaalsContact O-N 3.08Å; R180-N184 PolarHBondContact O-ND2 2.91Å; I181-N184 PolarHBondContact O-N 3.16Å; E182-N184 VanDerWaalsContact C-N 3.31Å; E182-N184 PolarHBondContact O-N 2.81Å; N184-K186 VanDerWaalsContact C-N 3.32Å; N184-K186 PolarHBondContact O-N 2.91Å; N184-Q187 WeakPolarHBondContact O-CB 3.43Å; N184-Q187 PolarHBondContact O-N 2.83Å; N184-Q187 VanDerWaalsContact O-N 3.13Å; N184-I188 WeakPolarHBondContact O-CG1 3.4Å; N184-I188 PolarHBondContact O-N 3.23Å
185	F	95.2	Very high	92.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.9	-37.9	174.9	-75.7	-67.8	0	0	0	112.5	M138 L159 I181 E182 Q187 I188 A189 W201 A205 I226 E229 I233	M138-F185 HydrophobicContact CE-CD1 4.01Å; M138-F185 HydrophobicContact CE-CD2 3.98Å; M138-F185 HydrophobicContact CE-CE1 3.85Å; M138-F185 HydrophobicContact CE-CE2 3.87Å; M138-F185 HydrophobicContact CE-CG 4.1Å; M138-F185 HydrophobicContact CE-CZ 3.8Å; M138-F185 HydrophobicContact SD-CE2 4.41Å; M138-F185 HydrophobicContact SD-CZ 4.29Å; L159-F185 HydrophobicContact CD1-CE2 4.39Å; L159-F185 HydrophobicContact CD1-CZ 4.41Å; I181-F185 HydrophobicContact CG2-CD2 3.63Å; I181-F185 HydrophobicContact CG2-CE2 3.45Å; I181-F185 VanDerWaalsContact CG2-CE2 3.45Å; I181-F185 WeakPolarHBondContact O-CD2 3.5Å; I181-F185 PolarHBondContact O-N 2.77Å; E182-F185 PolarHBondContact O-N 3.04Å; F185-Q187 VanDerWaalsContact C-N 3.34Å; F185-Q187 PolarHBondContact O-N 3.4Å; F185-I188 HydrophobicContact CD1-CD1 4.19Å; F185-I188 PolarHBondContact O-N 2.9Å; F185-A189 PolarHBondContact O-N 3.28Å; F185-W201 AromaticContact CE1-CE3 3.94Å; F185-W201 HydrophobicContact CE1-CE3 3.94Å; F185-A205 HydrophobicContact CD1-CB 3.72Å; F185-A205 HydrophobicContact CE1-CB 3.47Å; F185-A205 VanDerWaalsContact CE1-CB 3.47Å; F185-A205 HydrophobicContact CG-CB 4.39Å; F185-A205 HydrophobicContact CZ-CB 3.94Å; F185-I226 HydrophobicContact CB-CD1 4.43Å; F185-I226 HydrophobicContact CD2-CD1 3.4Å; F185-I226 HydrophobicContact CE2-CD1 3.81Å; F185-I226 HydrophobicContact CG-CD1 4.13Å; F185-E229 HydrophobicContact CB-CB 4.22Å; F185-I233 HydrophobicContact CB-CD1 4.28Å; F185-I233 HydrophobicContact CD1-CD1 3.84Å
186	K	94.1	Very high	92.5	Very high	89 Å²	89	52.2 Å²	52.2	39%	0.387	27%	0.27	S	S	.	.	H	α-helix	trans	-59.3	-42.7	169.6	-175.6	175	178.2	-179	0	112.5	E182 N184 A189 Q190 E229	E182-K186 WeakPolarHBondContact O-CB 3.5Å; E182-K186 PolarHBondContact O-N 3.43Å; N184-K186 VanDerWaalsContact C-N 3.32Å; N184-K186 PolarHBondContact O-N 2.91Å; K186-A189 PolarHBondContact O-N 3.43Å; K186-Q190 WeakPolarHBondContact O-CG 3.49Å; K186-Q190 PolarHBondContact O-N 2.98Å; K186-E229 WeakPolarHBondContact CA-OE2 3.31Å; K186-E229 HydrophobicContact CB-CG 4.3Å; K186-E229 WeakPolarHBondContact CB-OE2 3.27Å; K186-E229 WeakPolarHBondContact CG-OE2 3.32Å
187	Q	93.5	Very high	92.7	Very high	72 Å²	72	47.8 Å²	47.8	34%	0.336	25%	0.25	S	S	.	.	H	α-helix	trans	-64.8	-44.6	176.6	-171.8	177.2	-14.2	0	0	111.3	S183 N184 F185 A189 Q190 E191	S183-Q187 WeakPolarHBondContact O-CB 3.34Å; S183-Q187 PolarHBondContact O-N 3.26Å; S183-Q187 VanDerWaalsContact O-N 3.15Å; N184-Q187 WeakPolarHBondContact O-CB 3.43Å; N184-Q187 PolarHBondContact O-N 2.83Å; N184-Q187 VanDerWaalsContact O-N 3.13Å; F185-Q187 VanDerWaalsContact C-N 3.34Å; F185-Q187 PolarHBondContact O-N 3.4Å; Q187-A189 VanDerWaalsContact C-N 3.32Å; Q187-A189 PolarHBondContact O-N 2.96Å; Q187-Q190 PolarHBondContact O-N 3.47Å; Q187-E191 HydrophobicContact CG-CG 4.14Å; Q187-E191 WeakPolarHBondContact CG-OE1 3.41Å; Q187-E191 WeakPolarHBondContact CG-OE2 3.5Å; Q187-E191 PolarHBondContact NE2-OE1 3.11Å; Q187-E191 PolarHBondContact NE2-OE2 2.59Å; Q187-E191 WeakPolarHBondContact O-CB 3.34Å; Q187-E191 PolarHBondContact O-N 2.66Å
188	I	93	Very high	92.8	Very high	18 Å²	18	47.8 Å²	47.8	9%	0.092	25%	0.25	C	S	.	.	H	α-helix	trans	-55.8	-45.4	174.5	-70.5	158.7	0	0	0	111.1	M138 N184 F185 Q190 C192 W201	M138-I188 HydrophobicContact CE-CD1 3.73Å; N184-I188 WeakPolarHBondContact O-CG1 3.4Å; N184-I188 PolarHBondContact O-N 3.23Å; F185-I188 HydrophobicContact CD1-CD1 4.19Å; F185-I188 PolarHBondContact O-N 2.9Å; I188-Q190 PolarHBondContact O-N 3.41Å; I188-C192 HydrophobicContact CG2-CB 4.26Å; I188-C192 WeakPolarHBondContact O-CB 3.44Å; I188-C192 PolarHBondContact O-N 2.93Å; I188-W201 HydrophobicContact CD1-CB 4.49Å; I188-W201 HydrophobicContact CD1-CD2 3.68Å; I188-W201 HydrophobicContact CD1-CE3 4.14Å; I188-W201 HydrophobicContact CD1-CG 3.83Å; I188-W201 HydrophobicContact CD1-CZ2 4.49Å; I188-W201 HydrophobicContact CG1-CG 4.45Å; I188-W201 HydrophobicContact CG2-CB 3.83Å; I188-W201 HydrophobicContact CG2-CG 3.84Å
189	A	93.2	Very high	92.9	Very high	8 Å²	8	47.5 Å²	47.5	7%	0.066	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-23.7	177.6	0	0	0	0	0	114.3	F185 K186 Q187 R232 I233 R236	F185-A189 PolarHBondContact O-N 3.28Å; K186-A189 PolarHBondContact O-N 3.43Å; Q187-A189 VanDerWaalsContact C-N 3.32Å; Q187-A189 PolarHBondContact O-N 2.96Å; A189-R232 HydrophobicContact CB-CB 3.8Å; A189-I233 HydrophobicContact CB-CG1 3.82Å; A189-R236 WeakPolarHBondContact O-CG 3.36Å
190	Q	92.1	Very high	93.1	Very high	116 Å²	116	44.4 Å²	44.4	54%	0.542	23%	0.227	S	C	.	.	H	α-helix	trans	-97	-38	-177.1	-71.1	-179.4	-18.6	0	0	113.1	K186 Q187 I188 R236	K186-Q190 WeakPolarHBondContact O-CG 3.49Å; K186-Q190 PolarHBondContact O-N 2.98Å; Q187-Q190 PolarHBondContact O-N 3.47Å; I188-Q190 PolarHBondContact O-N 3.41Å; Q190-R236 PolarHBondContact O-NH1 2.86Å; Q190-R236 PolarHBondContact O-NH2 3.22Å
191	E	89.9	Confident	93.2	Very high	127 Å²	127	39.1 Å²	39.1	59%	0.593	21%	0.207	S	C	*	.	H	α-helix	trans	-100.9	-32.2	-171.6	-65.6	178.3	-175.7	0	0	113.1	Q187 R236	Q187-E191 HydrophobicContact CG-CG 4.14Å; Q187-E191 WeakPolarHBondContact CG-OE1 3.41Å; Q187-E191 WeakPolarHBondContact CG-OE2 3.5Å; Q187-E191 PolarHBondContact NE2-OE1 3.11Å; Q187-E191 PolarHBondContact NE2-OE2 2.59Å; Q187-E191 WeakPolarHBondContact O-CB 3.34Å; Q187-E191 PolarHBondContact O-N 2.66Å; E191-R236 PolarHBondContact O-NH2 3.18Å
192	C	90	Very high	93.3	Very high	16 Å²	16	39.1 Å²	39.1	11%	0.108	21%	0.207	C	C	.	.			trans	-70.6	136	-173.7	-164.9	0	0	0	0	112.5	I188 L198 R236	I188-C192 HydrophobicContact CG2-CB 4.26Å; I188-C192 WeakPolarHBondContact O-CB 3.44Å; I188-C192 PolarHBondContact O-N 2.93Å; C192-L198 HydrophobicContact CB-CD2 3.91Å; C192-L198 HydrophobicContact CB-CG 4.09Å; C192-R236 PolarHBondContact O-NE 3.42Å; C192-R236 PolarHBondContact O-NH2 3.14Å
193	S	89.8	Confident	93.4	Very high	92 Å²	92	36.8 Å²	36.8	64%	0.643	20%	0.197	S	C	*	.			trans	-121.1	-10	-179.6	55.3	0	0	0	0	113.6	V240	S193-V240 WeakPolarHBondContact O-CG1 3.43Å
194	S	92.2	Very high	93.4	Very high	38 Å²	38	34.6 Å²	34.6	27%	0.266	18%	0.181	S	C	.	.			trans	-83.3	125.1	179.5	166.1	0	0	0	0	110.2	D196 D197 L198	S194-D196 PolarHBondContact O-N 2.9Å; S194-D197 WeakPolarHBondContact CB-OD2 3.43Å; S194-D197 PolarHBondContact OG-N 3.5Å; S194-D197 PolarHBondContact OG-OD2 2.95Å; S194-L198 WeakPolarHBondContact O-CB 3.24Å; S194-L198 WeakPolarHBondContact O-CD1 3.37Å; S194-L198 VanDerWaalsContact O-CG 3.31Å; S194-L198 WeakPolarHBondContact O-CG 3.44Å; S194-L198 PolarHBondContact O-N 2.86Å
195	K	93.2	Very high	93.5	Very high	38 Å²	38	33.4 Å²	33.4	17%	0.165	18%	0.175	C	C	.	.	H	α-helix	trans	-61	-36.3	177.6	68.6	163.5	-164.3	173	0	111.8	L198 I199 L237 V240 L241 T272 T273	K195-L198 PolarHBondContact O-N 3.15Å; K195-I199 WeakPolarHBondContact O-CB 3.47Å; K195-I199 WeakPolarHBondContact O-CD1 3.47Å; K195-I199 WeakPolarHBondContact O-CG1 3.17Å; K195-I199 PolarHBondContact O-N 3.29Å; K195-L237 HydrophobicContact CB-CD1 4.09Å; K195-V240 HydrophobicContact CB-CG1 4.26Å; K195-L241 HydrophobicContact CB-CD2 4.03Å; K195-L241 HydrophobicContact CD-CD2 3.74Å; K195-T272 PolarHBondContact NZ-OG1 2.62Å; K195-T273 PolarHBondContact NZ-OG1 3.01Å
196	D	91.9	Very high	93.6	Very high	61 Å²	61	33.4 Å²	33.4	33%	0.326	18%	0.175	S	C	.	.	H	α-helix	trans	-79.6	-34.2	-170.5	-60.4	-45.5	0	0	0	111.2	S194 F200 Q276	S194-D196 PolarHBondContact O-N 2.9Å; D196-F200 WeakPolarHBondContact O-CB 3.46Å; D196-F200 PolarHBondContact O-N 2.83Å; D196-Q276 HydrophobicContact CB-CG 4.12Å; D196-Q276 WeakPolarHBondContact OD1-CG 3.33Å
197	D	92.3	Very high	93.6	Very high	23 Å²	23	29.3 Å²	29.3	12%	0.123	16%	0.157	C	C	.	.	H	α-helix	trans	-71.5	-39.4	170.9	-62	-57.2	0	0	0	111.5	A143 S194 I199 F200 W201	A143-D197 HydrophobicContact CB-CB 4.46Å; A143-D197 WeakPolarHBondContact CB-OD1 3.44Å; S194-D197 WeakPolarHBondContact CB-OD2 3.43Å; S194-D197 PolarHBondContact OG-N 3.5Å; S194-D197 PolarHBondContact OG-OD2 2.95Å; D197-I199 PolarHBondContact O-N 2.82Å; D197-F200 PolarHBondContact O-N 3.45Å; D197-W201 WeakPolarHBondContact O-CB 3.49Å; D197-W201 PolarHBondContact O-N 2.78Å
198	L	95.3	Very high	93.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.2	-39.4	174.7	-78	165.3	0	0	0	112	C192 S194 K195 L202 I233 R236 L237 V240	C192-L198 HydrophobicContact CB-CD2 3.91Å; C192-L198 HydrophobicContact CB-CG 4.09Å; S194-L198 WeakPolarHBondContact O-CB 3.24Å; S194-L198 WeakPolarHBondContact O-CD1 3.37Å; S194-L198 VanDerWaalsContact O-CG 3.31Å; S194-L198 WeakPolarHBondContact O-CG 3.44Å; S194-L198 PolarHBondContact O-N 2.86Å; K195-L198 PolarHBondContact O-N 3.15Å; L198-L202 VanDerWaalsContact O-CB 3.24Å; L198-L202 WeakPolarHBondContact O-CB 3.4Å; L198-L202 PolarHBondContact O-N 3.11Å; L198-I233 HydrophobicContact CD2-CG2 4.09Å; L198-R236 HydrophobicContact CD1-CG 3.9Å; L198-R236 HydrophobicContact CD2-CB 4.34Å; L198-R236 HydrophobicContact CD2-CG 3.86Å; L198-L237 HydrophobicContact CB-CB 4.19Å; L198-L237 HydrophobicContact CB-CD1 3.92Å; L198-V240 HydrophobicContact CD1-CB 4.41Å; L198-V240 HydrophobicContact CD1-CG2 3.88Å
199	I	95.6	Very high	93.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-45.9	172.8	-71.7	162.9	0	0	0	111.1	K195 D197 W201 L202 A203 L237 T273 Q276 A277 C280	K195-I199 WeakPolarHBondContact O-CB 3.47Å; K195-I199 WeakPolarHBondContact O-CD1 3.47Å; K195-I199 WeakPolarHBondContact O-CG1 3.17Å; K195-I199 PolarHBondContact O-N 3.29Å; D197-I199 PolarHBondContact O-N 2.82Å; I199-W201 PolarHBondContact O-N 3Å; I199-L202 PolarHBondContact O-N 3.11Å; I199-A203 PolarHBondContact O-N 2.65Å; I199-L237 HydrophobicContact CD1-CD1 4.32Å; I199-L237 HydrophobicContact CG1-CD1 3.86Å; I199-L237 HydrophobicContact CG1-CD2 3.57Å; I199-L237 HydrophobicContact CG1-CG 4.38Å; I199-T273 HydrophobicContact CD1-CG2 3.88Å; I199-Q276 HydrophobicContact CB-CG 4.34Å; I199-Q276 HydrophobicContact CD1-CB 4.2Å; I199-Q276 HydrophobicContact CD1-CG 4.09Å; I199-Q276 HydrophobicContact CG2-CG 4.05Å; I199-A277 HydrophobicContact CG2-CB 4.23Å; I199-C280 HydrophobicContact CG2-CB 4.03Å
200	F	94.4	Very high	93.5	Very high	1 Å²	1	25.9 Å²	25.9	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-59.9	-44.6	177.6	173.9	-90.1	0	0	0	112.3	A142 A143 R152 P155 D196 D197 N204	A142-F200 HydrophobicContact CB-CE1 4.38Å; A142-F200 HydrophobicContact CB-CZ 4.21Å; A142-F200 VanDerWaalsContact O-CZ 3.24Å; A142-F200 WeakPolarHBondContact O-CZ 3.41Å; A143-F200 HydrophobicContact CB-CB 4.28Å; A143-F200 HydrophobicContact CB-CD1 3.38Å; A143-F200 HydrophobicContact CB-CD2 4.45Å; A143-F200 HydrophobicContact CB-CE1 3.71Å; A143-F200 HydrophobicContact CB-CG 3.79Å; A143-F200 HydrophobicContact CB-CZ 4.37Å; R152-F200 HydrophobicContact CB-CE2 4.36Å; R152-F200 WeakPolarHBondContact O-CE2 3.37Å; P155-F200 HydrophobicContact CG-CE1 4.32Å; P155-F200 HydrophobicContact CG-CZ 3.9Å; D196-F200 WeakPolarHBondContact O-CB 3.46Å; D196-F200 PolarHBondContact O-N 2.83Å; D197-F200 PolarHBondContact O-N 3.45Å; F200-N204 PolarHBondContact O-N 2.65Å; F200-N204 VanDerWaalsContact O-N 3.09Å; F200-N204 PolarHBondContact O-ND2 2.98Å
201	W	95.2	Very high	93.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-74.1	-32	178.8	-73.1	124.3	0	0	0	113.1	V137 M138 N140 P155 F185 I188 D197 I199 N204 A205	V137-W201 WeakPolarHBondContact O-CH2 3.48Å; M138-W201 HydrophobicContact CE-CE3 4.43Å; M138-W201 HydrophobicContact CE-CZ3 4.13Å; M138-W201 WeakPolarHBondContact O-CZ2 3.41Å; M138-W201 HydrophobicContact SD-CH2 4.32Å; M138-W201 HydrophobicContact SD-CZ3 3.99Å; N140-W201 PolarHBondContact OD1-NE1 2.83Å; P155-W201 HydrophobicContact CB-CZ3 4.18Å; F185-W201 AromaticContact CE1-CE3 3.94Å; F185-W201 HydrophobicContact CE1-CE3 3.94Å; I188-W201 HydrophobicContact CD1-CB 4.49Å; I188-W201 HydrophobicContact CD1-CD2 3.68Å; I188-W201 HydrophobicContact CD1-CE3 4.14Å; I188-W201 HydrophobicContact CD1-CG 3.83Å; I188-W201 HydrophobicContact CD1-CZ2 4.49Å; I188-W201 HydrophobicContact CG1-CG 4.45Å; I188-W201 HydrophobicContact CG2-CB 3.83Å; I188-W201 HydrophobicContact CG2-CG 3.84Å; D197-W201 WeakPolarHBondContact O-CB 3.49Å; D197-W201 PolarHBondContact O-N 2.78Å; I199-W201 PolarHBondContact O-N 3Å; W201-N204 HydrophobicContact CE3-CB 4.2Å; W201-N204 HydrophobicContact CZ3-CB 4.49Å; W201-N204 PolarHBondContact O-N 3.36Å; W201-A205 WeakPolarHBondContact O-CB 3.4Å; W201-A205 PolarHBondContact O-N 3.31Å
202	L	96.7	Very high	93.5	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.7	-43.2	171.9	-177.3	67.5	0	0	0	111.6	L198 I199 S206 I230 I233 F234 L237 L282	L198-L202 VanDerWaalsContact O-CB 3.24Å; L198-L202 WeakPolarHBondContact O-CB 3.4Å; L198-L202 PolarHBondContact O-N 3.11Å; I199-L202 PolarHBondContact O-N 3.11Å; L202-S206 WeakPolarHBondContact O-CB 3.45Å; L202-S206 PolarHBondContact O-N 2.98Å; L202-S206 VanDerWaalsContact O-N 3.08Å; L202-S206 PolarHBondContact O-OG 3.09Å; L202-I230 HydrophobicContact CD1-CG2 3.92Å; L202-I233 HydrophobicContact CB-CG2 3.87Å; L202-I233 HydrophobicContact CD1-CB 4.37Å; L202-I233 HydrophobicContact CD1-CG2 4.2Å; L202-F234 HydrophobicContact CD1-CB 4.05Å; L202-F234 HydrophobicContact CD2-CD2 3.94Å; L202-L237 HydrophobicContact CD2-CD2 4.24Å; L202-L282 HydrophobicContact CB-CD1 4.33Å; L202-L282 HydrophobicContact CD2-CD1 3.84Å; L202-L282 HydrophobicContact CD2-CD2 4.05Å; L202-L282 HydrophobicContact CG-CD1 3.81Å
203	A	95.5	Very high	93.5	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.008	10%	0.104	C	C	.	.	H	α-helix	trans	-62.8	-49.6	176	0	0	0	0	0	111.1	L153 I199 S206 E207 C280 L282	L153-A203 HydrophobicContact CD2-CB 3.89Å; I199-A203 PolarHBondContact O-N 2.65Å; A203-S206 PolarHBondContact O-N 2.96Å; A203-S206 PolarHBondContact O-OG 3.05Å; A203-E207 WeakPolarHBondContact O-CB 3.35Å; A203-E207 PolarHBondContact O-N 3.38Å; A203-C280 HydrophobicContact CB-CB 4.2Å; A203-L282 HydrophobicContact CB-CB 4.17Å; A203-L282 HydrophobicContact CB-CD1 4.05Å
204	N	94.7	Very high	93.3	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-65.6	-39.8	178.8	-83.1	-86.5	0	0	0	113.4	R152 L153 P155 A156 F200 W201 F208	R152-N204 PolarHBondContact O-ND2 3.11Å; L153-N204 WeakPolarHBondContact CA-OD1 3.28Å; L153-N204 PolarHBondContact O-OD1 3Å; P155-N204 WeakPolarHBondContact CB-OD1 3.42Å; P155-N204 VanDerWaalsContact CD-OD1 3.32Å; P155-N204 WeakPolarHBondContact CD-OD1 3.39Å; A156-N204 HydrophobicContact CB-CB 4.25Å; A156-N204 VanDerWaalsContact CB-O 3.29Å; A156-N204 WeakPolarHBondContact CB-O 3.23Å; A156-N204 PolarHBondContact N-OD1 2.82Å; F200-N204 PolarHBondContact O-N 2.65Å; F200-N204 VanDerWaalsContact O-N 3.09Å; F200-N204 PolarHBondContact O-ND2 2.98Å; W201-N204 HydrophobicContact CE3-CB 4.2Å; W201-N204 HydrophobicContact CZ3-CB 4.49Å; W201-N204 PolarHBondContact O-N 3.36Å; N204-F208 VanDerWaalsContact O-CB 3.23Å; N204-F208 WeakPolarHBondContact O-CB 3.46Å; N204-F208 PolarHBondContact O-N 3.46Å
205	A	95.8	Very high	93.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-65	-43.7	178.6	0	0	0	0	0	111.9	F185 W201 F208 N209 I230 I233	F185-A205 HydrophobicContact CD1-CB 3.72Å; F185-A205 HydrophobicContact CE1-CB 3.47Å; F185-A205 VanDerWaalsContact CE1-CB 3.47Å; F185-A205 HydrophobicContact CG-CB 4.39Å; F185-A205 HydrophobicContact CZ-CB 3.94Å; W201-A205 WeakPolarHBondContact O-CB 3.4Å; W201-A205 PolarHBondContact O-N 3.31Å; A205-F208 PolarHBondContact O-N 3.16Å; A205-N209 PolarHBondContact O-N 3.49Å; A205-I230 HydrophobicContact CB-CG1 3.75Å; A205-I233 HydrophobicContact CB-CD1 4.15Å
206	S	96.1	Very high	92.7	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.007	10%	0.095	C	C	.	.	H	α-helix	trans	-73	-40.1	-177.9	59.6	0	0	0	0	112.9	L202 A203 N209 H210 Y442	L202-S206 WeakPolarHBondContact O-CB 3.45Å; L202-S206 PolarHBondContact O-N 2.98Å; L202-S206 VanDerWaalsContact O-N 3.08Å; L202-S206 PolarHBondContact O-OG 3.09Å; A203-S206 PolarHBondContact O-N 2.96Å; A203-S206 PolarHBondContact O-OG 3.05Å; S206-N209 PolarHBondContact O-N 2.82Å; S206-H210 WeakPolarHBondContact O-CB 3.36Å; S206-H210 PolarHBondContact O-N 2.85Å; S206-H210 VanDerWaalsContact O-N 3.07Å; S206-Y442 WeakPolarHBondContact O-CE1 3.42Å
207	E	94.2	Very high	92.4	Very high	3 Å²	3	19.9 Å²	19.9	1%	0.014	10%	0.098	C	C	.	.	H	α-helix	trans	-62.6	-42.8	171	-175.6	82.3	-163.7	0	0	111	L153 A156 Y157 A203 N209 H210 L211 Y442 F443 V444	L153-E207 HydrophobicContact CD1-CG 4.17Å; L153-E207 HydrophobicContact CD2-CB 4.29Å; A156-E207 HydrophobicContact CB-CB 4.14Å; A156-E207 HydrophobicContact CB-CG 4.21Å; Y157-E207 HydrophobicContact CD2-CG 4.41Å; Y157-E207 HydrophobicContact CE2-CG 3.67Å; Y157-E207 WeakPolarHBondContact CE2-OE1 3.3Å; Y157-E207 PolarHBondContact OH-OE1 2.89Å; A203-E207 WeakPolarHBondContact O-CB 3.35Å; A203-E207 PolarHBondContact O-N 3.38Å; E207-N209 PolarHBondContact O-N 3.28Å; E207-H210 PolarHBondContact O-N 3.26Å; E207-L211 HydrophobicContact CG-CD1 4.41Å; E207-L211 VanDerWaalsContact O-CG 3.31Å; E207-L211 WeakPolarHBondContact O-CG 3.4Å; E207-L211 PolarHBondContact O-N 2.67Å; E207-Y442 HydrophobicContact CB-CD1 4.35Å; E207-Y442 WeakPolarHBondContact OE2-CB 3.49Å; E207-Y442 WeakPolarHBondContact OE2-CD1 3.44Å; E207-F443 WeakPolarHBondContact OE1-CB 3.2Å; E207-F443 PolarHBondContact OE1-N 2.8Å; E207-F443 PolarHBondContact OE2-N 2.71Å; E207-V444 PolarHBondContact OE1-N 3.34Å
208	F	94.3	Very high	92.1	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.8	-43.4	176.1	173.4	-100.9	0	0	0	112.8	A156 L159 L163 F178 I181 N204 A205 H210 L211 V212 I226	A156-F208 HydrophobicContact CB-CB 4.08Å; L159-F208 HydrophobicContact CB-CD2 3.83Å; L159-F208 HydrophobicContact CB-CE2 3.75Å; L163-F208 HydrophobicContact CD2-CE2 4.34Å; L163-F208 HydrophobicContact CD2-CZ 4.06Å; F178-F208 HydrophobicContact CD2-CE1 4.47Å; F178-F208 HydrophobicContact CD2-CZ 4.26Å; F178-F208 AromaticContact CE2-CE1 3.93Å; F178-F208 HydrophobicContact CE2-CE1 3.93Å; F178-F208 HydrophobicContact CE2-CZ 4.11Å; I181-F208 HydrophobicContact CD1-CE2 4.39Å; I181-F208 HydrophobicContact CD1-CZ 3.99Å; I181-F208 HydrophobicContact CG2-CD1 4.48Å; I181-F208 HydrophobicContact CG2-CE1 3.88Å; I181-F208 HydrophobicContact CG2-CZ 4.12Å; N204-F208 VanDerWaalsContact O-CB 3.23Å; N204-F208 WeakPolarHBondContact O-CB 3.46Å; N204-F208 PolarHBondContact O-N 3.46Å; A205-F208 PolarHBondContact O-N 3.16Å; F208-H210 VanDerWaalsContact C-N 3.34Å; F208-H210 PolarHBondContact O-N 3.01Å; F208-L211 PolarHBondContact O-N 3.04Å; F208-V212 HydrophobicContact CD2-CG2 4.36Å; F208-V212 HydrophobicContact CE1-CG2 4.18Å; F208-V212 HydrophobicContact CE2-CG2 3.93Å; F208-V212 HydrophobicContact CZ-CG2 3.83Å; F208-V212 WeakPolarHBondContact O-CG2 3.44Å; F208-V212 PolarHBondContact O-N 2.83Å; F208-I226 HydrophobicContact CD1-CD1 4.04Å; F208-I226 HydrophobicContact CE1-CD1 4.13Å
209	N	93.4	Very high	91.5	Very high	10 Å²	10	24.9 Å²	24.9	5%	0.053	12%	0.119	C	C	.	.	H	α-helix	trans	-59.5	-45.9	174.6	-176.5	94.3	0	0	0	111.4	A205 S206 E207 L211 V212 E213 I226 I230	A205-N209 PolarHBondContact O-N 3.49Å; S206-N209 PolarHBondContact O-N 2.82Å; E207-N209 PolarHBondContact O-N 3.28Å; N209-L211 PolarHBondContact O-N 3.19Å; N209-V212 PolarHBondContact O-N 2.97Å; N209-E213 PolarHBondContact ND2-OE1 3.09Å; N209-E213 WeakPolarHBondContact O-CB 3.25Å; N209-E213 WeakPolarHBondContact O-CG 3.44Å; N209-E213 PolarHBondContact O-N 3.1Å; N209-I226 HydrophobicContact CB-CG2 3.81Å; N209-I226 WeakPolarHBondContact OD1-CG2 3.29Å; N209-I230 HydrophobicContact CB-CD1 3.57Å
210	H	91.8	Very high	90.6	Very high	16 Å²	16	28.5 Å²	28.5	7%	0.074	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-42.4	178.3	179.9	87.9	0	0	0	112.4	S206 E207 F208 V212 E213 R214 Q439 Y442 E445	S206-H210 WeakPolarHBondContact O-CB 3.36Å; S206-H210 PolarHBondContact O-N 2.85Å; S206-H210 VanDerWaalsContact O-N 3.07Å; E207-H210 PolarHBondContact O-N 3.26Å; F208-H210 VanDerWaalsContact C-N 3.34Å; F208-H210 PolarHBondContact O-N 3.01Å; H210-V212 PolarHBondContact O-N 3.22Å; H210-E213 PolarHBondContact O-N 3.17Å; H210-R214 PolarHBondContact NE2-NH1 3.42Å; H210-R214 WeakPolarHBondContact O-CB 3.29Å; H210-R214 WeakPolarHBondContact O-CG 3.21Å; H210-R214 PolarHBondContact O-N 3.06Å; H210-Q439 PolarHBondContact CE1-O 3.47Å; H210-Q439 PolarHBondContact ND1-O 3Å; H210-Q439 PolarHBondContact NE2-O 3.44Å; H210-Y442 HydrophobicContact CB-CD1 4.14Å; H210-Y442 HydrophobicContact CB-CD2 3.83Å; H210-Y442 HydrophobicContact CB-CE1 4.21Å; H210-Y442 HydrophobicContact CB-CE2 3.88Å; H210-Y442 HydrophobicContact CB-CG 3.92Å; H210-Y442 AromaticContact CD2-CD2 3.78Å; H210-Y442 AromaticContact CD2-CG 3.72Å; H210-Y442 AromaticContact CE1-CD2 3.22Å; H210-Y442 WeakPolarHBondContact CE1-CD2 3.48Å; H210-Y442 AromaticContact CE1-CE2 3.21Å; H210-Y442 WeakPolarHBondContact CE1-CE2 3.25Å; H210-Y442 AromaticContact CG-CD2 3.35Å; H210-Y442 AromaticContact CG-CE2 3.8Å; H210-Y442 AromaticContact CG-CG 3.62Å; H210-Y442 AromaticContact ND1-CD2 3.16Å; H210-Y442 WeakPolarHBondContact ND1-CD2 3.42Å; H210-Y442 AromaticContact ND1-CE2 3.53Å; H210-Y442 AromaticContact ND1-CG 3.9Å; H210-Y442 AromaticContact NE2-CD2 3.84Å; H210-E445 IonicContact NE2-OE1 3.55Å; H210-E445 PolarHBondContact NE2-OE1 3.46Å
211	L	91.4	Very high	89.8	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.5	-46.3	173.4	-70.4	170.2	0	0	0	112	L117 Y157 Y160 E207 F208 N209 R214 D215 V444	L117-L211 HydrophobicContact CD2-CD2 3.83Å; Y157-L211 HydrophobicContact CD1-CD1 4.48Å; Y157-L211 HydrophobicContact CD2-CD1 4.26Å; Y157-L211 HydrophobicContact CE1-CD2 4.48Å; Y157-L211 HydrophobicContact CE2-CD1 4.33Å; Y157-L211 HydrophobicContact CG-CD1 4.32Å; Y160-L211 HydrophobicContact CD1-CD1 4.44Å; Y160-L211 HydrophobicContact CD2-CB 3.59Å; Y160-L211 HydrophobicContact CE2-CB 3.99Å; Y160-L211 HydrophobicContact CG-CB 3.92Å; Y160-L211 HydrophobicContact CG-CD1 4.05Å; Y160-L211 HydrophobicContact CG-CG 4.44Å; E207-L211 HydrophobicContact CG-CD1 4.41Å; E207-L211 VanDerWaalsContact O-CG 3.31Å; E207-L211 WeakPolarHBondContact O-CG 3.4Å; E207-L211 PolarHBondContact O-N 2.67Å; F208-L211 PolarHBondContact O-N 3.04Å; N209-L211 PolarHBondContact O-N 3.19Å; L211-R214 PolarHBondContact O-N 3.01Å; L211-D215 PolarHBondContact O-N 2.96Å; L211-D215 VanDerWaalsContact O-N 3.15Å; L211-V444 HydrophobicContact CD2-CB 3.78Å; L211-V444 HydrophobicContact CD2-CG1 4.02Å; L211-V444 HydrophobicContact CD2-CG2 3.61Å
212	V	90.6	Very high	88.7	Confident	13 Å²	13	41.4 Å²	41.4	8%	0.079	20%	0.204	C	C	.	.	H	α-helix	trans	-69.6	-34.5	179	173.2	0	0	0	0	112.5	Y160 L163 F178 F208 N209 H210 R214 L218 Y223	Y160-V212 HydrophobicContact CD2-CG2 4.45Å; L163-V212 HydrophobicContact CD2-CG2 3.83Å; F178-V212 HydrophobicContact CE2-CG1 4.29Å; F208-V212 HydrophobicContact CD2-CG2 4.36Å; F208-V212 HydrophobicContact CE1-CG2 4.18Å; F208-V212 HydrophobicContact CE2-CG2 3.93Å; F208-V212 HydrophobicContact CZ-CG2 3.83Å; F208-V212 WeakPolarHBondContact O-CG2 3.44Å; F208-V212 PolarHBondContact O-N 2.83Å; N209-V212 PolarHBondContact O-N 2.97Å; H210-V212 PolarHBondContact O-N 3.22Å; V212-R214 VanDerWaalsContact C-N 3.35Å; V212-L218 HydrophobicContact CG1-CB 4.29Å; V212-L218 HydrophobicContact CG2-CD1 4.42Å; V212-Y223 HydrophobicContact CG1-CD2 4.33Å
213	E	88.7	Confident	87.9	Confident	91 Å²	91	42.9 Å²	42.9	43%	0.425	21%	0.209	S	C	.	.	H	α-helix	trans	-76.4	-18.1	176.2	-77.2	-163.7	-141.6	0	0	113.7	N209 H210 K219	N209-E213 PolarHBondContact ND2-OE1 3.09Å; N209-E213 WeakPolarHBondContact O-CB 3.25Å; N209-E213 WeakPolarHBondContact O-CG 3.44Å; N209-E213 PolarHBondContact O-N 3.1Å; H210-E213 PolarHBondContact O-N 3.17Å; E213-K219 WeakPolarHBondContact O-CD 3.36Å; E213-K219 WeakPolarHBondContact O-CE 3.39Å; E213-K219 PolarHBondContact O-NZ 2.86Å
214	R	86.8	Confident	86.8	Confident	77 Å²	77	44.4 Å²	44.4	29%	0.291	23%	0.225	S	C	.	.	H	α-helix	trans	-93.5	-27.2	176.2	-73.1	-172.1	71.9	123.9	8.1	114.1	L117 H210 L211 V212 T216 E445	L117-R214 HydrophobicContact CB-CB 4.29Å; L117-R214 HydrophobicContact CD1-CB 4.48Å; L117-R214 HydrophobicContact CD2-CB 4.05Å; H210-R214 PolarHBondContact NE2-NH1 3.42Å; H210-R214 WeakPolarHBondContact O-CB 3.29Å; H210-R214 WeakPolarHBondContact O-CG 3.21Å; H210-R214 PolarHBondContact O-N 3.06Å; L211-R214 PolarHBondContact O-N 3.01Å; V212-R214 VanDerWaalsContact C-N 3.35Å; R214-T216 PolarHBondContact O-N 2.7Å; R214-E445 IonicContact CZ-OE1 2.79Å; R214-E445 IonicContact NH1-OE1 2.78Å; R214-E445 PolarHBondContact NH1-OE1 2.72Å
215	D	88.5	Confident	86	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.027	26%	0.26	C	S	.	.	S	Bend	trans	-73.2	123.8	171.5	-176.4	-72.7	0	0	0	111.1	Y160 R164 L211 E217 L218 K219	Y160-D215 HydrophobicContact CE2-CB 4.05Å; Y160-D215 PolarHBondContact OH-OD2 3.05Å; R164-D215 IonicContact CZ-OD1 2.86Å; R164-D215 IonicContact CZ-OD2 3.64Å; R164-D215 VanDerWaalsContact CZ-OD2 3.25Å; R164-D215 IonicContact NE-OD1 2.7Å; R164-D215 IonicContact NE-OD2 3.76Å; R164-D215 PolarHBondContact NE-OD2 2.89Å; R164-D215 IonicContact NH2-OD1 3.25Å; R164-D215 IonicContact NH2-OD2 3.74Å; R164-D215 PolarHBondContact NH2-OD2 3.19Å; L211-D215 PolarHBondContact O-N 2.96Å; L211-D215 VanDerWaalsContact O-N 3.15Å; D215-E217 PolarHBondContact O-N 3.24Å; D215-E217 WeakPolarHBondContact OD1-CA 3.21Å; D215-E217 WeakPolarHBondContact OD1-CB 3.26Å; D215-E217 PolarHBondContact OD1-N 3.13Å; D215-L218 HydrophobicContact CB-CB 4.1Å; D215-L218 HydrophobicContact CB-CD1 4.06Å; D215-L218 HydrophobicContact CB-CG 4.1Å; D215-L218 WeakPolarHBondContact OD1-CG 3.09Å; D215-L218 PolarHBondContact OD1-N 3.03Å; D215-K219 WeakPolarHBondContact O-CB 3.47Å; D215-K219 PolarHBondContact O-N 3.03Å
216	T	84.6	Confident	85.7	Confident	92 Å²	92	52.5 Å²	52.5	56%	0.564	26%	0.261	S	S	*	.	H	α-helix	trans	-71	-29.2	-173.3	46.6	0	0	0	0	114	R214 A220	R214-T216 PolarHBondContact O-N 2.7Å; T216-A220 WeakPolarHBondContact O-CB 3.18Å; T216-A220 PolarHBondContact O-N 3.24Å
217	E	84.3	Confident	85.5	Confident	84 Å²	84	53.8 Å²	53.8	39%	0.393	27%	0.269	S	S	.	.	H	α-helix	trans	-80.8	-42.6	178	-70.6	172.5	-120.8	0	0	111.1	R164 H167 D215 A220 S221	R164-E217 IonicContact CZ-OE1 2.74Å; R164-E217 IonicContact CZ-OE2 3.16Å; R164-E217 IonicContact NH1-OE1 3.52Å; R164-E217 PolarHBondContact NH1-OE1 3.01Å; R164-E217 VanDerWaalsContact NH1-OE1 3.16Å; R164-E217 IonicContact NH1-OE2 2.9Å; R164-E217 PolarHBondContact NH1-OE2 3.4Å; R164-E217 IonicContact NH2-OE1 3.83Å; R164-E217 PolarHBondContact NH2-OE1 3.44Å; R164-E217 IonicContact NH2-OE2 3.25Å; H167-E217 IonicContact CD2-OE2 2.72Å; D215-E217 PolarHBondContact O-N 3.24Å; D215-E217 WeakPolarHBondContact OD1-CA 3.21Å; D215-E217 WeakPolarHBondContact OD1-CB 3.26Å; D215-E217 PolarHBondContact OD1-N 3.13Å; E217-A220 PolarHBondContact O-N 3.37Å; E217-S221 PolarHBondContact O-N 2.88Å; E217-S221 PolarHBondContact O-OG 2.95Å
218	L	86.1	Confident	85.4	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-64.8	-43.1	175.5	-61.8	-177.3	0	0	0	110.9	Y160 L163 H167 V212 D215 A220 S221 Y223	Y160-L218 HydrophobicContact CD2-CD1 3.98Å; Y160-L218 HydrophobicContact CE2-CD1 3.69Å; L163-L218 HydrophobicContact CD2-CD1 4.11Å; L163-L218 HydrophobicContact CD2-CD2 4.41Å; L163-L218 HydrophobicContact CG-CD1 4.41Å; L163-L218 HydrophobicContact CG-CD2 4.15Å; H167-L218 HydrophobicContact CB-CD2 3.61Å; V212-L218 HydrophobicContact CG1-CB 4.29Å; V212-L218 HydrophobicContact CG2-CD1 4.42Å; D215-L218 HydrophobicContact CB-CB 4.1Å; D215-L218 HydrophobicContact CB-CD1 4.06Å; D215-L218 HydrophobicContact CB-CG 4.1Å; D215-L218 WeakPolarHBondContact OD1-CG 3.09Å; D215-L218 PolarHBondContact OD1-N 3.03Å; L218-A220 VanDerWaalsContact C-N 3.32Å; L218-A220 PolarHBondContact O-N 2.88Å; L218-S221 VanDerWaalsContact O-CB 3.29Å; L218-S221 WeakPolarHBondContact O-CB 3.22Å; L218-S221 PolarHBondContact O-N 2.96Å; L218-S221 VanDerWaalsContact O-N 3.08Å; L218-Y223 HydrophobicContact CB-CE2 3.94Å; L218-Y223 HydrophobicContact CD2-CE2 3.82Å; L218-Y223 HydrophobicContact CG-CE2 4.46Å; L218-Y223 VanDerWaalsContact O-CD2 3.32Å; L218-Y223 WeakPolarHBondContact O-CD2 3.34Å; L218-Y223 WeakPolarHBondContact O-CE2 3.46Å
219	K	82.9	Confident	85.4	Confident	126 Å²	126	57.1 Å²	57.1	55%	0.548	29%	0.289	S	S	.	.	H	α-helix	trans	-60.2	-38.3	174.6	-168.3	175	-148.6	147.4	0	113	E213 D215 S221	E213-K219 WeakPolarHBondContact O-CD 3.36Å; E213-K219 WeakPolarHBondContact O-CE 3.39Å; E213-K219 PolarHBondContact O-NZ 2.86Å; D215-K219 WeakPolarHBondContact O-CB 3.47Å; D215-K219 PolarHBondContact O-N 3.03Å; K219-S221 PolarHBondContact O-N 3.37Å
220	A	77.8	Confident	85.5	Confident	77 Å²	77	56.7 Å²	56.7	64%	0.636	29%	0.287	S	S	*	.	H	α-helix	trans	-67.3	-18.9	176.7	0	0	0	0	0	113.7	T216 E217 L218 R222	T216-A220 WeakPolarHBondContact O-CB 3.18Å; T216-A220 PolarHBondContact O-N 3.24Å; E217-A220 PolarHBondContact O-N 3.37Å; L218-A220 VanDerWaalsContact C-N 3.32Å; L218-A220 PolarHBondContact O-N 2.88Å; A220-R222 VanDerWaalsContact C-N 3.31Å; A220-R222 PolarHBondContact O-N 2.79Å
221	S	75.8	Confident	85.7	Confident	37 Å²	37	58.3 Å²	58.3	26%	0.259	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-2.8	-171.6	-59.6	0	0	0	0	115.4	H167 E217 L218 K219 Y223	H167-S221 PolarHBondContact CE1-OG 3.34Å; H167-S221 PolarHBondContact ND1-OG 2.92Å; E217-S221 PolarHBondContact O-N 2.88Å; E217-S221 PolarHBondContact O-OG 2.95Å; L218-S221 VanDerWaalsContact O-CB 3.29Å; L218-S221 WeakPolarHBondContact O-CB 3.22Å; L218-S221 PolarHBondContact O-N 2.96Å; L218-S221 VanDerWaalsContact O-N 3.08Å; K219-S221 PolarHBondContact O-N 3.37Å; S221-Y223 VanDerWaalsContact C-N 3.34Å; S221-Y223 PolarHBondContact O-N 3.35Å
222	R	72.6	Confident	85.9	Confident	235 Å²	235	62.8 Å²	62.8	89%	0.887	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	41.2	-179.5	-49.4	-170.6	-167.4	-149.1	7	114.7	A220	A220-R222 VanDerWaalsContact C-N 3.31Å; A220-R222 PolarHBondContact O-N 2.79Å
223	Y	80.5	Confident	86.2	Confident	30 Å²	30	62.2 Å²	62.2	12%	0.118	31%	0.308	C	S	.	.			trans	-59.5	161.9	169.1	-58.4	-63.2	0	0	0	112	L163 H167 S174 V175 F178 V212 L218 S221	L163-Y223 HydrophobicContact CD1-CE1 4.32Å; L163-Y223 HydrophobicContact CD2-CE2 4.44Å; H167-Y223 PolarHBondContact ND1-OH 3.38Å; H167-Y223 VanDerWaalsContact ND1-OH 3.09Å; S174-Y223 PolarHBondContact OG-OH 3.43Å; S174-Y223 VanDerWaalsContact OG-OH 3.1Å; V175-Y223 HydrophobicContact CG2-CD1 4.46Å; V175-Y223 HydrophobicContact CG2-CE1 4.03Å; F178-Y223 HydrophobicContact CB-CD1 3.82Å; F178-Y223 HydrophobicContact CB-CE1 4.23Å; F178-Y223 HydrophobicContact CB-CG 4.4Å; F178-Y223 HydrophobicContact CD1-CD1 4.42Å; F178-Y223 HydrophobicContact CD1-CG 4.4Å; F178-Y223 HydrophobicContact CD2-CD1 4.13Å; F178-Y223 HydrophobicContact CD2-CD2 4.27Å; F178-Y223 AromaticContact CD2-CG 3.85Å; F178-Y223 HydrophobicContact CD2-CG 3.85Å; F178-Y223 HydrophobicContact CE2-CG 4.24Å; F178-Y223 AromaticContact CG-CD1 3.85Å; F178-Y223 HydrophobicContact CG-CD1 3.85Å; F178-Y223 AromaticContact CG-CG 3.94Å; F178-Y223 HydrophobicContact CG-CG 3.94Å; V212-Y223 HydrophobicContact CG1-CD2 4.33Å; L218-Y223 HydrophobicContact CB-CE2 3.94Å; L218-Y223 HydrophobicContact CD2-CE2 3.82Å; L218-Y223 HydrophobicContact CG-CE2 4.46Å; L218-Y223 VanDerWaalsContact O-CD2 3.32Å; L218-Y223 WeakPolarHBondContact O-CD2 3.34Å; L218-Y223 WeakPolarHBondContact O-CE2 3.46Å; S221-Y223 VanDerWaalsContact C-N 3.34Å; S221-Y223 PolarHBondContact O-N 3.35Å
224	G	71.6	Confident	86.6	Confident	34 Å²	34	58.1 Å²	58.1	35%	0.351	29%	0.289	S	S	.	.			trans	-60.7	150.9	176.3	0	0	0	0	0	112.8	F178 I226	F178-G224 WeakPolarHBondContact CE1-O 3.47Å; F178-G224 WeakPolarHBondContact CZ-O 3.46Å; G224-I226 PolarHBondContact O-N 3.19Å; G224-I226 VanDerWaalsContact O-N 3.16Å
225	K	78.4	Confident	87	Confident	168 Å²	168	61.9 Å²	61.9	73%	0.73	30%	0.303	S	S	*	.			trans	-83.8	90.3	178.1	-75.5	-165.1	175.8	-170.2	0	111.2	S227 V228	K225-S227 PolarHBondContact O-N 2.7Å; K225-V228 PolarHBondContact O-N 3.17Å
226	I	89.7	Confident	87.3	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.01	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-12.2	174.7	-169.6	165.6	0	0	0	113.7	F178 I181 F185 F208 N209 G224 V228 E229 I230	F178-I226 HydrophobicContact CZ-CB 4.35Å; F178-I226 HydrophobicContact CZ-CG2 4.39Å; I181-I226 HydrophobicContact CG2-CD1 4.39Å; F185-I226 HydrophobicContact CB-CD1 4.43Å; F185-I226 HydrophobicContact CD2-CD1 3.4Å; F185-I226 HydrophobicContact CE2-CD1 3.81Å; F185-I226 HydrophobicContact CG-CD1 4.13Å; F208-I226 HydrophobicContact CD1-CD1 4.04Å; F208-I226 HydrophobicContact CE1-CD1 4.13Å; N209-I226 HydrophobicContact CB-CG2 3.81Å; N209-I226 WeakPolarHBondContact OD1-CG2 3.29Å; G224-I226 PolarHBondContact O-N 3.19Å; G224-I226 VanDerWaalsContact O-N 3.16Å; I226-V228 PolarHBondContact O-N 2.87Å; I226-V228 VanDerWaalsContact O-N 3.08Å; I226-E229 HydrophobicContact CG1-CB 4.32Å; I226-E229 PolarHBondContact O-N 2.78Å; I226-I230 HydrophobicContact CG2-CD1 4.5Å; I226-I230 PolarHBondContact O-N 3.08Å
227	S	90.9	Very high	87.9	Confident	28 Å²	28	60.9 Å²	60.9	20%	0.196	29%	0.288	C	S	.	.	H	α-helix	trans	-44.2	-38.5	168.3	63.8	0	0	0	0	114.1	K225 I230 E231	K225-S227 PolarHBondContact O-N 2.7Å; S227-I230 PolarHBondContact O-N 2.85Å; S227-E231 PolarHBondContact O-N 2.91Å; S227-E231 VanDerWaalsContact O-N 3.09Å
228	V	92.3	Very high	88.4	Confident	63 Å²	63	57.8 Å²	57.8	38%	0.382	28%	0.275	S	S	.	.	H	α-helix	trans	-71	-34.9	-179.8	-175.6	0	0	0	0	111.7	K225 I226 R232	K225-V228 PolarHBondContact O-N 3.17Å; I226-V228 PolarHBondContact O-N 2.87Å; I226-V228 VanDerWaalsContact O-N 3.08Å; V228-R232 WeakPolarHBondContact O-CG 3.39Å; V228-R232 PolarHBondContact O-N 3.21Å; V228-R232 VanDerWaalsContact O-N 3.13Å
229	E	94.7	Very high	88.8	Confident	10 Å²	10	60.1 Å²	60.1	5%	0.047	30%	0.295	C	S	.	.	H	α-helix	trans	-76.8	-34.7	176.8	-52.2	-56.7	161.5	0	0	111.1	E182 F185 K186 I226 E231 R232 I233	E182-E229 HydrophobicContact CG-CG 4.19Å; F185-E229 HydrophobicContact CB-CB 4.22Å; K186-E229 WeakPolarHBondContact CA-OE2 3.31Å; K186-E229 HydrophobicContact CB-CG 4.3Å; K186-E229 WeakPolarHBondContact CB-OE2 3.27Å; K186-E229 WeakPolarHBondContact CG-OE2 3.32Å; I226-E229 HydrophobicContact CG1-CB 4.32Å; I226-E229 PolarHBondContact O-N 2.78Å; E229-E231 VanDerWaalsContact C-N 3.33Å; E229-E231 PolarHBondContact O-N 3.29Å; E229-R232 PolarHBondContact O-N 2.9Å; E229-R232 IonicContact OE1-CZ 3.45Å; E229-R232 IonicContact OE1-NH1 2.91Å; E229-R232 PolarHBondContact OE1-NH1 3.44Å; E229-R232 IonicContact OE1-NH2 3.83Å; E229-R232 WeakPolarHBondContact OE2-CD 3.48Å; E229-R232 IonicContact OE2-CZ 3.5Å; E229-R232 IonicContact OE2-NE 2.77Å; E229-R232 IonicContact OE2-NH1 3.54Å; E229-R232 PolarHBondContact OE2-NH1 2.99Å; E229-I233 WeakPolarHBondContact O-CG1 3.24Å; E229-I233 PolarHBondContact O-N 2.91Å
230	I	96.3	Very high	89.3	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-56.6	-47.8	170.2	-66.4	164.6	0	0	0	110.3	L202 A205 N209 I226 S227 R232 I233 F234 F435 I437	L202-I230 HydrophobicContact CD1-CG2 3.92Å; A205-I230 HydrophobicContact CB-CG1 3.75Å; N209-I230 HydrophobicContact CB-CD1 3.57Å; I226-I230 HydrophobicContact CG2-CD1 4.5Å; I226-I230 PolarHBondContact O-N 3.08Å; S227-I230 PolarHBondContact O-N 2.85Å; I230-R232 VanDerWaalsContact C-N 3.34Å; I230-R232 PolarHBondContact O-N 3.06Å; I230-I233 PolarHBondContact O-N 2.93Å; I230-F234 PolarHBondContact O-N 3.49Å; I230-F435 HydrophobicContact CG2-CE1 3.99Å; I230-F435 HydrophobicContact CG2-CZ 3.87Å; I230-I437 HydrophobicContact CD1-CD1 4.36Å
231	E	95.8	Very high	90.2	Very high	50 Å²	50	51.7 Å²	51.7	23%	0.234	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-41.3	176.4	-174.1	-177.8	174.6	0	0	112	S227 E229 F234 R235 F435	S227-E231 PolarHBondContact O-N 2.91Å; S227-E231 VanDerWaalsContact O-N 3.09Å; E229-E231 VanDerWaalsContact C-N 3.33Å; E229-E231 PolarHBondContact O-N 3.29Å; E231-F234 PolarHBondContact O-N 2.71Å; E231-R235 HydrophobicContact CG-CG 4.38Å; E231-R235 WeakPolarHBondContact O-CB 3.47Å; E231-R235 WeakPolarHBondContact O-CG 3.28Å; E231-R235 PolarHBondContact O-N 3.14Å; E231-R235 IonicContact OE1-CZ 3.95Å; E231-R235 IonicContact OE1-NE 3.6Å; E231-R235 PolarHBondContact OE1-NE 2.92Å; E231-R235 IonicContact OE1-NH2 2.69Å; E231-R235 PolarHBondContact OE1-NH2 3.15Å; E231-F435 HydrophobicContact CB-CD1 3.56Å; E231-F435 HydrophobicContact CB-CE1 3.85Å; E231-F435 HydrophobicContact CB-CG 4.23Å; E231-F435 HydrophobicContact CG-CB 3.89Å; E231-F435 HydrophobicContact CG-CD1 3.63Å; E231-F435 HydrophobicContact CG-CE1 4.33Å; E231-F435 HydrophobicContact CG-CG 3.8Å
232	R	95.7	Very high	90.9	Very high	95 Å²	95	52.6 Å²	52.6	36%	0.358	25%	0.246	S	C	.	.	H	α-helix	trans	-65.5	-38.2	176.4	-70.7	177.8	-162.5	149.8	9	112.6	A189 V228 E229 I230 F234 R236	A189-R232 HydrophobicContact CB-CB 3.8Å; V228-R232 WeakPolarHBondContact O-CG 3.39Å; V228-R232 PolarHBondContact O-N 3.21Å; V228-R232 VanDerWaalsContact O-N 3.13Å; E229-R232 PolarHBondContact O-N 2.9Å; E229-R232 IonicContact OE1-CZ 3.45Å; E229-R232 IonicContact OE1-NH1 2.91Å; E229-R232 PolarHBondContact OE1-NH1 3.44Å; E229-R232 IonicContact OE1-NH2 3.83Å; E229-R232 WeakPolarHBondContact OE2-CD 3.48Å; E229-R232 IonicContact OE2-CZ 3.5Å; E229-R232 IonicContact OE2-NE 2.77Å; E229-R232 IonicContact OE2-NH1 3.54Å; E229-R232 PolarHBondContact OE2-NH1 2.99Å; I230-R232 VanDerWaalsContact C-N 3.34Å; I230-R232 PolarHBondContact O-N 3.06Å; R232-F234 VanDerWaalsContact C-N 3.34Å; R232-R236 WeakPolarHBondContact O-CB 3.46Å; R232-R236 PolarHBondContact O-N 2.99Å
233	I	97	Very high	91.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-43.9	173	-64.5	167.9	0	0	0	109.9	F185 A189 L198 L202 A205 E229 I230 R236 L237	F185-I233 HydrophobicContact CB-CD1 4.28Å; F185-I233 HydrophobicContact CD1-CD1 3.84Å; A189-I233 HydrophobicContact CB-CG1 3.82Å; L198-I233 HydrophobicContact CD2-CG2 4.09Å; L202-I233 HydrophobicContact CB-CG2 3.87Å; L202-I233 HydrophobicContact CD1-CB 4.37Å; L202-I233 HydrophobicContact CD1-CG2 4.2Å; A205-I233 HydrophobicContact CB-CD1 4.15Å; E229-I233 WeakPolarHBondContact O-CG1 3.24Å; E229-I233 PolarHBondContact O-N 2.91Å; I230-I233 PolarHBondContact O-N 2.93Å; I233-R236 PolarHBondContact O-N 2.92Å; I233-L237 WeakPolarHBondContact O-CB 3.13Å; I233-L237 PolarHBondContact O-N 3.35Å
234	F	97.1	Very high	92.5	Very high	5 Å²	5	47.2 Å²	47.2	2%	0.022	25%	0.246	C	C	.	.	H	α-helix	trans	-62.1	-50.9	176.4	-177.7	-89.1	0	0	0	112.2	L202 I230 E231 R232 R236 L237 V238 Q289 L290 H293 F435	L202-F234 HydrophobicContact CD1-CB 4.05Å; L202-F234 HydrophobicContact CD2-CD2 3.94Å; I230-F234 PolarHBondContact O-N 3.49Å; E231-F234 PolarHBondContact O-N 2.71Å; R232-F234 VanDerWaalsContact C-N 3.34Å; F234-R236 VanDerWaalsContact C-N 3.29Å; F234-R236 PolarHBondContact O-N 3.11Å; F234-L237 WeakPolarHBondContact O-CB 3.34Å; F234-L237 PolarHBondContact O-N 3.07Å; F234-L237 VanDerWaalsContact O-N 3.15Å; F234-V238 HydrophobicContact CD1-CG2 4.17Å; F234-V238 HydrophobicContact CE1-CG2 3.75Å; F234-V238 HydrophobicContact CZ-CG2 4.07Å; F234-V238 WeakPolarHBondContact O-CG2 3.37Å; F234-V238 PolarHBondContact O-N 3.34Å; F234-Q289 HydrophobicContact CE2-CB 4.21Å; F234-Q289 HydrophobicContact CZ-CB 4.06Å; F234-L290 HydrophobicContact CE2-CB 3.99Å; F234-L290 HydrophobicContact CE2-CD1 4.36Å; F234-H293 AromaticContact CE1-CE1 3.63Å; F234-H293 AromaticContact CE1-ND1 3.85Å; F234-H293 AromaticContact CE1-NE2 3.82Å; F234-H293 AromaticContact CZ-CE1 3.84Å; F234-H293 AromaticContact CZ-ND1 3.66Å; F234-F435 HydrophobicContact CB-CD2 4.36Å; F234-F435 HydrophobicContact CB-CE2 3.77Å; F234-F435 HydrophobicContact CB-CZ 4.19Å; F234-F435 AromaticContact CD1-CD2 3.85Å; F234-F435 HydrophobicContact CD1-CD2 3.85Å; F234-F435 AromaticContact CD1-CE2 3.94Å; F234-F435 HydrophobicContact CD1-CE2 3.94Å; F234-F435 HydrophobicContact CD2-CD2 4.48Å; F234-F435 AromaticContact CD2-CE2 3.82Å; F234-F435 HydrophobicContact CD2-CE2 3.82Å; F234-F435 HydrophobicContact CE1-CD2 4.28Å; F234-F435 HydrophobicContact CE2-CE2 4.4Å; F234-F435 AromaticContact CG-CD2 3.98Å; F234-F435 HydrophobicContact CG-CD2 3.98Å; F234-F435 AromaticContact CG-CE2 3.55Å; F234-F435 HydrophobicContact CG-CE2 3.55Å; F234-F435 HydrophobicContact CG-CZ 4.43Å
235	R	94.7	Very high	93.5	Very high	157 Å²	157	45.7 Å²	45.7	59%	0.592	23%	0.229	S	C	*	.	H	α-helix	trans	-58.1	-40.5	176.4	-71.3	174.7	179.2	-120.7	10.2	111.7	E231 V238 A239	E231-R235 HydrophobicContact CG-CG 4.38Å; E231-R235 WeakPolarHBondContact O-CB 3.47Å; E231-R235 WeakPolarHBondContact O-CG 3.28Å; E231-R235 PolarHBondContact O-N 3.14Å; E231-R235 IonicContact OE1-CZ 3.95Å; E231-R235 IonicContact OE1-NE 3.6Å; E231-R235 PolarHBondContact OE1-NE 2.92Å; E231-R235 IonicContact OE1-NH2 2.69Å; E231-R235 PolarHBondContact OE1-NH2 3.15Å; R235-V238 PolarHBondContact O-N 2.87Å; R235-A239 PolarHBondContact O-N 3.47Å
236	R	95.7	Very high	94.1	Very high	75 Å²	75	41.4 Å²	41.4	28%	0.283	21%	0.209	S	C	.	.	H	α-helix	trans	-64.6	-42.1	175.4	179	59.1	166.2	-115.5	-10.4	112.3	A189 Q190 E191 C192 L198 R232 I233 F234 A239 V240	A189-R236 WeakPolarHBondContact O-CG 3.36Å; Q190-R236 PolarHBondContact O-NH1 2.86Å; Q190-R236 PolarHBondContact O-NH2 3.22Å; E191-R236 PolarHBondContact O-NH2 3.18Å; C192-R236 PolarHBondContact O-NE 3.42Å; C192-R236 PolarHBondContact O-NH2 3.14Å; L198-R236 HydrophobicContact CD1-CG 3.9Å; L198-R236 HydrophobicContact CD2-CB 4.34Å; L198-R236 HydrophobicContact CD2-CG 3.86Å; R232-R236 WeakPolarHBondContact O-CB 3.46Å; R232-R236 PolarHBondContact O-N 2.99Å; I233-R236 PolarHBondContact O-N 2.92Å; F234-R236 VanDerWaalsContact C-N 3.29Å; F234-R236 PolarHBondContact O-N 3.11Å; R236-A239 PolarHBondContact O-N 2.87Å; R236-V240 WeakPolarHBondContact O-CG2 3.44Å; R236-V240 PolarHBondContact O-N 2.56Å
237	L	96.5	Very high	94.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.4	-45.1	175	176.5	60.5	0	0	0	111.6	K195 L198 I199 L202 I233 F234 V240 L241 L290	K195-L237 HydrophobicContact CB-CD1 4.09Å; L198-L237 HydrophobicContact CB-CB 4.19Å; L198-L237 HydrophobicContact CB-CD1 3.92Å; I199-L237 HydrophobicContact CD1-CD1 4.32Å; I199-L237 HydrophobicContact CG1-CD1 3.86Å; I199-L237 HydrophobicContact CG1-CD2 3.57Å; I199-L237 HydrophobicContact CG1-CG 4.38Å; L202-L237 HydrophobicContact CD2-CD2 4.24Å; I233-L237 WeakPolarHBondContact O-CB 3.13Å; I233-L237 PolarHBondContact O-N 3.35Å; F234-L237 WeakPolarHBondContact O-CB 3.34Å; F234-L237 PolarHBondContact O-N 3.07Å; F234-L237 VanDerWaalsContact O-N 3.15Å; L237-V240 PolarHBondContact O-N 2.71Å; L237-L241 HydrophobicContact CD1-CD1 3.7Å; L237-L241 HydrophobicContact CD1-CG 4.18Å; L237-L241 HydrophobicContact CG-CD1 3.85Å; L237-L241 WeakPolarHBondContact O-CB 3.4Å; L237-L241 VanDerWaalsContact O-CG 3.31Å; L237-L241 WeakPolarHBondContact O-CG 3.45Å; L237-L241 PolarHBondContact O-N 2.76Å; L237-L290 HydrophobicContact CD2-CD1 3.9Å; L237-L290 HydrophobicContact CD2-CD2 3.86Å; L237-L290 HydrophobicContact CG-CD1 4.12Å
238	V	94.9	Very high	94.3	Very high	20 Å²	20	43.3 Å²	43.3	12%	0.121	22%	0.222	C	C	.	.	H	α-helix	trans	-60	-47.2	175.3	173.6	0	0	0	0	110.9	F234 R235 V240 L241 Q242 L290 H293 M297	F234-V238 HydrophobicContact CD1-CG2 4.17Å; F234-V238 HydrophobicContact CE1-CG2 3.75Å; F234-V238 HydrophobicContact CZ-CG2 4.07Å; F234-V238 WeakPolarHBondContact O-CG2 3.37Å; F234-V238 PolarHBondContact O-N 3.34Å; R235-V238 PolarHBondContact O-N 2.87Å; V238-V240 PolarHBondContact O-N 3.35Å; V238-L241 PolarHBondContact O-N 3.06Å; V238-Q242 WeakPolarHBondContact O-CB 3.47Å; V238-Q242 PolarHBondContact O-N 3.4Å; V238-L290 HydrophobicContact CG2-CD1 4.23Å; V238-H293 HydrophobicContact CG1-CB 4.26Å; V238-H293 HydrophobicContact CG2-CB 4.01Å; V238-M297 HydrophobicContact CG1-CE 3.91Å; V238-M297 HydrophobicContact CG1-SD 4.16Å
239	A	93.5	Very high	94.4	Very high	50 Å²	50	40.3 Å²	40.3	41%	0.413	20%	0.203	S	C	.	.	H	α-helix	trans	-62.8	-38.3	178.3	0	0	0	0	0	113.6	R235 R236	R235-A239 PolarHBondContact O-N 3.47Å; R236-A239 PolarHBondContact O-N 2.87Å
240	V	94.9	Very high	94.3	Very high	25 Å²	25	46.8 Å²	46.8	15%	0.152	23%	0.227	C	C	.	.	H	α-helix	trans	-62.4	-47.6	172.5	166.6	0	0	0	0	110.3	S193 K195 L198 R236 L237 V238 Q242 S243	S193-V240 WeakPolarHBondContact O-CG1 3.43Å; K195-V240 HydrophobicContact CB-CG1 4.26Å; L198-V240 HydrophobicContact CD1-CB 4.41Å; L198-V240 HydrophobicContact CD1-CG2 3.88Å; R236-V240 WeakPolarHBondContact O-CG2 3.44Å; R236-V240 PolarHBondContact O-N 2.56Å; L237-V240 PolarHBondContact O-N 2.71Å; V238-V240 PolarHBondContact O-N 3.35Å; V240-Q242 PolarHBondContact O-N 2.82Å; V240-S243 PolarHBondContact O-N 3.47Å; V240-S243 PolarHBondContact O-OG 2.94Å
241	L	95.1	Very high	94.1	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-68.8	-32.3	-179.2	-68.4	165.8	0	0	0	112.9	K195 L237 V238 S243 V244 I245 L269 T273 L290 L294	K195-L241 HydrophobicContact CB-CD2 4.03Å; K195-L241 HydrophobicContact CD-CD2 3.74Å; L237-L241 HydrophobicContact CD1-CD1 3.7Å; L237-L241 HydrophobicContact CD1-CG 4.18Å; L237-L241 HydrophobicContact CG-CD1 3.85Å; L237-L241 WeakPolarHBondContact O-CB 3.4Å; L237-L241 VanDerWaalsContact O-CG 3.31Å; L237-L241 WeakPolarHBondContact O-CG 3.45Å; L237-L241 PolarHBondContact O-N 2.76Å; V238-L241 PolarHBondContact O-N 3.06Å; L241-S243 PolarHBondContact O-N 3.12Å; L241-V244 PolarHBondContact O-N 2.83Å; L241-I245 WeakPolarHBondContact O-CG2 3.4Å; L241-I245 PolarHBondContact O-N 3.22Å; L241-L269 HydrophobicContact CD2-CD1 4.25Å; L241-T273 HydrophobicContact CD1-CG2 3.8Å; L241-T273 HydrophobicContact CD2-CG2 4.1Å; L241-L290 HydrophobicContact CD1-CD1 4Å; L241-L294 HydrophobicContact CB-CD2 3.7Å; L241-L294 HydrophobicContact CD1-CD2 3.93Å; L241-L294 HydrophobicContact CG-CD2 4.33Å
242	Q	92	Very high	94	Very high	55 Å²	55	45.5 Å²	45.5	26%	0.257	23%	0.225	S	C	.	.	H	α-helix	trans	-53.6	-40.7	173.9	-169.1	175.4	30	0	0	111.8	V238 V240 V244 R246 M297	V238-Q242 WeakPolarHBondContact O-CB 3.47Å; V238-Q242 PolarHBondContact O-N 3.4Å; V240-Q242 PolarHBondContact O-N 2.82Å; Q242-V244 PolarHBondContact O-N 2.96Å; Q242-R246 WeakPolarHBondContact O-CB 3.47Å; Q242-R246 PolarHBondContact O-N 3Å; Q242-M297 HydrophobicContact CB-CE 4.43Å; Q242-M297 HydrophobicContact CB-SD 3.48Å; Q242-M297 WeakPolarHBondContact CB-SD 3.48Å; Q242-M297 HydrophobicContact CG-SD 3.51Å; Q242-M297 VanDerWaalsContact CG-SD 3.51Å
243	S	91.1	Very high	93.8	Very high	82 Å²	82	42.3 Å²	42.3	57%	0.573	22%	0.215	S	C	*	.	H	α-helix	trans	-65.9	-22.3	179.8	77	0	0	0	0	114.2	V240 L241 P247	V240-S243 PolarHBondContact O-N 3.47Å; V240-S243 PolarHBondContact O-OG 2.94Å; L241-S243 PolarHBondContact O-N 3.12Å; S243-P247 WeakPolarHBondContact O-CD 3.39Å; S243-P247 VanDerWaalsContact O-CG 3.32Å; S243-P247 WeakPolarHBondContact O-CG 3.15Å
244	V	94	Very high	93.4	Very high	71 Å²	71	45.3 Å²	45.3	43%	0.43	23%	0.231	S	C	.	.	H	α-helix	trans	-102.6	-39.3	-177.6	-170.4	0	0	0	0	111.8	L241 Q242 P247 A248 L269	L241-V244 PolarHBondContact O-N 2.83Å; Q242-V244 PolarHBondContact O-N 2.96Å; V244-P247 WeakPolarHBondContact O-CD 3.45Å; V244-A248 PolarHBondContact O-N 3.35Å; V244-L269 HydrophobicContact CB-CD2 4.15Å; V244-L269 HydrophobicContact CG1-CD1 4.1Å; V244-L269 HydrophobicContact CG1-CD2 3.99Å
245	I	94.1	Very high	93	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-70.7	-34.5	-177.8	-158.9	158.3	0	0	0	112.5	L241 A248 A249 L269 L294 M297 V298	L241-I245 WeakPolarHBondContact O-CG2 3.4Å; L241-I245 PolarHBondContact O-N 3.22Å; I245-A248 PolarHBondContact O-N 3.5Å; I245-A249 VanDerWaalsContact O-CB 3.32Å; I245-A249 WeakPolarHBondContact O-CB 3.4Å; I245-A249 PolarHBondContact O-N 3.19Å; I245-L269 HydrophobicContact CB-CD2 3.62Å; I245-L269 HydrophobicContact CD1-CD2 4.3Å; I245-L269 HydrophobicContact CG1-CD2 3.92Å; I245-L294 HydrophobicContact CD1-CB 3.85Å; I245-L294 HydrophobicContact CD1-CD2 3.94Å; I245-L294 HydrophobicContact CD1-CG 4.45Å; I245-L294 WeakPolarHBondContact CD1-O 3.34Å; I245-M297 HydrophobicContact CG2-CB 4.01Å; I245-M297 HydrophobicContact CG2-CE 4.24Å; I245-M297 HydrophobicContact CG2-SD 4.4Å; I245-V298 HydrophobicContact CD1-CG2 3.67Å; I245-V298 HydrophobicContact CG1-CG2 3.76Å
246	R	90.1	Very high	92.7	Very high	78 Å²	78	46.4 Å²	46.4	29%	0.294	24%	0.243	S	C	.	.	H	α-helix	trans	-65.4	-44.2	178.9	176.6	175.8	-67.1	168	3.1	112.4	Q242 F301 D429	Q242-R246 WeakPolarHBondContact O-CB 3.47Å; Q242-R246 PolarHBondContact O-N 3Å; R246-F301 HydrophobicContact CG-CD2 3.69Å; R246-F301 HydrophobicContact CG-CE2 4.12Å; R246-F301 HydrophobicContact CG-CG 4.29Å; R246-D429 IonicContact CZ-OD1 3.22Å; R246-D429 IonicContact CZ-OD2 3.69Å; R246-D429 IonicContact NH1-OD2 3.36Å; R246-D429 IonicContact NH2-OD1 2.82Å; R246-D429 PolarHBondContact NH2-OD1 2.93Å; R246-D429 IonicContact NH2-OD2 2.81Å; R246-D429 PolarHBondContact NH2-OD2 3.09Å
247	P	91.3	Very high	92.5	Very high	62 Å²	62	45.9 Å²	45.9	40%	0.403	25%	0.246	S	C	.	.	H	α-helix	trans	-57	-49	166.3	-28.9	35.3	0	0	0	114	S243 V244 A249 R250	S243-P247 WeakPolarHBondContact O-CD 3.39Å; S243-P247 VanDerWaalsContact O-CG 3.32Å; S243-P247 WeakPolarHBondContact O-CG 3.15Å; V244-P247 WeakPolarHBondContact O-CD 3.45Å; P247-A249 VanDerWaalsContact C-N 3.33Å; P247-A249 PolarHBondContact O-N 2.66Å; P247-R250 WeakPolarHBondContact O-CB 3.23Å; P247-R250 PolarHBondContact O-N 3Å
248	A	93.4	Very high	92.3	Very high	9 Å²	9	51.2 Å²	51.2	7%	0.074	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-40.4	-178.5	0	0	0	0	0	112.7	V244 I245 R250 A251 D265 V266	V244-A248 PolarHBondContact O-N 3.35Å; I245-A248 PolarHBondContact O-N 3.5Å; A248-R250 PolarHBondContact O-N 2.81Å; A248-A251 PolarHBondContact O-N 3.25Å; A248-D265 HydrophobicContact CB-CB 3.73Å; A248-V266 HydrophobicContact CB-CG2 3.91Å
249	A	93.9	Very high	92.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-69.6	-12.5	-179.1	0	0	0	0	0	114.1	I245 P247 A251 L252 V266 F301	I245-A249 VanDerWaalsContact O-CB 3.32Å; I245-A249 WeakPolarHBondContact O-CB 3.4Å; I245-A249 PolarHBondContact O-N 3.19Å; P247-A249 VanDerWaalsContact C-N 3.33Å; P247-A249 PolarHBondContact O-N 2.66Å; A249-A251 VanDerWaalsContact C-N 3.3Å; A249-A251 PolarHBondContact O-N 2.77Å; A249-L252 HydrophobicContact CB-CD1 4.12Å; A249-L252 WeakPolarHBondContact O-CB 3.35Å; A249-L252 WeakPolarHBondContact O-CG 3.41Å; A249-L252 PolarHBondContact O-N 3.29Å; A249-V266 HydrophobicContact CB-CG2 4.33Å; A249-F301 HydrophobicContact CB-CD1 3.48Å; A249-F301 VanDerWaalsContact CB-CD1 3.48Å; A249-F301 HydrophobicContact CB-CE1 4.1Å; A249-F301 HydrophobicContact CB-CG 4.28Å
250	R	92.5	Very high	92.2	Very high	146 Å²	146	57.6 Å²	57.6	55%	0.551	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-61.3	-38.2	174.2	-72.8	174.6	173.8	134.5	1	112.6	P247 A248 L252 L253 F301	P247-R250 WeakPolarHBondContact O-CB 3.23Å; P247-R250 PolarHBondContact O-N 3Å; A248-R250 PolarHBondContact O-N 2.81Å; R250-L252 PolarHBondContact O-N 3.45Å; R250-L252 VanDerWaalsContact O-N 3.17Å; R250-L253 PolarHBondContact O-N 3.09Å; R250-L253 VanDerWaalsContact O-N 3.12Å; R250-F301 HydrophobicContact CB-CZ 4.47Å; R250-F301 HydrophobicContact CG-CE1 3.99Å; R250-F301 HydrophobicContact CG-CE2 4.4Å; R250-F301 HydrophobicContact CG-CZ 3.56Å
251	A	91.8	Very high	92.1	Very high	22 Å²	22	60.6 Å²	60.6	18%	0.182	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-62.1	-24.7	-178.7	0	0	0	0	0	112.4	A248 A249 L253 D254 L257 A262 R327	A248-A251 PolarHBondContact O-N 3.25Å; A249-A251 VanDerWaalsContact C-N 3.3Å; A249-A251 PolarHBondContact O-N 2.77Å; A251-L253 PolarHBondContact O-N 2.8Å; A251-D254 PolarHBondContact O-N 3.3Å; A251-L257 HydrophobicContact CB-CD2 3.99Å; A251-A262 VanDerWaalsContact O-CB 3.29Å; A251-A262 WeakPolarHBondContact O-CB 3.46Å; A251-R327 PolarHBondContact O-NH1 3.44Å
252	L	94	Very high	92	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.005	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-62.2	-28.2	176.6	-58.9	173.5	0	0	0	113.2	A249 R250 A262 T263 V266 V298 V302 L324 R327 I331	A249-L252 HydrophobicContact CB-CD1 4.12Å; A249-L252 WeakPolarHBondContact O-CB 3.35Å; A249-L252 WeakPolarHBondContact O-CG 3.41Å; A249-L252 PolarHBondContact O-N 3.29Å; R250-L252 PolarHBondContact O-N 3.45Å; R250-L252 VanDerWaalsContact O-N 3.17Å; L252-A262 VanDerWaalsContact CD2-O 3.31Å; L252-A262 WeakPolarHBondContact CD2-O 3.44Å; L252-T263 HydrophobicContact CD2-CG2 3.68Å; L252-V266 HydrophobicContact CD1-CG2 4.23Å; L252-V266 HydrophobicContact CG-CG2 4.4Å; L252-V298 HydrophobicContact CD1-CG1 3.84Å; L252-V302 HydrophobicContact CB-CG2 4.33Å; L252-V302 HydrophobicContact CD1-CG2 3.73Å; L252-L324 HydrophobicContact CB-CD2 4.4Å; L252-L324 VanDerWaalsContact O-CD2 3.29Å; L252-L324 WeakPolarHBondContact O-CD2 3.23Å; L252-R327 HydrophobicContact CD2-CB 4.16Å; L252-R327 WeakPolarHBondContact O-CD 3.13Å; L252-R327 PolarHBondContact O-NH1 3.2Å; L252-I331 HydrophobicContact CD1-CD1 4.08Å; L252-I331 HydrophobicContact CD2-CD1 3.92Å
253	L	91.9	Very high	92.2	Very high	29 Å²	29	58 Å²	58	15%	0.152	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-89.9	-12.9	-178.2	-64.8	162.7	0	0	0	113.3	R250 A251 I255 F301 V302 S305 L306 L320 L324	R250-L253 PolarHBondContact O-N 3.09Å; R250-L253 VanDerWaalsContact O-N 3.12Å; A251-L253 PolarHBondContact O-N 2.8Å; L253-I255 PolarHBondContact O-N 3.35Å; L253-F301 HydrophobicContact CD1-CE1 3.85Å; L253-F301 HydrophobicContact CD1-CZ 4.16Å; L253-V302 HydrophobicContact CD2-CG1 4.25Å; L253-S305 VanDerWaalsContact CD1-CB 3.43Å; L253-L306 HydrophobicContact CD2-CD2 4.1Å; L253-L306 HydrophobicContact CD2-CG 4.36Å; L253-L320 WeakPolarHBondContact O-CD1 3.47Å; L253-L324 HydrophobicContact CD2-CD1 4.3Å; L253-L324 HydrophobicContact CD2-CD2 4.31Å
254	D	89.1	Confident	92.4	Very high	63 Å²	63	55.3 Å²	55.3	34%	0.337	28%	0.284	S	S	.	.			trans	-79.9	110.6	-174.5	-168.1	-42.5	0	0	0	111.6	A251 H256 L257 R327	A251-D254 PolarHBondContact O-N 3.3Å; D254-H256 PolarHBondContact O-N 2.88Å; D254-H256 WeakPolarHBondContact OD1-CA 3.24Å; D254-H256 VanDerWaalsContact OD1-CB 3.31Å; D254-H256 WeakPolarHBondContact OD1-CB 3.41Å; D254-H256 IonicContact OD1-CD2 3.54Å; D254-H256 IonicContact OD1-CG 3.96Å; D254-H256 PolarHBondContact OD1-N 3Å; D254-L257 HydrophobicContact CB-CB 4.44Å; D254-L257 HydrophobicContact CB-CD1 4.17Å; D254-L257 PolarHBondContact O-N 3.18Å; D254-L257 PolarHBondContact OD1-N 2.94Å; D254-R327 VanDerWaalsContact O-CZ 3.29Å; D254-R327 PolarHBondContact O-NH1 2.73Å; D254-R327 PolarHBondContact O-NH2 3.15Å
255	I	88.6	Confident	92.5	Very high	35 Å²	35	56.9 Å²	56.9	18%	0.179	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-6.4	-178.6	63.8	171	0	0	0	114.5	L253 R319 L320	L253-I255 PolarHBondContact O-N 3.35Å; I255-R319 PolarHBondContact O-NE 2.81Å; I255-R319 PolarHBondContact O-NH2 3.13Å; I255-L320 HydrophobicContact CG2-CB 3.9Å; I255-L320 HydrophobicContact CG2-CD1 3.83Å; I255-L320 HydrophobicContact CG2-CG 4.43Å
256	H	88.3	Confident	92.6	Very high	149 Å²	149	56.8 Å²	56.8	69%	0.69	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-21.2	179.8	-53.6	-76.1	0	0	0	113.2	D254	D254-H256 PolarHBondContact O-N 2.88Å; D254-H256 WeakPolarHBondContact OD1-CA 3.24Å; D254-H256 VanDerWaalsContact OD1-CB 3.31Å; D254-H256 WeakPolarHBondContact OD1-CB 3.41Å; D254-H256 IonicContact OD1-CD2 3.54Å; D254-H256 IonicContact OD1-CG 3.96Å; D254-H256 PolarHBondContact OD1-N 3Å
257	L	90.9	Very high	93	Very high	65 Å²	65	54.6 Å²	54.6	34%	0.34	28%	0.284	S	S	.	.	S	Bend	trans	-72.4	151.9	170.2	-94.9	65.7	0	0	0	111.7	A251 D254 D261 A262 R327	A251-L257 HydrophobicContact CB-CD2 3.99Å; D254-L257 HydrophobicContact CB-CB 4.44Å; D254-L257 HydrophobicContact CB-CD1 4.17Å; D254-L257 PolarHBondContact O-N 3.18Å; D254-L257 PolarHBondContact OD1-N 2.94Å; L257-D261 HydrophobicContact CD2-CB 4.46Å; L257-A262 HydrophobicContact CB-CB 4.19Å; L257-A262 HydrophobicContact CD2-CB 4.49Å; L257-R327 PolarHBondContact O-NH2 2.91Å
258	N	93.2	Very high	93.2	Very high	111 Å²	111	57.2 Å²	57.2	59%	0.594	29%	0.29	S	S	*	.			trans	-73.7	151	167.4	-47.9	-72.8	0	0	0	110	H260 D261 A262	N258-H260 PolarHBondContact O-N 2.89Å; N258-H260 VanDerWaalsContact O-N 3.13Å; N258-D261 WeakPolarHBondContact CB-OD2 3.44Å; N258-D261 PolarHBondContact ND2-OD2 3.15Å; N258-D261 PolarHBondContact O-N 3.19Å; N258-D261 VanDerWaalsContact O-N 3.09Å; N258-A262 WeakPolarHBondContact O-CB 3.37Å; N258-A262 PolarHBondContact O-N 3.05Å
259	D	92.6	Very high	93.3	Very high	56 Å²	56	57.5 Å²	57.5	30%	0.299	29%	0.29	S	S	.	.	H	α-helix	trans	-62.8	-25.6	-175.5	-56.8	-41.2	0	0	0	113.7	T263 R327	D259-T263 WeakPolarHBondContact O-CB 3.47Å; D259-T263 WeakPolarHBondContact O-CG2 3.36Å; D259-T263 PolarHBondContact O-N 3.31Å; D259-T263 PolarHBondContact O-OG1 2.81Å; D259-R327 HydrophobicContact CB-CG 3.95Å; D259-R327 IonicContact OD1-CZ 3.09Å; D259-R327 IonicContact OD1-NE 2.68Å; D259-R327 PolarHBondContact OD1-NE 2.9Å; D259-R327 IonicContact OD1-NH2 2.74Å; D259-R327 PolarHBondContact OD1-NH2 2.98Å
260	H	92.8	Very high	93.4	Very high	148 Å²	148	57.5 Å²	57.5	69%	0.685	29%	0.291	S	S	*	.	H	α-helix	trans	-69.8	-48.7	173.2	-173.7	19	0	0	0	111.9	N258 T263 G264	N258-H260 PolarHBondContact O-N 2.89Å; N258-H260 VanDerWaalsContact O-N 3.13Å; H260-T263 PolarHBondContact O-N 3.33Å; H260-T263 PolarHBondContact O-OG1 2.88Å; H260-G264 PolarHBondContact O-N 3.04Å
261	D	93.1	Very high	93.5	Very high	88 Å²	88	52.1 Å²	52.1	47%	0.471	27%	0.272	S	S	.	.	H	α-helix	trans	-65.9	-43.6	179.9	-52.1	-45.4	0	0	0	110.1	L257 N258 T263 G264	L257-D261 HydrophobicContact CD2-CB 4.46Å; N258-D261 WeakPolarHBondContact CB-OD2 3.44Å; N258-D261 PolarHBondContact ND2-OD2 3.15Å; N258-D261 PolarHBondContact O-N 3.19Å; N258-D261 VanDerWaalsContact O-N 3.09Å; D261-T263 VanDerWaalsContact C-N 3.25Å; D261-T263 PolarHBondContact O-N 2.8Å; D261-G264 PolarHBondContact O-N 2.81Å
262	A	92.6	Very high	93.7	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-59.4	-30.2	177.2	0	0	0	0	0	114	A251 L252 L257 N258 R327	A251-A262 VanDerWaalsContact O-CB 3.29Å; A251-A262 WeakPolarHBondContact O-CB 3.46Å; L252-A262 VanDerWaalsContact CD2-O 3.31Å; L252-A262 WeakPolarHBondContact CD2-O 3.44Å; L257-A262 HydrophobicContact CB-CB 4.19Å; L257-A262 HydrophobicContact CD2-CB 4.49Å; N258-A262 WeakPolarHBondContact O-CB 3.37Å; N258-A262 PolarHBondContact O-N 3.05Å; A262-R327 HydrophobicContact CB-CG 4.38Å
263	T	96.4	Very high	93.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-98.6	-12.3	178.8	53.6	0	0	0	0	113.9	L252 D259 H260 D261 D265 V266 I267 R327 I331	L252-T263 HydrophobicContact CD2-CG2 3.68Å; D259-T263 WeakPolarHBondContact O-CB 3.47Å; D259-T263 WeakPolarHBondContact O-CG2 3.36Å; D259-T263 PolarHBondContact O-N 3.31Å; D259-T263 PolarHBondContact O-OG1 2.81Å; H260-T263 PolarHBondContact O-N 3.33Å; H260-T263 PolarHBondContact O-OG1 2.88Å; D261-T263 VanDerWaalsContact C-N 3.25Å; D261-T263 PolarHBondContact O-N 2.8Å; T263-D265 PolarHBondContact O-N 2.7Å; T263-V266 PolarHBondContact O-N 2.71Å; T263-I267 WeakPolarHBondContact O-CB 3.44Å; T263-I267 WeakPolarHBondContact O-CG1 3.4Å; T263-I267 PolarHBondContact O-N 3.48Å; T263-R327 HydrophobicContact CG2-CB 3.61Å; T263-R327 HydrophobicContact CG2-CG 3.89Å; T263-R327 WeakPolarHBondContact CG2-O 3.43Å; T263-I331 HydrophobicContact CG2-CG1 4.36Å
264	G	96	Very high	93.9	Very high	26 Å²	26	51.7 Å²	51.7	27%	0.268	27%	0.269	S	S	.	.	H	α-helix	trans	-55.7	-55	-171.5	0	0	0	0	0	113.9	H260 D261 V266 I267 H268	H260-G264 PolarHBondContact O-N 3.04Å; D261-G264 PolarHBondContact O-N 2.81Å; G264-V266 PolarHBondContact O-N 2.86Å; G264-I267 PolarHBondContact O-N 2.83Å; G264-H268 WeakPolarHBondContact O-CB 3.29Å; G264-H268 PolarHBondContact O-N 2.6Å
265	D	95.9	Very high	94	Very high	104 Å²	104	54.4 Å²	54.4	56%	0.556	27%	0.274	S	S	*	.	H	α-helix	trans	-64.4	-39.4	-177	-75.6	-21	0	0	0	113	A248 T263 L269	A248-D265 HydrophobicContact CB-CB 3.73Å; T263-D265 PolarHBondContact O-N 2.7Å; D265-L269 VanDerWaalsContact O-CB 3.31Å; D265-L269 WeakPolarHBondContact O-CB 3.45Å; D265-L269 PolarHBondContact O-N 2.68Å
266	V	96.9	Very high	94.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.3	-46.9	178.6	179.4	0	0	0	0	110.3	A248 A249 L252 T263 G264 H268 L269 L270 V298 I331	A248-V266 HydrophobicContact CB-CG2 3.91Å; A249-V266 HydrophobicContact CB-CG2 4.33Å; L252-V266 HydrophobicContact CD1-CG2 4.23Å; L252-V266 HydrophobicContact CG-CG2 4.4Å; T263-V266 PolarHBondContact O-N 2.71Å; G264-V266 PolarHBondContact O-N 2.86Å; V266-H268 PolarHBondContact O-N 3.13Å; V266-L269 PolarHBondContact O-N 2.88Å; V266-L270 HydrophobicContact CG1-CD1 4.12Å; V266-L270 WeakPolarHBondContact O-CB 3.31Å; V266-L270 VanDerWaalsContact O-CG 3.28Å; V266-L270 WeakPolarHBondContact O-CG 3.26Å; V266-L270 PolarHBondContact O-N 3.45Å; V266-V298 HydrophobicContact CG1-CG2 3.94Å; V266-I331 HydrophobicContact CG1-CD1 4.03Å
267	I	97.1	Very high	94.4	Very high	31 Å²	31	47.4 Å²	47.4	16%	0.159	24%	0.241	C	C	.	.	H	α-helix	trans	-64.9	-39.7	177.8	-71.4	174.7	0	0	0	111	T263 G264 L270 D271 I331 F334	T263-I267 WeakPolarHBondContact O-CB 3.44Å; T263-I267 WeakPolarHBondContact O-CG1 3.4Å; T263-I267 PolarHBondContact O-N 3.48Å; G264-I267 PolarHBondContact O-N 2.83Å; I267-L270 PolarHBondContact O-N 2.88Å; I267-D271 WeakPolarHBondContact O-CB 3.46Å; I267-D271 PolarHBondContact O-N 2.91Å; I267-I331 HydrophobicContact CD1-CG1 4.43Å; I267-I331 HydrophobicContact CG1-CG1 4.18Å; I267-F334 HydrophobicContact CD1-CB 4.35Å; I267-F334 HydrophobicContact CG1-CB 4.3Å; I267-F334 HydrophobicContact CG1-CG 4.38Å; I267-F334 HydrophobicContact CG2-CB 4.41Å; I267-F334 HydrophobicContact CG2-CD1 4.44Å; I267-F334 HydrophobicContact CG2-CD2 3.59Å; I267-F334 HydrophobicContact CG2-CE2 3.96Å; I267-F334 HydrophobicContact CG2-CG 3.86Å
268	H	96.1	Very high	94.3	Very high	118 Å²	118	48.1 Å²	48.1	55%	0.546	24%	0.239	S	C	.	.	H	α-helix	trans	-67.4	-39.7	176.8	178.6	-114.9	0	0	0	112.6	G264 V266 D271 T272	G264-H268 WeakPolarHBondContact O-CB 3.29Å; G264-H268 PolarHBondContact O-N 2.6Å; V266-H268 PolarHBondContact O-N 3.13Å; H268-D271 PolarHBondContact O-N 2.85Å; H268-T272 WeakPolarHBondContact NE2-CG2 3.46Å; H268-T272 WeakPolarHBondContact O-CB 3.44Å; H268-T272 WeakPolarHBondContact O-CG2 3Å; H268-T272 PolarHBondContact O-N 3.26Å; H268-T272 PolarHBondContact O-OG1 3.08Å
269	L	96.3	Very high	94.1	Very high	14 Å²	14	47.2 Å²	47.2	7%	0.073	23%	0.234	C	C	.	.	H	α-helix	trans	-65.2	-41.2	174.1	-178.1	60.5	0	0	0	111.5	L241 V244 I245 D265 V266 T272 T273	L241-L269 HydrophobicContact CD2-CD1 4.25Å; V244-L269 HydrophobicContact CB-CD2 4.15Å; V244-L269 HydrophobicContact CG1-CD1 4.1Å; V244-L269 HydrophobicContact CG1-CD2 3.99Å; I245-L269 HydrophobicContact CB-CD2 3.62Å; I245-L269 HydrophobicContact CD1-CD2 4.3Å; I245-L269 HydrophobicContact CG1-CD2 3.92Å; D265-L269 VanDerWaalsContact O-CB 3.31Å; D265-L269 WeakPolarHBondContact O-CB 3.45Å; D265-L269 PolarHBondContact O-N 2.68Å; V266-L269 PolarHBondContact O-N 2.88Å; L269-T272 PolarHBondContact O-OG1 2.95Å; L269-T273 WeakPolarHBondContact O-CB 3.41Å; L269-T273 PolarHBondContact O-N 3.22Å; L269-T273 PolarHBondContact O-OG1 2.58Å
270	L	95.8	Very high	94.1	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-48.4	174.8	-69.8	168.8	0	0	0	111.5	V266 I267 T273 M274 L294 L295 I331 F334	V266-L270 HydrophobicContact CG1-CD1 4.12Å; V266-L270 WeakPolarHBondContact O-CB 3.31Å; V266-L270 VanDerWaalsContact O-CG 3.28Å; V266-L270 WeakPolarHBondContact O-CG 3.26Å; V266-L270 PolarHBondContact O-N 3.45Å; I267-L270 PolarHBondContact O-N 2.88Å; L270-T273 PolarHBondContact O-N 3.36Å; L270-M274 VanDerWaalsContact O-CB 3.3Å; L270-M274 WeakPolarHBondContact O-CB 3.27Å; L270-M274 WeakPolarHBondContact O-CG 3.44Å; L270-M274 PolarHBondContact O-N 2.78Å; L270-L294 HydrophobicContact CD2-CB 3.81Å; L270-L294 HydrophobicContact CD2-CD1 3.88Å; L270-L294 HydrophobicContact CD2-CG 4.49Å; L270-L295 HydrophobicContact CD1-CD2 4.41Å; L270-I331 HydrophobicContact CD1-CG2 4.18Å; L270-F334 HydrophobicContact CB-CD1 4.29Å; L270-F334 HydrophobicContact CB-CE1 3.65Å; L270-F334 HydrophobicContact CB-CZ 4.43Å; L270-F334 HydrophobicContact CD1-CD1 4.38Å
271	D	95.1	Very high	93.9	Very high	32 Å²	32	39.1 Å²	39.1	17%	0.171	20%	0.203	C	C	.	.	H	α-helix	trans	-59.8	-55.1	178.6	-176	84.6	0	0	0	112	I267 H268 T273 M274 R275 F334	I267-D271 WeakPolarHBondContact O-CB 3.46Å; I267-D271 PolarHBondContact O-N 2.91Å; H268-D271 PolarHBondContact O-N 2.85Å; D271-T273 VanDerWaalsContact C-N 3.27Å; D271-T273 PolarHBondContact O-N 2.81Å; D271-M274 PolarHBondContact O-N 3.42Å; D271-R275 WeakPolarHBondContact O-CB 3.47Å; D271-R275 PolarHBondContact O-N 3.34Å; D271-R275 IonicContact OD1-CZ 2.71Å; D271-R275 IonicContact OD1-NE 3.87Å; D271-R275 IonicContact OD1-NH2 2.63Å; D271-R275 PolarHBondContact OD1-NH2 3.14Å; D271-R275 IonicContact OD2-CZ 3.99Å; D271-R275 IonicContact OD2-NE 2.77Å; D271-R275 PolarHBondContact OD2-NE 3.06Å; D271-R275 IonicContact OD2-NH2 3.45Å; D271-R275 PolarHBondContact OD2-NH2 2.82Å; D271-F334 HydrophobicContact CB-CE2 3.98Å; D271-F334 HydrophobicContact CB-CZ 3.63Å
272	T	95.6	Very high	93.9	Very high	39 Å²	39	35.5 Å²	35.5	24%	0.239	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-40	-177	53.8	0	0	0	0	112	K195 H268 L269 Q276	K195-T272 PolarHBondContact NZ-OG1 2.62Å; H268-T272 WeakPolarHBondContact NE2-CG2 3.46Å; H268-T272 WeakPolarHBondContact O-CB 3.44Å; H268-T272 WeakPolarHBondContact O-CG2 3Å; H268-T272 PolarHBondContact O-N 3.26Å; H268-T272 PolarHBondContact O-OG1 3.08Å; L269-T272 PolarHBondContact O-OG1 2.95Å; T272-Q276 WeakPolarHBondContact O-CB 3.37Å; T272-Q276 PolarHBondContact O-N 3.19Å
273	T	95.3	Very high	94	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-73	-43.9	-178.3	-52.3	0	0	0	0	112	K195 I199 L241 L269 L270 D271 Q276 A277 L290 L294	K195-T273 PolarHBondContact NZ-OG1 3.01Å; I199-T273 HydrophobicContact CD1-CG2 3.88Å; L241-T273 HydrophobicContact CD1-CG2 3.8Å; L241-T273 HydrophobicContact CD2-CG2 4.1Å; L269-T273 WeakPolarHBondContact O-CB 3.41Å; L269-T273 PolarHBondContact O-N 3.22Å; L269-T273 PolarHBondContact O-OG1 2.58Å; L270-T273 PolarHBondContact O-N 3.36Å; D271-T273 VanDerWaalsContact C-N 3.27Å; D271-T273 PolarHBondContact O-N 2.81Å; T273-Q276 PolarHBondContact O-N 3.36Å; T273-A277 PolarHBondContact O-N 3.41Å; T273-L290 HydrophobicContact CG2-CD2 4.27Å; T273-L294 HydrophobicContact CG2-CD1 4.27Å
274	M	93.4	Very high	93.7	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.02	21%	0.213	C	C	.	.	H	α-helix	trans	-70.6	-32.7	176	-66.1	-65.4	105	0	0	112.4	L270 D271 R278 T287 L290 C291 L294 M338	L270-M274 VanDerWaalsContact O-CB 3.3Å; L270-M274 WeakPolarHBondContact O-CB 3.27Å; L270-M274 WeakPolarHBondContact O-CG 3.44Å; L270-M274 PolarHBondContact O-N 2.78Å; D271-M274 PolarHBondContact O-N 3.42Å; M274-R278 WeakPolarHBondContact O-CG 3.44Å; M274-R278 PolarHBondContact O-N 2.89Å; M274-R278 VanDerWaalsContact O-N 3.13Å; M274-T287 HydrophobicContact CE-CG2 4.48Å; M274-T287 HydrophobicContact SD-CG2 3.65Å; M274-L290 HydrophobicContact CE-CB 4.25Å; M274-L290 HydrophobicContact CE-CD2 3.78Å; M274-L290 HydrophobicContact CE-CG 3.85Å; M274-C291 HydrophobicContact CE-CB 4.23Å; M274-C291 HydrophobicContact SD-CB 3.84Å; M274-L294 HydrophobicContact CE-CD1 4.1Å; M274-M338 HydrophobicContact CB-CE 3.41Å; M274-M338 VanDerWaalsContact CB-CE 3.41Å; M274-M338 HydrophobicContact CG-CE 4.1Å
275	R	92.1	Very high	93.6	Very high	121 Å²	121	39.9 Å²	39.9	46%	0.457	22%	0.216	S	C	.	.	H	α-helix	trans	-65.2	-45.9	173.1	-177.5	-177.8	-59.2	-83.6	-7.8	110.9	D271 R278 I279	D271-R275 WeakPolarHBondContact O-CB 3.47Å; D271-R275 PolarHBondContact O-N 3.34Å; D271-R275 IonicContact OD1-CZ 2.71Å; D271-R275 IonicContact OD1-NE 3.87Å; D271-R275 IonicContact OD1-NH2 2.63Å; D271-R275 PolarHBondContact OD1-NH2 3.14Å; D271-R275 IonicContact OD2-CZ 3.99Å; D271-R275 IonicContact OD2-NE 2.77Å; D271-R275 PolarHBondContact OD2-NE 3.06Å; D271-R275 IonicContact OD2-NH2 3.45Å; D271-R275 PolarHBondContact OD2-NH2 2.82Å; R275-R278 PolarHBondContact O-N 3.35Å; R275-I279 HydrophobicContact CG-CD1 3.96Å; R275-I279 VanDerWaalsContact O-CG1 3.31Å; R275-I279 WeakPolarHBondContact O-CG1 3.42Å; R275-I279 PolarHBondContact O-N 3.45Å
276	Q	92.4	Very high	93.5	Very high	37 Å²	37	35 Å²	35	17%	0.173	19%	0.19	C	C	.	.	H	α-helix	trans	-62.5	-43.4	174.9	-175.8	67.9	-3.9	0	0	111.7	D196 I199 T272 T273 R278 I279 C280	D196-Q276 HydrophobicContact CB-CG 4.12Å; D196-Q276 WeakPolarHBondContact OD1-CG 3.33Å; I199-Q276 HydrophobicContact CB-CG 4.34Å; I199-Q276 HydrophobicContact CD1-CB 4.2Å; I199-Q276 HydrophobicContact CD1-CG 4.09Å; I199-Q276 HydrophobicContact CG2-CG 4.05Å; T272-Q276 WeakPolarHBondContact O-CB 3.37Å; T272-Q276 PolarHBondContact O-N 3.19Å; T273-Q276 PolarHBondContact O-N 3.36Å; Q276-R278 VanDerWaalsContact C-N 3.32Å; Q276-R278 PolarHBondContact O-N 2.78Å; Q276-I279 PolarHBondContact O-N 3.18Å; Q276-I279 VanDerWaalsContact O-N 3.12Å; Q276-C280 WeakPolarHBondContact O-CB 3.38Å; Q276-C280 PolarHBondContact O-N 3.33Å; Q276-C280 PolarHBondContact O-SG 2.88Å; Q276-C280 VanDerWaalsContact O-SG 3.41Å
277	A	92.9	Very high	93.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-54.3	-46.3	174.9	0	0	0	0	0	112.4	I199 T273 C280 G281 L282 T287	I199-A277 HydrophobicContact CG2-CB 4.23Å; T273-A277 PolarHBondContact O-N 3.41Å; A277-C280 PolarHBondContact O-N 3.33Å; A277-G281 PolarHBondContact O-N 2.99Å; A277-L282 HydrophobicContact CB-CB 4.19Å; A277-L282 HydrophobicContact CB-CD2 3.95Å; A277-L282 WeakPolarHBondContact O-CB 3.13Å; A277-L282 PolarHBondContact O-N 2.97Å; A277-T287 HydrophobicContact CB-CG2 4.17Å
278	R	89.9	Confident	93.2	Very high	80 Å²	80	38.3 Å²	38.3	30%	0.302	21%	0.208	S	C	.	.	H	α-helix	trans	-65.3	-41.3	175.2	-67.3	173	-171.1	146.1	-0.7	112.7	M274 R275 Q276 C280 G281 M338	M274-R278 WeakPolarHBondContact O-CG 3.44Å; M274-R278 PolarHBondContact O-N 2.89Å; M274-R278 VanDerWaalsContact O-N 3.13Å; R275-R278 PolarHBondContact O-N 3.35Å; Q276-R278 VanDerWaalsContact C-N 3.32Å; Q276-R278 PolarHBondContact O-N 2.78Å; R278-C280 VanDerWaalsContact C-N 3.34Å; R278-C280 PolarHBondContact O-N 2.97Å; R278-G281 PolarHBondContact O-N 2.88Å; R278-G281 VanDerWaalsContact O-N 3.16Å; R278-M338 VanDerWaalsContact NH1-CE 3.26Å; R278-M338 PolarHBondContact NH1-SD 2.87Å; R278-M338 PolarHBondContact NH2-O 3.03Å; R278-M338 PolarHBondContact NH2-SD 3.15Å
279	I	88.8	Confident	93.1	Very high	92 Å²	92	34.5 Å²	34.5	47%	0.472	19%	0.19	S	C	.	.	H	α-helix	trans	-64.3	-37.7	177.9	-71.5	166.9	0	0	0	111.7	R152 R275 Q276 G281	R152-I279 WeakPolarHBondContact CG-O 3.09Å; R275-I279 HydrophobicContact CG-CD1 3.96Å; R275-I279 VanDerWaalsContact O-CG1 3.31Å; R275-I279 WeakPolarHBondContact O-CG1 3.42Å; R275-I279 PolarHBondContact O-N 3.45Å; Q276-I279 PolarHBondContact O-N 3.18Å; Q276-I279 VanDerWaalsContact O-N 3.12Å; I279-G281 PolarHBondContact O-N 3.36Å
280	C	90.9	Very high	93	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-8.8	176	-68.5	0	0	0	0	114	I199 A203 Q276 A277 R278	I199-C280 HydrophobicContact CG2-CB 4.03Å; A203-C280 HydrophobicContact CB-CB 4.2Å; Q276-C280 WeakPolarHBondContact O-CB 3.38Å; Q276-C280 PolarHBondContact O-N 3.33Å; Q276-C280 PolarHBondContact O-SG 2.88Å; Q276-C280 VanDerWaalsContact O-SG 3.41Å; A277-C280 PolarHBondContact O-N 3.33Å; R278-C280 VanDerWaalsContact C-N 3.34Å; R278-C280 PolarHBondContact O-N 2.97Å
281	G	89.4	Confident	93	Very high	34 Å²	34	33.9 Å²	33.9	35%	0.351	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	27.7	-174.8	0	0	0	0	0	113.8	A277 R278 I279 N283	A277-G281 PolarHBondContact O-N 2.99Å; R278-G281 PolarHBondContact O-N 2.88Å; R278-G281 VanDerWaalsContact O-N 3.16Å; I279-G281 PolarHBondContact O-N 3.36Å; G281-N283 PolarHBondContact O-N 2.91Å
282	L	93.9	Very high	93	Very high	11 Å²	11	32.5 Å²	32.5	6%	0.058	18%	0.18	C	C	.	.			trans	-63.8	132	176.9	-174.7	65.5	0	0	0	110.4	L202 A203 A277 L286 T287	L202-L282 HydrophobicContact CB-CD1 4.33Å; L202-L282 HydrophobicContact CD2-CD1 3.84Å; L202-L282 HydrophobicContact CD2-CD2 4.05Å; L202-L282 HydrophobicContact CG-CD1 3.81Å; A203-L282 HydrophobicContact CB-CB 4.17Å; A203-L282 HydrophobicContact CB-CD1 4.05Å; A277-L282 HydrophobicContact CB-CB 4.19Å; A277-L282 HydrophobicContact CB-CD2 3.95Å; A277-L282 WeakPolarHBondContact O-CB 3.13Å; A277-L282 PolarHBondContact O-N 2.97Å; L282-L286 HydrophobicContact CD1-CB 3.94Å; L282-L286 HydrophobicContact CD1-CD1 3.81Å; L282-L286 HydrophobicContact CD2-CB 4.26Å; L282-L286 HydrophobicContact CG-CB 3.99Å; L282-T287 PolarHBondContact O-OG1 3.04Å
283	N	93.2	Very high	93	Very high	11 Å²	11	32 Å²	32	6%	0.059	18%	0.175	C	C	.	.			trans	-52	140.4	178.9	-178.1	-61.9	0	0	0	111.5	G281 A285 L286 T287 P438 D440 G441 Y442	G281-N283 PolarHBondContact O-N 2.91Å; N283-A285 VanDerWaalsContact C-N 3.3Å; N283-A285 PolarHBondContact O-N 3.07Å; N283-A285 PolarHBondContact OD1-N 3.25Å; N283-L286 HydrophobicContact CB-CD1 4.37Å; N283-L286 PolarHBondContact O-N 3.38Å; N283-L286 VanDerWaalsContact O-N 3.11Å; N283-T287 PolarHBondContact O-N 2.72Å; N283-T287 PolarHBondContact O-OG1 3.41Å; N283-T287 VanDerWaalsContact O-OG1 3.07Å; N283-P438 HydrophobicContact CB-CG 4.09Å; N283-P438 VanDerWaalsContact CG-CG 3.48Å; N283-P438 WeakPolarHBondContact ND2-CB 3.44Å; N283-P438 WeakPolarHBondContact OD1-CG 3.49Å; N283-D440 PolarHBondContact ND2-O 3.08Å; N283-G441 PolarHBondContact ND2-O 3.04Å; N283-Y442 HydrophobicContact CB-CD1 4.47Å; N283-Y442 HydrophobicContact CB-CE1 4.19Å
284	A	91.3	Very high	93	Very high	68 Å²	68	32 Å²	32	56%	0.562	18%	0.175	S	C	*	.	H	α-helix	trans	-56.9	-39.5	-175.9	0	0	0	0	0	113.1	T287 I288	A284-T287 WeakPolarHBondContact O-CB 3.16Å; A284-T287 PolarHBondContact O-N 2.8Å; A284-I288 VanDerWaalsContact O-CG1 3.32Å; A284-I288 WeakPolarHBondContact O-CG1 3.39Å; A284-I288 PolarHBondContact O-N 3.38Å
285	A	92.6	Very high	93.1	Very high	41 Å²	41	31.8 Å²	31.8	34%	0.339	17%	0.174	S	C	.	.	H	α-helix	trans	-73.2	-27	179.7	0	0	0	0	0	113.3	N283 Q289 P438	N283-A285 VanDerWaalsContact C-N 3.3Å; N283-A285 PolarHBondContact O-N 3.07Å; N283-A285 PolarHBondContact OD1-N 3.25Å; A285-Q289 WeakPolarHBondContact O-CG 3.25Å; A285-Q289 PolarHBondContact O-N 2.85Å; A285-Q289 VanDerWaalsContact O-N 3.13Å; A285-Q289 PolarHBondContact O-NE2 2.88Å; A285-P438 HydrophobicContact CB-CB 4.36Å; A285-P438 HydrophobicContact CB-CG 4.01Å
286	L	94.9	Very high	93.3	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-73.3	-35.3	167.8	-71.1	173.2	0	0	0	111.4	L282 N283 Q289 L290 F435 P438	L282-L286 HydrophobicContact CD1-CB 3.94Å; L282-L286 HydrophobicContact CD1-CD1 3.81Å; L282-L286 HydrophobicContact CD2-CB 4.26Å; L282-L286 HydrophobicContact CG-CB 3.99Å; N283-L286 HydrophobicContact CB-CD1 4.37Å; N283-L286 PolarHBondContact O-N 3.38Å; N283-L286 VanDerWaalsContact O-N 3.11Å; L286-Q289 PolarHBondContact O-N 3.31Å; L286-L290 WeakPolarHBondContact O-CB 3.23Å; L286-L290 PolarHBondContact O-N 3.07Å; L286-F435 HydrophobicContact CD2-CE2 3.67Å; L286-F435 HydrophobicContact CD2-CZ 3.68Å; L286-P438 HydrophobicContact CD1-CG 4.3Å; L286-P438 HydrophobicContact CD2-CG 4.43Å; L286-P438 HydrophobicContact CG-CG 3.79Å
287	T	93.9	Very high	93.5	Very high	13 Å²	13	25.9 Å²	25.9	8%	0.08	15%	0.152	C	C	.	.	H	α-helix	trans	-66.7	-40.6	175.7	-55.9	0	0	0	0	111.6	M274 A277 L282 N283 A284 L290 C291	M274-T287 HydrophobicContact CE-CG2 4.48Å; M274-T287 HydrophobicContact SD-CG2 3.65Å; A277-T287 HydrophobicContact CB-CG2 4.17Å; L282-T287 PolarHBondContact O-OG1 3.04Å; N283-T287 PolarHBondContact O-N 2.72Å; N283-T287 PolarHBondContact O-OG1 3.41Å; N283-T287 VanDerWaalsContact O-OG1 3.07Å; A284-T287 WeakPolarHBondContact O-CB 3.16Å; A284-T287 PolarHBondContact O-N 2.8Å; T287-L290 PolarHBondContact O-N 2.86Å; T287-C291 WeakPolarHBondContact O-CB 3.39Å; T287-C291 PolarHBondContact O-N 3.26Å
288	I	92.7	Very high	93.6	Very high	89 Å²	89	26.1 Å²	26.1	46%	0.456	15%	0.153	S	C	.	.	H	α-helix	trans	-64.6	-46.6	173.5	-68.7	162.6	0	0	0	110.7	A284 L290 C291 G292 V340	A284-I288 VanDerWaalsContact O-CG1 3.32Å; A284-I288 WeakPolarHBondContact O-CG1 3.39Å; A284-I288 PolarHBondContact O-N 3.38Å; I288-L290 VanDerWaalsContact C-N 3.34Å; I288-L290 PolarHBondContact O-N 2.89Å; I288-C291 PolarHBondContact O-N 2.97Å; I288-G292 PolarHBondContact O-N 3.45Å; I288-V340 HydrophobicContact CG1-CG1 4.33Å
289	Q	94.5	Very high	93.9	Very high	37 Å²	37	22.5 Å²	22.5	17%	0.173	14%	0.14	C	C	.	.	H	α-helix	trans	-58	-44.7	175	-80.2	172.1	89.6	0	0	112	F234 A285 L286 G292 H293 L436	F234-Q289 HydrophobicContact CE2-CB 4.21Å; F234-Q289 HydrophobicContact CZ-CB 4.06Å; A285-Q289 WeakPolarHBondContact O-CG 3.25Å; A285-Q289 PolarHBondContact O-N 2.85Å; A285-Q289 VanDerWaalsContact O-N 3.13Å; A285-Q289 PolarHBondContact O-NE2 2.88Å; L286-Q289 PolarHBondContact O-N 3.31Å; Q289-G292 PolarHBondContact O-N 2.94Å; Q289-H293 PolarHBondContact O-N 2.93Å; Q289-H293 VanDerWaalsContact O-N 3.1Å; Q289-H293 PolarHBondContact O-ND1 3.18Å; Q289-L436 PolarHBondContact NE2-O 2.91Å; Q289-L436 PolarHBondContact OE1-O 3.17Å
290	L	94.9	Very high	94.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-45.3	176	-177.9	61.1	0	0	0	111.3	F234 L237 V238 L241 T273 M274 L286 T287 I288 G292 H293 L294	F234-L290 HydrophobicContact CE2-CB 3.99Å; F234-L290 HydrophobicContact CE2-CD1 4.36Å; L237-L290 HydrophobicContact CD2-CD1 3.9Å; L237-L290 HydrophobicContact CD2-CD2 3.86Å; L237-L290 HydrophobicContact CG-CD1 4.12Å; V238-L290 HydrophobicContact CG2-CD1 4.23Å; L241-L290 HydrophobicContact CD1-CD1 4Å; T273-L290 HydrophobicContact CG2-CD2 4.27Å; M274-L290 HydrophobicContact CE-CB 4.25Å; M274-L290 HydrophobicContact CE-CD2 3.78Å; M274-L290 HydrophobicContact CE-CG 3.85Å; L286-L290 WeakPolarHBondContact O-CB 3.23Å; L286-L290 PolarHBondContact O-N 3.07Å; T287-L290 PolarHBondContact O-N 2.86Å; I288-L290 VanDerWaalsContact C-N 3.34Å; I288-L290 PolarHBondContact O-N 2.89Å; L290-G292 PolarHBondContact O-N 2.89Å; L290-H293 PolarHBondContact O-N 3.31Å; L290-L294 WeakPolarHBondContact O-CG 3.45Å; L290-L294 PolarHBondContact O-N 3.26Å; L290-L294 VanDerWaalsContact O-N 3.09Å
291	C	94.9	Very high	94.2	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.014	12%	0.124	C	C	.	.	H	α-helix	trans	-61.8	-43.2	177.8	-165.2	0	0	0	0	112.1	M274 T287 I288 H293 L294 L295	M274-C291 HydrophobicContact CE-CB 4.23Å; M274-C291 HydrophobicContact SD-CB 3.84Å; T287-C291 WeakPolarHBondContact O-CB 3.39Å; T287-C291 PolarHBondContact O-N 3.26Å; I288-C291 PolarHBondContact O-N 2.97Å; C291-H293 PolarHBondContact O-N 3.33Å; C291-L294 PolarHBondContact O-N 2.82Å; C291-L295 WeakPolarHBondContact O-CB 3.5Å; C291-L295 WeakPolarHBondContact O-CD1 3.48Å; C291-L295 VanDerWaalsContact O-CG 3.31Å; C291-L295 WeakPolarHBondContact O-CG 3.33Å; C291-L295 PolarHBondContact O-N 3.32Å
292	G	95.3	Very high	94.5	Very high	3 Å²	3	18 Å²	18	3%	0.031	11%	0.108	C	C	.	.	H	α-helix	trans	-58.9	-42.8	175.6	0	0	0	0	0	113.1	I288 Q289 L290 L295 H296 H347	I288-G292 PolarHBondContact O-N 3.45Å; Q289-G292 PolarHBondContact O-N 2.94Å; L290-G292 PolarHBondContact O-N 2.89Å; G292-L295 PolarHBondContact O-N 3.48Å; G292-H296 VanDerWaalsContact O-CB 3.29Å; G292-H296 WeakPolarHBondContact O-CB 3.39Å; G292-H296 PolarHBondContact O-N 2.86Å; G292-H347 VanDerWaalsContact CA-CD2 3.49Å; G292-H347 WeakPolarHBondContact CA-CD2 3.29Å
293	H	95.4	Very high	94.5	Very high	29 Å²	29	17.5 Å²	17.5	13%	0.134	11%	0.105	C	C	.	.	H	α-helix	trans	-63.1	-41.6	174	-74.5	72.9	0	0	0	112.4	F234 V238 Q289 L290 C291 H296 M297 L431	F234-H293 AromaticContact CE1-CE1 3.63Å; F234-H293 AromaticContact CE1-ND1 3.85Å; F234-H293 AromaticContact CE1-NE2 3.82Å; F234-H293 AromaticContact CZ-CE1 3.84Å; F234-H293 AromaticContact CZ-ND1 3.66Å; V238-H293 HydrophobicContact CG1-CB 4.26Å; V238-H293 HydrophobicContact CG2-CB 4.01Å; Q289-H293 PolarHBondContact O-N 2.93Å; Q289-H293 VanDerWaalsContact O-N 3.1Å; Q289-H293 PolarHBondContact O-ND1 3.18Å; L290-H293 PolarHBondContact O-N 3.31Å; C291-H293 PolarHBondContact O-N 3.33Å; H293-H296 PolarHBondContact O-N 3.46Å; H293-M297 WeakPolarHBondContact O-CE 3.49Å; H293-M297 WeakPolarHBondContact O-CG 3.49Å; H293-M297 PolarHBondContact O-N 3.38Å; H293-L431 HydrophobicContact CB-CD2 4.5Å
294	L	95.5	Very high	94.5	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64.5	-44.2	176.9	-64.4	176.3	0	0	0	112	L241 I245 L270 T273 M274 L290 C291 M297 V298	L241-L294 HydrophobicContact CB-CD2 3.7Å; L241-L294 HydrophobicContact CD1-CD2 3.93Å; L241-L294 HydrophobicContact CG-CD2 4.33Å; I245-L294 HydrophobicContact CD1-CB 3.85Å; I245-L294 HydrophobicContact CD1-CD2 3.94Å; I245-L294 HydrophobicContact CD1-CG 4.45Å; I245-L294 WeakPolarHBondContact CD1-O 3.34Å; L270-L294 HydrophobicContact CD2-CB 3.81Å; L270-L294 HydrophobicContact CD2-CD1 3.88Å; L270-L294 HydrophobicContact CD2-CG 4.49Å; T273-L294 HydrophobicContact CG2-CD1 4.27Å; M274-L294 HydrophobicContact CE-CD1 4.1Å; L290-L294 WeakPolarHBondContact O-CG 3.45Å; L290-L294 PolarHBondContact O-N 3.26Å; L290-L294 VanDerWaalsContact O-N 3.09Å; C291-L294 PolarHBondContact O-N 2.82Å; L294-M297 HydrophobicContact CD2-CE 3.71Å; L294-M297 PolarHBondContact O-N 3.04Å; L294-V298 WeakPolarHBondContact O-CG2 3.19Å; L294-V298 PolarHBondContact O-N 3.02Å; L294-V298 VanDerWaalsContact O-N 3.08Å
295	L	96.3	Very high	94.5	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-68.3	-37.4	178.8	-67.8	162.7	0	0	0	111.8	L270 C291 G292 V298 N299 I331 A343 A344 H347 L348	L270-L295 HydrophobicContact CD1-CD2 4.41Å; C291-L295 WeakPolarHBondContact O-CB 3.5Å; C291-L295 WeakPolarHBondContact O-CD1 3.48Å; C291-L295 VanDerWaalsContact O-CG 3.31Å; C291-L295 WeakPolarHBondContact O-CG 3.33Å; C291-L295 PolarHBondContact O-N 3.32Å; G292-L295 PolarHBondContact O-N 3.48Å; L295-V298 PolarHBondContact O-N 2.95Å; L295-N299 PolarHBondContact O-N 3.48Å; L295-I331 HydrophobicContact CD2-CG2 4.09Å; L295-A343 HydrophobicContact CD1-CB 4Å; L295-A344 HydrophobicContact CD1-CB 4.08Å; L295-A344 HydrophobicContact CD2-CB 4.44Å; L295-H347 HydrophobicContact CB-CB 3.92Å; L295-L348 HydrophobicContact CB-CD2 4.35Å; L295-L348 HydrophobicContact CD2-CD1 4Å; L295-L348 HydrophobicContact CD2-CD2 4.21Å; L295-L348 HydrophobicContact CD2-CG 4.18Å; L295-L348 WeakPolarHBondContact O-CD2 3.25Å
296	H	96.3	Very high	94.4	Very high	19 Å²	19	13.7 Å²	13.7	9%	0.088	7%	0.071	C	C	.	.	H	α-helix	trans	-61.7	-44	171.5	-175.9	78.8	0	0	0	111.9	G292 H293 V298 N299 A300 S428 L431	G292-H296 VanDerWaalsContact O-CB 3.29Å; G292-H296 WeakPolarHBondContact O-CB 3.39Å; G292-H296 PolarHBondContact O-N 2.86Å; H293-H296 PolarHBondContact O-N 3.46Å; H296-V298 VanDerWaalsContact C-N 3.31Å; H296-V298 PolarHBondContact O-N 2.97Å; H296-N299 PolarHBondContact O-N 3.31Å; H296-N299 VanDerWaalsContact O-N 3.17Å; H296-A300 WeakPolarHBondContact O-CB 3.4Å; H296-A300 PolarHBondContact O-N 2.97Å; H296-S428 PolarHBondContact NE2-O 2.91Å; H296-L431 HydrophobicContact CB-CB 4.28Å; H296-L431 HydrophobicContact CB-CD1 4.38Å; H296-L431 HydrophobicContact CB-CD2 3.96Å; H296-L431 HydrophobicContact CB-CG 4.44Å
297	M	95.4	Very high	94.2	Very high	14 Å²	14	13.7 Å²	13.7	7%	0.069	7%	0.071	C	C	.	.	H	α-helix	trans	-65.5	-31.3	176.7	-72.3	-175.2	-67.3	0	0	113.2	V238 Q242 I245 H293 L294 F301	V238-M297 HydrophobicContact CG1-CE 3.91Å; V238-M297 HydrophobicContact CG1-SD 4.16Å; Q242-M297 HydrophobicContact CB-CE 4.43Å; Q242-M297 HydrophobicContact CB-SD 3.48Å; Q242-M297 WeakPolarHBondContact CB-SD 3.48Å; Q242-M297 HydrophobicContact CG-SD 3.51Å; Q242-M297 VanDerWaalsContact CG-SD 3.51Å; I245-M297 HydrophobicContact CG2-CB 4.01Å; I245-M297 HydrophobicContact CG2-CE 4.24Å; I245-M297 HydrophobicContact CG2-SD 4.4Å; H293-M297 WeakPolarHBondContact O-CE 3.49Å; H293-M297 WeakPolarHBondContact O-CG 3.49Å; H293-M297 PolarHBondContact O-N 3.38Å; L294-M297 HydrophobicContact CD2-CE 3.71Å; L294-M297 PolarHBondContact O-N 3.04Å; M297-F301 VanDerWaalsContact O-CB 3.28Å; M297-F301 WeakPolarHBondContact O-CB 3.43Å; M297-F301 PolarHBondContact O-N 3.01Å; M297-F301 VanDerWaalsContact O-N 3.1Å
298	V	95.9	Very high	93.7	Very high	5 Å²	5	14.2 Å²	14.2	3%	0.03	8%	0.075	C	C	.	.	H	α-helix	trans	-66.8	-47.5	169.8	173.8	0	0	0	0	110.4	I245 L252 V266 L294 L295 H296 F301 V302 L348	I245-V298 HydrophobicContact CD1-CG2 3.67Å; I245-V298 HydrophobicContact CG1-CG2 3.76Å; L252-V298 HydrophobicContact CD1-CG1 3.84Å; V266-V298 HydrophobicContact CG1-CG2 3.94Å; L294-V298 WeakPolarHBondContact O-CG2 3.19Å; L294-V298 PolarHBondContact O-N 3.02Å; L294-V298 VanDerWaalsContact O-N 3.08Å; L295-V298 PolarHBondContact O-N 2.95Å; H296-V298 VanDerWaalsContact C-N 3.31Å; H296-V298 PolarHBondContact O-N 2.97Å; V298-F301 PolarHBondContact O-N 2.6Å; V298-V302 HydrophobicContact CG1-CG2 4.29Å; V298-V302 WeakPolarHBondContact O-CB 3.37Å; V298-V302 WeakPolarHBondContact O-CG2 3.47Å; V298-V302 PolarHBondContact O-N 3.49Å; V298-L348 HydrophobicContact CB-CD2 4.21Å; V298-L348 HydrophobicContact CG1-CD2 4.08Å
299	N	95.4	Very high	92.4	Very high	5 Å²	5	16.1 Å²	16.1	3%	0.027	9%	0.09	C	C	.	.	H	α-helix	trans	-61.1	-50.6	178	175.7	75.4	0	0	0	112.4	L295 H296 F301 V302 F303 H347 L348 S351	L295-N299 PolarHBondContact O-N 3.48Å; H296-N299 PolarHBondContact O-N 3.31Å; H296-N299 VanDerWaalsContact O-N 3.17Å; N299-F301 VanDerWaalsContact C-N 3.31Å; N299-F301 PolarHBondContact O-N 2.95Å; N299-V302 PolarHBondContact O-N 3.03Å; N299-F303 WeakPolarHBondContact O-CB 3.36Å; N299-F303 PolarHBondContact O-N 3.02Å; N299-H347 WeakPolarHBondContact CB-O 3.37Å; N299-L348 HydrophobicContact CB-CD2 4.33Å; N299-S351 WeakPolarHBondContact CA-OG 3.48Å; N299-S351 PolarHBondContact O-OG 3.48Å; N299-S351 VanDerWaalsContact OD1-CB 3.25Å; N299-S351 WeakPolarHBondContact OD1-CB 3.26Å; N299-S351 PolarHBondContact OD1-N 2.66Å; N299-S351 PolarHBondContact OD1-OG 3.38Å
300	A	94.1	Very high	90.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.4	-42.1	179.8	0	0	0	0	0	111	H296 N304 E427	H296-A300 WeakPolarHBondContact O-CB 3.4Å; H296-A300 PolarHBondContact O-N 2.97Å; A300-N304 WeakPolarHBondContact O-CB 3.19Å; A300-N304 PolarHBondContact O-N 3.23Å; A300-N304 PolarHBondContact O-OD1 2.83Å; A300-E427 HydrophobicContact CB-CB 4.24Å
301	F	93.3	Very high	89.1	Confident	29 Å²	29	23.3 Å²	23.3	13%	0.127	13%	0.13	C	C	.	.	H	α-helix	trans	-65.9	-49.2	176.1	175.2	-96.8	0	0	0	113.3	R246 A249 R250 L253 M297 V298 N299 S305	R246-F301 HydrophobicContact CG-CD2 3.69Å; R246-F301 HydrophobicContact CG-CE2 4.12Å; R246-F301 HydrophobicContact CG-CG 4.29Å; A249-F301 HydrophobicContact CB-CD1 3.48Å; A249-F301 VanDerWaalsContact CB-CD1 3.48Å; A249-F301 HydrophobicContact CB-CE1 4.1Å; A249-F301 HydrophobicContact CB-CG 4.28Å; R250-F301 HydrophobicContact CB-CZ 4.47Å; R250-F301 HydrophobicContact CG-CE1 3.99Å; R250-F301 HydrophobicContact CG-CE2 4.4Å; R250-F301 HydrophobicContact CG-CZ 3.56Å; L253-F301 HydrophobicContact CD1-CE1 3.85Å; L253-F301 HydrophobicContact CD1-CZ 4.16Å; M297-F301 VanDerWaalsContact O-CB 3.28Å; M297-F301 WeakPolarHBondContact O-CB 3.43Å; M297-F301 PolarHBondContact O-N 3.01Å; M297-F301 VanDerWaalsContact O-N 3.1Å; V298-F301 PolarHBondContact O-N 2.6Å; N299-F301 VanDerWaalsContact C-N 3.31Å; N299-F301 PolarHBondContact O-N 2.95Å; F301-S305 WeakPolarHBondContact CZ-OG 3.21Å; F301-S305 WeakPolarHBondContact O-CB 3.34Å; F301-S305 PolarHBondContact O-N 3.49Å; F301-S305 VanDerWaalsContact O-N 3.12Å; F301-S305 PolarHBondContact O-OG 2.68Å
302	V	93.9	Very high	87.3	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.012	15%	0.152	C	C	.	.	H	α-helix	trans	-64.6	-49	-178.5	170	0	0	0	0	110.1	L252 L253 V298 N299 S305 L306 L324	L252-V302 HydrophobicContact CB-CG2 4.33Å; L252-V302 HydrophobicContact CD1-CG2 3.73Å; L253-V302 HydrophobicContact CD2-CG1 4.25Å; V298-V302 HydrophobicContact CG1-CG2 4.29Å; V298-V302 WeakPolarHBondContact O-CB 3.37Å; V298-V302 WeakPolarHBondContact O-CG2 3.47Å; V298-V302 PolarHBondContact O-N 3.49Å; N299-V302 PolarHBondContact O-N 3.03Å; V302-S305 WeakPolarHBondContact O-CB 3.37Å; V302-S305 PolarHBondContact O-N 2.79Å; V302-L306 WeakPolarHBondContact O-CG 3.26Å; V302-L306 PolarHBondContact O-N 2.91Å; V302-L306 VanDerWaalsContact O-N 3.15Å; V302-L324 HydrophobicContact CG1-CD2 4.04Å
303	F	94.8	Very high	85.1	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.2	-49.8	-179.8	-166.7	-82.6	0	0	0	112.4	N299 S305 L306 V307 R350 A354 L375 Q379 I383 E427	N299-F303 WeakPolarHBondContact O-CB 3.36Å; N299-F303 PolarHBondContact O-N 3.02Å; F303-S305 PolarHBondContact O-N 3.03Å; F303-S305 VanDerWaalsContact O-N 3.16Å; F303-L306 WeakPolarHBondContact O-CA 3.47Å; F303-L306 WeakPolarHBondContact O-CB 3.47Å; F303-L306 PolarHBondContact O-N 3.01Å; F303-V307 HydrophobicContact CD1-CG1 4.4Å; F303-V307 HydrophobicContact CD1-CG2 4.03Å; F303-V307 HydrophobicContact CE1-CB 4.49Å; F303-V307 HydrophobicContact CE1-CG1 3.73Å; F303-V307 HydrophobicContact CE1-CG2 3.89Å; F303-V307 HydrophobicContact CZ-CG1 4.09Å; F303-V307 PolarHBondContact O-N 3.16Å; F303-V307 VanDerWaalsContact O-N 3.08Å; F303-R350 HydrophobicContact CD2-CB 4.01Å; F303-R350 HydrophobicContact CE2-CB 4.15Å; F303-A354 HydrophobicContact CD2-CB 4.1Å; F303-A354 HydrophobicContact CE2-CB 3.89Å; F303-L375 HydrophobicContact CE2-CD2 3.63Å; F303-L375 HydrophobicContact CZ-CD2 4.1Å; F303-Q379 HydrophobicContact CE1-CG 3.79Å; F303-Q379 VanDerWaalsContact CE1-NE2 3.28Å; F303-Q379 HydrophobicContact CZ-CB 3.96Å; F303-Q379 HydrophobicContact CZ-CG 3.66Å; F303-I383 HydrophobicContact CE2-CD1 4.31Å; F303-I383 HydrophobicContact CZ-CD1 4.22Å; F303-E427 HydrophobicContact CB-CG 4.07Å; F303-E427 HydrophobicContact CD1-CG 3.64Å; F303-E427 HydrophobicContact CE1-CG 4.36Å; F303-E427 HydrophobicContact CG-CG 3.93Å
304	N	93.4	Very high	83.1	Confident	23 Å²	23	30.6 Å²	30.6	12%	0.123	19%	0.188	C	C	.	.	H	α-helix	trans	-66.7	-20.2	-178.8	-64.4	-0.3	0	0	0	112.2	A300 S308 E426 E427	A300-N304 WeakPolarHBondContact O-CB 3.19Å; A300-N304 PolarHBondContact O-N 3.23Å; A300-N304 PolarHBondContact O-OD1 2.83Å; N304-S308 VanDerWaalsContact O-CB 3.26Å; N304-S308 WeakPolarHBondContact O-CB 3.24Å; N304-S308 PolarHBondContact O-N 2.86Å; N304-E426 HydrophobicContact CB-CG 4.48Å; N304-E427 PolarHBondContact ND2-O 3.45Å; N304-E427 WeakPolarHBondContact OD1-CB 3.46Å; N304-E427 PolarHBondContact OD1-N 2.92Å
305	S	91.4	Very high	82	Confident	16 Å²	16	34.5 Å²	34.5	11%	0.112	21%	0.207	C	C	.	.	H	α-helix	trans	-71.3	-46.5	167.7	-57.3	0	0	0	0	111.4	L253 F301 V302 F303 V307 S308	L253-S305 VanDerWaalsContact CD1-CB 3.43Å; F301-S305 WeakPolarHBondContact CZ-OG 3.21Å; F301-S305 WeakPolarHBondContact O-CB 3.34Å; F301-S305 PolarHBondContact O-N 3.49Å; F301-S305 VanDerWaalsContact O-N 3.12Å; F301-S305 PolarHBondContact O-OG 2.68Å; V302-S305 WeakPolarHBondContact O-CB 3.37Å; V302-S305 PolarHBondContact O-N 2.79Å; F303-S305 PolarHBondContact O-N 3.03Å; F303-S305 VanDerWaalsContact O-N 3.16Å; S305-V307 PolarHBondContact O-N 2.74Å; S305-S308 WeakPolarHBondContact O-CB 3.02Å; S305-S308 PolarHBondContact O-N 3.03Å; S305-S308 VanDerWaalsContact O-N 3.08Å
306	L	91	Very high	81.6	Confident	1 Å²	1	35 Å²	35	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-61.6	-28.2	178	-66.9	174.7	0	0	0	113.9	L253 V302 F303 L316 L320 L324 A354 L358	L253-L306 HydrophobicContact CD2-CD2 4.1Å; L253-L306 HydrophobicContact CD2-CG 4.36Å; V302-L306 WeakPolarHBondContact O-CG 3.26Å; V302-L306 PolarHBondContact O-N 2.91Å; V302-L306 VanDerWaalsContact O-N 3.15Å; F303-L306 WeakPolarHBondContact O-CA 3.47Å; F303-L306 WeakPolarHBondContact O-CB 3.47Å; F303-L306 PolarHBondContact O-N 3.01Å; L306-L316 HydrophobicContact CD2-CD2 3.76Å; L306-L320 HydrophobicContact CD2-CD2 3.76Å; L306-L324 HydrophobicContact CD1-CD1 3.99Å; L306-L324 HydrophobicContact CD2-CD1 3.97Å; L306-L324 HydrophobicContact CG-CD1 4.45Å; L306-A354 HydrophobicContact CD1-CB 3.86Å; L306-L358 HydrophobicContact CD2-CD1 4.17Å
307	V	89.8	Confident	81.3	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.006	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	14.8	174.5	-58.4	0	0	0	0	113.7	F303 S305 H382 I383 L425 E426	F303-V307 HydrophobicContact CD1-CG1 4.4Å; F303-V307 HydrophobicContact CD1-CG2 4.03Å; F303-V307 HydrophobicContact CE1-CB 4.49Å; F303-V307 HydrophobicContact CE1-CG1 3.73Å; F303-V307 HydrophobicContact CE1-CG2 3.89Å; F303-V307 HydrophobicContact CZ-CG1 4.09Å; F303-V307 PolarHBondContact O-N 3.16Å; F303-V307 VanDerWaalsContact O-N 3.08Å; S305-V307 PolarHBondContact O-N 2.74Å; V307-H382 PolarHBondContact O-NE2 2.91Å; V307-I383 HydrophobicContact CG1-CD1 4.12Å; V307-I383 HydrophobicContact CG1-CG1 3.94Å; V307-L425 HydrophobicContact CB-CD1 3.86Å; V307-L425 HydrophobicContact CB-CD2 4.38Å; V307-L425 HydrophobicContact CB-CG 3.89Å; V307-L425 HydrophobicContact CG1-CD1 4.02Å; V307-L425 HydrophobicContact CG2-CD1 4.37Å; V307-L425 HydrophobicContact CG2-CG 4.02Å; V307-E426 HydrophobicContact CG2-CG 4.28Å
308	S	84.6	Confident	81.2	Confident	23 Å²	23	34.1 Å²	34.1	16%	0.161	21%	0.206	C	C	.	.			trans	-84.5	130.3	177.6	-153.9	0	0	0	0	111.5	N304 S305 N310 L311	N304-S308 VanDerWaalsContact O-CB 3.26Å; N304-S308 WeakPolarHBondContact O-CB 3.24Å; N304-S308 PolarHBondContact O-N 2.86Å; S305-S308 WeakPolarHBondContact O-CB 3.02Å; S305-S308 PolarHBondContact O-N 3.03Å; S305-S308 VanDerWaalsContact O-N 3.08Å; S308-N310 PolarHBondContact O-N 2.9Å; S308-N310 PolarHBondContact OG-ND2 3Å; S308-L311 PolarHBondContact O-N 2.79Å
309	V	65.3	Low	81	Confident	130 Å²	130	39.7 Å²	39.7	79%	0.788	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-10.4	167.8	-164.5	0	0	0	0	112.7
310	N	56.2	Low	80.8	Confident	143 Å²	143	39.6 Å²	39.6	77%	0.765	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-7.3	178.9	-53.9	-83.5	0	0	0	114.1	S308	S308-N310 PolarHBondContact O-N 2.9Å; S308-N310 PolarHBondContact OG-ND2 3Å
311	L	62.5	Low	80.8	Confident	45 Å²	45	39.6 Å²	39.6	24%	0.236	23%	0.225	C	C	.	.	S	Bend	trans	-80.1	137.5	166.7	-112.4	69.4	0	0	0	109.1	S308 A313	S308-L311 PolarHBondContact O-N 2.79Å; L311-A313 PolarHBondContact O-N 2.86Å
312	P	56.8	Low	80.8	Confident	75 Å²	75	43 Å²	43	49%	0.487	24%	0.24	S	C	.	.			trans	-61.7	133.5	167	-17	30	0	0	0	109.7	A314 Q315	P312-A314 PolarHBondContact O-N 2.69Å; P312-Q315 HydrophobicContact CB-CG 4.36Å; P312-Q315 HydrophobicContact CG-CG 4.42Å; P312-Q315 WeakPolarHBondContact O-CB 3.33Å; P312-Q315 PolarHBondContact O-N 3.5Å
313	A	50.6	Low	80.9	Confident	50 Å²	50	43.9 Å²	43.9	41%	0.413	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-52.7	-38.8	178.2	0	0	0	0	0	112.1	L311 Q315 L316 E388	L311-A313 PolarHBondContact O-N 2.86Å; A313-Q315 PolarHBondContact O-N 2.77Å; A313-L316 PolarHBondContact O-N 2.95Å; A313-E388 VanDerWaalsContact C-OE1 3.23Å; A313-E388 WeakPolarHBondContact CB-OE1 3.36Å
314	A	52.4	Low	80.9	Confident	61 Å²	61	43.9 Å²	43.9	50%	0.504	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-60.1	18.3	171.4	0	0	0	0	0	116.7	P312 E388	P312-A314 PolarHBondContact O-N 2.69Å; A314-E388 VanDerWaalsContact CA-CD 3.41Å; A314-E388 VanDerWaalsContact CA-OE2 3.28Å; A314-E388 WeakPolarHBondContact CA-OE2 3.21Å; A314-E388 WeakPolarHBondContact CB-OE2 3.22Å; A314-E388 VanDerWaalsContact N-CD 3.33Å; A314-E388 PolarHBondContact N-OE1 2.99Å
315	Q	72.4	Confident	81	Confident	83 Å²	83	45.8 Å²	45.8	39%	0.388	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-116.4	-19	168.5	-62.4	-171	-9.8	0	0	113.1	P312 A313 N317 L320	P312-Q315 HydrophobicContact CB-CG 4.36Å; P312-Q315 HydrophobicContact CG-CG 4.42Å; P312-Q315 WeakPolarHBondContact O-CB 3.33Å; P312-Q315 PolarHBondContact O-N 3.5Å; A313-Q315 PolarHBondContact O-N 2.77Å; Q315-N317 PolarHBondContact O-N 3.37Å; Q315-L320 WeakPolarHBondContact O-CB 3.25Å; Q315-L320 WeakPolarHBondContact O-CD2 3.07Å
316	L	88.7	Confident	81.2	Confident	9 Å²	9	52.3 Å²	52.3	5%	0.047	28%	0.278	C	S	.	.			trans	-83.1	65	179.9	-65.2	-176.7	0	0	0	111.6	L306 A313 L320 L358 G386 F387 E388	L306-L316 HydrophobicContact CD2-CD2 3.76Å; A313-L316 PolarHBondContact O-N 2.95Å; L316-L320 HydrophobicContact CD2-CD2 4.27Å; L316-L358 HydrophobicContact CB-CD2 4.23Å; L316-L358 HydrophobicContact CD2-CD1 4.41Å; L316-G386 WeakPolarHBondContact CB-O 3.24Å; L316-F387 WeakPolarHBondContact O-CA 3.05Å; L316-F387 WeakPolarHBondContact O-CD2 3.39Å; L316-E388 PolarHBondContact O-N 3.03Å
317	N	90.4	Very high	81.5	Confident	14 Å²	14	52.3 Å²	52.3	8%	0.075	28%	0.277	C	S	.	.	S	Bend	trans	-111.2	170	179.1	60.2	26.4	0	0	0	112.8	Q315 R319 L320 G321 E388 D390	Q315-N317 PolarHBondContact O-N 3.37Å; N317-R319 PolarHBondContact O-N 3.06Å; N317-R319 WeakPolarHBondContact OD1-CB 3.48Å; N317-R319 PolarHBondContact OD1-N 3.25Å; N317-L320 PolarHBondContact O-N 3.35Å; N317-L320 PolarHBondContact OD1-N 3.43Å; N317-G321 PolarHBondContact O-N 3Å; N317-G321 VanDerWaalsContact O-N 3.15Å; N317-E388 WeakPolarHBondContact CA-O 3.38Å; N317-E388 VanDerWaalsContact CB-O 3.25Å; N317-E388 WeakPolarHBondContact CB-O 3.42Å; N317-D390 PolarHBondContact ND2-OD1 3.33Å
318	T	92.3	Very high	81.9	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-65	-27.2	180	-77.6	0	0	0	0	112	G321 K322 L358 K362 F387 E393	T318-G321 PolarHBondContact O-N 3.12Å; T318-K322 HydrophobicContact CG2-CD 3.9Å; T318-K322 HydrophobicContact CG2-CG 4.48Å; T318-K322 WeakPolarHBondContact O-CG 3.33Å; T318-K322 PolarHBondContact O-N 3Å; T318-L358 PolarHBondContact OG1-O 3.09Å; T318-K362 PolarHBondContact OG1-NZ 3.32Å; T318-F387 WeakPolarHBondContact OG1-CZ 3.33Å; T318-E393 VanDerWaalsContact CB-OE1 3.24Å; T318-E393 WeakPolarHBondContact CB-OE1 3.43Å; T318-E393 WeakPolarHBondContact CB-OE2 3.16Å; T318-E393 WeakPolarHBondContact CG2-OE1 3.35Å; T318-E393 PolarHBondContact OG1-OE1 3.4Å; T318-E393 PolarHBondContact OG1-OE2 3.31Å
319	R	91.3	Very high	82.4	Confident	121 Å²	121	54.9 Å²	54.9	46%	0.457	29%	0.287	S	S	.	.	H	α-helix	trans	-61.2	-48.8	170.4	176.5	178.2	174.5	158.7	-1.3	112.1	I255 N317 G321 K322 C323 D390	I255-R319 PolarHBondContact O-NE 2.81Å; I255-R319 PolarHBondContact O-NH2 3.13Å; N317-R319 PolarHBondContact O-N 3.06Å; N317-R319 WeakPolarHBondContact OD1-CB 3.48Å; N317-R319 PolarHBondContact OD1-N 3.25Å; R319-G321 VanDerWaalsContact C-N 3.33Å; R319-G321 PolarHBondContact O-N 3.33Å; R319-K322 PolarHBondContact O-N 3.1Å; R319-C323 PolarHBondContact O-N 3.45Å; R319-D390 PolarHBondContact N-OD2 3.48Å
320	L	92.6	Very high	83.9	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-59.8	-44.8	176	176.3	60.2	0	0	0	111	L253 I255 L306 Q315 L316 N317 K322 C323 L324	L253-L320 WeakPolarHBondContact O-CD1 3.47Å; I255-L320 HydrophobicContact CG2-CB 3.9Å; I255-L320 HydrophobicContact CG2-CD1 3.83Å; I255-L320 HydrophobicContact CG2-CG 4.43Å; L306-L320 HydrophobicContact CD2-CD2 3.76Å; Q315-L320 WeakPolarHBondContact O-CB 3.25Å; Q315-L320 WeakPolarHBondContact O-CD2 3.07Å; L316-L320 HydrophobicContact CD2-CD2 4.27Å; N317-L320 PolarHBondContact O-N 3.35Å; N317-L320 PolarHBondContact OD1-N 3.43Å; L320-K322 PolarHBondContact O-N 2.89Å; L320-C323 PolarHBondContact O-N 2.81Å; L320-L324 HydrophobicContact CD1-CD1 3.86Å; L320-L324 HydrophobicContact CD1-CG 3.98Å; L320-L324 HydrophobicContact CG-CD1 3.93Å; L320-L324 HydrophobicContact CG-CG 4.45Å; L320-L324 WeakPolarHBondContact O-CB 3.46Å; L320-L324 WeakPolarHBondContact O-CG 3.37Å; L320-L324 PolarHBondContact O-N 3.35Å
321	G	94.1	Very high	85.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-53.8	-50.8	175	0	0	0	0	0	112.7	N317 T318 R319 L324 Q325	N317-G321 PolarHBondContact O-N 3Å; N317-G321 VanDerWaalsContact O-N 3.15Å; T318-G321 PolarHBondContact O-N 3.12Å; R319-G321 VanDerWaalsContact C-N 3.33Å; R319-G321 PolarHBondContact O-N 3.33Å; G321-L324 PolarHBondContact O-N 2.89Å; G321-Q325 WeakPolarHBondContact O-CG 3.46Å; G321-Q325 PolarHBondContact O-N 2.96Å
322	K	93.4	Very high	87.5	Confident	102 Å²	102	43 Å²	43	44%	0.443	22%	0.221	S	C	.	.	H	α-helix	trans	-63.6	-43.1	178.7	-72.6	165.3	-178.7	163.9	0	112.8	T318 R319 L320 Q325 Y326 A359	T318-K322 HydrophobicContact CG2-CD 3.9Å; T318-K322 HydrophobicContact CG2-CG 4.48Å; T318-K322 WeakPolarHBondContact O-CG 3.33Å; T318-K322 PolarHBondContact O-N 3Å; R319-K322 PolarHBondContact O-N 3.1Å; L320-K322 PolarHBondContact O-N 2.89Å; K322-Q325 WeakPolarHBondContact O-CB 3.28Å; K322-Q325 PolarHBondContact O-N 2.91Å; K322-Y326 WeakPolarHBondContact O-CD2 3.44Å; K322-Y326 PolarHBondContact O-N 3.06Å; K322-A359 HydrophobicContact CG-CB 3.99Å
323	C	94.8	Very high	89.3	Confident	19 Å²	19	45.8 Å²	45.8	13%	0.128	22%	0.222	C	C	.	.	H	α-helix	trans	-59.3	-47.8	173.9	-78.8	0	0	0	0	111.2	R319 L320 Q325 Y326 R327	R319-C323 PolarHBondContact O-N 3.45Å; L320-C323 PolarHBondContact O-N 2.81Å; C323-Q325 PolarHBondContact O-N 2.77Å; C323-Y326 PolarHBondContact O-N 2.97Å; C323-R327 WeakPolarHBondContact O-CB 3.28Å; C323-R327 VanDerWaalsContact O-CD 3.29Å; C323-R327 WeakPolarHBondContact O-CD 3.34Å; C323-R327 WeakPolarHBondContact O-CG 3.46Å; C323-R327 PolarHBondContact O-N 2.93Å
324	L	95.9	Very high	91.4	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-63.4	-37.4	178.1	-74.5	171.9	0	0	0	112.8	L252 L253 V302 L306 L320 G321 R327 I328 A355	L252-L324 HydrophobicContact CB-CD2 4.4Å; L252-L324 VanDerWaalsContact O-CD2 3.29Å; L252-L324 WeakPolarHBondContact O-CD2 3.23Å; L253-L324 HydrophobicContact CD2-CD1 4.3Å; L253-L324 HydrophobicContact CD2-CD2 4.31Å; V302-L324 HydrophobicContact CG1-CD2 4.04Å; L306-L324 HydrophobicContact CD1-CD1 3.99Å; L306-L324 HydrophobicContact CD2-CD1 3.97Å; L306-L324 HydrophobicContact CG-CD1 4.45Å; L320-L324 HydrophobicContact CD1-CD1 3.86Å; L320-L324 HydrophobicContact CD1-CG 3.98Å; L320-L324 HydrophobicContact CG-CD1 3.93Å; L320-L324 HydrophobicContact CG-CG 4.45Å; L320-L324 WeakPolarHBondContact O-CB 3.46Å; L320-L324 WeakPolarHBondContact O-CG 3.37Å; L320-L324 PolarHBondContact O-N 3.35Å; G321-L324 PolarHBondContact O-N 2.89Å; L324-R327 PolarHBondContact O-N 3.16Å; L324-I328 HydrophobicContact CB-CD1 4.38Å; L324-I328 VanDerWaalsContact O-CB 3.28Å; L324-I328 WeakPolarHBondContact O-CB 3.33Å; L324-I328 VanDerWaalsContact O-CG1 3.23Å; L324-I328 WeakPolarHBondContact O-CG1 3.49Å; L324-I328 PolarHBondContact O-N 2.75Å; L324-A355 HydrophobicContact CB-CB 3.6Å
325	Q	95.4	Very high	93.4	Very high	62 Å²	62	41.5 Å²	41.5	29%	0.29	18%	0.183	S	C	.	.	H	α-helix	trans	-55.2	-54.9	172.6	-75.1	177.9	-43.5	0	0	111.4	G321 K322 C323 R327 E329 A355 N356 A359	G321-Q325 WeakPolarHBondContact O-CG 3.46Å; G321-Q325 PolarHBondContact O-N 2.96Å; K322-Q325 WeakPolarHBondContact O-CB 3.28Å; K322-Q325 PolarHBondContact O-N 2.91Å; C323-Q325 PolarHBondContact O-N 2.77Å; Q325-R327 VanDerWaalsContact C-N 3.34Å; Q325-R327 PolarHBondContact O-N 3.17Å; Q325-E329 WeakPolarHBondContact O-CB 3.36Å; Q325-E329 PolarHBondContact O-N 3.13Å; Q325-A355 HydrophobicContact CG-CB 4.06Å; Q325-N356 PolarHBondContact NE2-OD1 3.17Å; Q325-A359 HydrophobicContact CG-CB 4.43Å; Q325-A359 VanDerWaalsContact OE1-CB 3.26Å
326	Y	95.7	Very high	94.4	Very high	154 Å²	154	41.8 Å²	41.8	60%	0.604	18%	0.184	S	C	*	.	H	α-helix	trans	-64.6	-36.4	-179.8	-68.1	-60.8	0	0	0	113	K322 C323 S330	K322-Y326 WeakPolarHBondContact O-CD2 3.44Å; K322-Y326 PolarHBondContact O-N 3.06Å; C323-Y326 PolarHBondContact O-N 2.97Å; Y326-S330 WeakPolarHBondContact O-CB 3.47Å; Y326-S330 PolarHBondContact O-N 3.36Å
327	R	97	Very high	94.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-72.4	-43.9	-178.7	-67.8	164.9	-170.5	-160.5	-5.3	112.4	A251 L252 D254 L257 D259 A262 T263 C323 L324 Q325 E329 S330 I331	A251-R327 PolarHBondContact O-NH1 3.44Å; L252-R327 HydrophobicContact CD2-CB 4.16Å; L252-R327 WeakPolarHBondContact O-CD 3.13Å; L252-R327 PolarHBondContact O-NH1 3.2Å; D254-R327 VanDerWaalsContact O-CZ 3.29Å; D254-R327 PolarHBondContact O-NH1 2.73Å; D254-R327 PolarHBondContact O-NH2 3.15Å; L257-R327 PolarHBondContact O-NH2 2.91Å; D259-R327 HydrophobicContact CB-CG 3.95Å; D259-R327 IonicContact OD1-CZ 3.09Å; D259-R327 IonicContact OD1-NE 2.68Å; D259-R327 PolarHBondContact OD1-NE 2.9Å; D259-R327 IonicContact OD1-NH2 2.74Å; D259-R327 PolarHBondContact OD1-NH2 2.98Å; A262-R327 HydrophobicContact CB-CG 4.38Å; T263-R327 HydrophobicContact CG2-CB 3.61Å; T263-R327 HydrophobicContact CG2-CG 3.89Å; T263-R327 WeakPolarHBondContact CG2-O 3.43Å; C323-R327 WeakPolarHBondContact O-CB 3.28Å; C323-R327 VanDerWaalsContact O-CD 3.29Å; C323-R327 WeakPolarHBondContact O-CD 3.34Å; C323-R327 WeakPolarHBondContact O-CG 3.46Å; C323-R327 PolarHBondContact O-N 2.93Å; L324-R327 PolarHBondContact O-N 3.16Å; Q325-R327 VanDerWaalsContact C-N 3.34Å; Q325-R327 PolarHBondContact O-N 3.17Å; R327-E329 VanDerWaalsContact C-N 3.35Å; R327-S330 WeakPolarHBondContact O-CB 3.47Å; R327-S330 PolarHBondContact O-N 3.39Å; R327-I331 WeakPolarHBondContact O-CG1 3.5Å; R327-I331 PolarHBondContact O-N 3.32Å; R327-I331 VanDerWaalsContact O-N 3.16Å
328	I	96.9	Very high	94.3	Very high	10 Å²	10	50.4 Å²	50.4	5%	0.051	22%	0.217	C	C	.	.	H	α-helix	trans	-65.9	-40.1	175.5	-67.5	168.5	0	0	0	110.2	L324 I331 H332 L348 R352 A355	L324-I328 HydrophobicContact CB-CD1 4.38Å; L324-I328 VanDerWaalsContact O-CB 3.28Å; L324-I328 WeakPolarHBondContact O-CB 3.33Å; L324-I328 VanDerWaalsContact O-CG1 3.23Å; L324-I328 WeakPolarHBondContact O-CG1 3.49Å; L324-I328 PolarHBondContact O-N 2.75Å; I328-I331 PolarHBondContact O-N 2.96Å; I328-H332 PolarHBondContact O-N 2.94Å; I328-L348 HydrophobicContact CG2-CB 4.17Å; I328-L348 HydrophobicContact CG2-CD1 4.26Å; I328-R352 HydrophobicContact CG2-CB 4.3Å; I328-A355 HydrophobicContact CD1-CB 4.36Å
329	E	95.9	Very high	94.1	Very high	68 Å²	68	52.7 Å²	52.7	32%	0.318	24%	0.24	S	C	.	.	H	α-helix	trans	-63.9	-37.5	174	176.7	65.4	177.9	0	0	112.7	Q325 R327 I331 H332 R333	Q325-E329 WeakPolarHBondContact O-CB 3.36Å; Q325-E329 PolarHBondContact O-N 3.13Å; R327-E329 VanDerWaalsContact C-N 3.35Å; E329-I331 VanDerWaalsContact C-N 3.34Å; E329-I331 PolarHBondContact O-N 2.77Å; E329-H332 WeakPolarHBondContact O-CB 3.19Å; E329-H332 PolarHBondContact O-N 3.47Å; E329-R333 WeakPolarHBondContact O-CG 3.36Å; E329-R333 PolarHBondContact O-N 3.46Å; E329-R333 IonicContact OE1-CZ 3.75Å; E329-R333 IonicContact OE1-NE 2.93Å; E329-R333 PolarHBondContact OE1-NE 3.17Å; E329-R333 IonicContact OE1-NH2 2.67Å; E329-R333 PolarHBondContact OE1-NH2 3.31Å
330	S	96.6	Very high	94	Very high	40 Å²	40	47.6 Å²	47.6	28%	0.28	22%	0.223	S	C	.	.	H	α-helix	trans	-60.8	-42.1	173	-175.3	0	0	0	0	111.9	Y326 R327 F334	Y326-S330 WeakPolarHBondContact O-CB 3.47Å; Y326-S330 PolarHBondContact O-N 3.36Å; R327-S330 WeakPolarHBondContact O-CB 3.47Å; R327-S330 PolarHBondContact O-N 3.39Å; S330-F334 PolarHBondContact O-N 3.18Å
331	I	97.3	Very high	94	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-66.4	-41.7	174	-63	166.8	0	0	0	110.5	L252 T263 V266 I267 L270 L295 R327 I328 E329 F334 C335 L348	L252-I331 HydrophobicContact CD1-CD1 4.08Å; L252-I331 HydrophobicContact CD2-CD1 3.92Å; T263-I331 HydrophobicContact CG2-CG1 4.36Å; V266-I331 HydrophobicContact CG1-CD1 4.03Å; I267-I331 HydrophobicContact CD1-CG1 4.43Å; I267-I331 HydrophobicContact CG1-CG1 4.18Å; L270-I331 HydrophobicContact CD1-CG2 4.18Å; L295-I331 HydrophobicContact CD2-CG2 4.09Å; R327-I331 WeakPolarHBondContact O-CG1 3.5Å; R327-I331 PolarHBondContact O-N 3.32Å; R327-I331 VanDerWaalsContact O-N 3.16Å; I328-I331 PolarHBondContact O-N 2.96Å; E329-I331 VanDerWaalsContact C-N 3.34Å; E329-I331 PolarHBondContact O-N 2.77Å; I331-F334 WeakPolarHBondContact O-CB 3.41Å; I331-F334 PolarHBondContact O-N 2.96Å; I331-F334 VanDerWaalsContact O-N 3.14Å; I331-C335 PolarHBondContact O-N 2.96Å; I331-L348 HydrophobicContact CB-CD1 4.36Å; I331-L348 HydrophobicContact CG2-CD1 3.81Å
332	H	96	Very high	93.8	Very high	27 Å²	27	56.6 Å²	56.6	13%	0.125	27%	0.266	C	S	.	.	H	α-helix	trans	-58.9	-50.4	176.1	-165.8	-93.4	0	0	0	112	I328 E329 F334 C335 E336	I328-H332 PolarHBondContact O-N 2.94Å; E329-H332 WeakPolarHBondContact O-CB 3.19Å; E329-H332 PolarHBondContact O-N 3.47Å; H332-F334 PolarHBondContact O-N 3.48Å; H332-C335 CarbonylContact O-C 3.59Å; H332-C335 WeakPolarHBondContact O-CA 3.29Å; H332-C335 WeakPolarHBondContact O-CB 3.11Å; H332-C335 PolarHBondContact O-N 3.15Å; H332-E336 IonicContact CE1-OE1 2.65Å; H332-E336 PolarHBondContact CE1-OE1 2.87Å; H332-E336 VanDerWaalsContact CE1-OE1 3.23Å; H332-E336 IonicContact ND1-OE1 3.64Å; H332-E336 PolarHBondContact ND1-OE1 3.44Å; H332-E336 WeakPolarHBondContact O-CG 3.48Å; H332-E336 PolarHBondContact O-N 2.96Å
333	R	95.5	Very high	93.7	Very high	135 Å²	135	52.2 Å²	52.2	51%	0.509	25%	0.249	S	C	.	.	H	α-helix	trans	-64.9	-21.3	175.9	-67	176.3	-169.6	168.9	7	113.6	E329 E336 R337	E329-R333 WeakPolarHBondContact O-CG 3.36Å; E329-R333 PolarHBondContact O-N 3.46Å; E329-R333 IonicContact OE1-CZ 3.75Å; E329-R333 IonicContact OE1-NE 2.93Å; E329-R333 PolarHBondContact OE1-NE 3.17Å; E329-R333 IonicContact OE1-NH2 2.67Å; E329-R333 PolarHBondContact OE1-NH2 3.31Å; R333-E336 WeakPolarHBondContact CA-OE2 3.37Å; R333-R337 WeakPolarHBondContact O-CG 3.41Å; R333-R337 PolarHBondContact O-NE 3.24Å
334	F	95.2	Very high	93.6	Very high	19 Å²	19	51.3 Å²	51.3	8%	0.083	24%	0.243	C	C	.	.	H	α-helix	trans	-72.3	-45.9	167	174.8	-95.8	0	0	0	111.2	I267 L270 D271 S330 I331 H332 R337 M338	I267-F334 HydrophobicContact CD1-CB 4.35Å; I267-F334 HydrophobicContact CG1-CB 4.3Å; I267-F334 HydrophobicContact CG1-CG 4.38Å; I267-F334 HydrophobicContact CG2-CB 4.41Å; I267-F334 HydrophobicContact CG2-CD1 4.44Å; I267-F334 HydrophobicContact CG2-CD2 3.59Å; I267-F334 HydrophobicContact CG2-CE2 3.96Å; I267-F334 HydrophobicContact CG2-CG 3.86Å; L270-F334 HydrophobicContact CB-CD1 4.29Å; L270-F334 HydrophobicContact CB-CE1 3.65Å; L270-F334 HydrophobicContact CB-CZ 4.43Å; L270-F334 HydrophobicContact CD1-CD1 4.38Å; D271-F334 HydrophobicContact CB-CE2 3.98Å; D271-F334 HydrophobicContact CB-CZ 3.63Å; S330-F334 PolarHBondContact O-N 3.18Å; I331-F334 WeakPolarHBondContact O-CB 3.41Å; I331-F334 PolarHBondContact O-N 2.96Å; I331-F334 VanDerWaalsContact O-N 3.14Å; H332-F334 PolarHBondContact O-N 3.48Å; F334-R337 PolarHBondContact O-N 2.88Å; F334-M338 HydrophobicContact CD1-CG 4.42Å; F334-M338 HydrophobicContact CE1-CE 4.33Å; F334-M338 HydrophobicContact CE1-CG 3.87Å; F334-M338 HydrophobicContact CE2-CG 4.1Å; F334-M338 HydrophobicContact CE2-SD 4.47Å; F334-M338 HydrophobicContact CZ-CE 3.84Å; F334-M338 HydrophobicContact CZ-CG 3.69Å; F334-M338 HydrophobicContact CZ-SD 4.08Å; F334-M338 VanDerWaalsContact O-CG 3.26Å; F334-M338 WeakPolarHBondContact O-CG 3.33Å; F334-M338 PolarHBondContact O-N 3.26Å
335	C	95	Very high	93.5	Very high	1 Å²	1	56 Å²	56	1%	0.007	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-40.4	176.4	-71.7	0	0	0	0	113.6	I331 H332 R337 M338 G339 V340 A344	I331-C335 PolarHBondContact O-N 2.96Å; H332-C335 CarbonylContact O-C 3.59Å; H332-C335 WeakPolarHBondContact O-CA 3.29Å; H332-C335 WeakPolarHBondContact O-CB 3.11Å; H332-C335 PolarHBondContact O-N 3.15Å; C335-R337 PolarHBondContact O-N 2.88Å; C335-M338 CarbonylContact O-C 3.54Å; C335-M338 WeakPolarHBondContact O-CA 3.13Å; C335-M338 WeakPolarHBondContact O-CB 3.44Å; C335-M338 PolarHBondContact O-N 2.79Å; C335-G339 PolarHBondContact O-N 3.42Å; C335-V340 HydrophobicContact CB-CG2 3.85Å; C335-V340 WeakPolarHBondContact O-CG2 3.42Å; C335-V340 PolarHBondContact O-N 2.96Å; C335-A344 HydrophobicContact CB-CB 3.56Å
336	E	92.9	Very high	93.3	Very high	89 Å²	89	56.5 Å²	56.5	42%	0.416	27%	0.274	S	S	.	.	H	α-helix	trans	-55.5	-49.2	171.1	-70.4	166.6	-174.6	0	0	112.3	H332 R333 M338 G339 E341	H332-E336 IonicContact CE1-OE1 2.65Å; H332-E336 PolarHBondContact CE1-OE1 2.87Å; H332-E336 VanDerWaalsContact CE1-OE1 3.23Å; H332-E336 IonicContact ND1-OE1 3.64Å; H332-E336 PolarHBondContact ND1-OE1 3.44Å; H332-E336 WeakPolarHBondContact O-CG 3.48Å; H332-E336 PolarHBondContact O-N 2.96Å; R333-E336 WeakPolarHBondContact CA-OE2 3.37Å; E336-M338 PolarHBondContact O-N 3.23Å; E336-G339 PolarHBondContact O-N 3.37Å; E336-G339 VanDerWaalsContact O-N 3.12Å; E336-E341 HydrophobicContact CB-CB 4.42Å; E336-E341 HydrophobicContact CG-CB 3.79Å
337	R	91.9	Very high	93.3	Very high	178 Å²	178	50.6 Å²	50.6	67%	0.672	25%	0.252	S	S	*	.	H	α-helix	trans	-64.5	-13.4	177.4	-72.5	178.1	-69	167.4	0.3	113.1	R333 F334 C335	R333-R337 WeakPolarHBondContact O-CG 3.41Å; R333-R337 PolarHBondContact O-NE 3.24Å; F334-R337 PolarHBondContact O-N 2.88Å; C335-R337 PolarHBondContact O-N 2.88Å
338	M	85.6	Confident	93.2	Very high	27 Å²	27	50.7 Å²	50.7	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-103.8	-7	179.6	-68	-73.6	-88.4	0	0	113.5	M274 R278 F334 C335 E336 V340	M274-M338 HydrophobicContact CB-CE 3.41Å; M274-M338 VanDerWaalsContact CB-CE 3.41Å; M274-M338 HydrophobicContact CG-CE 4.1Å; R278-M338 VanDerWaalsContact NH1-CE 3.26Å; R278-M338 PolarHBondContact NH1-SD 2.87Å; R278-M338 PolarHBondContact NH2-O 3.03Å; R278-M338 PolarHBondContact NH2-SD 3.15Å; F334-M338 HydrophobicContact CD1-CG 4.42Å; F334-M338 HydrophobicContact CE1-CE 4.33Å; F334-M338 HydrophobicContact CE1-CG 3.87Å; F334-M338 HydrophobicContact CE2-CG 4.1Å; F334-M338 HydrophobicContact CE2-SD 4.47Å; F334-M338 HydrophobicContact CZ-CE 3.84Å; F334-M338 HydrophobicContact CZ-CG 3.69Å; F334-M338 HydrophobicContact CZ-SD 4.08Å; F334-M338 VanDerWaalsContact O-CG 3.26Å; F334-M338 WeakPolarHBondContact O-CG 3.33Å; F334-M338 PolarHBondContact O-N 3.26Å; C335-M338 CarbonylContact O-C 3.54Å; C335-M338 WeakPolarHBondContact O-CA 3.13Å; C335-M338 WeakPolarHBondContact O-CB 3.44Å; C335-M338 PolarHBondContact O-N 2.79Å; E336-M338 PolarHBondContact O-N 3.23Å; M338-V340 HydrophobicContact CB-CG2 3.97Å
339	G	87.8	Confident	93	Very high	49 Å²	49	50.8 Å²	50.8	51%	0.505	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	35.4	-177.5	0	0	0	0	0	113.8	C335 E336 E341	C335-G339 PolarHBondContact O-N 3.42Å; E336-G339 PolarHBondContact O-N 3.37Å; E336-G339 VanDerWaalsContact O-N 3.12Å; G339-E341 VanDerWaalsContact C-OE2 3.28Å; G339-E341 WeakPolarHBondContact CA-OE2 3.48Å
340	V	88.7	Confident	92.9	Very high	15 Å²	15	49.6 Å²	49.6	9%	0.091	25%	0.246	C	C	.	.			trans	-135.2	23.9	-179.4	-65.3	0	0	0	0	112.2	I288 C335 M338 M342 A343 A344	I288-V340 HydrophobicContact CG1-CG1 4.33Å; C335-V340 HydrophobicContact CB-CG2 3.85Å; C335-V340 WeakPolarHBondContact O-CG2 3.42Å; C335-V340 PolarHBondContact O-N 2.96Å; M338-V340 HydrophobicContact CB-CG2 3.97Å; V340-M342 PolarHBondContact O-N 3.21Å; V340-A343 WeakPolarHBondContact O-CB 3.34Å; V340-A343 PolarHBondContact O-N 3.43Å; V340-A343 VanDerWaalsContact O-N 3.13Å; V340-A344 PolarHBondContact O-N 3.31Å
341	E	92.6	Very high	92.8	Very high	69 Å²	69	47.8 Å²	47.8	32%	0.322	23%	0.233	S	C	.	.	H	α-helix	trans	-52.7	-45.8	179.7	55.4	-74.3	173.9	0	0	113.1	E336 G339 A343 A344 E345	E336-E341 HydrophobicContact CB-CB 4.42Å; E336-E341 HydrophobicContact CG-CB 3.79Å; G339-E341 VanDerWaalsContact C-OE2 3.28Å; G339-E341 WeakPolarHBondContact CA-OE2 3.48Å; E341-A343 PolarHBondContact O-N 3.36Å; E341-A343 VanDerWaalsContact O-N 3.17Å; E341-A344 CarbonylContact O-C 3.51Å; E341-A344 WeakPolarHBondContact O-CA 3.39Å; E341-A344 PolarHBondContact O-N 3.31Å; E341-E345 PolarHBondContact O-N 3.32Å
342	M	90.4	Very high	92.7	Very high	122 Å²	122	50.2 Å²	50.2	60%	0.601	24%	0.242	S	C	*	.	H	α-helix	trans	-59.6	-30.9	179.8	-60.3	-74	90	0	0	113.2	V340 E345 C346	V340-M342 PolarHBondContact O-N 3.21Å; M342-E345 WeakPolarHBondContact CE-OE2 3.49Å; M342-C346 VanDerWaalsContact O-CB 3.26Å; M342-C346 WeakPolarHBondContact O-CB 3.41Å; M342-C346 PolarHBondContact O-N 3.31Å; M342-C346 VanDerWaalsContact O-N 3.16Å
343	A	90.4	Very high	92.7	Very high	10 Å²	10	49.1 Å²	49.1	8%	0.083	24%	0.237	C	C	.	.	H	α-helix	trans	-72.9	-38.9	173.9	0	0	0	0	0	111.4	L295 V340 E341 H347	L295-A343 HydrophobicContact CD1-CB 4Å; V340-A343 WeakPolarHBondContact O-CB 3.34Å; V340-A343 PolarHBondContact O-N 3.43Å; V340-A343 VanDerWaalsContact O-N 3.13Å; E341-A343 PolarHBondContact O-N 3.36Å; E341-A343 VanDerWaalsContact O-N 3.17Å; A343-H347 WeakPolarHBondContact O-CB 3.39Å; A343-H347 PolarHBondContact O-CD2 2.93Å; A343-H347 PolarHBondContact O-N 3.06Å
344	A	93.8	Very high	92.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-71	-39.4	176.5	0	0	0	0	0	112.3	L295 C335 V340 E341 L348 R352	L295-A344 HydrophobicContact CD1-CB 4.08Å; L295-A344 HydrophobicContact CD2-CB 4.44Å; C335-A344 HydrophobicContact CB-CB 3.56Å; V340-A344 PolarHBondContact O-N 3.31Å; E341-A344 CarbonylContact O-C 3.51Å; E341-A344 WeakPolarHBondContact O-CA 3.39Å; E341-A344 PolarHBondContact O-N 3.31Å; A344-L348 HydrophobicContact CB-CD1 4.34Å; A344-L348 WeakPolarHBondContact O-CB 3.15Å; A344-L348 PolarHBondContact O-N 2.91Å; A344-R352 PolarHBondContact O-NH2 2.89Å
345	E	92.1	Very high	92.7	Very high	100 Å²	100	41.8 Å²	41.8	47%	0.467	21%	0.209	S	C	.	.	H	α-helix	trans	-57.1	-52.3	173.2	-172.3	173.5	-164.7	0	0	109.9	E341 M342 D349 R352	E341-E345 PolarHBondContact O-N 3.32Å; M342-E345 WeakPolarHBondContact CE-OE2 3.49Å; E345-D349 WeakPolarHBondContact O-CB 3.46Å; E345-R352 PolarHBondContact O-NH1 2.96Å; E345-R352 PolarHBondContact O-NH2 3.43Å
346	C	92.6	Very high	92.7	Very high	72 Å²	72	43.7 Å²	43.7	49%	0.486	22%	0.219	S	C	.	.	H	α-helix	trans	-68.4	-51.5	-177.1	-177.2	0	0	0	0	114.2	M342 D349 K374	M342-C346 VanDerWaalsContact O-CB 3.26Å; M342-C346 WeakPolarHBondContact O-CB 3.41Å; M342-C346 PolarHBondContact O-N 3.31Å; M342-C346 VanDerWaalsContact O-N 3.16Å; C346-D349 WeakPolarHBondContact O-CB 3.1Å; C346-K374 PolarHBondContact O-NZ 3.42Å
347	H	94.8	Very high	92.8	Very high	31 Å²	31	39.5 Å²	39.5	14%	0.144	20%	0.199	C	C	.	.	H	α-helix	trans	-82.3	-32	-169.7	-69.3	-68.6	0	0	0	114.2	G292 L295 N299 A343 D349	G292-H347 VanDerWaalsContact CA-CD2 3.49Å; G292-H347 WeakPolarHBondContact CA-CD2 3.29Å; L295-H347 HydrophobicContact CB-CB 3.92Å; N299-H347 WeakPolarHBondContact CB-O 3.37Å; A343-H347 WeakPolarHBondContact O-CB 3.39Å; A343-H347 PolarHBondContact O-CD2 2.93Å; A343-H347 PolarHBondContact O-N 3.06Å; H347-D349 PolarHBondContact O-N 2.67Å
348	L	95.6	Very high	92.8	Very high	2 Å²	2	31 Å²	31	1%	0.01	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	3.5	178.5	-57.5	178.3	0	0	0	113.5	L295 V298 N299 I328 I331 A344 S351 R352	L295-L348 HydrophobicContact CB-CD2 4.35Å; L295-L348 HydrophobicContact CD2-CD1 4Å; L295-L348 HydrophobicContact CD2-CD2 4.21Å; L295-L348 HydrophobicContact CD2-CG 4.18Å; L295-L348 WeakPolarHBondContact O-CD2 3.25Å; V298-L348 HydrophobicContact CB-CD2 4.21Å; V298-L348 HydrophobicContact CG1-CD2 4.08Å; N299-L348 HydrophobicContact CB-CD2 4.33Å; I328-L348 HydrophobicContact CG2-CB 4.17Å; I328-L348 HydrophobicContact CG2-CD1 4.26Å; I331-L348 HydrophobicContact CB-CD1 4.36Å; I331-L348 HydrophobicContact CG2-CD1 3.81Å; A344-L348 HydrophobicContact CB-CD1 4.34Å; A344-L348 WeakPolarHBondContact O-CB 3.15Å; A344-L348 PolarHBondContact O-N 2.91Å; L348-S351 PolarHBondContact O-N 2.94Å; L348-R352 WeakPolarHBondContact O-CB 3.34Å; L348-R352 PolarHBondContact O-N 2.79Å
349	D	93.1	Very high	93.2	Very high	11 Å²	11	30.5 Å²	30.5	6%	0.059	17%	0.168	C	C	.	.	H	α-helix	trans	-66.9	-42	-165.1	-162.8	17.5	0	0	0	114.5	E345 C346 H347 R352 Q353 K374	E345-D349 WeakPolarHBondContact O-CB 3.46Å; C346-D349 WeakPolarHBondContact O-CB 3.1Å; H347-D349 PolarHBondContact O-N 2.67Å; D349-R352 VanDerWaalsContact CA-NH1 3.35Å; D349-R352 WeakPolarHBondContact O-CB 3.08Å; D349-R352 PolarHBondContact O-N 3.1Å; D349-R352 IonicContact OD1-CZ 2.83Å; D349-R352 IonicContact OD1-NH1 3.92Å; D349-R352 PolarHBondContact OD1-NH1 2.74Å; D349-Q353 VanDerWaalsContact CG-NE2 3.26Å; D349-Q353 WeakPolarHBondContact O-CB 3.49Å; D349-Q353 VanDerWaalsContact O-CG 3.27Å; D349-Q353 WeakPolarHBondContact O-CG 3.39Å; D349-Q353 PolarHBondContact O-N 3Å; D349-Q353 PolarHBondContact OD1-NE2 3.1Å; D349-Q353 PolarHBondContact OD2-NE2 2.94Å; D349-K374 HydrophobicContact CB-CD 4.19Å; D349-K374 WeakPolarHBondContact OD2-CD 3.42Å; D349-K374 WeakPolarHBondContact OD2-CE 3.41Å; D349-K374 IonicContact OD2-NZ 3.29Å; D349-K374 PolarHBondContact OD2-NZ 3.41Å
350	R	92.9	Very high	93.4	Very high	43 Å²	43	29.4 Å²	29.4	16%	0.162	15%	0.151	C	C	.	.	H	α-helix	trans	-67.6	-40.5	179.1	-74.6	-172	170.4	162	0.4	111.5	F303 Q353 A354 K374 L375 E427	F303-R350 HydrophobicContact CD2-CB 4.01Å; F303-R350 HydrophobicContact CE2-CB 4.15Å; R350-Q353 PolarHBondContact O-N 2.91Å; R350-A354 WeakPolarHBondContact O-CB 3.4Å; R350-A354 PolarHBondContact O-N 3.36Å; R350-K374 HydrophobicContact CG-CD 4.34Å; R350-K374 HydrophobicContact CG-CG 4.3Å; R350-K374 PolarHBondContact NE-O 3.21Å; R350-L375 HydrophobicContact CB-CD2 3.97Å; R350-L375 HydrophobicContact CG-CD2 4.05Å; R350-E427 WeakPolarHBondContact CD-OE1 3.49Å; R350-E427 WeakPolarHBondContact CD-OE2 3.49Å; R350-E427 IonicContact CZ-OE1 3.19Å; R350-E427 IonicContact CZ-OE2 3.36Å; R350-E427 IonicContact NE-OE1 2.65Å; R350-E427 IonicContact NH1-OE1 3.88Å; R350-E427 PolarHBondContact NH1-OE1 2.9Å; R350-E427 IonicContact NH1-OE2 2.7Å; R350-E427 PolarHBondContact NH1-OE2 2.91Å
351	S	94.9	Very high	93.5	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.014	18%	0.176	C	C	.	.	H	α-helix	trans	-62.9	-39.6	171.5	-66.4	0	0	0	0	112.6	N299 L348 A354 A355	N299-S351 WeakPolarHBondContact CA-OG 3.48Å; N299-S351 PolarHBondContact O-OG 3.48Å; N299-S351 VanDerWaalsContact OD1-CB 3.25Å; N299-S351 WeakPolarHBondContact OD1-CB 3.26Å; N299-S351 PolarHBondContact OD1-N 2.66Å; N299-S351 PolarHBondContact OD1-OG 3.38Å; L348-S351 PolarHBondContact O-N 2.94Å; S351-A354 PolarHBondContact O-N 3.13Å; S351-A355 WeakPolarHBondContact O-CB 3.43Å; S351-A355 PolarHBondContact O-N 3.13Å
352	R	95.6	Very high	93.5	Very high	53 Å²	53	31.7 Å²	31.7	20%	0.2	16%	0.161	C	C	.	.	H	α-helix	trans	-62	-43.9	173.9	-173.3	-166.5	-56.6	121.2	7.9	111.5	I328 A344 E345 L348 D349 A355 N356	I328-R352 HydrophobicContact CG2-CB 4.3Å; A344-R352 PolarHBondContact O-NH2 2.89Å; E345-R352 PolarHBondContact O-NH1 2.96Å; E345-R352 PolarHBondContact O-NH2 3.43Å; L348-R352 WeakPolarHBondContact O-CB 3.34Å; L348-R352 PolarHBondContact O-N 2.79Å; D349-R352 VanDerWaalsContact CA-NH1 3.35Å; D349-R352 WeakPolarHBondContact O-CB 3.08Å; D349-R352 PolarHBondContact O-N 3.1Å; D349-R352 IonicContact OD1-CZ 2.83Å; D349-R352 IonicContact OD1-NH1 3.92Å; D349-R352 PolarHBondContact OD1-NH1 2.74Å; R352-A355 PolarHBondContact O-N 2.67Å; R352-N356 WeakPolarHBondContact O-CB 3.45Å; R352-N356 PolarHBondContact O-N 3.22Å; R352-N356 PolarHBondContact O-ND2 3.02Å
353	Q	95.6	Very high	93.4	Very high	3 Å²	3	29.7 Å²	29.7	1%	0.014	15%	0.152	C	C	.	.	H	α-helix	trans	-68.8	-39.6	178.3	-70.5	-177.4	40.2	0	0	112.1	D349 R350 N356 L357 T371 Y373 K374 L375	D349-Q353 VanDerWaalsContact CG-NE2 3.26Å; D349-Q353 WeakPolarHBondContact O-CB 3.49Å; D349-Q353 VanDerWaalsContact O-CG 3.27Å; D349-Q353 WeakPolarHBondContact O-CG 3.39Å; D349-Q353 PolarHBondContact O-N 3Å; D349-Q353 PolarHBondContact OD1-NE2 3.1Å; D349-Q353 PolarHBondContact OD2-NE2 2.94Å; R350-Q353 PolarHBondContact O-N 2.91Å; Q353-N356 PolarHBondContact O-N 3.33Å; Q353-L357 WeakPolarHBondContact O-CB 3.46Å; Q353-L357 PolarHBondContact O-N 3.46Å; Q353-T371 WeakPolarHBondContact CB-O 3.46Å; Q353-T371 WeakPolarHBondContact CG-O 3.38Å; Q353-T371 PolarHBondContact OE1-O 3.45Å; Q353-Y373 HydrophobicContact CG-CE1 4.44Å; Q353-Y373 PolarHBondContact NE2-OH 3.49Å; Q353-K374 VanDerWaalsContact NE2-CB 3.32Å; Q353-K374 VanDerWaalsContact OE1-CB 3.3Å; Q353-L375 HydrophobicContact CB-CD1 4.12Å; Q353-L375 HydrophobicContact CB-CD2 4.14Å; Q353-L375 HydrophobicContact CB-CG 3.98Å
354	A	95.1	Very high	93.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-44.7	172.5	0	0	0	0	0	112.2	F303 L306 R350 S351 N356 L357 L358 I383	F303-A354 HydrophobicContact CD2-CB 4.1Å; F303-A354 HydrophobicContact CE2-CB 3.89Å; L306-A354 HydrophobicContact CD1-CB 3.86Å; R350-A354 WeakPolarHBondContact O-CB 3.4Å; R350-A354 PolarHBondContact O-N 3.36Å; S351-A354 PolarHBondContact O-N 3.13Å; A354-N356 VanDerWaalsContact C-N 3.33Å; A354-N356 PolarHBondContact O-N 3.18Å; A354-L357 PolarHBondContact O-N 3.08Å; A354-L358 WeakPolarHBondContact O-CG 3.41Å; A354-L358 PolarHBondContact O-N 3.49Å; A354-I383 HydrophobicContact CB-CD1 3.91Å
355	A	95.3	Very high	93.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.8	-40.4	175.4	0	0	0	0	0	112.2	L324 Q325 I328 S351 R352 A359	L324-A355 HydrophobicContact CB-CB 3.6Å; Q325-A355 HydrophobicContact CG-CB 4.06Å; I328-A355 HydrophobicContact CD1-CB 4.36Å; S351-A355 WeakPolarHBondContact O-CB 3.43Å; S351-A355 PolarHBondContact O-N 3.13Å; R352-A355 PolarHBondContact O-N 2.67Å; A355-A359 VanDerWaalsContact O-CB 3.23Å; A355-A359 WeakPolarHBondContact O-CB 3.32Å; A355-A359 PolarHBondContact O-N 3.35Å
356	N	95.2	Very high	93	Very high	42 Å²	42	34 Å²	34	23%	0.225	19%	0.19	C	C	.	.	H	α-helix	trans	-64.7	-43	173.8	-70.8	-19.9	0	0	0	112.4	Q325 R352 Q353 A354 A359 T360 T371	Q325-N356 PolarHBondContact NE2-OD1 3.17Å; R352-N356 WeakPolarHBondContact O-CB 3.45Å; R352-N356 PolarHBondContact O-N 3.22Å; R352-N356 PolarHBondContact O-ND2 3.02Å; Q353-N356 PolarHBondContact O-N 3.33Å; A354-N356 VanDerWaalsContact C-N 3.33Å; A354-N356 PolarHBondContact O-N 3.18Å; N356-A359 PolarHBondContact O-N 2.89Å; N356-T360 WeakPolarHBondContact O-CB 3.47Å; N356-T360 PolarHBondContact O-N 3.36Å; N356-T360 PolarHBondContact O-OG1 3.39Å; N356-T371 HydrophobicContact CB-CG2 3.86Å
357	L	94.6	Very high	92.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.5	-43.9	179.2	-173.1	65.1	0	0	0	111.1	Q353 A354 L368 C372 L375 I383 L384	Q353-L357 WeakPolarHBondContact O-CB 3.46Å; Q353-L357 PolarHBondContact O-N 3.46Å; A354-L357 PolarHBondContact O-N 3.08Å; L357-L368 HydrophobicContact CD1-CB 4.35Å; L357-L368 HydrophobicContact CD1-CD2 3.76Å; L357-C372 HydrophobicContact CD1-CB 4.31Å; L357-C372 HydrophobicContact CD2-CB 4.42Å; L357-L375 HydrophobicContact CD2-CD1 4.09Å; L357-I383 HydrophobicContact CD2-CB 4.38Å; L357-I383 HydrophobicContact CD2-CG2 4.04Å; L357-L384 HydrophobicContact CD1-CD1 4.46Å; L357-L384 HydrophobicContact CD1-CD2 4.06Å; L357-L384 HydrophobicContact CD2-CD2 4.25Å; L357-L384 HydrophobicContact CD2-CG 4.17Å; L357-L384 HydrophobicContact CG-CD2 3.92Å; L357-L384 HydrophobicContact CG-CG 4.37Å
358	L	93.1	Very high	92.7	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-62.6	-42.4	172.6	-73.7	172.3	0	0	0	112.3	L306 L316 T318 A354 K362 I383 F387	L306-L358 HydrophobicContact CD2-CD1 4.17Å; L316-L358 HydrophobicContact CB-CD2 4.23Å; L316-L358 HydrophobicContact CD2-CD1 4.41Å; T318-L358 PolarHBondContact OG1-O 3.09Å; A354-L358 WeakPolarHBondContact O-CG 3.41Å; A354-L358 PolarHBondContact O-N 3.49Å; L358-K362 PolarHBondContact O-NZ 2.81Å; L358-I383 HydrophobicContact CD2-CG2 3.81Å; L358-I383 HydrophobicContact CG-CG2 3.97Å; L358-F387 HydrophobicContact CD2-CD2 3.95Å
359	A	93	Very high	92.3	Very high	16 Å²	16	30.8 Å²	30.8	13%	0.132	18%	0.175	C	C	.	.	H	α-helix	trans	-78.8	-13.9	-176.4	0	0	0	0	0	115.2	K322 Q325 A355 N356	K322-A359 HydrophobicContact CG-CB 3.99Å; Q325-A359 HydrophobicContact CG-CB 4.43Å; Q325-A359 VanDerWaalsContact OE1-CB 3.26Å; A355-A359 VanDerWaalsContact O-CB 3.23Å; A355-A359 WeakPolarHBondContact O-CB 3.32Å; A355-A359 PolarHBondContact O-N 3.35Å; N356-A359 PolarHBondContact O-N 2.89Å
360	T	92.9	Very high	92.1	Very high	26 Å²	26	34 Å²	34	16%	0.16	20%	0.199	C	C	.	.	S	Bend	trans	-82.3	148	-177.6	-63.1	0	0	0	0	111.4	N356 K362 A367 L368	N356-T360 WeakPolarHBondContact O-CB 3.47Å; N356-T360 PolarHBondContact O-N 3.36Å; N356-T360 PolarHBondContact O-OG1 3.39Å; T360-K362 PolarHBondContact O-N 3.02Å; T360-K362 PolarHBondContact O-NZ 3.36Å; T360-A367 HydrophobicContact CG2-CB 3.74Å; T360-L368 HydrophobicContact CG2-CD2 3.72Å; T360-L368 HydrophobicContact CG2-CG 4Å
361	Q	89.8	Confident	91.9	Very high	129 Å²	129	33 Å²	33	60%	0.603	20%	0.197	S	C	*	.			trans	-65.4	129.7	177.7	-62	-176.1	-2.5	0	0	110.8	N363 D364	Q361-N363 WeakPolarHBondContact CB-OD1 3.48Å; Q361-N363 PolarHBondContact O-N 2.84Å; Q361-N363 VanDerWaalsContact O-N 3.13Å; Q361-D364 PolarHBondContact O-N 2.89Å
362	K	92.5	Very high	91.5	Very high	2 Å²	2	33 Å²	33	1%	0.009	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-4.8	-168.1	-54.3	-55.1	178.3	-61.4	0	115	T318 L358 T360 L368 L384 F387 C396	T318-K362 PolarHBondContact OG1-NZ 3.32Å; L358-K362 PolarHBondContact O-NZ 2.81Å; T360-K362 PolarHBondContact O-N 3.02Å; T360-K362 PolarHBondContact O-NZ 3.36Å; K362-L368 HydrophobicContact CD-CD2 4.4Å; K362-L384 HydrophobicContact CD-CD2 4.34Å; K362-F387 HydrophobicContact CD-CD1 4.25Å; K362-F387 HydrophobicContact CD-CE1 4.2Å; K362-F387 HydrophobicContact CD-CG 4.5Å; K362-F387 HydrophobicContact CD-CZ 4.42Å; K362-F387 VanDerWaalsContact CE-CD2 3.44Å; K362-F387 VanDerWaalsContact CE-CZ 3.48Å; K362-F387 HydrophobicContact CG-CD1 3.95Å; K362-F387 HydrophobicContact CG-CE1 3.65Å; K362-F387 HydrophobicContact CG-CZ 4.16Å; K362-C396 HydrophobicContact CB-CB 4.11Å; K362-C396 HydrophobicContact CG-CB 4.2Å
363	N	88.4	Confident	91.1	Very high	80 Å²	80	36.3 Å²	36.3	43%	0.428	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-20.9	174.3	60.7	-17.9	0	0	0	114.1	Q361 V365	Q361-N363 WeakPolarHBondContact CB-OD1 3.48Å; Q361-N363 PolarHBondContact O-N 2.84Å; Q361-N363 VanDerWaalsContact O-N 3.13Å; N363-V365 PolarHBondContact O-N 3.46Å; N363-V365 VanDerWaalsContact O-N 3.14Å
364	D	89.4	Confident	90.8	Very high	75 Å²	75	39.3 Å²	39.3	40%	0.401	22%	0.223	S	C	.	.			trans	-87.1	85.1	-179.1	-170.3	-15.2	0	0	0	111.5	Q361 A366 A367 L368	Q361-D364 PolarHBondContact O-N 2.89Å; D364-A366 PolarHBondContact O-N 3.41Å; D364-A366 VanDerWaalsContact O-N 3.14Å; D364-A366 WeakPolarHBondContact OD1-CA 3.29Å; D364-A366 WeakPolarHBondContact OD1-CB 3.43Å; D364-A366 PolarHBondContact OD1-N 2.91Å; D364-A367 HydrophobicContact CB-CB 3.89Å; D364-A367 VanDerWaalsContact CG-CB 3.43Å; D364-A367 PolarHBondContact O-N 3.39Å; D364-A367 PolarHBondContact OD1-N 2.76Å; D364-A367 WeakPolarHBondContact OD2-CB 3.32Å; D364-L368 WeakPolarHBondContact O-CB 3.44Å; D364-L368 VanDerWaalsContact O-CG 3.24Å; D364-L368 WeakPolarHBondContact O-CG 3.45Å; D364-L368 PolarHBondContact O-N 3.16Å
365	V	89.5	Confident	90.8	Very high	50 Å²	50	39.3 Å²	39.3	30%	0.303	22%	0.223	S	C	.	.	H	α-helix	trans	-54.5	-29.9	176.5	-174	0	0	0	0	112.5	N363 G369 V400 R403 I404	N363-V365 PolarHBondContact O-N 3.46Å; N363-V365 VanDerWaalsContact O-N 3.14Å; V365-G369 PolarHBondContact O-N 3.17Å; V365-V400 HydrophobicContact CG2-CG1 4.36Å; V365-V400 HydrophobicContact CG2-CG2 4.25Å; V365-R403 HydrophobicContact CG1-CB 4.03Å; V365-I404 HydrophobicContact CB-CD1 4.46Å; V365-I404 HydrophobicContact CG1-CD1 3.72Å; V365-I404 WeakPolarHBondContact O-CD1 3.28Å
366	A	88.8	Confident	90.8	Very high	76 Å²	76	39.4 Å²	39.4	63%	0.628	22%	0.224	S	C	*	.	H	α-helix	trans	-79	-41.9	180	0	0	0	0	0	111.8	D364 S370	D364-A366 PolarHBondContact O-N 3.41Å; D364-A366 VanDerWaalsContact O-N 3.14Å; D364-A366 WeakPolarHBondContact OD1-CA 3.29Å; D364-A366 WeakPolarHBondContact OD1-CB 3.43Å; D364-A366 PolarHBondContact OD1-N 2.91Å; A366-S370 WeakPolarHBondContact O-CB 3.43Å; A366-S370 PolarHBondContact O-N 3.08Å; A366-S370 VanDerWaalsContact O-N 3.09Å
367	A	90.2	Very high	90.7	Very high	28 Å²	28	38 Å²	38	23%	0.231	22%	0.218	C	C	.	.	H	α-helix	trans	-64.7	-49.2	172.9	0	0	0	0	0	111.3	T360 D364 G369 S370 T371	T360-A367 HydrophobicContact CG2-CB 3.74Å; D364-A367 HydrophobicContact CB-CB 3.89Å; D364-A367 VanDerWaalsContact CG-CB 3.43Å; D364-A367 PolarHBondContact O-N 3.39Å; D364-A367 PolarHBondContact OD1-N 2.76Å; D364-A367 WeakPolarHBondContact OD2-CB 3.32Å; A367-G369 PolarHBondContact O-N 2.95Å; A367-S370 PolarHBondContact O-N 3.03Å; A367-S370 PolarHBondContact O-OG 3.08Å; A367-T371 PolarHBondContact O-N 3.29Å
368	L	91	Very high	90.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-55.2	-50.3	175.6	-66.5	166.8	0	0	0	111	L357 T360 K362 D364 S370 T371 C372 V400 I404	L357-L368 HydrophobicContact CD1-CB 4.35Å; L357-L368 HydrophobicContact CD1-CD2 3.76Å; T360-L368 HydrophobicContact CG2-CD2 3.72Å; T360-L368 HydrophobicContact CG2-CG 4Å; K362-L368 HydrophobicContact CD-CD2 4.4Å; D364-L368 WeakPolarHBondContact O-CB 3.44Å; D364-L368 VanDerWaalsContact O-CG 3.24Å; D364-L368 WeakPolarHBondContact O-CG 3.45Å; D364-L368 PolarHBondContact O-N 3.16Å; L368-S370 PolarHBondContact O-N 2.92Å; L368-S370 VanDerWaalsContact O-N 3.17Å; L368-T371 PolarHBondContact O-N 3.12Å; L368-T371 PolarHBondContact O-OG1 3.34Å; L368-C372 PolarHBondContact O-SG 2.88Å; L368-V400 HydrophobicContact CD1-CG1 3.6Å; L368-I404 HydrophobicContact CB-CD1 3.73Å; L368-I404 HydrophobicContact CB-CG1 4.04Å; L368-I404 HydrophobicContact CD1-CG1 4.44Å
369	G	88	Confident	90.8	Very high	10 Å²	10	42 Å²	42	10%	0.103	24%	0.239	C	C	.	.	H	α-helix	trans	-64.6	-19.9	178.6	0	0	0	0	0	114.7	V365 A367 L407	V365-G369 PolarHBondContact O-N 3.17Å; A367-G369 PolarHBondContact O-N 2.95Å; G369-L407 VanDerWaalsContact CA-CD2 3.42Å; G369-L407 WeakPolarHBondContact O-CD2 3.33Å
370	S	89.2	Confident	90.8	Very high	79 Å²	79	41.3 Å²	41.3	55%	0.552	23%	0.232	S	C	*	.	H	α-helix	trans	-84.6	-20.7	173.9	77.1	0	0	0	0	113.8	A366 A367 L368	A366-S370 WeakPolarHBondContact O-CB 3.43Å; A366-S370 PolarHBondContact O-N 3.08Å; A366-S370 VanDerWaalsContact O-N 3.09Å; A367-S370 PolarHBondContact O-N 3.03Å; A367-S370 PolarHBondContact O-OG 3.08Å; L368-S370 PolarHBondContact O-N 2.92Å; L368-S370 VanDerWaalsContact O-N 3.17Å
371	T	87.6	Confident	90.8	Very high	21 Å²	21	42.6 Å²	42.6	13%	0.129	24%	0.24	C	C	.	.	H	α-helix	trans	-92.1	-17.8	-175.2	54.9	0	0	0	0	114.3	Q353 N356 A367 L368	Q353-T371 WeakPolarHBondContact CB-O 3.46Å; Q353-T371 WeakPolarHBondContact CG-O 3.38Å; Q353-T371 PolarHBondContact OE1-O 3.45Å; N356-T371 HydrophobicContact CB-CG2 3.86Å; A367-T371 PolarHBondContact O-N 3.29Å; L368-T371 PolarHBondContact O-N 3.12Å; L368-T371 PolarHBondContact O-OG1 3.34Å
372	C	86.3	Confident	91	Very high	2 Å²	2	39 Å²	39	1%	0.014	22%	0.223	C	C	.	.			trans	-112.4	21.3	-170.6	69.5	0	0	0	0	115.5	L357 L368 K374 L375 V380 I404	L357-C372 HydrophobicContact CD1-CB 4.31Å; L357-C372 HydrophobicContact CD2-CB 4.42Å; L368-C372 PolarHBondContact O-SG 2.88Å; C372-K374 PolarHBondContact O-N 3.37Å; C372-L375 HydrophobicContact CB-CB 4.26Å; C372-L375 HydrophobicContact CB-CD1 4.02Å; C372-L375 HydrophobicContact CB-CG 4.28Å; C372-L375 PolarHBondContact O-N 3.2Å; C372-V380 HydrophobicContact CB-CG2 4.07Å; C372-I404 WeakPolarHBondContact SG-CG2 3.42Å
373	Y	87.9	Confident	90.9	Very high	122 Å²	122	38.9 Å²	38.9	48%	0.478	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-12.9	-170.2	67.4	-94	0	0	0	116.2	Q353	Q353-Y373 HydrophobicContact CG-CE1 4.44Å; Q353-Y373 PolarHBondContact NE2-OH 3.49Å
374	K	89.6	Confident	91.1	Very high	66 Å²	66	35.2 Å²	35.2	29%	0.287	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-0.4	178.8	-160.1	179.3	-173.1	178.1	0	113.2	C346 D349 R350 Q353 C372	C346-K374 PolarHBondContact O-NZ 3.42Å; D349-K374 HydrophobicContact CB-CD 4.19Å; D349-K374 WeakPolarHBondContact OD2-CD 3.42Å; D349-K374 WeakPolarHBondContact OD2-CE 3.41Å; D349-K374 IonicContact OD2-NZ 3.29Å; D349-K374 PolarHBondContact OD2-NZ 3.41Å; R350-K374 HydrophobicContact CG-CD 4.34Å; R350-K374 HydrophobicContact CG-CG 4.3Å; R350-K374 PolarHBondContact NE-O 3.21Å; Q353-K374 VanDerWaalsContact NE2-CB 3.32Å; Q353-K374 VanDerWaalsContact OE1-CB 3.3Å; C372-K374 PolarHBondContact O-N 3.37Å
375	L	94.3	Very high	91.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-90.1	132	173.7	-56.2	-173.5	0	0	0	108.8	F303 R350 Q353 L357 C372 Q379 V380 A412	F303-L375 HydrophobicContact CE2-CD2 3.63Å; F303-L375 HydrophobicContact CZ-CD2 4.1Å; R350-L375 HydrophobicContact CB-CD2 3.97Å; R350-L375 HydrophobicContact CG-CD2 4.05Å; Q353-L375 HydrophobicContact CB-CD1 4.12Å; Q353-L375 HydrophobicContact CB-CD2 4.14Å; Q353-L375 HydrophobicContact CB-CG 3.98Å; L357-L375 HydrophobicContact CD2-CD1 4.09Å; C372-L375 HydrophobicContact CB-CB 4.26Å; C372-L375 HydrophobicContact CB-CD1 4.02Å; C372-L375 HydrophobicContact CB-CG 4.28Å; C372-L375 PolarHBondContact O-N 3.2Å; L375-Q379 HydrophobicContact CB-CB 4.42Å; L375-V380 HydrophobicContact CB-CG2 3.8Å; L375-A412 WeakPolarHBondContact O-CB 3.47Å
376	N	94.6	Very high	91.1	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.016	21%	0.206	C	C	.	.			trans	-78.7	168.4	179.4	67.8	54.8	0	0	0	112.7	L378 Q379 V380 D413 V423 T424	N376-L378 VanDerWaalsContact C-N 3.33Å; N376-L378 PolarHBondContact O-N 2.78Å; N376-L378 WeakPolarHBondContact OD1-CB 3.26Å; N376-L378 PolarHBondContact OD1-N 3.49Å; N376-Q379 VanDerWaalsContact N-OE1 3.16Å; N376-Q379 PolarHBondContact ND2-OE1 3.17Å; N376-Q379 WeakPolarHBondContact O-CB 3.47Å; N376-Q379 PolarHBondContact O-N 3.31Å; N376-Q379 VanDerWaalsContact O-N 3.15Å; N376-Q379 WeakPolarHBondContact OD1-CG 3.32Å; N376-Q379 PolarHBondContact OD1-N 3.37Å; N376-V380 WeakPolarHBondContact O-CG2 3.4Å; N376-V380 PolarHBondContact O-N 2.85Å; N376-D413 WeakPolarHBondContact CA-OD1 3.41Å; N376-D413 VanDerWaalsContact CB-OD1 3.29Å; N376-D413 WeakPolarHBondContact CB-OD1 3.31Å; N376-V423 HydrophobicContact CB-CG1 3.73Å; N376-T424 PolarHBondContact ND2-O 2.95Å
377	S	94.6	Very high	91.2	Very high	13 Å²	13	31.2 Å²	31.2	9%	0.091	18%	0.179	C	C	.	.	H	α-helix	trans	-51.3	-48.3	-179	60.6	0	0	0	0	112.7	Q379 V380 V381 D413	S377-Q379 PolarHBondContact O-N 2.92Å; S377-V380 PolarHBondContact O-N 3.4Å; S377-V381 WeakPolarHBondContact O-CB 3.43Å; S377-V381 VanDerWaalsContact O-CG2 3.26Å; S377-V381 WeakPolarHBondContact O-CG2 3.26Å; S377-V381 PolarHBondContact O-N 3.44Å; S377-D413 VanDerWaalsContact CB-OD2 3.25Å; S377-D413 WeakPolarHBondContact CB-OD2 3.29Å; S377-D413 PolarHBondContact N-OD1 3.14Å; S377-D413 PolarHBondContact OG-OD2 2.69Å
378	L	94	Very high	91.1	Very high	85 Å²	85	34 Å²	34	45%	0.445	19%	0.188	S	C	.	.	H	α-helix	trans	-61.7	-43.6	179.8	-53.3	-178.8	0	0	0	111.6	N376 H382 V423 L425	N376-L378 VanDerWaalsContact C-N 3.33Å; N376-L378 PolarHBondContact O-N 2.78Å; N376-L378 WeakPolarHBondContact OD1-CB 3.26Å; N376-L378 PolarHBondContact OD1-N 3.49Å; L378-H382 VanDerWaalsContact O-CB 3.29Å; L378-H382 WeakPolarHBondContact O-CB 3.38Å; L378-H382 PolarHBondContact O-N 3.04Å; L378-V423 HydrophobicContact CD1-CG1 4Å; L378-V423 HydrophobicContact CG-CG1 4.1Å; L378-L425 HydrophobicContact CB-CD1 4.44Å
379	Q	94.3	Very high	91	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.2	-47.3	177.3	-72.9	175	-16.2	0	0	112	F303 L375 N376 S377 I383 L425 E427	F303-Q379 HydrophobicContact CE1-CG 3.79Å; F303-Q379 VanDerWaalsContact CE1-NE2 3.28Å; F303-Q379 HydrophobicContact CZ-CB 3.96Å; F303-Q379 HydrophobicContact CZ-CG 3.66Å; L375-Q379 HydrophobicContact CB-CB 4.42Å; N376-Q379 VanDerWaalsContact N-OE1 3.16Å; N376-Q379 PolarHBondContact ND2-OE1 3.17Å; N376-Q379 WeakPolarHBondContact O-CB 3.47Å; N376-Q379 PolarHBondContact O-N 3.31Å; N376-Q379 VanDerWaalsContact O-N 3.15Å; N376-Q379 WeakPolarHBondContact OD1-CG 3.32Å; N376-Q379 PolarHBondContact OD1-N 3.37Å; S377-Q379 PolarHBondContact O-N 2.92Å; Q379-I383 WeakPolarHBondContact O-CB 3.47Å; Q379-I383 WeakPolarHBondContact O-CD1 3.47Å; Q379-I383 VanDerWaalsContact O-CG1 3.26Å; Q379-I383 WeakPolarHBondContact O-CG1 3.4Å; Q379-I383 PolarHBondContact O-N 3.17Å; Q379-L425 HydrophobicContact CG-CD1 4.34Å; Q379-L425 VanDerWaalsContact CG-O 3.24Å; Q379-L425 WeakPolarHBondContact CG-O 3.38Å; Q379-L425 PolarHBondContact NE2-O 3.4Å; Q379-E427 PolarHBondContact NE2-OE1 2.82Å
380	V	94.4	Very high	90.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.4	-48.3	177.4	164.5	0	0	0	0	111.2	C372 L375 N376 S377 L384 I404 A408	C372-V380 HydrophobicContact CB-CG2 4.07Å; L375-V380 HydrophobicContact CB-CG2 3.8Å; N376-V380 WeakPolarHBondContact O-CG2 3.4Å; N376-V380 PolarHBondContact O-N 2.85Å; S377-V380 PolarHBondContact O-N 3.4Å; V380-L384 HydrophobicContact CG1-CD1 3.92Å; V380-L384 WeakPolarHBondContact O-CB 3.36Å; V380-L384 WeakPolarHBondContact O-CG 3.36Å; V380-L384 PolarHBondContact O-N 3.3Å; V380-L384 VanDerWaalsContact O-N 3.07Å; V380-I404 HydrophobicContact CG1-CB 3.97Å; V380-I404 HydrophobicContact CG1-CG2 3.62Å; V380-A408 HydrophobicContact CB-CB 4.49Å; V380-A408 HydrophobicContact CG2-CB 4.03Å
381	V	93.3	Very high	90.3	Very high	53 Å²	53	44.1 Å²	44.1	32%	0.321	24%	0.236	S	C	.	.	H	α-helix	trans	-59.9	-52	178.6	169.6	0	0	0	0	109.9	S377 I383 L384 S385 V401 C405	S377-V381 WeakPolarHBondContact O-CB 3.43Å; S377-V381 VanDerWaalsContact O-CG2 3.26Å; S377-V381 WeakPolarHBondContact O-CG2 3.26Å; S377-V381 PolarHBondContact O-N 3.44Å; V381-I383 PolarHBondContact O-N 3.29Å; V381-L384 PolarHBondContact O-N 3.05Å; V381-S385 VanDerWaalsContact O-CB 3.31Å; V381-S385 WeakPolarHBondContact O-CB 3.43Å; V381-S385 PolarHBondContact O-N 3.15Å; V381-S385 PolarHBondContact O-OG 3.12Å; V381-V401 HydrophobicContact CB-CG1 4.45Å; V381-V401 HydrophobicContact CG1-CG1 4.49Å; V381-V401 HydrophobicContact CG2-CG1 4.15Å; V381-C405 HydrophobicContact CG2-CB 3.81Å; V381-C405 VanDerWaalsContact CG2-SG 3.59Å
382	H	92.3	Very high	89.9	Confident	53 Å²	53	47.3 Å²	47.3	25%	0.245	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-43.8	-176.7	-167.2	99.2	0	0	0	113	V307 L378 G386 L425	V307-H382 PolarHBondContact O-NE2 2.91Å; L378-H382 VanDerWaalsContact O-CB 3.29Å; L378-H382 WeakPolarHBondContact O-CB 3.38Å; L378-H382 PolarHBondContact O-N 3.04Å; H382-G386 PolarHBondContact O-N 2.9Å; H382-L425 HydrophobicContact CB-CD1 3.7Å
383	I	92.3	Very high	90	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-68.2	-36.9	-179.9	-67.1	167.4	0	0	0	111.5	F303 V307 A354 L357 L358 Q379 V381	F303-I383 HydrophobicContact CE2-CD1 4.31Å; F303-I383 HydrophobicContact CZ-CD1 4.22Å; V307-I383 HydrophobicContact CG1-CD1 4.12Å; V307-I383 HydrophobicContact CG1-CG1 3.94Å; A354-I383 HydrophobicContact CB-CD1 3.91Å; L357-I383 HydrophobicContact CD2-CB 4.38Å; L357-I383 HydrophobicContact CD2-CG2 4.04Å; L358-I383 HydrophobicContact CD2-CG2 3.81Å; L358-I383 HydrophobicContact CG-CG2 3.97Å; Q379-I383 WeakPolarHBondContact O-CB 3.47Å; Q379-I383 WeakPolarHBondContact O-CD1 3.47Å; Q379-I383 VanDerWaalsContact O-CG1 3.26Å; Q379-I383 WeakPolarHBondContact O-CG1 3.4Å; Q379-I383 PolarHBondContact O-N 3.17Å; V381-I383 PolarHBondContact O-N 3.29Å
384	L	91.8	Very high	89.9	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.016	28%	0.281	C	S	.	.	H	α-helix	trans	-83.7	-35.1	-179.1	-67.4	177.7	0	0	0	113.5	L357 K362 V380 V381 G386 F387 V401 I404	L357-L384 HydrophobicContact CD1-CD1 4.46Å; L357-L384 HydrophobicContact CD1-CD2 4.06Å; L357-L384 HydrophobicContact CD2-CD2 4.25Å; L357-L384 HydrophobicContact CD2-CG 4.17Å; L357-L384 HydrophobicContact CG-CD2 3.92Å; L357-L384 HydrophobicContact CG-CG 4.37Å; K362-L384 HydrophobicContact CD-CD2 4.34Å; V380-L384 HydrophobicContact CG1-CD1 3.92Å; V380-L384 WeakPolarHBondContact O-CB 3.36Å; V380-L384 WeakPolarHBondContact O-CG 3.36Å; V380-L384 PolarHBondContact O-N 3.3Å; V380-L384 VanDerWaalsContact O-N 3.07Å; V381-L384 PolarHBondContact O-N 3.05Å; L384-G386 VanDerWaalsContact C-N 3.32Å; L384-F387 WeakPolarHBondContact O-CB 3.44Å; L384-F387 PolarHBondContact O-N 3.07Å; L384-V401 HydrophobicContact CB-CG1 4.18Å; L384-V401 HydrophobicContact CB-CG2 3.87Å; L384-I404 HydrophobicContact CD1-CB 4.23Å; L384-I404 HydrophobicContact CD1-CG1 4.35Å
385	S	90.3	Very high	89.7	Confident	82 Å²	82	48 Å²	48	57%	0.573	29%	0.29	S	S	*	.	H	α-helix	trans	-74.7	-24.7	175.4	69.1	0	0	0	0	112.6	V381 F387	V381-S385 VanDerWaalsContact O-CB 3.31Å; V381-S385 WeakPolarHBondContact O-CB 3.43Å; V381-S385 PolarHBondContact O-N 3.15Å; V381-S385 PolarHBondContact O-OG 3.12Å; S385-F387 VanDerWaalsContact C-N 3.35Å
386	G	87.7	Confident	89.5	Confident	19 Å²	19	49.1 Å²	49.1	20%	0.196	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	0.8	172.5	0	0	0	0	0	114.3	L316 H382 L384 E388	L316-G386 WeakPolarHBondContact CB-O 3.24Å; H382-G386 PolarHBondContact O-N 2.9Å; L384-G386 VanDerWaalsContact C-N 3.32Å; G386-E388 PolarHBondContact O-N 3.49Å
387	F	91.2	Very high	89.3	Confident	15 Å²	15	53.6 Å²	53.6	7%	0.066	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-75.5	116.1	-174.9	177.8	-98.3	0	0	0	112.2	L316 T318 L358 K362 L384 S385 P389 C396	L316-F387 WeakPolarHBondContact O-CA 3.05Å; L316-F387 WeakPolarHBondContact O-CD2 3.39Å; T318-F387 WeakPolarHBondContact OG1-CZ 3.33Å; L358-F387 HydrophobicContact CD2-CD2 3.95Å; K362-F387 HydrophobicContact CD-CD1 4.25Å; K362-F387 HydrophobicContact CD-CE1 4.2Å; K362-F387 HydrophobicContact CD-CG 4.5Å; K362-F387 HydrophobicContact CD-CZ 4.42Å; K362-F387 VanDerWaalsContact CE-CD2 3.44Å; K362-F387 VanDerWaalsContact CE-CZ 3.48Å; K362-F387 HydrophobicContact CG-CD1 3.95Å; K362-F387 HydrophobicContact CG-CE1 3.65Å; K362-F387 HydrophobicContact CG-CZ 4.16Å; L384-F387 WeakPolarHBondContact O-CB 3.44Å; L384-F387 PolarHBondContact O-N 3.07Å; S385-F387 VanDerWaalsContact C-N 3.35Å; F387-P389 HydrophobicContact CE1-CB 3.93Å; F387-C396 HydrophobicContact CD1-CB 4.33Å
388	E	88.5	Confident	89.1	Confident	87 Å²	87	59.5 Å²	59.5	41%	0.407	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-98.5	118.8	170.9	-71.4	-171.2	-151.2	0	0	110.1	A313 A314 L316 N317 G386	A313-E388 VanDerWaalsContact C-OE1 3.23Å; A313-E388 WeakPolarHBondContact CB-OE1 3.36Å; A314-E388 VanDerWaalsContact CA-CD 3.41Å; A314-E388 VanDerWaalsContact CA-OE2 3.28Å; A314-E388 WeakPolarHBondContact CA-OE2 3.21Å; A314-E388 WeakPolarHBondContact CB-OE2 3.22Å; A314-E388 VanDerWaalsContact N-CD 3.33Å; A314-E388 PolarHBondContact N-OE1 2.99Å; L316-E388 PolarHBondContact O-N 3.03Å; N317-E388 WeakPolarHBondContact CA-O 3.38Å; N317-E388 VanDerWaalsContact CB-O 3.25Å; N317-E388 WeakPolarHBondContact CB-O 3.42Å; G386-E388 PolarHBondContact O-N 3.49Å
389	P	88.1	Confident	89.1	Confident	54 Å²	54	60.1 Å²	60.1	35%	0.351	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-71.8	141.5	179	28.1	-33.3	0	0	0	112	F387 E393 P395	F387-P389 HydrophobicContact CE1-CB 3.93Å; P389-E393 HydrophobicContact CB-CB 3.95Å; P389-E393 HydrophobicContact CB-CG 4.25Å; P389-P395 HydrophobicContact CG-CB 4.33Å; P389-P395 HydrophobicContact CG-CG 4.23Å
390	D	84.5	Confident	89	Confident	66 Å²	66	60.2 Å²	60.2	35%	0.353	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-68.4	161.7	168.9	-71.6	-50.8	0	0	0	110.9	N317 R319 G392 E393	N317-D390 PolarHBondContact ND2-OD1 3.33Å; R319-D390 PolarHBondContact N-OD2 3.48Å; D390-G392 PolarHBondContact O-N 3.14Å; D390-E393 VanDerWaalsContact O-CB 3.31Å; D390-E393 WeakPolarHBondContact O-CB 3.49Å; D390-E393 PolarHBondContact O-N 3.16Å
391	D	78.8	Confident	88.9	Confident	182 Å²	182	60.9 Å²	60.9	97%	0.973	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	112.2	-178.4	-91.7	-34.7	0	0	0	113
392	G	79.6	Confident	89	Confident	88 Å²	88	62.6 Å²	62.6	91%	0.907	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	4.5	-179.5	0	0	0	0	0	115.5	D390	D390-G392 PolarHBondContact O-N 3.14Å
393	E	87.8	Confident	89.1	Confident	52 Å²	52	64.5 Å²	64.5	24%	0.243	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-79.9	156.7	169.3	-175.4	162.8	-145.4	0	0	112.3	T318 P389 D390 P395	T318-E393 VanDerWaalsContact CB-OE1 3.24Å; T318-E393 WeakPolarHBondContact CB-OE1 3.43Å; T318-E393 WeakPolarHBondContact CB-OE2 3.16Å; T318-E393 WeakPolarHBondContact CG2-OE1 3.35Å; T318-E393 PolarHBondContact OG1-OE1 3.4Å; T318-E393 PolarHBondContact OG1-OE2 3.31Å; P389-E393 HydrophobicContact CB-CB 3.95Å; P389-E393 HydrophobicContact CB-CG 4.25Å; D390-E393 VanDerWaalsContact O-CB 3.31Å; D390-E393 WeakPolarHBondContact O-CB 3.49Å; D390-E393 PolarHBondContact O-N 3.16Å; E393-P395 WeakPolarHBondContact O-CD 3.48Å
394	I	86.1	Confident	89.2	Confident	79 Å²	79	64.5 Å²	64.5	41%	0.405	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-77.6	122.3	177.4	-54.2	175	0	0	0	108.8
395	P	86.3	Confident	89.4	Confident	73 Å²	73	65.3 Å²	65.3	47%	0.474	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-59.3	163.1	172.7	-21.8	33.2	0	0	0	112.7	P389 E393	P389-P395 HydrophobicContact CG-CB 4.33Å; P389-P395 HydrophobicContact CG-CG 4.23Å; E393-P395 WeakPolarHBondContact O-CD 3.48Å
396	C	88.3	Confident	89.6	Confident	24 Å²	24	67.8 Å²	67.8	16%	0.162	38%	0.375	C	S	.	.			trans	-87.6	113.1	170.5	-158	0	0	0	0	109.5	K362 F387	K362-C396 HydrophobicContact CB-CB 4.11Å; K362-C396 HydrophobicContact CG-CB 4.2Å; F387-C396 HydrophobicContact CD1-CB 4.33Å
397	D	91.1	Very high	89.9	Confident	96 Å²	96	69.4 Å²	69.4	51%	0.513	38%	0.379	S	S	.	.			trans	-68.9	137.9	172.4	-60.8	-49.8	0	0	0	110.1	D399 V400 V401	D397-D399 HydrophobicContact CB-CB 4.32Å; D397-D399 PolarHBondContact O-N 2.8Å; D397-D399 VanDerWaalsContact O-N 3.1Å; D397-V400 HydrophobicContact CB-CG2 4.24Å; D397-V400 WeakPolarHBondContact O-CA 3.38Å; D397-V400 WeakPolarHBondContact O-CB 3.38Å; D397-V400 PolarHBondContact O-N 2.74Å; D397-V401 PolarHBondContact O-N 2.92Å
398	D	91.6	Very high	90.1	Very high	137 Å²	137	68.8 Å²	68.8	73%	0.733	38%	0.376	S	S	*	.	H	α-helix	trans	-49.4	-39.9	171.7	-64.6	-43.1	0	0	0	111.3	V400 V401 D402	D398-V400 PolarHBondContact O-N 3.27Å; D398-V401 WeakPolarHBondContact O-CA 3.45Å; D398-V401 WeakPolarHBondContact O-CB 3.34Å; D398-V401 PolarHBondContact O-N 2.75Å; D398-D402 WeakPolarHBondContact O-CB 3.48Å; D398-D402 PolarHBondContact O-N 3.31Å
399	D	92.4	Very high	90.4	Very high	98 Å²	98	69.4 Å²	69.4	52%	0.524	38%	0.379	S	S	.	.	H	α-helix	trans	-59.2	-28	178.1	-162.1	54.8	0	0	0	112.9	D397 R403	D397-D399 HydrophobicContact CB-CB 4.32Å; D397-D399 PolarHBondContact O-N 2.8Å; D397-D399 VanDerWaalsContact O-N 3.1Å; D399-R403 WeakPolarHBondContact O-CG 3.49Å; D399-R403 PolarHBondContact O-NE 3.29Å; D399-R403 VanDerWaalsContact O-NE 3.15Å; D399-R403 PolarHBondContact O-NH1 2.81Å; D399-R403 VanDerWaalsContact O-NH1 3.11Å; D399-R403 PolarHBondContact O-NH2 2.71Å; D399-R403 IonicContact OD1-NH1 3.38Å; D399-R403 IonicContact OD2-CZ 2.7Å; D399-R403 VanDerWaalsContact OD2-CZ 3.3Å; D399-R403 IonicContact OD2-NH1 3.86Å; D399-R403 PolarHBondContact OD2-NH1 3.06Å; D399-R403 IonicContact OD2-NH2 3.59Å; D399-R403 PolarHBondContact OD2-NH2 3.13Å; D399-R403 VanDerWaalsContact OD2-NH2 3.08Å
400	V	92.4	Very high	90.6	Very high	3 Å²	3	74.4 Å²	74.4	2%	0.018	40%	0.396	C	S	.	.	H	α-helix	trans	-78.5	-47.5	169	174.1	0	0	0	0	111.1	V365 L368 D397 D398 D402 R403 I404	V365-V400 HydrophobicContact CG2-CG1 4.36Å; V365-V400 HydrophobicContact CG2-CG2 4.25Å; L368-V400 HydrophobicContact CD1-CG1 3.6Å; D397-V400 HydrophobicContact CB-CG2 4.24Å; D397-V400 WeakPolarHBondContact O-CA 3.38Å; D397-V400 WeakPolarHBondContact O-CB 3.38Å; D397-V400 PolarHBondContact O-N 2.74Å; D398-V400 PolarHBondContact O-N 3.27Å; V400-D402 PolarHBondContact O-N 3.44Å; V400-R403 WeakPolarHBondContact O-CA 3.49Å; V400-R403 WeakPolarHBondContact O-CB 3.31Å; V400-R403 PolarHBondContact O-N 2.9Å; V400-I404 HydrophobicContact CG1-CG1 4.18Å; V400-I404 WeakPolarHBondContact O-CG1 3.49Å; V400-I404 PolarHBondContact O-N 2.77Å
401	V	93.9	Very high	90.8	Very high	14 Å²	14	74.8 Å²	74.8	9%	0.085	40%	0.395	C	S	.	.	H	α-helix	trans	-52.6	-46.3	178.2	-172.6	0	0	0	0	110.2	V381 L384 D397 D398 R403 I404 C405	V381-V401 HydrophobicContact CB-CG1 4.45Å; V381-V401 HydrophobicContact CG1-CG1 4.49Å; V381-V401 HydrophobicContact CG2-CG1 4.15Å; L384-V401 HydrophobicContact CB-CG1 4.18Å; L384-V401 HydrophobicContact CB-CG2 3.87Å; D397-V401 PolarHBondContact O-N 2.92Å; D398-V401 WeakPolarHBondContact O-CA 3.45Å; D398-V401 WeakPolarHBondContact O-CB 3.34Å; D398-V401 PolarHBondContact O-N 2.75Å; V401-R403 VanDerWaalsContact C-N 3.26Å; V401-R403 PolarHBondContact O-N 3.27Å; V401-I404 PolarHBondContact O-N 2.87Å; V401-C405 WeakPolarHBondContact O-CB 3.47Å; V401-C405 PolarHBondContact O-N 3.3Å
402	D	94.6	Very high	91.5	Very high	88 Å²	88	66.4 Å²	66.4	47%	0.471	35%	0.351	S	S	.	.	H	α-helix	trans	-62.2	-29.5	179.6	-141.3	56.5	0	0	0	113.1	D398 V400 R406	D398-D402 WeakPolarHBondContact O-CB 3.48Å; D398-D402 PolarHBondContact O-N 3.31Å; V400-D402 PolarHBondContact O-N 3.44Å; D402-R406 WeakPolarHBondContact O-CG 3.4Å; D402-R406 PolarHBondContact O-N 2.74Å; D402-R406 PolarHBondContact O-NE 2.76Å; D402-R406 IonicContact OD2-CZ 3.57Å; D402-R406 IonicContact OD2-NE 3.3Å; D402-R406 IonicContact OD2-NH2 2.91Å; D402-R406 PolarHBondContact OD2-NH2 3.12Å
403	R	94.3	Very high	92.2	Very high	94 Å²	94	63 Å²	63	36%	0.355	31%	0.312	S	S	.	.	H	α-helix	trans	-79.6	-39.8	174.9	-75.9	-176.9	-74.9	-95	5.6	113	V365 D399 V400 V401 L407	V365-R403 HydrophobicContact CG1-CB 4.03Å; D399-R403 WeakPolarHBondContact O-CG 3.49Å; D399-R403 PolarHBondContact O-NE 3.29Å; D399-R403 VanDerWaalsContact O-NE 3.15Å; D399-R403 PolarHBondContact O-NH1 2.81Å; D399-R403 VanDerWaalsContact O-NH1 3.11Å; D399-R403 PolarHBondContact O-NH2 2.71Å; D399-R403 IonicContact OD1-NH1 3.38Å; D399-R403 IonicContact OD2-CZ 2.7Å; D399-R403 VanDerWaalsContact OD2-CZ 3.3Å; D399-R403 IonicContact OD2-NH1 3.86Å; D399-R403 PolarHBondContact OD2-NH1 3.06Å; D399-R403 IonicContact OD2-NH2 3.59Å; D399-R403 PolarHBondContact OD2-NH2 3.13Å; D399-R403 VanDerWaalsContact OD2-NH2 3.08Å; V400-R403 WeakPolarHBondContact O-CA 3.49Å; V400-R403 WeakPolarHBondContact O-CB 3.31Å; V400-R403 PolarHBondContact O-N 2.9Å; V401-R403 VanDerWaalsContact C-N 3.26Å; V401-R403 PolarHBondContact O-N 3.27Å; R403-L407 PolarHBondContact O-N 3.23Å
404	I	94.9	Very high	92.5	Very high	1 Å²	1	65.3 Å²	65.3	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-76	-36.6	178.9	-49.4	-54.8	0	0	0	110.6	V365 L368 C372 V380 L384 V400 V401 R406 L407 A408	V365-I404 HydrophobicContact CB-CD1 4.46Å; V365-I404 HydrophobicContact CG1-CD1 3.72Å; V365-I404 WeakPolarHBondContact O-CD1 3.28Å; L368-I404 HydrophobicContact CB-CD1 3.73Å; L368-I404 HydrophobicContact CB-CG1 4.04Å; L368-I404 HydrophobicContact CD1-CG1 4.44Å; C372-I404 WeakPolarHBondContact SG-CG2 3.42Å; V380-I404 HydrophobicContact CG1-CB 3.97Å; V380-I404 HydrophobicContact CG1-CG2 3.62Å; L384-I404 HydrophobicContact CD1-CB 4.23Å; L384-I404 HydrophobicContact CD1-CG1 4.35Å; V400-I404 HydrophobicContact CG1-CG1 4.18Å; V400-I404 WeakPolarHBondContact O-CG1 3.49Å; V400-I404 PolarHBondContact O-N 2.77Å; V401-I404 PolarHBondContact O-N 2.87Å; I404-R406 PolarHBondContact O-N 2.68Å; I404-L407 WeakPolarHBondContact O-CA 3.5Å; I404-L407 WeakPolarHBondContact O-CB 3.32Å; I404-L407 PolarHBondContact O-N 2.75Å; I404-A408 PolarHBondContact O-N 3.37Å
405	C	94.9	Very high	92.7	Very high	19 Å²	19	66.2 Å²	66.2	13%	0.128	33%	0.326	C	S	.	.	H	α-helix	trans	-54.1	-54.1	172	-177.1	0	0	0	0	111.3	V381 V401 L407 A408 E409	V381-C405 HydrophobicContact CG2-CB 3.81Å; V381-C405 VanDerWaalsContact CG2-SG 3.59Å; V401-C405 WeakPolarHBondContact O-CB 3.47Å; V401-C405 PolarHBondContact O-N 3.3Å; C405-L407 PolarHBondContact O-N 2.59Å; C405-L407 VanDerWaalsContact O-N 3.09Å; C405-A408 WeakPolarHBondContact O-CA 3.4Å; C405-A408 WeakPolarHBondContact O-CB 3.44Å; C405-A408 PolarHBondContact O-N 3.42Å; C405-E409 WeakPolarHBondContact O-CG 3.38Å; C405-E409 PolarHBondContact O-N 3.09Å
406	R	94.4	Very high	92.8	Very high	135 Å²	135	63.2 Å²	63.2	51%	0.509	31%	0.307	S	S	.	.	H	α-helix	trans	-62.5	-16.1	176.2	-76.7	178.8	-79.8	176.4	-12.4	114.8	D402 I404 E409	D402-R406 WeakPolarHBondContact O-CG 3.4Å; D402-R406 PolarHBondContact O-N 2.74Å; D402-R406 PolarHBondContact O-NE 2.76Å; D402-R406 IonicContact OD2-CZ 3.57Å; D402-R406 IonicContact OD2-NE 3.3Å; D402-R406 IonicContact OD2-NH2 2.91Å; D402-R406 PolarHBondContact OD2-NH2 3.12Å; I404-R406 PolarHBondContact O-N 2.68Å; R406-E409 WeakPolarHBondContact CA-OE2 3.2Å; R406-E409 WeakPolarHBondContact CG-OE2 3.3Å
407	L	93.8	Very high	93	Very high	52 Å²	52	67.3 Å²	67.3	27%	0.272	33%	0.327	S	S	.	.	H	α-helix	trans	-82.9	-42.8	170.2	-169.9	67	0	0	0	111.3	G369 R403 I404 C405 K410 Q411	G369-L407 VanDerWaalsContact CA-CD2 3.42Å; G369-L407 WeakPolarHBondContact O-CD2 3.33Å; R403-L407 PolarHBondContact O-N 3.23Å; I404-L407 WeakPolarHBondContact O-CA 3.5Å; I404-L407 WeakPolarHBondContact O-CB 3.32Å; I404-L407 PolarHBondContact O-N 2.75Å; C405-L407 PolarHBondContact O-N 2.59Å; C405-L407 VanDerWaalsContact O-N 3.09Å; L407-K410 PolarHBondContact O-N 3.14Å; L407-Q411 WeakPolarHBondContact O-CB 3.28Å; L407-Q411 WeakPolarHBondContact O-CG 3.49Å; L407-Q411 PolarHBondContact O-N 3.25Å; L407-Q411 VanDerWaalsContact O-N 3.11Å
408	A	95.3	Very high	93.1	Very high	2 Å²	2	68.5 Å²	68.5	2%	0.017	33%	0.329	C	S	.	.	H	α-helix	trans	-63.7	-46.7	176	0	0	0	0	0	112.1	V380 I404 C405 K410 Q411 A412 D413	V380-A408 HydrophobicContact CB-CB 4.49Å; V380-A408 HydrophobicContact CG2-CB 4.03Å; I404-A408 PolarHBondContact O-N 3.37Å; C405-A408 WeakPolarHBondContact O-CA 3.4Å; C405-A408 WeakPolarHBondContact O-CB 3.44Å; C405-A408 PolarHBondContact O-N 3.42Å; A408-K410 PolarHBondContact O-N 2.95Å; A408-K410 VanDerWaalsContact O-N 3.16Å; A408-Q411 CarbonylContact O-C 3.58Å; A408-Q411 PolarHBondContact O-N 3.36Å; A408-A412 PolarHBondContact O-N 2.89Å; A408-D413 PolarHBondContact O-N 3.48Å; A408-D413 VanDerWaalsContact O-N 3.12Å
409	E	94.8	Very high	92.8	Very high	100 Å²	100	67.8 Å²	67.8	47%	0.467	33%	0.325	S	S	.	.	I	π-helix	trans	-48.2	-44.3	171.9	-72.4	179.2	153.2	0	0	112	C405 R406 K414	C405-E409 WeakPolarHBondContact O-CG 3.38Å; C405-E409 PolarHBondContact O-N 3.09Å; R406-E409 WeakPolarHBondContact CA-OE2 3.2Å; R406-E409 WeakPolarHBondContact CG-OE2 3.3Å; E409-K414 PolarHBondContact O-N 3.09Å
410	K	92.3	Very high	92.6	Very high	159 Å²	159	66.5 Å²	66.5	69%	0.691	34%	0.335	S	S	*	.	I	π-helix	trans	-79.2	-18.6	-176.2	-173.7	173.5	178.3	-179.9	0	113.7	L407 A408	L407-K410 PolarHBondContact O-N 3.14Å; A408-K410 PolarHBondContact O-N 2.95Å; A408-K410 VanDerWaalsContact O-N 3.16Å
411	Q	90.3	Very high	92.3	Very high	75 Å²	75	71.7 Å²	71.7	35%	0.35	36%	0.359	S	S	.	.	I	π-helix	trans	-115.7	-76.9	-175.2	-65.9	-176	8.4	0	0	111.3	L407 A408 L415	L407-Q411 WeakPolarHBondContact O-CB 3.28Å; L407-Q411 WeakPolarHBondContact O-CG 3.49Å; L407-Q411 PolarHBondContact O-N 3.25Å; L407-Q411 VanDerWaalsContact O-N 3.11Å; A408-Q411 CarbonylContact O-C 3.58Å; A408-Q411 PolarHBondContact O-N 3.36Å; Q411-L415 WeakPolarHBondContact O-CB 3.34Å; Q411-L415 VanDerWaalsContact O-CG 3.25Å; Q411-L415 WeakPolarHBondContact O-CG 3.31Å; Q411-L415 PolarHBondContact O-N 3Å
412	A	92.4	Very high	92.1	Very high	5 Å²	5	80.1 Å²	80.1	4%	0.041	39%	0.39	C	S	.	.	I	π-helix	trans	-69.3	-46	-172.4	0	0	0	0	0	112.6	L375 A408 L415 T416	L375-A412 WeakPolarHBondContact O-CB 3.47Å; A408-A412 PolarHBondContact O-N 2.89Å; A412-L415 PolarHBondContact O-N 3.41Å; A412-T416 WeakPolarHBondContact O-CB 3.41Å; A412-T416 PolarHBondContact O-N 3.03Å; A412-T416 PolarHBondContact O-OG1 3.31Å
413	D	95.1	Very high	92	Very high	17 Å²	17	77.7 Å²	77.7	9%	0.091	38%	0.378	C	S	.	.	I	π-helix	trans	-65.5	-45.8	-179.5	-62.8	38.3	0	0	0	110.5	N376 S377 A408 L415 T416 L417 V423	N376-D413 WeakPolarHBondContact CA-OD1 3.41Å; N376-D413 VanDerWaalsContact CB-OD1 3.29Å; N376-D413 WeakPolarHBondContact CB-OD1 3.31Å; S377-D413 VanDerWaalsContact CB-OD2 3.25Å; S377-D413 WeakPolarHBondContact CB-OD2 3.29Å; S377-D413 PolarHBondContact N-OD1 3.14Å; S377-D413 PolarHBondContact OG-OD2 2.69Å; A408-D413 PolarHBondContact O-N 3.48Å; A408-D413 VanDerWaalsContact O-N 3.12Å; D413-L415 VanDerWaalsContact C-N 3.33Å; D413-L415 PolarHBondContact O-N 3.01Å; D413-T416 WeakPolarHBondContact O-CB 3.4Å; D413-T416 PolarHBondContact O-N 2.92Å; D413-L417 WeakPolarHBondContact O-CB 3.25Å; D413-L417 VanDerWaalsContact O-CG 3.29Å; D413-L417 WeakPolarHBondContact O-CG 3.27Å; D413-L417 PolarHBondContact O-N 3.4Å; D413-V423 HydrophobicContact CB-CG2 4.03Å
414	K	92.6	Very high	91.9	Very high	101 Å²	101	76.4 Å²	76.4	44%	0.439	38%	0.381	S	S	.	.	H	α-helix	trans	-56.7	-45.4	175.7	-176.5	178.6	173.9	-69.3	0	111.9	E409 L417 E418	E409-K414 PolarHBondContact O-N 3.09Å; K414-L417 PolarHBondContact O-N 2.91Å; K414-E418 IonicContact NZ-OE1 3.45Å; K414-E418 PolarHBondContact NZ-OE1 2.66Å; K414-E418 IonicContact NZ-OE2 2.67Å; K414-E418 PolarHBondContact NZ-OE2 2.67Å; K414-E418 WeakPolarHBondContact O-CB 3.46Å; K414-E418 WeakPolarHBondContact O-CG 3.4Å; K414-E418 PolarHBondContact O-N 2.84Å
415	L	90.2	Very high	91.8	Very high	97 Å²	97	78.8 Å²	78.8	51%	0.508	39%	0.393	S	S	.	.	H	α-helix	trans	-65.5	-42.9	175.8	-73.2	169.3	0	0	0	111.8	Q411 A412 D413 L417 E418 D419	Q411-L415 WeakPolarHBondContact O-CB 3.34Å; Q411-L415 VanDerWaalsContact O-CG 3.25Å; Q411-L415 WeakPolarHBondContact O-CG 3.31Å; Q411-L415 PolarHBondContact O-N 3Å; A412-L415 PolarHBondContact O-N 3.41Å; D413-L415 VanDerWaalsContact C-N 3.33Å; D413-L415 PolarHBondContact O-N 3.01Å; L415-L417 VanDerWaalsContact C-N 3.28Å; L415-L417 PolarHBondContact O-N 3.5Å; L415-E418 PolarHBondContact O-N 3.03Å; L415-E418 VanDerWaalsContact O-N 3.15Å; L415-D419 PolarHBondContact O-N 2.73Å
416	T	89.9	Confident	91.6	Very high	11 Å²	11	82.8 Å²	82.8	7%	0.067	41%	0.41	C	S	.	.	H	α-helix	trans	-58.5	-41.5	177.4	-55.7	0	0	0	0	111.4	A412 D413 G420 Q421 V423	A412-T416 WeakPolarHBondContact O-CB 3.41Å; A412-T416 PolarHBondContact O-N 3.03Å; A412-T416 PolarHBondContact O-OG1 3.31Å; D413-T416 WeakPolarHBondContact O-CB 3.4Å; D413-T416 PolarHBondContact O-N 2.92Å; T416-G420 PolarHBondContact O-N 2.42Å; T416-Q421 HydrophobicContact CG2-CB 3.71Å; T416-Q421 WeakPolarHBondContact O-CA 3.35Å; T416-Q421 WeakPolarHBondContact O-CB 3.33Å; T416-Q421 PolarHBondContact O-N 3.39Å; T416-V423 HydrophobicContact CG2-CG2 4.27Å
417	L	91.9	Very high	91.5	Very high	110 Å²	110	77.3 Å²	77.3	58%	0.576	39%	0.39	S	S	*	.	H	α-helix	trans	-73.3	-34.3	176.1	-67.2	168	0	0	0	112.9	D413 K414 L415 D419 G420 V423	D413-L417 WeakPolarHBondContact O-CB 3.25Å; D413-L417 VanDerWaalsContact O-CG 3.29Å; D413-L417 WeakPolarHBondContact O-CG 3.27Å; D413-L417 PolarHBondContact O-N 3.4Å; K414-L417 PolarHBondContact O-N 2.91Å; L415-L417 VanDerWaalsContact C-N 3.28Å; L415-L417 PolarHBondContact O-N 3.5Å; L417-D419 VanDerWaalsContact C-N 3.34Å; L417-G420 PolarHBondContact O-N 3.45Å; L417-G420 VanDerWaalsContact O-N 3.11Å; L417-V423 HydrophobicContact CG-CG2 4.33Å
418	E	92.1	Very high	91.3	Very high	121 Å²	121	78 Å²	78	57%	0.565	40%	0.399	S	S	*	.	H	α-helix	trans	-68.2	-32.4	173.1	-78.8	176.2	144.4	0	0	112.3	K414 L415 G420	K414-E418 IonicContact NZ-OE1 3.45Å; K414-E418 PolarHBondContact NZ-OE1 2.66Å; K414-E418 IonicContact NZ-OE2 2.67Å; K414-E418 PolarHBondContact NZ-OE2 2.67Å; K414-E418 WeakPolarHBondContact O-CB 3.46Å; K414-E418 WeakPolarHBondContact O-CG 3.4Å; K414-E418 PolarHBondContact O-N 2.84Å; L415-E418 PolarHBondContact O-N 3.03Å; L415-E418 VanDerWaalsContact O-N 3.15Å; E418-G420 PolarHBondContact O-N 2.79Å
419	D	86.8	Confident	90.9	Very high	122 Å²	122	81.1 Å²	81.1	65%	0.652	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	3.3	169.9	-72.4	-21.2	0	0	0	113	L415 L417 Q421	L415-D419 PolarHBondContact O-N 2.73Å; L417-D419 VanDerWaalsContact C-N 3.34Å; D419-Q421 VanDerWaalsContact C-N 3.26Å; D419-Q421 HydrophobicContact CB-CG 4.49Å; D419-Q421 PolarHBondContact O-N 2.42Å
420	G	87.1	Confident	90.5	Very high	71 Å²	71	83.3 Å²	83.3	73%	0.732	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	11.8	178.6	0	0	0	0	0	115	T416 L417 E418	T416-G420 PolarHBondContact O-N 2.42Å; L417-G420 PolarHBondContact O-N 3.45Å; L417-G420 VanDerWaalsContact O-N 3.11Å; E418-G420 PolarHBondContact O-N 2.79Å
421	Q	87.4	Confident	90.4	Very high	111 Å²	111	77.1 Å²	77.1	52%	0.519	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-89.4	150.4	178.8	-59.9	-174.4	8.7	0	0	111.1	T416 D419	T416-Q421 HydrophobicContact CG2-CB 3.71Å; T416-Q421 WeakPolarHBondContact O-CA 3.35Å; T416-Q421 WeakPolarHBondContact O-CB 3.33Å; T416-Q421 PolarHBondContact O-N 3.39Å; D419-Q421 VanDerWaalsContact C-N 3.26Å; D419-Q421 HydrophobicContact CB-CG 4.49Å; D419-Q421 PolarHBondContact O-N 2.42Å
422	R	89.3	Confident	90	Very high	192 Å²	192	79.9 Å²	79.9	73%	0.725	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-79.9	140.9	169.9	-63.9	-173.4	-173.9	-95	13.5	109.1	T424 E1020	R422-T424 PolarHBondContact O-N 2.92Å; R422-E1020 IonicContact NH2-OE1 3.43Å; R422-E1020 PolarHBondContact NH2-OE1 3.43Å
423	V	92.1	Very high	89.6	Confident	36 Å²	36	84.3 Å²	84.3	22%	0.218	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-68.9	120.4	171.4	-178.6	0	0	0	0	109	N376 L378 D413 T416 L417	N376-V423 HydrophobicContact CB-CG1 3.73Å; L378-V423 HydrophobicContact CD1-CG1 4Å; L378-V423 HydrophobicContact CG-CG1 4.1Å; D413-V423 HydrophobicContact CB-CG2 4.03Å; T416-V423 HydrophobicContact CG2-CG2 4.27Å; L417-V423 HydrophobicContact CG-CG2 4.33Å
424	T	92.7	Very high	89.2	Confident	68 Å²	68	88.2 Å²	88.2	42%	0.417	47%	0.466	S	S	.	.			trans	-126.4	149.7	-179.1	56.2	0	0	0	0	111.3	N376 R422 E426	N376-T424 PolarHBondContact ND2-O 2.95Å; R422-T424 PolarHBondContact O-N 2.92Å; T424-E426 PolarHBondContact OG1-O 3.38Å
425	L	91.8	Very high	89.2	Confident	50 Å²	50	85.2 Å²	85.2	26%	0.262	45%	0.453	S	S	.	.	S	Bend	trans	-67.6	-52.7	173.1	-178.6	61.8	0	0	0	110.7	V307 L378 Q379 H382	V307-L425 HydrophobicContact CB-CD1 3.86Å; V307-L425 HydrophobicContact CB-CD2 4.38Å; V307-L425 HydrophobicContact CB-CG 3.89Å; V307-L425 HydrophobicContact CG1-CD1 4.02Å; V307-L425 HydrophobicContact CG2-CD1 4.37Å; V307-L425 HydrophobicContact CG2-CG 4.02Å; L378-L425 HydrophobicContact CB-CD1 4.44Å; Q379-L425 HydrophobicContact CG-CD1 4.34Å; Q379-L425 VanDerWaalsContact CG-O 3.24Å; Q379-L425 WeakPolarHBondContact CG-O 3.38Å; Q379-L425 PolarHBondContact NE2-O 3.4Å; H382-L425 HydrophobicContact CB-CD1 3.7Å
426	E	92	Very high	89.3	Confident	104 Å²	104	86.1 Å²	86.1	49%	0.486	46%	0.458	S	S	.	.	S	Bend	trans	-82.5	149.2	178.9	-65.8	-179.4	170.3	0	0	112.5	N304 V307 T424	N304-E426 HydrophobicContact CB-CG 4.48Å; V307-E426 HydrophobicContact CG2-CG 4.28Å; T424-E426 PolarHBondContact OG1-O 3.38Å
427	E	91.3	Very high	89.3	Confident	20 Å²	20	87.8 Å²	87.8	9%	0.093	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-72.9	150.9	166.2	-62	-61.7	119.8	0	0	111.4	A300 F303 N304 R350 Q379 D429	A300-E427 HydrophobicContact CB-CB 4.24Å; F303-E427 HydrophobicContact CB-CG 4.07Å; F303-E427 HydrophobicContact CD1-CG 3.64Å; F303-E427 HydrophobicContact CE1-CG 4.36Å; F303-E427 HydrophobicContact CG-CG 3.93Å; N304-E427 PolarHBondContact ND2-O 3.45Å; N304-E427 WeakPolarHBondContact OD1-CB 3.46Å; N304-E427 PolarHBondContact OD1-N 2.92Å; R350-E427 WeakPolarHBondContact CD-OE1 3.49Å; R350-E427 WeakPolarHBondContact CD-OE2 3.49Å; R350-E427 IonicContact CZ-OE1 3.19Å; R350-E427 IonicContact CZ-OE2 3.36Å; R350-E427 IonicContact NE-OE1 2.65Å; R350-E427 IonicContact NH1-OE1 3.88Å; R350-E427 PolarHBondContact NH1-OE1 2.9Å; R350-E427 IonicContact NH1-OE2 2.7Å; R350-E427 PolarHBondContact NH1-OE2 2.91Å; Q379-E427 PolarHBondContact NE2-OE1 2.82Å; E427-D429 PolarHBondContact O-N 3.13Å
428	S	90.6	Very high	89.2	Confident	65 Å²	65	83.3 Å²	83.3	46%	0.455	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-67	127	172.5	-67.5	0	0	0	0	111.4	H296 E430	H296-S428 PolarHBondContact NE2-O 2.91Å; S428-E430 WeakPolarHBondContact CB-O 3.37Å; S428-E430 PolarHBondContact O-N 3.11Å
429	D	86.5	Confident	88.8	Confident	68 Å²	68	85.2 Å²	85.2	36%	0.364	45%	0.452	S	S	.	.	S	Bend	trans	-67.7	-21.1	177.9	-140.9	19.8	0	0	0	112.4	R246 E427	R246-D429 IonicContact CZ-OD1 3.22Å; R246-D429 IonicContact CZ-OD2 3.69Å; R246-D429 IonicContact NH1-OD2 3.36Å; R246-D429 IonicContact NH2-OD1 2.82Å; R246-D429 PolarHBondContact NH2-OD1 2.93Å; R246-D429 IonicContact NH2-OD2 2.81Å; R246-D429 PolarHBondContact NH2-OD2 3.09Å; E427-D429 PolarHBondContact O-N 3.13Å
430	E	85.9	Confident	88.7	Confident	146 Å²	146	84.7 Å²	84.7	68%	0.682	45%	0.449	S	S	*	.	S	Bend	trans	-104.4	141.7	172.2	-62.9	-170.7	175.2	0	0	111.4	S428	S428-E430 WeakPolarHBondContact CB-O 3.37Å; S428-E430 PolarHBondContact O-N 3.11Å
431	L	89.9	Confident	88.3	Confident	30 Å²	30	83.2 Å²	83.2	16%	0.157	43%	0.434	C	S	.	.			trans	-90.3	103.7	176.3	178.4	55.9	0	0	0	109.9	H293 H296 L433	H293-L431 HydrophobicContact CB-CD2 4.5Å; H296-L431 HydrophobicContact CB-CB 4.28Å; H296-L431 HydrophobicContact CB-CD1 4.38Å; H296-L431 HydrophobicContact CB-CD2 3.96Å; H296-L431 HydrophobicContact CB-CG 4.44Å; L431-L433 HydrophobicContact CD1-CD1 4.12Å; L431-L433 HydrophobicContact CD1-CG 3.94Å; L431-L433 HydrophobicContact CD2-CD1 3.87Å; L431-L433 HydrophobicContact CD2-CG 4.37Å; L431-L433 HydrophobicContact CG-CB 4.4Å; L431-L433 HydrophobicContact CG-CD1 3.99Å; L431-L433 HydrophobicContact CG-CG 3.93Å; L431-L433 PolarHBondContact O-N 3.33Å
432	N	82.9	Confident	88.3	Confident	132 Å²	132	78.1 Å²	78.1	71%	0.706	41%	0.41	S	S	*	.			trans	-76.2	51.6	-176.5	-69.3	-44.9	0	0	0	114
433	L	83.9	Confident	88	Confident	98 Å²	98	71.4 Å²	71.4	51%	0.513	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-96.7	136.7	170	-69.1	178.9	0	0	0	110.7	L431 F435	L431-L433 HydrophobicContact CD1-CD1 4.12Å; L431-L433 HydrophobicContact CD1-CG 3.94Å; L431-L433 HydrophobicContact CD2-CD1 3.87Å; L431-L433 HydrophobicContact CD2-CG 4.37Å; L431-L433 HydrophobicContact CG-CB 4.4Å; L431-L433 HydrophobicContact CG-CD1 3.99Å; L431-L433 HydrophobicContact CG-CG 3.93Å; L431-L433 PolarHBondContact O-N 3.33Å; L433-F435 PolarHBondContact O-N 3.44Å
434	P	86.8	Confident	87.3	Confident	100 Å²	100	70.2 Å²	70.2	65%	0.649	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-57.7	132.1	168.1	-22.9	33.7	0	0	0	110.8	L436	P434-L436 PolarHBondContact O-N 3.1Å
435	F	91.6	Very high	86.3	Confident	38 Å²	38	70.1 Å²	70.1	17%	0.167	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-68.6	123.5	174.1	177.5	-109	0	0	0	110.3	I230 E231 F234 L286 L433 I437	I230-F435 HydrophobicContact CG2-CE1 3.99Å; I230-F435 HydrophobicContact CG2-CZ 3.87Å; E231-F435 HydrophobicContact CB-CD1 3.56Å; E231-F435 HydrophobicContact CB-CE1 3.85Å; E231-F435 HydrophobicContact CB-CG 4.23Å; E231-F435 HydrophobicContact CG-CB 3.89Å; E231-F435 HydrophobicContact CG-CD1 3.63Å; E231-F435 HydrophobicContact CG-CE1 4.33Å; E231-F435 HydrophobicContact CG-CG 3.8Å; F234-F435 HydrophobicContact CB-CD2 4.36Å; F234-F435 HydrophobicContact CB-CE2 3.77Å; F234-F435 HydrophobicContact CB-CZ 4.19Å; F234-F435 AromaticContact CD1-CD2 3.85Å; F234-F435 HydrophobicContact CD1-CD2 3.85Å; F234-F435 AromaticContact CD1-CE2 3.94Å; F234-F435 HydrophobicContact CD1-CE2 3.94Å; F234-F435 HydrophobicContact CD2-CD2 4.48Å; F234-F435 AromaticContact CD2-CE2 3.82Å; F234-F435 HydrophobicContact CD2-CE2 3.82Å; F234-F435 HydrophobicContact CE1-CD2 4.28Å; F234-F435 HydrophobicContact CE2-CE2 4.4Å; F234-F435 AromaticContact CG-CD2 3.98Å; F234-F435 HydrophobicContact CG-CD2 3.98Å; F234-F435 AromaticContact CG-CE2 3.55Å; F234-F435 HydrophobicContact CG-CE2 3.55Å; F234-F435 HydrophobicContact CG-CZ 4.43Å; L286-F435 HydrophobicContact CD2-CE2 3.67Å; L286-F435 HydrophobicContact CD2-CZ 3.68Å; L433-F435 PolarHBondContact O-N 3.44Å; F435-I437 HydrophobicContact CD1-CG1 4.23Å; F435-I437 HydrophobicContact CE1-CD1 4.27Å; F435-I437 HydrophobicContact CE1-CG1 3.58Å; F435-I437 HydrophobicContact CZ-CG1 4.31Å
436	L	92.2	Very high	85.1	Confident	115 Å²	115	73.9 Å²	73.9	60%	0.602	39%	0.39	S	S	*	.			trans	-110.1	116.4	-178	-61.7	-178.3	0	0	0	110.6	Q289 P434 P438	Q289-L436 PolarHBondContact NE2-O 2.91Å; Q289-L436 PolarHBondContact OE1-O 3.17Å; P434-L436 PolarHBondContact O-N 3.1Å; L436-P438 WeakPolarHBondContact O-CD 3.06Å
437	I	90.3	Very high	83.9	Confident	47 Å²	47	73 Å²	73	24%	0.241	39%	0.385	C	S	.	.			trans	-74.9	125.9	166.5	-62.1	-179	0	0	0	107.8	I230 F435	I230-I437 HydrophobicContact CD1-CD1 4.36Å; F435-I437 HydrophobicContact CD1-CG1 4.23Å; F435-I437 HydrophobicContact CE1-CD1 4.27Å; F435-I437 HydrophobicContact CE1-CG1 3.58Å; F435-I437 HydrophobicContact CZ-CG1 4.31Å
438	P	90.6	Very high	82.5	Confident	16 Å²	16	83.7 Å²	83.7	10%	0.104	43%	0.425	C	S	.	.			trans	-57.5	150.1	174.5	-20.3	29.1	0	0	0	111.9	N283 A285 L286 L436 Y442	N283-P438 HydrophobicContact CB-CG 4.09Å; N283-P438 VanDerWaalsContact CG-CG 3.48Å; N283-P438 WeakPolarHBondContact ND2-CB 3.44Å; N283-P438 WeakPolarHBondContact OD1-CG 3.49Å; A285-P438 HydrophobicContact CB-CB 4.36Å; A285-P438 HydrophobicContact CB-CG 4.01Å; L286-P438 HydrophobicContact CD1-CG 4.3Å; L286-P438 HydrophobicContact CD2-CG 4.43Å; L286-P438 HydrophobicContact CG-CG 3.79Å; L436-P438 WeakPolarHBondContact O-CD 3.06Å; P438-Y442 HydrophobicContact CB-CE2 3.82Å; P438-Y442 WeakPolarHBondContact CD-OH 3.37Å; P438-Y442 HydrophobicContact CG-CE2 4.5Å; P438-Y442 WeakPolarHBondContact O-CE2 3.15Å
439	Q	83.4	Confident	81.4	Confident	160 Å²	160	85.4 Å²	85.4	75%	0.748	43%	0.432	S	S	*	.	S	Bend	trans	-97.5	-34.6	174.4	-63.6	-175.9	12.7	0	0	111.8	H210	H210-Q439 PolarHBondContact CE1-O 3.47Å; H210-Q439 PolarHBondContact ND1-O 3Å; H210-Q439 PolarHBondContact NE2-O 3.44Å
440	D	83.5	Confident	80.9	Confident	111 Å²	111	83.5 Å²	83.5	59%	0.594	42%	0.423	S	S	*	.	S	Bend	trans	-128	176.3	-178.9	-47.5	-81.8	0	0	0	111.1	N283	N283-D440 PolarHBondContact ND2-O 3.08Å
441	G	78.9	Confident	80.7	Confident	41 Å²	41	77.6 Å²	77.6	42%	0.423	40%	0.397	S	S	.	.			trans	85.2	14.4	175.7	0	0	0	0	0	114.2	N283 E445	N283-G441 PolarHBondContact ND2-O 3.04Å; G441-E445 PolarHBondContact N-OE2 3.14Å
442	Y	87.3	Confident	80.3	Confident	4 Å²	4	82.1 Å²	82.1	2%	0.016	42%	0.422	C	S	.	.			trans	-78.3	165.9	173.3	-74.4	-82.4	0	0	0	111.6	S206 E207 H210 N283 P438 V444 E445 Q446	S206-Y442 WeakPolarHBondContact O-CE1 3.42Å; E207-Y442 HydrophobicContact CB-CD1 4.35Å; E207-Y442 WeakPolarHBondContact OE2-CB 3.49Å; E207-Y442 WeakPolarHBondContact OE2-CD1 3.44Å; H210-Y442 HydrophobicContact CB-CD1 4.14Å; H210-Y442 HydrophobicContact CB-CD2 3.83Å; H210-Y442 HydrophobicContact CB-CE1 4.21Å; H210-Y442 HydrophobicContact CB-CE2 3.88Å; H210-Y442 HydrophobicContact CB-CG 3.92Å; H210-Y442 AromaticContact CD2-CD2 3.78Å; H210-Y442 AromaticContact CD2-CG 3.72Å; H210-Y442 AromaticContact CE1-CD2 3.22Å; H210-Y442 WeakPolarHBondContact CE1-CD2 3.48Å; H210-Y442 AromaticContact CE1-CE2 3.21Å; H210-Y442 WeakPolarHBondContact CE1-CE2 3.25Å; H210-Y442 AromaticContact CG-CD2 3.35Å; H210-Y442 AromaticContact CG-CE2 3.8Å; H210-Y442 AromaticContact CG-CG 3.62Å; H210-Y442 AromaticContact ND1-CD2 3.16Å; H210-Y442 WeakPolarHBondContact ND1-CD2 3.42Å; H210-Y442 AromaticContact ND1-CE2 3.53Å; H210-Y442 AromaticContact ND1-CG 3.9Å; H210-Y442 AromaticContact NE2-CD2 3.84Å; N283-Y442 HydrophobicContact CB-CD1 4.47Å; N283-Y442 HydrophobicContact CB-CE1 4.19Å; P438-Y442 HydrophobicContact CB-CE2 3.82Å; P438-Y442 WeakPolarHBondContact CD-OH 3.37Å; P438-Y442 HydrophobicContact CG-CE2 4.5Å; P438-Y442 WeakPolarHBondContact O-CE2 3.15Å; Y442-V444 PolarHBondContact O-N 3.32Å; Y442-E445 PolarHBondContact N-OE2 3.47Å; Y442-Q446 PolarHBondContact O-NE2 3.1Å
443	F	82.9	Confident	80.3	Confident	51 Å²	51	76.2 Å²	76.2	22%	0.224	39%	0.392	C	S	.	.	S	Bend	trans	-67.8	-38	-173.4	-163.7	-93.4	0	0	0	111.4	F151 L153 E207 E445 Q446 F447 P451	F151-F443 HydrophobicContact CD2-CE1 4.15Å; F151-F443 HydrophobicContact CD2-CZ 4.04Å; F151-F443 AromaticContact CE2-CD1 3.59Å; F151-F443 HydrophobicContact CE2-CD1 3.59Å; F151-F443 HydrophobicContact CE2-CD2 4.24Å; F151-F443 AromaticContact CE2-CE1 3.19Å; F151-F443 HydrophobicContact CE2-CE1 3.19Å; F151-F443 AromaticContact CE2-CE2 3.91Å; F151-F443 HydrophobicContact CE2-CE2 3.91Å; F151-F443 HydrophobicContact CE2-CG 4.09Å; F151-F443 AromaticContact CE2-CZ 3.36Å; F151-F443 HydrophobicContact CE2-CZ 3.36Å; F151-F443 AromaticContact CZ-CD1 3.56Å; F151-F443 HydrophobicContact CZ-CD1 3.56Å; F151-F443 AromaticContact CZ-CE1 3.47Å; F151-F443 HydrophobicContact CZ-CE1 3.47Å; F151-F443 VanDerWaalsContact CZ-CE1 3.47Å; F151-F443 HydrophobicContact CZ-CG 4.28Å; F151-F443 HydrophobicContact CZ-CZ 4.14Å; L153-F443 HydrophobicContact CD1-CB 3.59Å; L153-F443 HydrophobicContact CD1-CD2 4.28Å; L153-F443 HydrophobicContact CD1-CG 3.97Å; E207-F443 WeakPolarHBondContact OE1-CB 3.2Å; E207-F443 PolarHBondContact OE1-N 2.8Å; E207-F443 PolarHBondContact OE2-N 2.71Å; F443-E445 PolarHBondContact O-N 3.21Å; F443-E445 VanDerWaalsContact O-N 3.14Å; F443-Q446 WeakPolarHBondContact O-CB 3.48Å; F443-Q446 PolarHBondContact O-N 3.26Å; F443-Q446 VanDerWaalsContact O-N 3.09Å; F443-F447 AromaticContact CD1-CD2 3.7Å; F443-F447 HydrophobicContact CD1-CD2 3.7Å; F443-F447 AromaticContact CD1-CE2 3.7Å; F443-F447 HydrophobicContact CD1-CE2 3.7Å; F443-F447 HydrophobicContact CD1-CG 4.49Å; F443-F447 HydrophobicContact CD1-CZ 4.47Å; F443-F447 HydrophobicContact CD2-CE2 4.18Å; F443-F447 HydrophobicContact CE1-CD1 4.36Å; F443-F447 AromaticContact CE1-CD2 3.45Å; F443-F447 HydrophobicContact CE1-CD2 3.45Å; F443-F447 VanDerWaalsContact CE1-CD2 3.45Å; F443-F447 HydrophobicContact CE1-CE1 4.08Å; F443-F447 AromaticContact CE1-CE2 3.13Å; F443-F447 HydrophobicContact CE1-CE2 3.13Å; F443-F447 HydrophobicContact CE1-CG 4.08Å; F443-F447 AromaticContact CE1-CZ 3.49Å; F443-F447 HydrophobicContact CE1-CZ 3.49Å; F443-F447 VanDerWaalsContact CE1-CZ 3.49Å; F443-F447 AromaticContact CE2-CE2 3.68Å; F443-F447 HydrophobicContact CE2-CE2 3.68Å; F443-F447 HydrophobicContact CE2-CZ 4.07Å; F443-F447 HydrophobicContact CG-CD2 4.39Å; F443-F447 HydrophobicContact CG-CE2 4.2Å; F443-F447 AromaticContact CZ-CD2 3.96Å; F443-F447 HydrophobicContact CZ-CD2 3.96Å; F443-F447 HydrophobicContact CZ-CE1 4.15Å; F443-F447 AromaticContact CZ-CE2 3.13Å; F443-F447 HydrophobicContact CZ-CE2 3.13Å; F443-F447 AromaticContact CZ-CZ 3.25Å; F443-F447 HydrophobicContact CZ-CZ 3.25Å; F443-F447 WeakPolarHBondContact O-CD2 3.43Å; F443-P451 HydrophobicContact CE1-CG 3.95Å
444	V	78.2	Confident	80.4	Confident	10 Å²	10	71.7 Å²	71.7	6%	0.061	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-59.2	-31.6	-174.7	76.7	0	0	0	0	113.9	L117 L119 Y157 E207 L211 Y442 Q446 F447	L117-V444 HydrophobicContact CD1-CG1 4.12Å; L117-V444 HydrophobicContact CD1-CG2 3.98Å; L117-V444 HydrophobicContact CD2-CG2 4.23Å; L117-V444 HydrophobicContact CG-CG2 4.42Å; L119-V444 HydrophobicContact CD2-CG2 3.97Å; Y157-V444 HydrophobicContact CE1-CG2 4.29Å; Y157-V444 WeakPolarHBondContact OH-CA 3.46Å; Y157-V444 VanDerWaalsContact OH-CB 3.27Å; Y157-V444 WeakPolarHBondContact OH-CB 3.48Å; Y157-V444 PolarHBondContact OH-N 2.74Å; E207-V444 PolarHBondContact OE1-N 3.34Å; L211-V444 HydrophobicContact CD2-CB 3.78Å; L211-V444 HydrophobicContact CD2-CG1 4.02Å; L211-V444 HydrophobicContact CD2-CG2 3.61Å; Y442-V444 PolarHBondContact O-N 3.32Å; V444-Q446 PolarHBondContact O-N 3.27Å; V444-F447 PolarHBondContact O-N 3.09Å
445	E	72.9	Confident	80.3	Confident	67 Å²	67	70.1 Å²	70.1	31%	0.313	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-69.2	-17.3	-176.8	-56.8	178.9	150.6	0	0	112.8	H210 R214 G441 Y442 F443	H210-E445 IonicContact NE2-OE1 3.55Å; H210-E445 PolarHBondContact NE2-OE1 3.46Å; R214-E445 IonicContact CZ-OE1 2.79Å; R214-E445 IonicContact NH1-OE1 2.78Å; R214-E445 PolarHBondContact NH1-OE1 2.72Å; G441-E445 PolarHBondContact N-OE2 3.14Å; Y442-E445 PolarHBondContact N-OE2 3.47Å; F443-E445 PolarHBondContact O-N 3.21Å; F443-E445 VanDerWaalsContact O-N 3.14Å
446	Q	66.3	Low	80	Confident	128 Å²	128	72.5 Å²	72.5	60%	0.598	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-97.1	-11.3	-172.5	-53.9	175.6	29.5	0	0	112.2	Y442 F443 V444	Y442-Q446 PolarHBondContact O-NE2 3.1Å; F443-Q446 WeakPolarHBondContact O-CB 3.48Å; F443-Q446 PolarHBondContact O-N 3.26Å; F443-Q446 VanDerWaalsContact O-N 3.09Å; V444-Q446 PolarHBondContact O-N 3.27Å
447	F	67	Low	79.7	Confident	87 Å²	87	67.3 Å²	67.3	38%	0.382	33%	0.333	S	S	.	.			trans	-111.7	123.6	-169.1	-80	-98.2	0	0	0	113.6	F443 V444 P451	F443-F447 AromaticContact CD1-CD2 3.7Å; F443-F447 HydrophobicContact CD1-CD2 3.7Å; F443-F447 AromaticContact CD1-CE2 3.7Å; F443-F447 HydrophobicContact CD1-CE2 3.7Å; F443-F447 HydrophobicContact CD1-CG 4.49Å; F443-F447 HydrophobicContact CD1-CZ 4.47Å; F443-F447 HydrophobicContact CD2-CE2 4.18Å; F443-F447 HydrophobicContact CE1-CD1 4.36Å; F443-F447 AromaticContact CE1-CD2 3.45Å; F443-F447 HydrophobicContact CE1-CD2 3.45Å; F443-F447 VanDerWaalsContact CE1-CD2 3.45Å; F443-F447 HydrophobicContact CE1-CE1 4.08Å; F443-F447 AromaticContact CE1-CE2 3.13Å; F443-F447 HydrophobicContact CE1-CE2 3.13Å; F443-F447 HydrophobicContact CE1-CG 4.08Å; F443-F447 AromaticContact CE1-CZ 3.49Å; F443-F447 HydrophobicContact CE1-CZ 3.49Å; F443-F447 VanDerWaalsContact CE1-CZ 3.49Å; F443-F447 AromaticContact CE2-CE2 3.68Å; F443-F447 HydrophobicContact CE2-CE2 3.68Å; F443-F447 HydrophobicContact CE2-CZ 4.07Å; F443-F447 HydrophobicContact CG-CD2 4.39Å; F443-F447 HydrophobicContact CG-CE2 4.2Å; F443-F447 AromaticContact CZ-CD2 3.96Å; F443-F447 HydrophobicContact CZ-CD2 3.96Å; F443-F447 HydrophobicContact CZ-CE1 4.15Å; F443-F447 AromaticContact CZ-CE2 3.13Å; F443-F447 HydrophobicContact CZ-CE2 3.13Å; F443-F447 AromaticContact CZ-CZ 3.25Å; F443-F447 HydrophobicContact CZ-CZ 3.25Å; F443-F447 WeakPolarHBondContact O-CD2 3.43Å; V444-F447 PolarHBondContact O-N 3.09Å; F447-P451 HydrophobicContact CD1-CG 3.91Å; F447-P451 HydrophobicContact CE1-CB 4.47Å; F447-P451 HydrophobicContact CE1-CG 4.08Å; F447-P451 HydrophobicContact CG-CG 4.47Å
448	R	60.3	Low	79.6	Confident	244 Å²	244	65 Å²	65	92%	0.921	32%	0.322	S	S	*	.	S	Bend	trans	-95.8	-6.3	169.6	-66.1	-179.3	178	-97.7	-1.9	113.2
449	T	67.6	Low	79.4	Confident	101 Å²	101	67.8 Å²	67.8	62%	0.62	33%	0.333	S	S	*	.	S	Bend	trans	-142.8	159.1	-175.3	54.9	0	0	0	0	110
450	V	76.8	Confident	79.4	Confident	28 Å²	28	63.2 Å²	63.2	17%	0.17	31%	0.312	C	S	.	.			trans	-62.8	132.9	175.3	-177.8	0	0	0	0	110.4	P120 L121 W455 L472	P120-V450 HydrophobicContact CG-CG2 4.02Å; L121-V450 HydrophobicContact CD1-CG1 3.8Å; L121-V450 HydrophobicContact CD1-CG2 3.91Å; L121-V450 HydrophobicContact CD2-CG1 4.45Å; L121-V450 HydrophobicContact CD2-CG2 3.92Å; L121-V450 HydrophobicContact CG-CG1 4.37Å; L121-V450 HydrophobicContact CG-CG2 3.65Å; V450-W455 HydrophobicContact CG1-CB 4.15Å; V450-L472 HydrophobicContact CG2-CD2 3.89Å
451	P	82.4	Confident	79.6	Confident	21 Å²	21	58.2 Å²	58.2	14%	0.136	29%	0.285	C	S	.	.			trans	-68.8	131	169	-17.8	30.9	0	0	0	111.2	F443 F447 G453 L454 W455	F443-P451 HydrophobicContact CE1-CG 3.95Å; F447-P451 HydrophobicContact CD1-CG 3.91Å; F447-P451 HydrophobicContact CE1-CB 4.47Å; F447-P451 HydrophobicContact CE1-CG 4.08Å; F447-P451 HydrophobicContact CG-CG 4.47Å; P451-G453 PolarHBondContact O-N 3.07Å; P451-G453 VanDerWaalsContact O-N 3.13Å; P451-L454 HydrophobicContact CB-CB 4.27Å; P451-L454 HydrophobicContact CG-CB 4.47Å; P451-L454 WeakPolarHBondContact O-CB 3.36Å; P451-L454 PolarHBondContact O-N 3.5Å; P451-W455 PolarHBondContact O-N 3.27Å; P451-W455 VanDerWaalsContact O-N 3.12Å
452	D	79.9	Confident	80	Confident	126 Å²	126	59.6 Å²	59.6	67%	0.674	28%	0.281	S	S	*	.	H	α-helix	trans	-54.8	-36.6	-179.5	-66.1	-47.6	0	0	0	112.9	W455 Q456	D452-W455 PolarHBondContact O-N 3.43Å; D452-Q456 WeakPolarHBondContact O-CB 3.44Å; D452-Q456 VanDerWaalsContact O-CG 3.23Å; D452-Q456 WeakPolarHBondContact O-CG 3.37Å; D452-Q456 PolarHBondContact O-N 2.96Å
453	G	83.4	Confident	79.9	Confident	7 Å²	7	66.8 Å²	66.8	7%	0.072	31%	0.314	C	S	.	.	H	α-helix	trans	-67.6	-31.6	177.2	0	0	0	0	0	114.4	T150 P451 Y457	T150-G453 WeakPolarHBondContact OG1-CA 3.5Å; P451-G453 PolarHBondContact O-N 3.07Å; P451-G453 VanDerWaalsContact O-N 3.13Å; G453-Y457 WeakPolarHBondContact O-CB 3.31Å; G453-Y457 PolarHBondContact O-N 2.86Å; G453-Y457 VanDerWaalsContact O-N 3.11Å
454	L	86	Confident	80	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.016	32%	0.324	C	S	.	.	H	α-helix	trans	-68.8	-44.5	171.2	178.7	60.2	0	0	0	110	L121 F151 Y157 P451 Y457 L458	L121-L454 HydrophobicContact CD1-CD2 4.03Å; F151-L454 HydrophobicContact CD1-CB 3.71Å; F151-L454 HydrophobicContact CD1-CD1 4.34Å; F151-L454 HydrophobicContact CE1-CB 4.1Å; F151-L454 HydrophobicContact CE1-CD1 4.42Å; Y157-L454 HydrophobicContact CD1-CD2 3.75Å; Y157-L454 HydrophobicContact CG-CD1 4.44Å; Y157-L454 HydrophobicContact CG-CD2 3.98Å; P451-L454 HydrophobicContact CB-CB 4.27Å; P451-L454 HydrophobicContact CG-CB 4.47Å; P451-L454 WeakPolarHBondContact O-CB 3.36Å; P451-L454 PolarHBondContact O-N 3.5Å; L454-Y457 PolarHBondContact O-N 3.2Å; L454-L458 HydrophobicContact CD1-CD1 4.16Å; L454-L458 HydrophobicContact CD1-CG 4.21Å; L454-L458 HydrophobicContact CG-CD1 4.03Å; L454-L458 HydrophobicContact CG-CG 4.47Å; L454-L458 WeakPolarHBondContact O-CB 3.48Å; L454-L458 VanDerWaalsContact O-CG 3.31Å; L454-L458 WeakPolarHBondContact O-CG 3.4Å; L454-L458 PolarHBondContact O-N 3.12Å
455	W	84.3	Confident	80.3	Confident	68 Å²	68	78.5 Å²	78.5	26%	0.258	36%	0.355	S	S	.	.	H	α-helix	trans	-61.1	-45.6	177.8	-177.9	-96	0	0	0	111.8	L121 V450 P451 D452 Y457 L458 Q459 V470 L472	L121-W455 HydrophobicContact CD2-CE3 3.8Å; L121-W455 HydrophobicContact CD2-CZ3 3.65Å; V450-W455 HydrophobicContact CG1-CB 4.15Å; P451-W455 PolarHBondContact O-N 3.27Å; P451-W455 VanDerWaalsContact O-N 3.12Å; D452-W455 PolarHBondContact O-N 3.43Å; W455-Y457 PolarHBondContact O-N 3.42Å; W455-L458 PolarHBondContact O-N 3.17Å; W455-Q459 WeakPolarHBondContact O-CB 3.46Å; W455-Q459 WeakPolarHBondContact O-CG 3.44Å; W455-Q459 PolarHBondContact O-N 3.4Å; W455-V470 HydrophobicContact CE3-CG1 3.99Å; W455-V470 HydrophobicContact CH2-CB 4.42Å; W455-V470 HydrophobicContact CH2-CG1 4.08Å; W455-V470 HydrophobicContact CZ3-CB 4.35Å; W455-V470 HydrophobicContact CZ3-CG1 3.53Å; W455-L472 HydrophobicContact CH2-CG 4.35Å; W455-L472 HydrophobicContact CZ3-CD2 4.31Å; W455-L472 HydrophobicContact CZ3-CG 4.05Å
456	Q	85.3	Confident	80.8	Confident	88 Å²	88	76.1 Å²	76.1	41%	0.411	35%	0.345	S	S	.	.	H	α-helix	trans	-58.4	-45.8	174.7	-73	165.6	10.2	0	0	112.1	T150 D452 Q459 Q460	T150-Q456 PolarHBondContact OG1-OE1 3.23Å; D452-Q456 WeakPolarHBondContact O-CB 3.44Å; D452-Q456 VanDerWaalsContact O-CG 3.23Å; D452-Q456 WeakPolarHBondContact O-CG 3.37Å; D452-Q456 PolarHBondContact O-N 2.96Å; Q456-Q459 PolarHBondContact O-N 3.4Å; Q456-Q460 WeakPolarHBondContact O-CG 3.27Å; Q456-Q460 PolarHBondContact O-N 3.19Å
457	Y	87.3	Confident	81.7	Confident	5 Å²	5	70.1 Å²	70.1	2%	0.02	32%	0.317	C	S	.	.	H	α-helix	trans	-62.5	-46	177	-179.8	-102.2	0	0	0	112.1	M148 S154 S158 G453 L454 W455 Q459 Q460 L461	M148-Y457 HydrophobicContact CG-CD2 4.3Å; M148-Y457 HydrophobicContact CG-CE2 4.15Å; S154-Y457 VanDerWaalsContact CB-CD1 3.47Å; S158-Y457 WeakPolarHBondContact OG-CE1 3.34Å; G453-Y457 WeakPolarHBondContact O-CB 3.31Å; G453-Y457 PolarHBondContact O-N 2.86Å; G453-Y457 VanDerWaalsContact O-N 3.11Å; L454-Y457 PolarHBondContact O-N 3.2Å; W455-Y457 PolarHBondContact O-N 3.42Å; Y457-Q459 VanDerWaalsContact C-N 3.31Å; Y457-Q459 PolarHBondContact O-N 2.99Å; Y457-Q460 WeakPolarHBondContact O-CB 3.15Å; Y457-Q460 PolarHBondContact O-N 3.28Å; Y457-Q460 VanDerWaalsContact O-N 3.11Å; Y457-L461 HydrophobicContact CD1-CD1 4.09Å; Y457-L461 HydrophobicContact CE1-CD1 3.62Å; Y457-L461 HydrophobicContact CE1-CG 4.25Å; Y457-L461 PolarHBondContact O-N 3.49Å
458	L	87.5	Confident	82	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63	-36.7	176.4	-68.5	174.4	0	0	0	112	L121 I123 S158 L161 L454 W455 L461 Q462 V470	L121-L458 HydrophobicContact CD1-CD1 4.01Å; I123-L458 HydrophobicContact CG2-CD1 4.44Å; I123-L458 HydrophobicContact CG2-CD2 4.32Å; S158-L458 WeakPolarHBondContact OG-CD2 3.49Å; L161-L458 HydrophobicContact CD1-CD1 4Å; L454-L458 HydrophobicContact CD1-CD1 4.16Å; L454-L458 HydrophobicContact CD1-CG 4.21Å; L454-L458 HydrophobicContact CG-CD1 4.03Å; L454-L458 HydrophobicContact CG-CG 4.47Å; L454-L458 WeakPolarHBondContact O-CB 3.48Å; L454-L458 VanDerWaalsContact O-CG 3.31Å; L454-L458 WeakPolarHBondContact O-CG 3.4Å; L454-L458 PolarHBondContact O-N 3.12Å; W455-L458 PolarHBondContact O-N 3.17Å; L458-L461 HydrophobicContact CD2-CD1 4.48Å; L458-L461 PolarHBondContact O-N 2.85Å; L458-Q462 PolarHBondContact O-N 3.27Å; L458-V470 HydrophobicContact CB-CG1 4.15Å; L458-V470 HydrophobicContact CB-CG2 3.95Å; L458-V470 HydrophobicContact CD1-CG1 4.07Å
459	Q	85.6	Confident	82.5	Confident	74 Å²	74	62.1 Å²	62.1	35%	0.346	30%	0.295	S	S	.	.	H	α-helix	trans	-63.2	-39.6	171.3	-76.2	-175.1	-39.4	0	0	112.4	W455 Q456 Y457 Q462 H463	W455-Q459 WeakPolarHBondContact O-CB 3.46Å; W455-Q459 WeakPolarHBondContact O-CG 3.44Å; W455-Q459 PolarHBondContact O-N 3.4Å; Q456-Q459 PolarHBondContact O-N 3.4Å; Y457-Q459 VanDerWaalsContact C-N 3.31Å; Y457-Q459 PolarHBondContact O-N 2.99Å; Q459-Q462 WeakPolarHBondContact O-CB 3.41Å; Q459-Q462 PolarHBondContact O-N 3.38Å; Q459-H463 PolarHBondContact O-CD2 3.5Å; Q459-H463 PolarHBondContact O-N 3.39Å
460	Q	84.5	Confident	82.8	Confident	64 Å²	64	58 Å²	58	30%	0.299	27%	0.27	S	S	.	.	H	α-helix	trans	-63.6	-41.6	175.7	-69.2	174.9	18.4	0	0	111.9	M148 Q456 Y457 Q462 H463 R464	M148-Q460 VanDerWaalsContact CG-OE1 3.3Å; M148-Q460 PolarHBondContact O-NE2 2.97Å; M148-Q460 PolarHBondContact O-OE1 3.5Å; M148-Q460 VanDerWaalsContact O-OE1 3.11Å; M148-Q460 PolarHBondContact SD-OE1 3.48Å; Q456-Q460 WeakPolarHBondContact O-CG 3.27Å; Q456-Q460 PolarHBondContact O-N 3.19Å; Y457-Q460 WeakPolarHBondContact O-CB 3.15Å; Y457-Q460 PolarHBondContact O-N 3.28Å; Y457-Q460 VanDerWaalsContact O-N 3.11Å; Q460-Q462 VanDerWaalsContact C-N 3.31Å; Q460-Q462 PolarHBondContact O-N 2.8Å; Q460-H463 PolarHBondContact O-N 2.98Å; Q460-R464 WeakPolarHBondContact O-CG 3.4Å; Q460-R464 PolarHBondContact O-N 3.4Å
461	L	86.9	Confident	82.5	Confident	5 Å²	5	58.8 Å²	58.8	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-37.9	172.9	-63.2	179.5	0	0	0	111.8	F133 E136 V137 Y457 L458 R464 R465 L466	F133-L461 HydrophobicContact CD2-CD1 4.33Å; F133-L461 HydrophobicContact CE2-CD1 3.77Å; F133-L461 HydrophobicContact CZ-CD1 4.46Å; E136-L461 HydrophobicContact CG-CD2 4.25Å; V137-L461 HydrophobicContact CG2-CD1 3.78Å; V137-L461 HydrophobicContact CG2-CD2 4.42Å; Y457-L461 HydrophobicContact CD1-CD1 4.09Å; Y457-L461 HydrophobicContact CE1-CD1 3.62Å; Y457-L461 HydrophobicContact CE1-CG 4.25Å; Y457-L461 PolarHBondContact O-N 3.49Å; L458-L461 HydrophobicContact CD2-CD1 4.48Å; L458-L461 PolarHBondContact O-N 2.85Å; L461-R464 CarbonylContact O-C 3.46Å; L461-R464 PolarHBondContact O-N 3.34Å; L461-R465 PolarHBondContact O-N 3.25Å; L461-L466 HydrophobicContact CB-CB 4.49Å; L461-L466 HydrophobicContact CD2-CD1 3.93Å; L461-L466 PolarHBondContact O-N 3.25Å
462	Q	87.3	Confident	81.9	Confident	71 Å²	71	62.8 Å²	62.8	33%	0.332	30%	0.296	S	S	.	.	H	α-helix	trans	-67.3	-42.2	175.3	-161.5	-174.8	-92.2	0	0	112	L458 Q459 Q460 R464 R465 C467	L458-Q462 PolarHBondContact O-N 3.27Å; Q459-Q462 WeakPolarHBondContact O-CB 3.41Å; Q459-Q462 PolarHBondContact O-N 3.38Å; Q460-Q462 VanDerWaalsContact C-N 3.31Å; Q460-Q462 PolarHBondContact O-N 2.8Å; Q462-R464 VanDerWaalsContact C-N 3.25Å; Q462-R464 PolarHBondContact O-N 3.48Å; Q462-R465 WeakPolarHBondContact O-CA 3.33Å; Q462-R465 PolarHBondContact O-N 2.83Å; Q462-C467 VanDerWaalsContact CA-SG 3.6Å; Q462-C467 PolarHBondContact N-SG 3.31Å
463	H	85.3	Confident	80.9	Confident	154 Å²	154	58.9 Å²	58.9	71%	0.713	28%	0.277	S	S	*	.	H	α-helix	trans	-61.9	-33.8	174.1	-78.8	-62.9	0	0	0	112.4	Q459 Q460 R465	Q459-H463 PolarHBondContact O-CD2 3.5Å; Q459-H463 PolarHBondContact O-N 3.39Å; Q460-H463 PolarHBondContact O-N 2.98Å; H463-R465 PolarHBondContact O-N 2.98Å
464	R	84.9	Confident	79.1	Confident	114 Å²	114	63.8 Å²	63.8	43%	0.43	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	4.9	172.2	-67.7	-178	62.2	-173.7	-10.2	114	E136 Q460 L461 Q462 L466	E136-R464 VanDerWaalsContact CD-CZ 3.48Å; E136-R464 IonicContact OE1-CZ 3.37Å; E136-R464 IonicContact OE1-NH1 2.67Å; E136-R464 PolarHBondContact OE1-NH1 3Å; E136-R464 IonicContact OE1-NH2 2.82Å; E136-R464 IonicContact OE2-CZ 2.79Å; E136-R464 IonicContact OE2-NH1 2.79Å; E136-R464 PolarHBondContact OE2-NH1 3.24Å; E136-R464 IonicContact OE2-NH2 3.19Å; E136-R464 PolarHBondContact OE2-NH2 3.21Å; Q460-R464 WeakPolarHBondContact O-CG 3.4Å; Q460-R464 PolarHBondContact O-N 3.4Å; L461-R464 CarbonylContact O-C 3.46Å; L461-R464 PolarHBondContact O-N 3.34Å; Q462-R464 VanDerWaalsContact C-N 3.25Å; Q462-R464 PolarHBondContact O-N 3.48Å; R464-L466 HydrophobicContact CB-CD1 4.34Å; R464-L466 HydrophobicContact CB-CG 4.24Å; R464-L466 PolarHBondContact O-N 3.2Å
465	R	84.9	Confident	76.8	Confident	193 Å²	193	67.7 Å²	67.7	73%	0.728	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	19.9	-179.7	-52.9	-176.4	179.1	-168.5	-1.1	114.9	N129 L461 Q462 H463 C467	N129-R465 PolarHBondContact ND2-O 2.9Å; L461-R465 PolarHBondContact O-N 3.25Å; Q462-R465 WeakPolarHBondContact O-CA 3.33Å; Q462-R465 PolarHBondContact O-N 2.83Å; H463-R465 PolarHBondContact O-N 2.98Å; R465-C467 VanDerWaalsContact C-N 3.35Å
466	L	83.9	Confident	74.4	Confident	17 Å²	17	69.4 Å²	69.4	9%	0.089	36%	0.36	C	S	.	.	S	Bend	trans	-77.8	-24.8	176.7	-61.4	176.3	0	0	0	111.6	D132 F133 E136 L461 R464	D132-L466 HydrophobicContact CB-CD2 3.82Å; F133-L466 HydrophobicContact CB-CB 4.23Å; F133-L466 HydrophobicContact CD2-CB 4.14Å; E136-L466 HydrophobicContact CB-CD1 3.73Å; E136-L466 HydrophobicContact CG-CD1 3.88Å; L461-L466 HydrophobicContact CB-CB 4.49Å; L461-L466 HydrophobicContact CD2-CD1 3.93Å; L461-L466 PolarHBondContact O-N 3.25Å; R464-L466 HydrophobicContact CB-CD1 4.34Å; R464-L466 HydrophobicContact CB-CG 4.24Å; R464-L466 PolarHBondContact O-N 3.2Å
467	C	84.8	Confident	71.9	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.014	38%	0.379	C	S	.	.			trans	-130	157.7	164.1	60	0	0	0	0	110.6	Q124 I125 Q462 R465	Q124-C467 CarbonylContact O-C 3.41Å; Q124-C467 WeakPolarHBondContact O-CA 3.48Å; Q124-C467 WeakPolarHBondContact O-CB 3.33Å; I125-C467 HydrophobicContact CG1-CB 4.28Å; Q462-C467 VanDerWaalsContact CA-SG 3.6Å; Q462-C467 PolarHBondContact N-SG 3.31Å; R465-C467 VanDerWaalsContact C-N 3.35Å
468	H	73.6	Confident	69.3	Low	103 Å²	103	75 Å²	75	48%	0.477	41%	0.412	S	S	.	.	S	Bend	trans	-102.6	-30	-172	-71	92.3	0	0	0	113.7	Q124 G126	Q124-H468 PolarHBondContact O-N 2.99Å; G126-H468 PolarHBondContact N-ND1 3.23Å
469	T	69.8	Low	66.7	Low	61 Å²	61	80 Å²	80	37%	0.374	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	125.7	179.9	-68.5	0	0	0	0	108.8	I123 Q124	I123-T469 WeakPolarHBondContact CA-O 3.45Å; Q124-T469 PolarHBondContact N-O 3.24Å
470	V	74.6	Confident	64.2	Low	14 Å²	14	85.1 Å²	85.1	9%	0.085	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	109.4	162.8	-172.2	0	0	0	0	106.4	L121 I123 W455 L458	L121-V470 HydrophobicContact CD2-CG1 4.17Å; I123-V470 HydrophobicContact CG2-CG1 4.23Å; I123-V470 HydrophobicContact CG2-CG2 4.23Å; W455-V470 HydrophobicContact CE3-CG1 3.99Å; W455-V470 HydrophobicContact CH2-CB 4.42Å; W455-V470 HydrophobicContact CH2-CG1 4.08Å; W455-V470 HydrophobicContact CZ3-CB 4.35Å; W455-V470 HydrophobicContact CZ3-CG1 3.53Å; L458-V470 HydrophobicContact CB-CG1 4.15Å; L458-V470 HydrophobicContact CB-CG2 3.95Å; L458-V470 HydrophobicContact CD1-CG1 4.07Å
471	S	70.8	Confident	61.7	Low	44 Å²	44	88.5 Å²	88.5	31%	0.308	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.2	-178.7	65.8	0	0	0	0	111.1	L121 S122 T473	L121-S471 WeakPolarHBondContact CA-O 3.19Å; S122-S471 PolarHBondContact N-O 3.09Å; S122-S471 PolarHBondContact O-N 2.9Å; S122-S471 PolarHBondContact OG-OG 3.39Å; S471-T473 PolarHBondContact O-N 2.82Å
472	L	68.6	Low	59	Low	106 Å²	106	97.3 Å²	97.3	56%	0.555	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	117.3	165.8	-73.1	165.3	0	0	0	107.8	P120 L121 V450 W455 P474	P120-L472 VanDerWaalsContact O-CA 3.31Å; P120-L472 WeakPolarHBondContact O-CA 3.29Å; L121-L472 HydrophobicContact CD2-CD2 4.02Å; V450-L472 HydrophobicContact CG2-CD2 3.89Å; W455-L472 HydrophobicContact CH2-CG 4.35Å; W455-L472 HydrophobicContact CZ3-CD2 4.31Å; W455-L472 HydrophobicContact CZ3-CG 4.05Å; L472-P474 WeakPolarHBondContact O-CD 3.35Å
473	T	59.8	Low	56.2	Low	43 Å²	43	99.9 Å²	99.9	26%	0.264	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-69.4	120.5	175.3	-44.5	0	0	0	0	107.8	P120 L121 S471 A475	P120-T473 PolarHBondContact O-N 2.76Å; L121-T473 PolarHBondContact N-OG1 3.44Å; S471-T473 PolarHBondContact O-N 2.82Å; T473-A475 PolarHBondContact O-N 2.88Å
474	P	45.3	Very low	53.4	Low	111 Å²	111	99.7 Å²	99.7	72%	0.721	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-61.8	130.3	174.3	26.4	-33	0	0	0	108.5	L472	L472-P474 WeakPolarHBondContact O-CD 3.35Å
475	A	37.3	Very low	50.7	Low	85 Å²	85	101.6 Å²	101.6	70%	0.702	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-55.9	138.2	176.4	0	0	0	0	0	109.8	T473	T473-A475 PolarHBondContact O-N 2.88Å
476	P	34.4	Very low	48	Very low	103 Å²	103	97.3 Å²	97.3	67%	0.669	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-57.2	131.8	173.8	25.2	-33.2	0	0	0	108.4	A478	P476-A478 PolarHBondContact O-N 3.02Å
477	P	32.8	Very low	45.2	Very low	126 Å²	126	104.3 Å²	104.3	82%	0.818	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-61.4	118.5	180	24.8	-32.8	0	0	0	108.5	A479	P477-A479 PolarHBondContact O-N 3.15Å
478	A	33.8	Very low	42.4	Very low	85 Å²	85	112.4 Å²	112.4	70%	0.702	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-52.8	134.3	175.7	0	0	0	0	0	109.2	P476 M480	P476-A478 PolarHBondContact O-N 3.02Å; A478-M480 VanDerWaalsContact C-N 3.3Å; A478-M480 PolarHBondContact O-N 3.29Å
479	A	32.8	Very low	40.2	Very low	104 Å²	104	114.8 Å²	114.8	86%	0.86	68%	0.678	S	S	*	*			trans	-66.4	85.4	-172	0	0	0	0	0	111.4	P477 T481	P477-A479 PolarHBondContact O-N 3.15Å; A479-T481 PolarHBondContact O-N 3.44Å
480	M	32.2	Very low	38.1	Very low	182 Å²	182	115.2 Å²	115.2	90%	0.897	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-69.1	119.6	175.3	-81.6	-165.8	-89.3	0	0	109.6	A478	A478-M480 VanDerWaalsContact C-N 3.3Å; A478-M480 PolarHBondContact O-N 3.29Å
481	T	31.9	Very low	35.7	Very low	135 Å²	135	119 Å²	119	83%	0.828	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-55.6	142.7	170.8	42.5	0	0	0	0	110.8	A479	A479-T481 PolarHBondContact O-N 3.44Å
482	H	29.7	Very low	33.6	Very low	190 Å²	190	121.6 Å²	121.6	88%	0.88	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-51.2	139.5	-173.6	-67.4	-104.5	0	0	0	114.2
483	S	28.5	Very low	31.5	Very low	125 Å²	125	124 Å²	124	87%	0.874	76%	0.758	S	S	*	*			trans	-141.3	164.8	140.1	-162.7	0	0	0	0	110
484	M	27.4	Very low	29.9	Very low	150 Å²	150	126 Å²	126	74%	0.739	78%	0.779	S	S	*	*			trans	-112.5	160.1	-155.8	-90.8	-98.2	-86.4	0	0	114.9
485	H	27.3	Very low	29	Very low	155 Å²	155	128.7 Å²	128.7	72%	0.718	78%	0.782	S	S	*	*			trans	73	111.3	155.2	-89.2	53.6	0	0	0	120.4
486	A	28.2	Very low	28.5	Very low	102 Å²	102	133.8 Å²	133.8	84%	0.843	78%	0.784	S	S	*	*				-150.3	149.7	124.2	0	0	0	0	0	109.9
487	M	25.9	Very low	28.2	Very low	165 Å²	165	135.6 Å²	135.6	81%	0.813	78%	0.783	S	S	*	*			trans	-88.6	138.5	-174.8	-88.3	-171.8	-71.6	0	0	112.4
488	H	26.6	Very low	27.8	Very low	171 Å²	171	136.3 Å²	136.3	79%	0.792	78%	0.776	S	S	*	*				75.7	134	95.7	-144.6	62.1	0	0	0	112.6
489	I	26.6	Very low	27.6	Very low	154 Å²	154	139.2 Å²	139.2	79%	0.79	77%	0.774	S	S	*	*				-163.7	141.2	64.8	-78	158	0	0	0	111.4
490	G	25	Very low	27.1	Very low	70 Å²	70	141.6 Å²	141.6	72%	0.722	77%	0.768	S	S	*	*			trans	68.8	162.6	150.7	0	0	0	0	0	120.8
491	A	25.2	Very low	26.9	Very low	92 Å²	92	139.7 Å²	139.7	76%	0.76	76%	0.756	S	S	*	*			cis	-165.3	150.9	-21	0	0	0	0	0	111.8
492	S	25.9	Very low	26.6	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	75%	0.75	S	S	*	*			trans	48.4	120.4	154.2	56.2	0	0	0	0	123.5
493	D	25.7	Very low	26.4	Very low	156 Å²	156	140.7 Å²	140.7	83%	0.834	75%	0.752	S	S	*	*				72.8	112.6	126.4	-52.6	-27	0	0	0	125.5
494	A	26.1	Very low	26.3	Very low	85 Å²	85	144.2 Å²	144.2	70%	0.702	76%	0.755	S	S	*	*				64	119.2	121	0	0	0	0	0	125.3
495	H	26.2	Very low	26.2	Very low	168 Å²	168	144.9 Å²	144.9	78%	0.778	76%	0.756	S	S	*	*				85.9	128.5	127.5	-85.8	39.8	0	0	0	124.1
496	Y	26.5	Very low	26	Very low	192 Å²	192	144.1 Å²	144.1	75%	0.753	76%	0.757	S	S	*	*			trans	77.9	142.2	148.7	-85	-72.8	0	0	0	125.9
497	H	27.3	Very low	26.7	Very low	142 Å²	142	144.2 Å²	144.2	66%	0.657	75%	0.749	S	S	*	*			trans	59.9	102.6	154.1	-73.4	-60.4	0	0	0	124.7
498	Q	24.3	Very low	26.6	Very low	140 Å²	140	143.7 Å²	143.7	65%	0.654	75%	0.748	S	S	*	*				60	131.1	98.6	-173.2	173.3	-15.5	0	0	123
499	H	29.4	Very low	26.4	Very low	146 Å²	146	141.3 Å²	141.3	68%	0.676	75%	0.746	S	S	*	*			trans	93.4	115.8	160	-73	-33.4	0	0	0	121.8
500	Q	23.9	Very low	26.3	Very low	155 Å²	155	145.9 Å²	145.9	72%	0.724	75%	0.753	S	S	*	*			trans	46.4	134.4	134.7	-56.8	-163.5	12.7	0	0	120.5
501	H	28.2	Very low	26.2	Very low	141 Å²	141	148.1 Å²	148.1	65%	0.653	76%	0.758	S	S	*	*				-164.6	149.8	63.1	-126.3	18.4	0	0	0	114
502	Q	24.1	Very low	26.3	Very low	150 Å²	150	149.2 Å²	149.2	70%	0.701	75%	0.754	S	S	*	*			trans	40.9	121.3	147	-55.2	-179.7	30.4	0	0	122.8
503	Q	26.6	Very low	26.1	Very low	196 Å²	196	150 Å²	150	92%	0.916	76%	0.76	S	S	*	*				-160.6	174.8	105.8	-104.6	177.1	32.7	0	0	111.8
504	Q	26.5	Very low	26.1	Very low	199 Å²	199	150.7 Å²	150.7	93%	0.93	76%	0.758	S	S	*	*			trans	-102.2	176.2	-154.1	-70.3	175.4	-23.2	0	0	116
505	Q	24.8	Very low	26	Very low	165 Å²	165	151.9 Å²	151.9	77%	0.771	76%	0.757	S	S	*	*			trans	-111.6	146.5	-163.8	-66.6	-177.5	-14.4	0	0	115.1
506	N	24	Very low	25.9	Very low	138 Å²	138	149.7 Å²	149.7	74%	0.738	76%	0.755	S	S	*	*			trans	63.7	177	135.4	-67.1	-10.5	0	0	0	119.9
507	P	42	Very low	25.7	Very low	105 Å²	105	147.3 Å²	147.3	68%	0.682	76%	0.755	S	S	*	*			cis	-131.9	-171.5	-47.2	36.7	-20.5	0	0	0	112.5
508	I	23.7	Very low	25.6	Very low	153 Å²	153	146.4 Å²	146.4	79%	0.785	76%	0.76	S	S	*	*			trans	174.2	111.8	141.7	-94.1	155.3	0	0	0	107.6
509	V	22.6	Very low	25.6	Very low	122 Å²	122	145.5 Å²	145.5	74%	0.739	77%	0.769	S	S	*	*				68.4	125.7	77.3	175.4	0	0	0	0	113.8
510	R	25.2	Very low	25.7	Very low	249 Å²	249	146.3 Å²	146.3	94%	0.94	78%	0.776	S	S	*	*			trans	-132.6	139.1	160	-83.2	-169.7	166.9	120.8	1	109.7
511	S	22	Very low	25.8	Very low	118 Å²	118	144.7 Å²	144.7	83%	0.825	78%	0.779	S	S	*	*			trans	-88.6	156.8	-176.3	-167.6	0	0	0	0	112.8
512	V	26.9	Very low	25.8	Very low	114 Å²	114	143.7 Å²	143.7	69%	0.691	78%	0.784	S	S	*	*			trans	-88.4	154.2	167.3	-170.2	0	0	0	0	109.6
513	S	22.7	Very low	25.9	Very low	117 Å²	117	141.9 Å²	141.9	82%	0.818	78%	0.783	S	S	*	*			trans	-137	140.2	153.9	-72.3	0	0	0	0	109.5
514	Q	24.5	Very low	25.9	Very low	170 Å²	170	140.7 Å²	140.7	79%	0.794	78%	0.777	S	S	*	*			trans	-90.9	-178.5	175.1	-62.8	170.4	-3.4	0	0	108.8
515	T	23.9	Very low	25.8	Very low	109 Å²	109	137.8 Å²	137.8	67%	0.669	76%	0.762	S	S	*	*			cis	-173	147.5	48.6	45.8	0	0	0	0	112.8
516	T	24.3	Very low	26	Very low	122 Å²	122	132.6 Å²	132.6	75%	0.748	75%	0.752	S	S	*	*			trans	58.9	150.4	142.6	56.5	0	0	0	0	121.5
517	L	23.6	Very low	26.3	Very low	142 Å²	142	133.5 Å²	133.5	74%	0.743	76%	0.757	S	S	*	*			cis	-161.7	160	3.9	-116.1	160.7	0	0	0	111.6
518	T	25.4	Very low	25.6	Very low	124 Å²	124	133.3 Å²	133.3	76%	0.761	76%	0.758	S	S	*	*			trans	50.4	118.6	155.4	45.2	0	0	0	0	123.3
519	S	23.3	Very low	25.8	Very low	121 Å²	121	136 Å²	136	85%	0.846	77%	0.765	S	S	*	*				-168	156.4	113.7	32.7	0	0	0	0	111.2
520	I	32.2	Very low	25.9	Very low	162 Å²	162	133.5 Å²	133.5	83%	0.831	76%	0.764	S	S	*	*			trans	-110.2	136.9	-173.5	-59.9	167.3	0	0	0	110.6
521	P	25.4	Very low	26.2	Very low	121 Å²	121	126.8 Å²	126.8	79%	0.786	75%	0.754	S	S	*	*			trans	-118.3	147.5	151.5	36.4	-27.3	0	0	0	112.7
522	T	28	Very low	26.7	Very low	121 Å²	121	126.2 Å²	126.2	74%	0.742	76%	0.757	S	S	*	*			trans	-89.3	163.6	178.2	-47.8	0	0	0	0	111.6
523	T	26.8	Very low	27.2	Very low	111 Å²	111	126.3 Å²	126.3	68%	0.681	76%	0.758	S	S	*	*			trans	102.4	148.1	156.9	78.4	0	0	0	0	119.4
524	Q	26.3	Very low	27.9	Very low	171 Å²	171	125.5 Å²	125.5	80%	0.799	75%	0.752	S	S	*	*			trans	68.4	90.1	155.4	-69	163.5	109.4	0	0	119.2
525	F	24.6	Very low	29.2	Very low	139 Å²	139	120.4 Å²	120.4	61%	0.61	73%	0.73	S	S	*	*			trans	-60.9	126.8	144	-99.1	-93	0	0	0	108.9	R562	F525-R562 VanDerWaalsContact O-CZ 3.26Å; F525-R562 PolarHBondContact O-NH1 3.46Å; F525-R562 PolarHBondContact O-NH2 3.15Å
526	G	29.7	Very low	31	Very low	55 Å²	55	119.8 Å²	119.8	57%	0.567	73%	0.727	S	S	*	*			trans	164.5	25.3	176.8	0	0	0	0	0	117.9
527	D	28.5	Very low	33.7	Very low	158 Å²	158	118.1 Å²	118.1	85%	0.845	71%	0.712	S	S	*	*			trans	-165.8	159.1	161.9	-107.2	-32.7	0	0	0	110.7
528	S	27.3	Very low	36.7	Very low	101 Å²	101	113.4 Å²	113.4	71%	0.706	69%	0.691	S	S	*	*			trans	75	131.2	-171.9	-33.2	0	0	0	0	114.7
529	F	28.7	Very low	39.7	Very low	210 Å²	210	114.5 Å²	114.5	92%	0.921	69%	0.685	S	S	*	*			cis	-123.7	147	4.6	-87.4	-89.2	0	0	0	112.6
530	G	25.4	Very low	42.9	Very low	69 Å²	69	108.8 Å²	108.8	71%	0.711	65%	0.645	S	S	*	*	S	Bend	trans	-165.6	57.7	-175.8	0	0	0	0	0	114.4
531	S	31.6	Very low	45.6	Very low	107 Å²	107	103.2 Å²	103.2	75%	0.748	62%	0.619	S	S	*	*			trans	69.5	138	179.9	-166.5	0	0	0	0	117.1	V533	S531-V533 VanDerWaalsContact C-N 3.34Å; S531-V533 PolarHBondContact O-N 3.2Å; S531-V533 VanDerWaalsContact O-N 3.09Å
532	A	32.7	Very low	48.6	Very low	107 Å²	107	97.7 Å²	97.7	88%	0.884	58%	0.582	S	S	*	*	S	Bend	trans	-83.4	73.5	174.5	0	0	0	0	0	111.4
533	V	35.6	Very low	51.2	Low	116 Å²	116	100 Å²	100	70%	0.703	58%	0.578	S	S	*	*	S	Bend	trans	-120.6	118.5	159.9	-177.4	0	0	0	0	106.6	S531 D535	S531-V533 VanDerWaalsContact C-N 3.34Å; S531-V533 PolarHBondContact O-N 3.2Å; S531-V533 VanDerWaalsContact O-N 3.09Å; V533-D535 PolarHBondContact O-N 3.07Å
534	S	37.9	Very low	53.7	Low	100 Å²	100	96.3 Å²	96.3	70%	0.699	55%	0.552	S	S	*	*			trans	-54.5	127.8	-169.8	-53.6	0	0	0	0	112.4	T536	S534-T536 PolarHBondContact O-N 3.09Å; S534-T536 PolarHBondContact O-OG1 2.93Å; S534-T536 VanDerWaalsContact O-OG1 3.1Å
535	D	51.5	Low	55.7	Low	62 Å²	62	94.1 Å²	94.1	33%	0.332	55%	0.546	S	S	.	.			trans	-68.6	79.5	178.4	-139.1	60.8	0	0	0	109.6	V533 I537 R621 R627	V533-D535 PolarHBondContact O-N 3.07Å; D535-I537 VanDerWaalsContact C-N 3.32Å; D535-I537 PolarHBondContact O-N 3.03Å; D535-R621 IonicContact OD1-NE 3.52Å; D535-R621 IonicContact OD2-CZ 2.67Å; D535-R621 VanDerWaalsContact OD2-CZ 3.3Å; D535-R621 IonicContact OD2-NE 3.85Å; D535-R621 PolarHBondContact OD2-NE 3.12Å; D535-R621 IonicContact OD2-NH2 3.7Å; D535-R621 PolarHBondContact OD2-NH2 3.41Å; D535-R627 IonicContact OD1-CZ 2.7Å; D535-R627 IonicContact OD1-NH1 3.77Å; D535-R627 PolarHBondContact OD1-NH1 2.8Å; D535-R627 IonicContact OD1-NH2 3.73Å; D535-R627 PolarHBondContact OD1-NH2 3.37Å
536	T	61.8	Low	57.5	Low	97 Å²	97	88.6 Å²	88.6	60%	0.595	53%	0.528	S	S	*	.			trans	-80.5	80.3	-167.9	27.3	0	0	0	0	110	S534 S538	S534-T536 PolarHBondContact O-N 3.09Å; S534-T536 PolarHBondContact O-OG1 2.93Å; S534-T536 VanDerWaalsContact O-OG1 3.1Å; T536-S538 PolarHBondContact O-N 3.4Å
537	I	81.8	Confident	59.1	Low	87 Å²	87	88 Å²	88	45%	0.446	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	105.3	169.7	-59.8	177.1	0	0	0	108.1	D535 L590 D619 V620	D535-I537 VanDerWaalsContact C-N 3.32Å; D535-I537 PolarHBondContact O-N 3.03Å; I537-L590 HydrophobicContact CD1-CD1 3.84Å; I537-L590 HydrophobicContact CG1-CD1 3.9Å; I537-L590 HydrophobicContact CG2-CD1 4.18Å; I537-D619 HydrophobicContact CG2-CB 3.83Å; I537-V620 CarbonylContact C-O 3.59Å; I537-V620 WeakPolarHBondContact CA-O 3.32Å
538	S	85.5	Confident	61.4	Low	42 Å²	42	82.1 Å²	82.1	29%	0.294	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.8	179.8	-165	0	0	0	0	109.5	T536 V620	T536-S538 PolarHBondContact O-N 3.4Å; S538-V620 PolarHBondContact N-O 2.99Å; S538-V620 WeakPolarHBondContact O-CB 3.35Å; S538-V620 PolarHBondContact O-N 3.09Å
539	K	89.3	Confident	64.1	Low	148 Å²	148	78 Å²	78	64%	0.643	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	110.6	174.9	-63.5	-168.2	-178.3	-91.1	0	109.7	F618 D619	K539-F618 WeakPolarHBondContact CA-O 3.31Å; K539-D619 WeakPolarHBondContact CG-OD1 3.3Å; K539-D619 IonicContact NZ-OD1 2.67Å; K539-D619 PolarHBondContact NZ-OD1 2.98Å; K539-D619 IonicContact NZ-OD2 2.79Å
540	V	90.9	Very high	66.9	Low	0 Å²	0	68.7 Å²	68.7	0%	0	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	108.1	-177.3	-173.5	0	0	0	0	109.6	L542 R582 L583 F618 V620	V540-L542 HydrophobicContact CG1-CD2 3.91Å; V540-L542 HydrophobicContact CG1-CG 4.02Å; V540-R582 HydrophobicContact CG1-CB 4.25Å; V540-R582 HydrophobicContact CG2-CB 4.19Å; V540-L583 HydrophobicContact CB-CD2 4.3Å; V540-L583 HydrophobicContact CG1-CD2 4.31Å; V540-L583 HydrophobicContact CG1-CG 4.15Å; V540-L583 HydrophobicContact CG2-CD2 4.04Å; V540-F618 PolarHBondContact N-O 3.36Å; V540-F618 PolarHBondContact O-N 3.35Å; V540-V620 HydrophobicContact CB-CG2 4.24Å; V540-V620 HydrophobicContact CG2-CG2 3.94Å
541	T	88.7	Confident	69.9	Low	46 Å²	46	66.9 Å²	66.9	28%	0.282	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	119.9	172.8	-52.3	0	0	0	0	110	R582 E615 V616 H617	T541-R582 PolarHBondContact O-NH2 3.27Å; T541-R582 VanDerWaalsContact O-NH2 3.17Å; T541-E615 HydrophobicContact CG2-CG 3.4Å; T541-E615 VanDerWaalsContact CG2-CG 3.4Å; T541-V616 CarbonylContact C-O 3.47Å; T541-V616 WeakPolarHBondContact CA-O 3.38Å; T541-H617 PolarHBondContact OG1-CD2 3.05Å
542	L	87.6	Confident	72.6	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.021	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	146	177.9	-61.5	-177.8	0	0	0	111.5	V540 I549 A577 D580 L583 E615 V616 F618	V540-L542 HydrophobicContact CG1-CD2 3.91Å; V540-L542 HydrophobicContact CG1-CG 4.02Å; L542-I549 HydrophobicContact CB-CG2 4.3Å; L542-I549 HydrophobicContact CD1-CG2 3.52Å; L542-A577 HydrophobicContact CD1-CB 3.88Å; L542-D580 HydrophobicContact CD2-CB 3.36Å; L542-L583 HydrophobicContact CD1-CD1 3.71Å; L542-E615 CarbonylContact O-C 3.55Å; L542-E615 WeakPolarHBondContact O-CA 3.02Å; L542-V616 PolarHBondContact N-O 3.39Å; L542-V616 PolarHBondContact O-N 2.65Å; L542-F618 HydrophobicContact CD1-CE2 4.24Å
543	R	83.2	Confident	75.4	Confident	171 Å²	171	59.9 Å²	59.9	65%	0.645	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	131.9	178.3	-61.2	179.4	73.4	-161.2	3.9	111.1	N545 P576 N614 E615	R543-N545 PolarHBondContact O-N 3.25Å; R543-P576 VanDerWaalsContact O-CB 3.22Å; R543-P576 WeakPolarHBondContact O-CB 3.34Å; R543-P576 WeakPolarHBondContact O-CG 3.43Å; R543-N614 CarbonylContact C-O 3.55Å; R543-N614 VanDerWaalsContact CA-O 3.3Å; R543-N614 WeakPolarHBondContact CA-O 3.46Å; R543-E615 HydrophobicContact CG-CG 4.23Å
544	K	79.5	Confident	78	Confident	32 Å²	32	55.2 Å²	55.2	14%	0.139	32%	0.32	C	S	.	.			trans	-81.1	104.3	-175.2	-66.6	-173.4	-173.7	176.1	0	112.1	G546 I549 M609 T610 S612 G613 N614 V616	K544-G546 VanDerWaalsContact C-N 3.27Å; K544-G546 PolarHBondContact O-N 2.67Å; K544-I549 HydrophobicContact CD-CG1 4.49Å; K544-I549 HydrophobicContact CG-CG1 4.02Å; K544-M609 VanDerWaalsContact CE-O 3.25Å; K544-M609 WeakPolarHBondContact CE-O 3.5Å; K544-M609 PolarHBondContact NZ-O 3.38Å; K544-T610 PolarHBondContact NZ-O 2.96Å; K544-S612 PolarHBondContact NZ-O 3.33Å; K544-G613 VanDerWaalsContact CD-O 3.28Å; K544-G613 WeakPolarHBondContact CD-O 3.35Å; K544-G613 VanDerWaalsContact CE-O 3.26Å; K544-G613 WeakPolarHBondContact CE-O 3.31Å; K544-N614 PolarHBondContact N-O 3.01Å; K544-V616 HydrophobicContact CD-CG2 4.3Å; K544-V616 VanDerWaalsContact CE-CG2 3.42Å; K544-V616 HydrophobicContact CG-CG2 4.07Å
545	N	67.2	Low	80.4	Confident	126 Å²	126	51.3 Å²	51.3	67%	0.674	29%	0.294	S	S	*	.			trans	-85.6	62	177.6	-68.4	-5.7	0	0	0	112.2	R543 G547 P576	R543-N545 PolarHBondContact O-N 3.25Å; N545-G547 PolarHBondContact O-N 3.29Å; N545-P576 HydrophobicContact CB-CG 3.9Å
546	G	62.9	Low	82	Confident	23 Å²	23	48.8 Å²	48.8	24%	0.237	28%	0.282	C	S	.	.	S	Bend	trans	71.4	-29.1	172.5	0	0	0	0	0	116.9	K544 T788	K544-G546 VanDerWaalsContact C-N 3.27Å; K544-G546 PolarHBondContact O-N 2.67Å; G546-T788 PolarHBondContact O-N 3.39Å
547	G	63.9	Low	83.2	Confident	43 Å²	43	49.3 Å²	49.3	44%	0.443	28%	0.278	S	S	.	.	S	Bend	trans	-108	28.3	-178.1	0	0	0	0	0	115.8	N545	N545-G547 PolarHBondContact O-N 3.29Å
548	G	76.3	Confident	82.7	Confident	33 Å²	33	45.5 Å²	45.5	34%	0.34	26%	0.259	S	S	.	.			trans	83.1	-155.6	-175.3	0	0	0	0	0	113.1
549	I	85	Confident	81.4	Confident	15 Å²	15	49.8 Å²	49.8	8%	0.077	28%	0.283	C	S	.	.			trans	-99.1	-31.7	-173.3	-53.7	174.8	0	0	0	111.3	L542 K544 L551 A577 M609 V616 F618	L542-I549 HydrophobicContact CB-CG2 4.3Å; L542-I549 HydrophobicContact CD1-CG2 3.52Å; K544-I549 HydrophobicContact CD-CG1 4.49Å; K544-I549 HydrophobicContact CG-CG1 4.02Å; I549-L551 HydrophobicContact CG2-CD1 3.96Å; I549-L551 HydrophobicContact CG2-CG 4.12Å; I549-A577 HydrophobicContact CG2-CB 4.49Å; I549-A577 VanDerWaalsContact O-CB 3.32Å; I549-A577 WeakPolarHBondContact O-CB 3.36Å; I549-A577 PolarHBondContact O-N 3.19Å; I549-A577 VanDerWaalsContact O-N 3.11Å; I549-M609 HydrophobicContact CD1-CB 4.16Å; I549-V616 HydrophobicContact CD1-CB 4.18Å; I549-V616 HydrophobicContact CD1-CG1 3.99Å; I549-V616 HydrophobicContact CD1-CG2 3.88Å; I549-V616 HydrophobicContact CG1-CG2 4.36Å; I549-F618 HydrophobicContact CD1-CE2 4.15Å; I549-F618 HydrophobicContact CD1-CZ 3.76Å; I549-F618 HydrophobicContact CG2-CE2 4.25Å
550	G	86.2	Confident	79.7	Confident	14 Å²	14	46.4 Å²	46.4	14%	0.144	29%	0.291	C	S	.	.			trans	94.3	22.1	-178.8	0	0	0	0	0	115.8	V572 T575	G550-V572 WeakPolarHBondContact O-CB 3.29Å; G550-V572 PolarHBondContact O-N 3.07Å; G550-T575 WeakPolarHBondContact CA-OG1 3.48Å
551	L	88.7	Confident	78.6	Confident	31 Å²	31	48.1 Å²	48.1	16%	0.162	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126.2	177.7	-61.9	172.5	0	0	0	110.6	I549 I553 V568 V571 A577 L583 L589 F618	I549-L551 HydrophobicContact CG2-CD1 3.96Å; I549-L551 HydrophobicContact CG2-CG 4.12Å; L551-I553 HydrophobicContact CB-CG2 4.21Å; L551-V568 HydrophobicContact CD2-CG1 4.09Å; L551-V568 HydrophobicContact CD2-CG2 4.47Å; L551-V571 HydrophobicContact CD2-CG1 4.39Å; L551-V571 HydrophobicContact CD2-CG2 3.96Å; L551-A577 HydrophobicContact CD2-CB 3.69Å; L551-A577 HydrophobicContact CG-CB 4.01Å; L551-L583 HydrophobicContact CD1-CD1 3.63Å; L551-L583 HydrophobicContact CD2-CB 4.38Å; L551-L583 HydrophobicContact CD2-CD1 3.73Å; L551-L583 HydrophobicContact CG-CD1 4.23Å; L551-L589 HydrophobicContact CD1-CD1 4.31Å; L551-F618 HydrophobicContact CD1-CE2 4.34Å; L551-F618 HydrophobicContact CD1-CZ 4.23Å
552	S	88.9	Confident	77.3	Confident	52 Å²	52	54.4 Å²	54.4	36%	0.364	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	115.8	157	-179.4	0	0	0	0	107.6	K569 K570	S552-K569 PolarHBondContact O-N 2.9Å; S552-K570 WeakPolarHBondContact CB-O 3.31Å; S552-K570 PolarHBondContact N-O 3.27Å; S552-K570 PolarHBondContact O-N 3.27Å
553	I	91.6	Very high	76.8	Confident	16 Å²	16	59.6 Å²	59.6	8%	0.082	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	156.9	177.4	60.8	167	0	0	0	110.9	L551 I566 Y567 L589 Q602 A605 A606 M609	L551-I553 HydrophobicContact CB-CG2 4.21Å; I553-I566 HydrophobicContact CB-CG2 3.96Å; I553-I566 HydrophobicContact CD1-CG2 3.93Å; I553-I566 HydrophobicContact CG2-CG2 4.17Å; I553-Y567 CarbonylContact C-O 3.58Å; I553-Y567 VanDerWaalsContact CA-O 3.3Å; I553-Y567 WeakPolarHBondContact CA-O 3.21Å; I553-L589 HydrophobicContact CG2-CD1 3.97Å; I553-Q602 HydrophobicContact CD1-CG 4.46Å; I553-Q602 HydrophobicContact CG1-CG 4.35Å; I553-Q602 PolarHBondContact O-NE2 3.27Å; I553-A605 HydrophobicContact CD1-CB 3.83Å; I553-A606 HydrophobicContact CD1-CB 4.47Å; I553-M609 HydrophobicContact CD1-CE 3.9Å; I553-M609 HydrophobicContact CD1-SD 4.07Å; I553-M609 HydrophobicContact CG2-CE 4.36Å; I553-M609 HydrophobicContact CG2-SD 4.39Å
554	V	88.9	Confident	76.6	Confident	17 Å²	17	55 Å²	55	10%	0.103	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	142.6	168.9	-70.9	0	0	0	0	110.6	Y567 K569 W633 L634	V554-Y567 PolarHBondContact N-O 3.48Å; V554-Y567 PolarHBondContact O-N 3.36Å; V554-K569 HydrophobicContact CG1-CB 4.03Å; V554-K569 HydrophobicContact CG1-CD 3.83Å; V554-K569 HydrophobicContact CG2-CB 4.08Å; V554-W633 HydrophobicContact CB-CH2 4.06Å; V554-W633 HydrophobicContact CB-CZ3 4.13Å; V554-W633 HydrophobicContact CG1-CH2 4.41Å; V554-W633 HydrophobicContact CG2-CH2 4.06Å; V554-W633 HydrophobicContact CG2-CZ3 3.6Å; V554-L634 HydrophobicContact CG2-CD2 3.6Å
555	A	89.7	Confident	77.1	Confident	19 Å²	19	53.5 Å²	53.5	16%	0.157	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	129.7	164.5	0	0	0	0	0	109.1	M564 G565 I566 Q602	A555-M564 VanDerWaalsContact C-CE 3.5Å; A555-M564 HydrophobicContact CB-CE 3.75Å; A555-G565 WeakPolarHBondContact CA-O 3.36Å; A555-I566 HydrophobicContact CB-CD1 3.87Å; A555-Q602 HydrophobicContact CB-CB 3.85Å
556	A	84.3	Confident	78.4	Confident	8 Å²	8	47.5 Å²	47.5	7%	0.066	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	153.4	176.8	0	0	0	0	0	111	G565 Y567 L630 W633	A556-G565 PolarHBondContact N-O 2.95Å; A556-G565 PolarHBondContact O-N 2.78Å; A556-Y567 HydrophobicContact CB-CD2 4.03Å; A556-Y567 HydrophobicContact CB-CE2 4.28Å; A556-Y567 WeakPolarHBondContact O-CE2 3.31Å; A556-L630 HydrophobicContact CB-CD1 3.77Å; A556-L630 HydrophobicContact CB-CD2 4.12Å; A556-W633 HydrophobicContact CB-CE3 4.36Å; A556-W633 HydrophobicContact CB-CH2 4.16Å; A556-W633 HydrophobicContact CB-CZ3 3.69Å
557	Q	86.5	Confident	79.9	Confident	109 Å²	109	46.4 Å²	46.4	51%	0.509	28%	0.28	S	S	.	.			trans	-105	122.9	171.4	-170	170	-0.5	0	0	108.5	D561 M564	Q557-D561 HydrophobicContact CG-CB 4.07Å; Q557-D561 WeakPolarHBondContact CG-O 3.48Å; Q557-D561 PolarHBondContact NE2-O 3.26Å; Q557-M564 HydrophobicContact CB-SD 3.76Å
558	G	72.3	Confident	81.3	Confident	6 Å²	6	44.3 Å²	44.3	6%	0.062	26%	0.258	C	S	.	.			trans	-72.1	161.9	173.6	0	0	0	0	0	113.2	G560 D561 N628	G558-G560 PolarHBondContact O-N 3.09Å; G558-D561 VanDerWaalsContact CA-OD2 3.25Å; G558-D561 WeakPolarHBondContact CA-OD2 3.49Å; G558-D561 PolarHBondContact N-OD2 3.08Å; G558-D561 PolarHBondContact O-N 2.87Å; G558-N628 CarbonylContact C-O 3.59Å; G558-N628 WeakPolarHBondContact CA-O 3.38Å
559	V	57.6	Low	81.9	Confident	132 Å²	132	45.8 Å²	45.8	80%	0.8	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	106.6	169.6	-177	0	0	0	0	108.1	N628	V559-N628 PolarHBondContact N-O 3.5Å
560	G	54.5	Low	82.1	Confident	77 Å²	77	49.6 Å²	49.6	79%	0.794	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.9	-9.5	-174.5	0	0	0	0	0	115.6	G558 R562	G558-G560 PolarHBondContact O-N 3.09Å; G560-R562 PolarHBondContact O-N 2.67Å
561	D	66.8	Low	82.2	Confident	37 Å²	37	50 Å²	50	20%	0.198	27%	0.271	C	S	.	.			trans	-70.6	129.3	170.2	-79.2	-34	0	0	0	109.6	Q557 G558 Q563 Y567 N628	Q557-D561 HydrophobicContact CG-CB 4.07Å; Q557-D561 WeakPolarHBondContact CG-O 3.48Å; Q557-D561 PolarHBondContact NE2-O 3.26Å; G558-D561 VanDerWaalsContact CA-OD2 3.25Å; G558-D561 WeakPolarHBondContact CA-OD2 3.49Å; G558-D561 PolarHBondContact N-OD2 3.08Å; G558-D561 PolarHBondContact O-N 2.87Å; D561-Q563 VanDerWaalsContact C-N 3.33Å; D561-Y567 PolarHBondContact OD2-OH 2.84Å; D561-N628 PolarHBondContact OD1-ND2 3.33Å; D561-N628 PolarHBondContact OD2-ND2 3.46Å
562	R	61.9	Low	82.2	Confident	178 Å²	178	51.7 Å²	51.7	67%	0.672	28%	0.283	S	S	*	.	S	Bend	trans	-81.3	-9	173	-73	-169	-178.7	140.6	2.5	114.7	F525 G560	F525-R562 VanDerWaalsContact O-CZ 3.26Å; F525-R562 PolarHBondContact O-NH1 3.46Å; F525-R562 PolarHBondContact O-NH2 3.15Å; G560-R562 PolarHBondContact O-N 2.67Å
563	Q	75.9	Confident	81.9	Confident	113 Å²	113	56.3 Å²	56.3	53%	0.528	30%	0.298	S	S	.	.	S	Bend	trans	-143.5	150.2	-174.3	-69.8	-174.8	-14.5	0	0	110.1	D561 G565 I598	D561-Q563 VanDerWaalsContact C-N 3.33Å; Q563-G565 PolarHBondContact O-N 3.01Å; Q563-I598 HydrophobicContact CB-CG2 4.13Å
564	M	80.2	Confident	81.2	Confident	73 Å²	73	58.4 Å²	58.4	36%	0.36	32%	0.324	S	S	.	.			trans	-59.5	126.4	174.1	-66	-68	-74	0	0	110.4	A555 Q557 G599	A555-M564 VanDerWaalsContact C-CE 3.5Å; A555-M564 HydrophobicContact CB-CE 3.75Å; Q557-M564 HydrophobicContact CB-SD 3.76Å; M564-G599 WeakPolarHBondContact O-CA 3.49Å; M564-G599 PolarHBondContact O-N 3.38Å
565	G	90.1	Very high	81.1	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	150.6	172	0	0	0	0	0	111.8	A555 A556 Q563 Y567	A555-G565 WeakPolarHBondContact CA-O 3.36Å; A556-G565 PolarHBondContact N-O 2.95Å; A556-G565 PolarHBondContact O-N 2.78Å; Q563-G565 PolarHBondContact O-N 3.01Å; G565-Y567 VanDerWaalsContact O-CD2 3.28Å; G565-Y567 WeakPolarHBondContact O-CD2 3.43Å
566	I	94.3	Very high	80.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	113.7	173.2	-58.5	-62.3	0	0	0	109.3	I553 A555 Q588 L589 L597 I600 A605 M609	I553-I566 HydrophobicContact CB-CG2 3.96Å; I553-I566 HydrophobicContact CD1-CG2 3.93Å; I553-I566 HydrophobicContact CG2-CG2 4.17Å; A555-I566 HydrophobicContact CB-CD1 3.87Å; I566-Q588 WeakPolarHBondContact O-CA 3.43Å; I566-L589 HydrophobicContact CG2-CB 4.48Å; I566-L589 HydrophobicContact CG2-CD1 4.34Å; I566-L589 PolarHBondContact O-N 2.92Å; I566-L597 HydrophobicContact CB-CB 4.35Å; I566-L597 HydrophobicContact CG1-CB 4.11Å; I566-L597 WeakPolarHBondContact CG1-O 3.34Å; I566-I600 HydrophobicContact CG1-CG1 4.49Å; I566-A605 HydrophobicContact CD1-CB 3.52Å; I566-A605 HydrophobicContact CG1-CB 3.65Å; I566-A605 HydrophobicContact CG2-CB 4.16Å; I566-M609 HydrophobicContact CG2-CE 4.07Å
567	Y	93.6	Very high	81	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	144.6	-176.6	-65.1	-91.1	0	0	0	111.7	I553 V554 A556 D561 G565 K569 D587 Q588 A624 A625 N628 L630	I553-Y567 CarbonylContact C-O 3.58Å; I553-Y567 VanDerWaalsContact CA-O 3.3Å; I553-Y567 WeakPolarHBondContact CA-O 3.21Å; V554-Y567 PolarHBondContact N-O 3.48Å; V554-Y567 PolarHBondContact O-N 3.36Å; A556-Y567 HydrophobicContact CB-CD2 4.03Å; A556-Y567 HydrophobicContact CB-CE2 4.28Å; A556-Y567 WeakPolarHBondContact O-CE2 3.31Å; D561-Y567 PolarHBondContact OD2-OH 2.84Å; G565-Y567 VanDerWaalsContact O-CD2 3.28Å; G565-Y567 WeakPolarHBondContact O-CD2 3.43Å; Y567-K569 PolarHBondContact O-N 2.93Å; Y567-D587 CarbonylContact C-O 3.57Å; Y567-D587 WeakPolarHBondContact CA-O 3.32Å; Y567-Q588 HydrophobicContact CD1-CB 3.84Å; Y567-Q588 HydrophobicContact CD1-CG 4.41Å; Y567-Q588 HydrophobicContact CE1-CB 3.72Å; Y567-Q588 HydrophobicContact CE1-CG 4.1Å; Y567-Q588 PolarHBondContact OH-NE2 2.84Å; Y567-A624 HydrophobicContact CE1-CB 3.92Å; Y567-A625 HydrophobicContact CD1-CB 3.99Å; Y567-A625 HydrophobicContact CE1-CB 4.29Å; Y567-N628 PolarHBondContact OH-ND2 3.5Å; Y567-L630 HydrophobicContact CD2-CD1 3.95Å; Y567-L630 HydrophobicContact CE1-CD1 4.11Å; Y567-L630 HydrophobicContact CE2-CD1 3.48Å; Y567-L630 VanDerWaalsContact CE2-CD1 3.48Å; Y567-L630 HydrophobicContact CG-CD1 4.45Å
568	V	93.4	Very high	81	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	112.9	173.1	-179.6	0	0	0	0	109.3	L551 V571 T585 G586 D587 L589	L551-V568 HydrophobicContact CD2-CG1 4.09Å; L551-V568 HydrophobicContact CD2-CG2 4.47Å; V568-V571 HydrophobicContact CG1-CG2 3.86Å; V568-T585 WeakPolarHBondContact O-CA 3.4Å; V568-G586 PolarHBondContact O-N 3.44Å; V568-D587 HydrophobicContact CG2-CB 4.28Å; V568-D587 PolarHBondContact N-O 3.36Å; V568-L589 HydrophobicContact CG2-CD1 4.23Å; V568-L589 HydrophobicContact CG2-CD2 4.06Å; V568-L589 HydrophobicContact CG2-CG 4.08Å
569	K	89.4	Confident	81.6	Confident	64 Å²	64	62.1 Å²	62.1	28%	0.278	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-41.2	175.3	179.5	159.2	-176.9	155.3	0	113	S552 V554 Y567 T585 L634 S636	S552-K569 PolarHBondContact O-N 2.9Å; V554-K569 HydrophobicContact CG1-CB 4.03Å; V554-K569 HydrophobicContact CG1-CD 3.83Å; V554-K569 HydrophobicContact CG2-CB 4.08Å; Y567-K569 PolarHBondContact O-N 2.93Å; K569-T585 WeakPolarHBondContact O-CG2 3.23Å; K569-T585 PolarHBondContact O-OG1 3.48Å; K569-L634 HydrophobicContact CB-CD2 3.75Å; K569-L634 HydrophobicContact CG-CD2 4.1Å; K569-S636 PolarHBondContact NZ-OG 3.45Å
570	K	88.8	Confident	83	Confident	94 Å²	94	58.3 Å²	58.3	41%	0.409	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	136.9	172.2	177	162.9	-178.6	170	0	110.4	S552 E573	S552-K570 WeakPolarHBondContact CB-O 3.31Å; S552-K570 PolarHBondContact N-O 3.27Å; S552-K570 PolarHBondContact O-N 3.27Å; K570-E573 IonicContact NZ-OE1 3.36Å; K570-E573 PolarHBondContact NZ-OE1 3.15Å
571	V	89.9	Confident	84.4	Confident	24 Å²	24	57 Å²	57	15%	0.145	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	129.5	161	-171	0	0	0	0	108.1	L551 V568 A577 A578 L583	L551-V571 HydrophobicContact CD2-CG1 4.39Å; L551-V571 HydrophobicContact CD2-CG2 3.96Å; V568-V571 HydrophobicContact CG1-CG2 3.86Å; V571-A577 HydrophobicContact CG1-CB 3.73Å; V571-A578 HydrophobicContact CG1-CB 3.98Å; V571-L583 HydrophobicContact CG2-CB 4.33Å
572	V	87.6	Confident	85.5	Confident	66 Å²	66	60.2 Å²	60.2	40%	0.4	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-86.8	123.4	-175.6	-178.2	0	0	0	0	109.4	G550 T575 A578	G550-V572 WeakPolarHBondContact O-CB 3.29Å; G550-V572 PolarHBondContact O-N 3.07Å; V572-T575 HydrophobicContact CB-CG2 3.75Å; V572-T575 HydrophobicContact CG1-CG2 3.76Å; V572-T575 WeakPolarHBondContact O-CB 3.22Å; V572-T575 WeakPolarHBondContact O-CG2 3.19Å; V572-T575 PolarHBondContact O-N 3.48Å; V572-T575 PolarHBondContact O-OG1 2.98Å; V572-A578 VanDerWaalsContact O-CB 3.23Å; V572-A578 WeakPolarHBondContact O-CB 3.5Å
573	E	82.9	Confident	86.8	Confident	148 Å²	148	52.1 Å²	52.1	69%	0.692	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	145.9	179.7	-67	144.9	-116.1	0	0	111.9	K570 T575	K570-E573 IonicContact NZ-OE1 3.36Å; K570-E573 PolarHBondContact NZ-OE1 3.15Å; E573-T575 VanDerWaalsContact C-N 3.26Å; E573-T575 PolarHBondContact O-N 3.28Å
574	G	77.3	Confident	87.5	Confident	61 Å²	61	50.8 Å²	50.8	63%	0.629	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	8.8	-177.3	0	0	0	0	0	115.8
575	T	86.5	Confident	87.9	Confident	27 Å²	27	50.8 Å²	50.8	17%	0.166	28%	0.283	C	S	.	.	S	Bend	trans	-104.8	165.8	177.7	70.3	0	0	0	0	112.5	G550 V572 E573 A577 A578 H579	G550-T575 WeakPolarHBondContact CA-OG1 3.48Å; V572-T575 HydrophobicContact CB-CG2 3.75Å; V572-T575 HydrophobicContact CG1-CG2 3.76Å; V572-T575 WeakPolarHBondContact O-CB 3.22Å; V572-T575 WeakPolarHBondContact O-CG2 3.19Å; V572-T575 PolarHBondContact O-N 3.48Å; V572-T575 PolarHBondContact O-OG1 2.98Å; E573-T575 VanDerWaalsContact C-N 3.26Å; E573-T575 PolarHBondContact O-N 3.28Å; T575-A577 VanDerWaalsContact C-N 3.27Å; T575-A577 PolarHBondContact O-N 3.34Å; T575-A578 PolarHBondContact O-N 2.96Å; T575-H579 PolarHBondContact O-CD2 3.39Å; T575-H579 PolarHBondContact O-N 3.44Å
576	P	84.9	Confident	87.8	Confident	24 Å²	24	51 Å²	51	16%	0.156	29%	0.286	C	S	.	.	H	α-helix	trans	-54.3	-38.1	178.4	-28.6	37	0	0	0	114.4	R543 N545 H579 D580	R543-P576 VanDerWaalsContact O-CB 3.22Å; R543-P576 WeakPolarHBondContact O-CB 3.34Å; R543-P576 WeakPolarHBondContact O-CG 3.43Å; N545-P576 HydrophobicContact CB-CG 3.9Å; P576-H579 PolarHBondContact O-N 2.74Å; P576-D580 VanDerWaalsContact O-CB 3.28Å; P576-D580 WeakPolarHBondContact O-CB 3.32Å; P576-D580 PolarHBondContact O-N 3.13Å
577	A	87.6	Confident	87.8	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-66.2	-36.5	175.8	0	0	0	0	0	113.2	L542 I549 L551 V571 T575 G581	L542-A577 HydrophobicContact CD1-CB 3.88Å; I549-A577 HydrophobicContact CG2-CB 4.49Å; I549-A577 VanDerWaalsContact O-CB 3.32Å; I549-A577 WeakPolarHBondContact O-CB 3.36Å; I549-A577 PolarHBondContact O-N 3.19Å; I549-A577 VanDerWaalsContact O-N 3.11Å; L551-A577 HydrophobicContact CD2-CB 3.69Å; L551-A577 HydrophobicContact CG-CB 4.01Å; V571-A577 HydrophobicContact CG1-CB 3.73Å; T575-A577 VanDerWaalsContact C-N 3.27Å; T575-A577 PolarHBondContact O-N 3.34Å; A577-G581 PolarHBondContact O-N 2.81Å
578	A	86.4	Confident	87.8	Confident	37 Å²	37	51.4 Å²	51.4	31%	0.306	29%	0.287	S	S	.	.	H	α-helix	trans	-73.6	-37.1	175.5	0	0	0	0	0	112.6	V571 V572 T575 G581	V571-A578 HydrophobicContact CG1-CB 3.98Å; V572-A578 VanDerWaalsContact O-CB 3.23Å; V572-A578 WeakPolarHBondContact O-CB 3.5Å; T575-A578 PolarHBondContact O-N 2.96Å; A578-G581 PolarHBondContact O-N 3.42Å
579	H	84.7	Confident	87.8	Confident	148 Å²	148	51.4 Å²	51.4	69%	0.685	29%	0.287	S	S	*	.	H	α-helix	trans	-72.1	-31.8	177.5	-74.5	-61.9	0	0	0	113.4	T575 P576	T575-H579 PolarHBondContact O-CD2 3.39Å; T575-H579 PolarHBondContact O-N 3.44Å; P576-H579 PolarHBondContact O-N 2.74Å
580	D	85.8	Confident	87.9	Confident	53 Å²	53	49.2 Å²	49.2	28%	0.283	28%	0.279	S	S	.	.	H	α-helix	trans	-71.9	-32.4	172.3	-177.3	-92	0	0	0	112	L542 P576 R582	L542-D580 HydrophobicContact CD2-CB 3.36Å; P576-D580 VanDerWaalsContact O-CB 3.28Å; P576-D580 WeakPolarHBondContact O-CB 3.32Å; P576-D580 PolarHBondContact O-N 3.13Å; D580-R582 PolarHBondContact O-N 3.48Å; D580-R582 VanDerWaalsContact OD1-CB 3.23Å; D580-R582 WeakPolarHBondContact OD1-CB 3.33Å; D580-R582 WeakPolarHBondContact OD1-CG 3.22Å; D580-R582 IonicContact OD1-CZ 3.31Å; D580-R582 PolarHBondContact OD1-N 3.03Å; D580-R582 IonicContact OD1-NE 3.85Å; D580-R582 PolarHBondContact OD1-NE 3.04Å; D580-R582 IonicContact OD1-NH2 2.66Å; D580-R582 PolarHBondContact OD1-NH2 3.21Å; D580-R582 IonicContact OD2-CZ 3.84Å; D580-R582 IonicContact OD2-NE 2.67Å; D580-R582 PolarHBondContact OD2-NE 2.76Å; D580-R582 IonicContact OD2-NH2 2.42Å; D580-R582 PolarHBondContact OD2-NH2 3.28Å
581	G	84.8	Confident	88.1	Confident	48 Å²	48	45.2 Å²	45.2	50%	0.495	26%	0.263	S	S	.	.			trans	69.5	-10.5	173	0	0	0	0	0	115.6	A577 A578 L583	A577-G581 PolarHBondContact O-N 2.81Å; A578-G581 PolarHBondContact O-N 3.42Å; G581-L583 VanDerWaalsContact C-N 3.28Å; G581-L583 PolarHBondContact O-N 3.31Å
582	R	88.5	Confident	88.3	Confident	105 Å²	105	44.1 Å²	44.1	40%	0.396	26%	0.256	S	S	.	.			trans	-81.5	2.9	-178	-57.3	176.8	-69.4	166	-6.4	114.3	V540 T541 D580 K622	V540-R582 HydrophobicContact CG1-CB 4.25Å; V540-R582 HydrophobicContact CG2-CB 4.19Å; T541-R582 PolarHBondContact O-NH2 3.27Å; T541-R582 VanDerWaalsContact O-NH2 3.17Å; D580-R582 PolarHBondContact O-N 3.48Å; D580-R582 VanDerWaalsContact OD1-CB 3.23Å; D580-R582 WeakPolarHBondContact OD1-CB 3.33Å; D580-R582 WeakPolarHBondContact OD1-CG 3.22Å; D580-R582 IonicContact OD1-CZ 3.31Å; D580-R582 PolarHBondContact OD1-N 3.03Å; D580-R582 IonicContact OD1-NE 3.85Å; D580-R582 PolarHBondContact OD1-NE 3.04Å; D580-R582 IonicContact OD1-NH2 2.66Å; D580-R582 PolarHBondContact OD1-NH2 3.21Å; D580-R582 IonicContact OD2-CZ 3.84Å; D580-R582 IonicContact OD2-NE 2.67Å; D580-R582 PolarHBondContact OD2-NE 2.76Å; D580-R582 IonicContact OD2-NH2 2.42Å; D580-R582 PolarHBondContact OD2-NH2 3.28Å; R582-K622 WeakPolarHBondContact O-CE 3.12Å; R582-K622 PolarHBondContact O-NZ 2.97Å
583	L	90.1	Very high	88.3	Confident	8 Å²	8	43.6 Å²	43.6	4%	0.042	25%	0.251	C	S	.	.			trans	-113.8	135.9	171.5	-66.3	-179.4	0	0	0	110.4	V540 L542 L551 V571 G581 L589 V620	V540-L583 HydrophobicContact CB-CD2 4.3Å; V540-L583 HydrophobicContact CG1-CD2 4.31Å; V540-L583 HydrophobicContact CG1-CG 4.15Å; V540-L583 HydrophobicContact CG2-CD2 4.04Å; L542-L583 HydrophobicContact CD1-CD1 3.71Å; L551-L583 HydrophobicContact CD1-CD1 3.63Å; L551-L583 HydrophobicContact CD2-CB 4.38Å; L551-L583 HydrophobicContact CD2-CD1 3.73Å; L551-L583 HydrophobicContact CG-CD1 4.23Å; V571-L583 HydrophobicContact CG2-CB 4.33Å; G581-L583 VanDerWaalsContact C-N 3.28Å; G581-L583 PolarHBondContact O-N 3.31Å; L583-L589 HydrophobicContact CD2-CD2 4.39Å; L583-V620 HydrophobicContact CD2-CB 4.47Å; L583-V620 HydrophobicContact CD2-CG1 3.96Å; L583-V620 HydrophobicContact CD2-CG2 3.79Å
584	E	90.2	Very high	88.3	Confident	85 Å²	85	39.7 Å²	39.7	40%	0.397	25%	0.25	S	C	.	.			trans	-123.3	156.3	179.7	-63.2	-177.3	158.5	0	0	110.7	G586 D587 R623	E584-G586 PolarHBondContact O-N 3.03Å; E584-D587 PolarHBondContact N-OD2 2.89Å; E584-D587 WeakPolarHBondContact O-CB 3.49Å; E584-D587 PolarHBondContact O-N 3.06Å; E584-R623 IonicContact OE2-NE 3.53Å; E584-R623 IonicContact OE2-NH2 2.65Å
585	T	89.6	Confident	88.8	Confident	73 Å²	73	42.3 Å²	42.3	45%	0.448	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	130.4	168.2	-72	0	0	0	0	109.8	V568 K569	V568-T585 WeakPolarHBondContact O-CA 3.4Å; K569-T585 WeakPolarHBondContact O-CG2 3.23Å; K569-T585 PolarHBondContact O-OG1 3.48Å
586	G	87.6	Confident	88.9	Confident	7 Å²	7	44.2 Å²	44.2	7%	0.072	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.7	-0.4	-176.8	0	0	0	0	0	115.3	V568 E584 R623 A624 A625	V568-G586 PolarHBondContact O-N 3.44Å; E584-G586 PolarHBondContact O-N 3.03Å; G586-R623 CarbonylContact O-C 3.59Å; G586-A624 PolarHBondContact O-N 2.99Å; G586-A624 VanDerWaalsContact O-N 3.15Å; G586-A625 VanDerWaalsContact O-CB 3.27Å; G586-A625 WeakPolarHBondContact O-CB 3.35Å; G586-A625 PolarHBondContact O-N 3.49Å
587	D	93.6	Very high	89.1	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.252	C	S	.	.			trans	-68.9	146.2	164.5	-74.2	-22.5	0	0	0	111.3	Y567 V568 E584 V620 K622 R623	Y567-D587 CarbonylContact C-O 3.57Å; Y567-D587 WeakPolarHBondContact CA-O 3.32Å; V568-D587 HydrophobicContact CG2-CB 4.28Å; V568-D587 PolarHBondContact N-O 3.36Å; E584-D587 PolarHBondContact N-OD2 2.89Å; E584-D587 WeakPolarHBondContact O-CB 3.49Å; E584-D587 PolarHBondContact O-N 3.06Å; D587-V620 HydrophobicContact CB-CG1 3.82Å; D587-K622 WeakPolarHBondContact OD1-CA 3.15Å; D587-K622 WeakPolarHBondContact OD1-CD 3.32Å; D587-K622 IonicContact OD1-NZ 3.37Å; D587-K622 WeakPolarHBondContact OD2-CD 3.41Å; D587-K622 IonicContact OD2-NZ 2.66Å; D587-K622 PolarHBondContact OD2-NZ 3.43Å; D587-R623 PolarHBondContact OD1-N 3.2Å
588	Q	93.4	Very high	89.2	Confident	7 Å²	7	46.4 Å²	46.4	3%	0.033	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	128.8	171.6	177.3	-176	52	0	0	109.3	I566 Y567 L590 V620 R621 A624	I566-Q588 WeakPolarHBondContact O-CA 3.43Å; Y567-Q588 HydrophobicContact CD1-CB 3.84Å; Y567-Q588 HydrophobicContact CD1-CG 4.41Å; Y567-Q588 HydrophobicContact CE1-CB 3.72Å; Y567-Q588 HydrophobicContact CE1-CG 4.1Å; Y567-Q588 PolarHBondContact OH-NE2 2.84Å; Q588-L590 HydrophobicContact CG-CD2 3.98Å; Q588-V620 WeakPolarHBondContact O-CA 3.4Å; Q588-R621 HydrophobicContact CB-CB 4.34Å; Q588-R621 PolarHBondContact N-O 2.62Å; Q588-R621 PolarHBondContact O-N 3.35Å; Q588-A624 HydrophobicContact CB-CB 3.33Å; Q588-A624 HydrophobicContact CG-CB 4.44Å
589	L	93.9	Very high	89.1	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	113.5	173.9	-53.5	177.9	0	0	0	107.6	L551 I553 I566 V568 L583 L597 M609 F618 V620	L551-L589 HydrophobicContact CD1-CD1 4.31Å; I553-L589 HydrophobicContact CG2-CD1 3.97Å; I566-L589 HydrophobicContact CG2-CB 4.48Å; I566-L589 HydrophobicContact CG2-CD1 4.34Å; I566-L589 PolarHBondContact O-N 2.92Å; V568-L589 HydrophobicContact CG2-CD1 4.23Å; V568-L589 HydrophobicContact CG2-CD2 4.06Å; V568-L589 HydrophobicContact CG2-CG 4.08Å; L583-L589 HydrophobicContact CD2-CD2 4.39Å; L589-L597 HydrophobicContact CB-CD1 3.5Å; L589-L597 WeakPolarHBondContact O-CB 3.44Å; L589-M609 HydrophobicContact CD1-CE 3.63Å; L589-M609 HydrophobicContact CD1-SD 4.41Å; L589-F618 HydrophobicContact CB-CD1 4.45Å; L589-F618 HydrophobicContact CD1-CD1 4.19Å; L589-F618 HydrophobicContact CD1-CE1 4.03Å; L589-F618 HydrophobicContact CD2-CB 4.41Å; L589-F618 HydrophobicContact CD2-CD1 4.1Å; L589-F618 HydrophobicContact CD2-CG 4.32Å; L589-F618 HydrophobicContact CG-CD1 4.48Å; L589-V620 HydrophobicContact CD2-CG1 4.35Å; L589-V620 HydrophobicContact CD2-CG2 4Å
590	L	92.6	Very high	89.1	Confident	18 Å²	18	41.7 Å²	41.7	9%	0.094	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-36.2	-177.7	-57.5	177.7	0	0	0	111.9	I537 Q588 L597 I598 D619 R621	I537-L590 HydrophobicContact CD1-CD1 3.84Å; I537-L590 HydrophobicContact CG1-CD1 3.9Å; I537-L590 HydrophobicContact CG2-CD1 4.18Å; Q588-L590 HydrophobicContact CG-CD2 3.98Å; L590-L597 PolarHBondContact O-N 2.95Å; L590-I598 HydrophobicContact CD2-CD1 4.32Å; L590-D619 HydrophobicContact CB-CB 4.27Å; L590-D619 WeakPolarHBondContact CB-O 2.99Å; L590-D619 PolarHBondContact N-O 3.45Å; L590-R621 HydrophobicContact CD1-CB 4.14Å; L590-R621 HydrophobicContact CD2-CB 4.21Å; L590-R621 HydrophobicContact CG-CB 4.22Å
591	S	92.5	Very high	89.2	Confident	10 Å²	10	41.2 Å²	41.2	7%	0.07	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	159.7	177.9	93.3	0	0	0	0	112	H595 F618 D619	S591-H595 CarbonylContact C-O 3.53Å; S591-H595 WeakPolarHBondContact CA-O 3.4Å; S591-H595 WeakPolarHBondContact CB-O 3.29Å; S591-F618 WeakPolarHBondContact O-CA 3.38Å; S591-F618 WeakPolarHBondContact O-CD1 3.32Å; S591-D619 WeakPolarHBondContact CB-OD2 3.24Å; S591-D619 PolarHBondContact N-O 2.99Å; S591-D619 WeakPolarHBondContact OG-CB 3.07Å; S591-D619 PolarHBondContact OG-N 2.83Å; S591-D619 PolarHBondContact OG-OD2 3Å
592	V	93.1	Very high	89.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	119.1	164.1	65	0	0	0	0	110.1	G594 H595 L597 L608 M609 V616 H617 F618	V592-G594 PolarHBondContact O-N 2.87Å; V592-G594 VanDerWaalsContact O-N 3.08Å; V592-H595 HydrophobicContact CG1-CB 4.49Å; V592-H595 PolarHBondContact N-O 2.64Å; V592-H595 WeakPolarHBondContact O-CB 3.31Å; V592-H595 PolarHBondContact O-N 3.38Å; V592-L597 HydrophobicContact CB-CD1 4.13Å; V592-L597 HydrophobicContact CB-CD2 4.35Å; V592-L597 HydrophobicContact CB-CG 4.36Å; V592-L597 HydrophobicContact CG1-CD1 4.38Å; V592-L597 HydrophobicContact CG1-CD2 3.69Å; V592-L597 HydrophobicContact CG1-CG 4.14Å; V592-L608 HydrophobicContact CG1-CB 3.73Å; V592-L608 HydrophobicContact CG1-CD1 4.46Å; V592-M609 HydrophobicContact CB-CG 4.46Å; V592-M609 HydrophobicContact CG2-CG 4.05Å; V592-V616 HydrophobicContact CG2-CG1 3.38Å; V592-H617 CarbonylContact C-O 3.52Å; V592-H617 WeakPolarHBondContact CA-O 3.34Å; V592-F618 HydrophobicContact CB-CD1 4.17Å; V592-F618 HydrophobicContact CB-CE1 4Å; V592-F618 HydrophobicContact CG2-CD1 4.19Å; V592-F618 HydrophobicContact CG2-CE1 3.72Å; V592-F618 HydrophobicContact CG2-CZ 4.23Å
593	N	88.3	Confident	89.5	Confident	56 Å²	56	43.1 Å²	43.1	30%	0.299	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	33.8	-175.1	-72.7	-40.3	0	0	0	113.6	S612 H617	N593-S612 VanDerWaalsContact ND2-CB 3.25Å; N593-S612 WeakPolarHBondContact ND2-CB 3.43Å; N593-S612 PolarHBondContact ND2-OG 2.85Å; N593-H617 PolarHBondContact N-O 2.86Å; N593-H617 PolarHBondContact OD1-N 2.78Å; N593-H617 PolarHBondContact OD1-ND1 3.31Å
594	G	83.3	Confident	89.3	Confident	65 Å²	65	45.5 Å²	45.5	67%	0.67	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	-7.4	-178	0	0	0	0	0	115.7	V592	V592-G594 PolarHBondContact O-N 2.87Å; V592-G594 VanDerWaalsContact O-N 3.08Å
595	H	86.6	Confident	89.2	Confident	116 Å²	116	41.4 Å²	41.4	54%	0.537	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	128.8	168.9	-64.4	-80.7	0	0	0	110.1	S591 V592 L608	S591-H595 CarbonylContact C-O 3.53Å; S591-H595 WeakPolarHBondContact CA-O 3.4Å; S591-H595 WeakPolarHBondContact CB-O 3.29Å; V592-H595 HydrophobicContact CG1-CB 4.49Å; V592-H595 PolarHBondContact N-O 2.64Å; V592-H595 WeakPolarHBondContact O-CB 3.31Å; V592-H595 PolarHBondContact O-N 3.38Å; H595-L608 HydrophobicContact CB-CD1 4.36Å
596	S	89.3	Confident	89.1	Confident	67 Å²	67	39.9 Å²	39.9	47%	0.469	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	139.4	174.8	-176	0	0	0	0	111.4	I598	S596-I598 PolarHBondContact OG-N 3.28Å; S596-I598 VanDerWaalsContact OG-N 3.13Å
597	L	90.2	Very high	89	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.266	C	S	.	.			trans	-105.2	3.1	170.1	-65.9	175.6	0	0	0	112.1	I566 L589 L590 V592 I600 A605 L608 M609	I566-L597 HydrophobicContact CB-CB 4.35Å; I566-L597 HydrophobicContact CG1-CB 4.11Å; I566-L597 WeakPolarHBondContact CG1-O 3.34Å; L589-L597 HydrophobicContact CB-CD1 3.5Å; L589-L597 WeakPolarHBondContact O-CB 3.44Å; L590-L597 PolarHBondContact O-N 2.95Å; V592-L597 HydrophobicContact CB-CD1 4.13Å; V592-L597 HydrophobicContact CB-CD2 4.35Å; V592-L597 HydrophobicContact CB-CG 4.36Å; V592-L597 HydrophobicContact CG1-CD1 4.38Å; V592-L597 HydrophobicContact CG1-CD2 3.69Å; V592-L597 HydrophobicContact CG1-CG 4.14Å; L597-I600 HydrophobicContact CD2-CD1 3.71Å; L597-A605 HydrophobicContact CD2-CB 3.98Å; L597-L608 HydrophobicContact CD2-CD1 4.32Å; L597-M609 HydrophobicContact CD1-CE 3.68Å; L597-M609 HydrophobicContact CD2-CE 4.16Å
598	I	89.8	Confident	88.7	Confident	71 Å²	71	48.5 Å²	48.5	36%	0.364	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	129.2	178.4	-46.2	178.6	0	0	0	109	Q563 L590 S596	Q563-I598 HydrophobicContact CB-CG2 4.13Å; L590-I598 HydrophobicContact CD2-CD1 4.32Å; S596-I598 PolarHBondContact OG-N 3.28Å; S596-I598 VanDerWaalsContact OG-N 3.13Å
599	G	82.8	Confident	88.4	Confident	42 Å²	42	48.9 Å²	48.9	43%	0.433	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	3.3	175.9	0	0	0	0	0	116.2	M564	M564-G599 WeakPolarHBondContact O-CA 3.49Å; M564-G599 PolarHBondContact O-N 3.38Å
600	I	85.7	Confident	87.8	Confident	44 Å²	44	53.9 Å²	53.9	23%	0.226	31%	0.31	C	S	.	.			trans	-101	162.9	-177.9	71.7	171.7	0	0	0	112.9	I566 L597 D604 A605 L608	I566-I600 HydrophobicContact CG1-CG1 4.49Å; L597-I600 HydrophobicContact CD2-CD1 3.71Å; I600-D604 HydrophobicContact CB-CB 4.23Å; I600-D604 HydrophobicContact CD1-CB 4.11Å; I600-D604 HydrophobicContact CG1-CB 4.45Å; I600-A605 HydrophobicContact CD1-CB 3.98Å; I600-A605 HydrophobicContact CG1-CB 4.35Å; I600-L608 HydrophobicContact CD1-CD1 3.76Å
601	S	87.5	Confident	87.2	Confident	42 Å²	42	60.3 Å²	60.3	29%	0.294	34%	0.339	S	S	.	.			trans	-69.5	160.6	176.3	75.2	0	0	0	0	112.6	E603 D604 A605	S601-E603 PolarHBondContact O-N 3.16Å; S601-D604 PolarHBondContact O-N 3.3Å; S601-D604 WeakPolarHBondContact OG-CB 3.38Å; S601-D604 PolarHBondContact OG-N 3.48Å; S601-D604 PolarHBondContact OG-OD2 2.96Å; S601-A605 WeakPolarHBondContact O-CB 3.39Å; S601-A605 PolarHBondContact O-N 3.12Å
602	Q	90.2	Very high	86.5	Confident	72 Å²	72	60.8 Å²	60.8	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-36.2	174	-175.3	176.4	-40	0	0	111.1	I553 A555 A606	I553-Q602 HydrophobicContact CD1-CG 4.46Å; I553-Q602 HydrophobicContact CG1-CG 4.35Å; I553-Q602 PolarHBondContact O-NE2 3.27Å; A555-Q602 HydrophobicContact CB-CB 3.85Å; Q602-A606 VanDerWaalsContact O-CB 3.29Å; Q602-A606 WeakPolarHBondContact O-CB 3.41Å; Q602-A606 PolarHBondContact O-N 3.32Å
603	E	88.6	Confident	85.8	Confident	122 Å²	122	63 Å²	63	57%	0.57	37%	0.365	S	S	*	.	H	α-helix	trans	-64.6	-42.8	176.4	-67.2	67.2	-154	0	0	111.1	S601 A606 R607	S601-E603 PolarHBondContact O-N 3.16Å; E603-A606 PolarHBondContact O-N 3.34Å; E603-R607 WeakPolarHBondContact O-CB 3.42Å; E603-R607 VanDerWaalsContact O-CG 3.3Å; E603-R607 WeakPolarHBondContact O-CG 3.18Å; E603-R607 PolarHBondContact O-N 3.4Å
604	D	86.4	Confident	85.4	Confident	57 Å²	57	65 Å²	65	31%	0.305	38%	0.376	S	S	.	.	H	α-helix	trans	-68.2	-43.6	176.2	-69.9	-48.5	0	0	0	112.3	I600 S601 A606 R607 L608	I600-D604 HydrophobicContact CB-CB 4.23Å; I600-D604 HydrophobicContact CD1-CB 4.11Å; I600-D604 HydrophobicContact CG1-CB 4.45Å; S601-D604 PolarHBondContact O-N 3.3Å; S601-D604 WeakPolarHBondContact OG-CB 3.38Å; S601-D604 PolarHBondContact OG-N 3.48Å; S601-D604 PolarHBondContact OG-OD2 2.96Å; D604-A606 VanDerWaalsContact C-N 3.31Å; D604-A606 PolarHBondContact O-N 3.13Å; D604-R607 PolarHBondContact O-N 3.46Å; D604-R607 VanDerWaalsContact O-N 3.15Å; D604-R607 IonicContact OD1-CZ 2.99Å; D604-R607 IonicContact OD1-NE 2.98Å; D604-R607 PolarHBondContact OD1-NE 3.01Å; D604-R607 IonicContact OD1-NH2 3.21Å; D604-R607 PolarHBondContact OD1-NH2 3.46Å; D604-L608 WeakPolarHBondContact O-CG 3.32Å; D604-L608 PolarHBondContact O-N 2.96Å
605	A	88.7	Confident	85.5	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-58.1	-45.2	173.2	0	0	0	0	0	111.3	I553 I566 L597 I600 S601 L608 M609	I553-A605 HydrophobicContact CD1-CB 3.83Å; I566-A605 HydrophobicContact CD1-CB 3.52Å; I566-A605 HydrophobicContact CG1-CB 3.65Å; I566-A605 HydrophobicContact CG2-CB 4.16Å; L597-A605 HydrophobicContact CD2-CB 3.98Å; I600-A605 HydrophobicContact CD1-CB 3.98Å; I600-A605 HydrophobicContact CG1-CB 4.35Å; S601-A605 WeakPolarHBondContact O-CB 3.39Å; S601-A605 PolarHBondContact O-N 3.12Å; A605-L608 PolarHBondContact O-N 2.78Å; A605-M609 HydrophobicContact CB-CE 4.18Å; A605-M609 WeakPolarHBondContact O-CB 3.47Å; A605-M609 VanDerWaalsContact O-CG 3.24Å; A605-M609 WeakPolarHBondContact O-CG 3.38Å; A605-M609 PolarHBondContact O-N 3.34Å
606	A	87.1	Confident	85.6	Confident	41 Å²	41	60.6 Å²	60.6	34%	0.339	34%	0.338	S	S	.	.	H	α-helix	trans	-64.3	-38.8	174.7	0	0	0	0	0	112.4	I553 Q602 E603 D604 T610	I553-A606 HydrophobicContact CD1-CB 4.47Å; Q602-A606 VanDerWaalsContact O-CB 3.29Å; Q602-A606 WeakPolarHBondContact O-CB 3.41Å; Q602-A606 PolarHBondContact O-N 3.32Å; E603-A606 PolarHBondContact O-N 3.34Å; D604-A606 VanDerWaalsContact C-N 3.31Å; D604-A606 PolarHBondContact O-N 3.13Å; A606-T610 VanDerWaalsContact O-CB 3.23Å; A606-T610 WeakPolarHBondContact O-CB 3.2Å; A606-T610 PolarHBondContact O-N 3.26Å; A606-T610 PolarHBondContact O-OG1 3.32Å
607	R	85.5	Confident	85.6	Confident	144 Å²	144	61.5 Å²	61.5	54%	0.543	34%	0.335	S	S	.	.	H	α-helix	trans	-61.9	-50	174.1	-78.2	-167.9	-75.7	-150.5	3.1	111.5	E603 D604 M609 T610 Q611	E603-R607 WeakPolarHBondContact O-CB 3.42Å; E603-R607 VanDerWaalsContact O-CG 3.3Å; E603-R607 WeakPolarHBondContact O-CG 3.18Å; E603-R607 PolarHBondContact O-N 3.4Å; D604-R607 PolarHBondContact O-N 3.46Å; D604-R607 VanDerWaalsContact O-N 3.15Å; D604-R607 IonicContact OD1-CZ 2.99Å; D604-R607 IonicContact OD1-NE 2.98Å; D604-R607 PolarHBondContact OD1-NE 3.01Å; D604-R607 IonicContact OD1-NH2 3.21Å; D604-R607 PolarHBondContact OD1-NH2 3.46Å; R607-M609 PolarHBondContact O-N 2.94Å; R607-T610 PolarHBondContact O-N 3.49Å; R607-T610 VanDerWaalsContact O-N 3.14Å; R607-Q611 WeakPolarHBondContact O-CB 3.36Å; R607-Q611 VanDerWaalsContact O-CG 3.31Å; R607-Q611 WeakPolarHBondContact O-CG 3.38Å; R607-Q611 PolarHBondContact O-N 2.86Å
608	L	87.1	Confident	85.8	Confident	43 Å²	43	61.6 Å²	61.6	23%	0.225	34%	0.336	C	S	.	.	H	α-helix	trans	-62	-44	178.4	-68.8	171	0	0	0	112.2	V592 H595 L597 I600 D604 A605 T610 S612	V592-L608 HydrophobicContact CG1-CB 3.73Å; V592-L608 HydrophobicContact CG1-CD1 4.46Å; H595-L608 HydrophobicContact CB-CD1 4.36Å; L597-L608 HydrophobicContact CD2-CD1 4.32Å; I600-L608 HydrophobicContact CD1-CD1 3.76Å; D604-L608 WeakPolarHBondContact O-CG 3.32Å; D604-L608 PolarHBondContact O-N 2.96Å; A605-L608 PolarHBondContact O-N 2.78Å; L608-T610 VanDerWaalsContact C-N 3.29Å; L608-T610 PolarHBondContact O-N 3.2Å; L608-S612 WeakPolarHBondContact O-CB 3.47Å; L608-S612 PolarHBondContact O-N 2.89Å; L608-S612 PolarHBondContact O-OG 3.44Å
609	M	86.8	Confident	85.9	Confident	15 Å²	15	60 Å²	60	7%	0.074	33%	0.328	C	S	.	.	H	α-helix	trans	-64.5	-32.9	174.5	-70	176.8	-152.2	0	0	112.3	K544 I549 I553 I566 L589 V592 L597 A605 R607 F618	K544-M609 VanDerWaalsContact CE-O 3.25Å; K544-M609 WeakPolarHBondContact CE-O 3.5Å; K544-M609 PolarHBondContact NZ-O 3.38Å; I549-M609 HydrophobicContact CD1-CB 4.16Å; I553-M609 HydrophobicContact CD1-CE 3.9Å; I553-M609 HydrophobicContact CD1-SD 4.07Å; I553-M609 HydrophobicContact CG2-CE 4.36Å; I553-M609 HydrophobicContact CG2-SD 4.39Å; I566-M609 HydrophobicContact CG2-CE 4.07Å; L589-M609 HydrophobicContact CD1-CE 3.63Å; L589-M609 HydrophobicContact CD1-SD 4.41Å; V592-M609 HydrophobicContact CB-CG 4.46Å; V592-M609 HydrophobicContact CG2-CG 4.05Å; L597-M609 HydrophobicContact CD1-CE 3.68Å; L597-M609 HydrophobicContact CD2-CE 4.16Å; A605-M609 HydrophobicContact CB-CE 4.18Å; A605-M609 WeakPolarHBondContact O-CB 3.47Å; A605-M609 VanDerWaalsContact O-CG 3.24Å; A605-M609 WeakPolarHBondContact O-CG 3.38Å; A605-M609 PolarHBondContact O-N 3.34Å; R607-M609 PolarHBondContact O-N 2.94Å; M609-F618 HydrophobicContact CE-CE1 4.02Å; M609-F618 HydrophobicContact CG-CE1 3.96Å; M609-F618 HydrophobicContact CG-CZ 4.16Å; M609-F618 HydrophobicContact SD-CE1 3.99Å; M609-F618 HydrophobicContact SD-CZ 4.19Å
610	T	82.1	Confident	86.4	Confident	107 Å²	107	58 Å²	58	66%	0.656	31%	0.307	S	S	*	.	H	α-helix	trans	-75.1	-46.7	177.6	-59.2	0	0	0	0	111.9	K544 A606 R607 L608 S612	K544-T610 PolarHBondContact NZ-O 2.96Å; A606-T610 VanDerWaalsContact O-CB 3.23Å; A606-T610 WeakPolarHBondContact O-CB 3.2Å; A606-T610 PolarHBondContact O-N 3.26Å; A606-T610 PolarHBondContact O-OG1 3.32Å; R607-T610 PolarHBondContact O-N 3.49Å; R607-T610 VanDerWaalsContact O-N 3.14Å; L608-T610 VanDerWaalsContact C-N 3.29Å; L608-T610 PolarHBondContact O-N 3.2Å; T610-S612 VanDerWaalsContact C-N 3.3Å; T610-S612 PolarHBondContact O-N 3.5Å
611	Q	79.3	Confident	86.6	Confident	152 Å²	152	59 Å²	59	71%	0.71	31%	0.308	S	S	*	.	H	α-helix	trans	-69.6	-23.6	179.8	-70.5	173.8	-5.7	0	0	113.6	R607	R607-Q611 WeakPolarHBondContact O-CB 3.36Å; R607-Q611 VanDerWaalsContact O-CG 3.31Å; R607-Q611 WeakPolarHBondContact O-CG 3.38Å; R607-Q611 PolarHBondContact O-N 2.86Å
612	S	78.6	Confident	86.8	Confident	20 Å²	20	59.7 Å²	59.7	14%	0.14	31%	0.306	C	S	.	.	S	Bend	trans	-51.9	154.2	170.5	-73.4	0	0	0	0	112.7	K544 N593 L608 T610	K544-S612 PolarHBondContact NZ-O 3.33Å; N593-S612 VanDerWaalsContact ND2-CB 3.25Å; N593-S612 WeakPolarHBondContact ND2-CB 3.43Å; N593-S612 PolarHBondContact ND2-OG 2.85Å; L608-S612 WeakPolarHBondContact O-CB 3.47Å; L608-S612 PolarHBondContact O-N 2.89Å; L608-S612 PolarHBondContact O-OG 3.44Å; T610-S612 VanDerWaalsContact C-N 3.3Å; T610-S612 PolarHBondContact O-N 3.5Å
613	G	77.5	Confident	86.4	Confident	47 Å²	47	64 Å²	64	49%	0.485	32%	0.319	S	S	.	.			trans	-67.9	-165.2	-175.4	0	0	0	0	0	115.7	K544 E615	K544-G613 VanDerWaalsContact CD-O 3.28Å; K544-G613 WeakPolarHBondContact CD-O 3.35Å; K544-G613 VanDerWaalsContact CE-O 3.26Å; K544-G613 WeakPolarHBondContact CE-O 3.31Å; G613-E615 PolarHBondContact O-N 2.82Å; G613-E615 VanDerWaalsContact O-N 3.11Å
614	N	80.4	Confident	86.1	Confident	98 Å²	98	58.2 Å²	58.2	52%	0.524	29%	0.292	S	S	.	.	S	Bend	trans	-59.8	-15.8	170.5	-81.6	-19.9	0	0	0	113	R543 K544 R789	R543-N614 CarbonylContact C-O 3.55Å; R543-N614 VanDerWaalsContact CA-O 3.3Å; R543-N614 WeakPolarHBondContact CA-O 3.46Å; K544-N614 PolarHBondContact N-O 3.01Å; N614-R789 PolarHBondContact OD1-NH2 2.96Å
615	E	84.4	Confident	85.9	Confident	88 Å²	88	55.5 Å²	55.5	41%	0.411	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.8	-179.1	-171.9	159.7	-117.9	0	0	109.2	T541 L542 R543 G613	T541-E615 HydrophobicContact CG2-CG 3.4Å; T541-E615 VanDerWaalsContact CG2-CG 3.4Å; L542-E615 CarbonylContact O-C 3.55Å; L542-E615 WeakPolarHBondContact O-CA 3.02Å; R543-E615 HydrophobicContact CG-CG 4.23Å; G613-E615 PolarHBondContact O-N 2.82Å; G613-E615 VanDerWaalsContact O-N 3.11Å
616	V	88.9	Confident	85.5	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	116.4	-170.2	-168.4	0	0	0	0	109.2	T541 L542 K544 I549 V592 F618	T541-V616 CarbonylContact C-O 3.47Å; T541-V616 WeakPolarHBondContact CA-O 3.38Å; L542-V616 PolarHBondContact N-O 3.39Å; L542-V616 PolarHBondContact O-N 2.65Å; K544-V616 HydrophobicContact CD-CG2 4.3Å; K544-V616 VanDerWaalsContact CE-CG2 3.42Å; K544-V616 HydrophobicContact CG-CG2 4.07Å; I549-V616 HydrophobicContact CD1-CB 4.18Å; I549-V616 HydrophobicContact CD1-CG1 3.99Å; I549-V616 HydrophobicContact CD1-CG2 3.88Å; I549-V616 HydrophobicContact CG1-CG2 4.36Å; V592-V616 HydrophobicContact CG2-CG1 3.38Å; V616-F618 HydrophobicContact CB-CE2 4.15Å; V616-F618 HydrophobicContact CG1-CD2 4.24Å; V616-F618 HydrophobicContact CG1-CE1 4.18Å; V616-F618 HydrophobicContact CG1-CE2 3.59Å; V616-F618 HydrophobicContact CG1-CZ 3.57Å
617	H	90.3	Very high	84.8	Confident	87 Å²	87	67.1 Å²	67.1	40%	0.403	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	125.4	178.6	-57.1	76.1	0	0	0	109	T541 V592 N593	T541-H617 PolarHBondContact OG1-CD2 3.05Å; V592-H617 CarbonylContact C-O 3.52Å; V592-H617 WeakPolarHBondContact CA-O 3.34Å; N593-H617 PolarHBondContact N-O 2.86Å; N593-H617 PolarHBondContact OD1-N 2.78Å; N593-H617 PolarHBondContact OD1-ND1 3.31Å
618	F	93.5	Very high	84.6	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.009	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.7	172.1	-63.9	-80.7	0	0	0	110.4	K539 V540 L542 I549 L551 L589 S591 V592 M609 V616 V620	K539-F618 WeakPolarHBondContact CA-O 3.31Å; V540-F618 PolarHBondContact N-O 3.36Å; V540-F618 PolarHBondContact O-N 3.35Å; L542-F618 HydrophobicContact CD1-CE2 4.24Å; I549-F618 HydrophobicContact CD1-CE2 4.15Å; I549-F618 HydrophobicContact CD1-CZ 3.76Å; I549-F618 HydrophobicContact CG2-CE2 4.25Å; L551-F618 HydrophobicContact CD1-CE2 4.34Å; L551-F618 HydrophobicContact CD1-CZ 4.23Å; L589-F618 HydrophobicContact CB-CD1 4.45Å; L589-F618 HydrophobicContact CD1-CD1 4.19Å; L589-F618 HydrophobicContact CD1-CE1 4.03Å; L589-F618 HydrophobicContact CD2-CB 4.41Å; L589-F618 HydrophobicContact CD2-CD1 4.1Å; L589-F618 HydrophobicContact CD2-CG 4.32Å; L589-F618 HydrophobicContact CG-CD1 4.48Å; S591-F618 WeakPolarHBondContact O-CA 3.38Å; S591-F618 WeakPolarHBondContact O-CD1 3.32Å; V592-F618 HydrophobicContact CB-CD1 4.17Å; V592-F618 HydrophobicContact CB-CE1 4Å; V592-F618 HydrophobicContact CG2-CD1 4.19Å; V592-F618 HydrophobicContact CG2-CE1 3.72Å; V592-F618 HydrophobicContact CG2-CZ 4.23Å; M609-F618 HydrophobicContact CE-CE1 4.02Å; M609-F618 HydrophobicContact CG-CE1 3.96Å; M609-F618 HydrophobicContact CG-CZ 4.16Å; M609-F618 HydrophobicContact SD-CE1 3.99Å; M609-F618 HydrophobicContact SD-CZ 4.19Å; V616-F618 HydrophobicContact CB-CE2 4.15Å; V616-F618 HydrophobicContact CG1-CD2 4.24Å; V616-F618 HydrophobicContact CG1-CE1 4.18Å; V616-F618 HydrophobicContact CG1-CE2 3.59Å; V616-F618 HydrophobicContact CG1-CZ 3.57Å; F618-V620 HydrophobicContact CB-CG2 3.6Å
619	D	92.6	Very high	84.1	Confident	37 Å²	37	61.7 Å²	61.7	20%	0.198	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	122.2	156.9	-65.5	-59.2	0	0	0	107.8	I537 K539 L590 S591	I537-D619 HydrophobicContact CG2-CB 3.83Å; K539-D619 WeakPolarHBondContact CG-OD1 3.3Å; K539-D619 IonicContact NZ-OD1 2.67Å; K539-D619 PolarHBondContact NZ-OD1 2.98Å; K539-D619 IonicContact NZ-OD2 2.79Å; L590-D619 HydrophobicContact CB-CB 4.27Å; L590-D619 WeakPolarHBondContact CB-O 2.99Å; L590-D619 PolarHBondContact N-O 3.45Å; S591-D619 WeakPolarHBondContact CB-OD2 3.24Å; S591-D619 PolarHBondContact N-O 2.99Å; S591-D619 WeakPolarHBondContact OG-CB 3.07Å; S591-D619 PolarHBondContact OG-N 2.83Å; S591-D619 PolarHBondContact OG-OD2 3Å
620	V	92.4	Very high	83.8	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.3	-166.8	-173.5	0	0	0	0	111.2	I537 S538 V540 L583 D587 Q588 L589 F618	I537-V620 CarbonylContact C-O 3.59Å; I537-V620 WeakPolarHBondContact CA-O 3.32Å; S538-V620 PolarHBondContact N-O 2.99Å; S538-V620 WeakPolarHBondContact O-CB 3.35Å; S538-V620 PolarHBondContact O-N 3.09Å; V540-V620 HydrophobicContact CB-CG2 4.24Å; V540-V620 HydrophobicContact CG2-CG2 3.94Å; L583-V620 HydrophobicContact CD2-CB 4.47Å; L583-V620 HydrophobicContact CD2-CG1 3.96Å; L583-V620 HydrophobicContact CD2-CG2 3.79Å; D587-V620 HydrophobicContact CB-CG1 3.82Å; Q588-V620 WeakPolarHBondContact O-CA 3.4Å; L589-V620 HydrophobicContact CD2-CG1 4.35Å; L589-V620 HydrophobicContact CD2-CG2 4Å; F618-V620 HydrophobicContact CB-CG2 3.6Å
621	R	91.6	Very high	83.5	Confident	64 Å²	64	58.8 Å²	58.8	24%	0.242	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	117.6	168.5	-179.6	-179.5	-79	137.3	-11.2	109.7	D535 Q588 L590 A624	D535-R621 IonicContact OD1-NE 3.52Å; D535-R621 IonicContact OD2-CZ 2.67Å; D535-R621 VanDerWaalsContact OD2-CZ 3.3Å; D535-R621 IonicContact OD2-NE 3.85Å; D535-R621 PolarHBondContact OD2-NE 3.12Å; D535-R621 IonicContact OD2-NH2 3.7Å; D535-R621 PolarHBondContact OD2-NH2 3.41Å; Q588-R621 HydrophobicContact CB-CB 4.34Å; Q588-R621 PolarHBondContact N-O 2.62Å; Q588-R621 PolarHBondContact O-N 3.35Å; L590-R621 HydrophobicContact CD1-CB 4.14Å; L590-R621 HydrophobicContact CD2-CB 4.21Å; L590-R621 HydrophobicContact CG-CB 4.22Å; R621-A624 HydrophobicContact CB-CB 4.26Å; R621-A624 HydrophobicContact CG-CB 3.94Å
622	K	89.8	Confident	83	Confident	58 Å²	58	58.6 Å²	58.6	25%	0.252	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	133.9	-175.7	-76.1	-55.8	-160.1	166	0	113.8	R582 D587 A624	R582-K622 WeakPolarHBondContact O-CE 3.12Å; R582-K622 PolarHBondContact O-NZ 2.97Å; D587-K622 WeakPolarHBondContact OD1-CA 3.15Å; D587-K622 WeakPolarHBondContact OD1-CD 3.32Å; D587-K622 IonicContact OD1-NZ 3.37Å; D587-K622 WeakPolarHBondContact OD2-CD 3.41Å; D587-K622 IonicContact OD2-NZ 2.66Å; D587-K622 PolarHBondContact OD2-NZ 3.43Å; K622-A624 PolarHBondContact O-N 3.04Å
623	R	82.5	Confident	82.6	Confident	162 Å²	162	63.5 Å²	63.5	61%	0.611	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	25	176.9	-58.1	179.2	179.3	166.6	-0	114.4	E584 G586 D587 A625 H626	E584-R623 IonicContact OE2-NE 3.53Å; E584-R623 IonicContact OE2-NH2 2.65Å; G586-R623 CarbonylContact O-C 3.59Å; D587-R623 PolarHBondContact OD1-N 3.2Å; R623-A625 VanDerWaalsContact C-N 3.25Å; R623-A625 PolarHBondContact O-N 3.33Å; R623-H626 WeakPolarHBondContact O-CB 3.45Å; R623-H626 PolarHBondContact O-N 3.34Å
624	A	82.9	Confident	82.2	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-53.7	-39.9	-175.2	0	0	0	0	0	112.9	Y567 G586 Q588 R621 K622 H626 R627 N628	Y567-A624 HydrophobicContact CE1-CB 3.92Å; G586-A624 PolarHBondContact O-N 2.99Å; G586-A624 VanDerWaalsContact O-N 3.15Å; Q588-A624 HydrophobicContact CB-CB 3.33Å; Q588-A624 HydrophobicContact CG-CB 4.44Å; R621-A624 HydrophobicContact CB-CB 4.26Å; R621-A624 HydrophobicContact CG-CB 3.94Å; K622-A624 PolarHBondContact O-N 3.04Å; A624-H626 PolarHBondContact O-N 2.87Å; A624-R627 WeakPolarHBondContact O-CB 3.49Å; A624-R627 PolarHBondContact O-N 3.37Å; A624-N628 WeakPolarHBondContact O-CB 3.45Å; A624-N628 PolarHBondContact O-N 3.08Å; A624-N628 PolarHBondContact O-OD1 3.32Å
625	A	82.9	Confident	81	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.008	30%	0.296	C	S	.	.	H	α-helix	trans	-57.7	-32.6	178	0	0	0	0	0	114	Y567 G586 R623 G629 L630 S631 L634	Y567-A625 HydrophobicContact CD1-CB 3.99Å; Y567-A625 HydrophobicContact CE1-CB 4.29Å; G586-A625 VanDerWaalsContact O-CB 3.27Å; G586-A625 WeakPolarHBondContact O-CB 3.35Å; G586-A625 PolarHBondContact O-N 3.49Å; R623-A625 VanDerWaalsContact C-N 3.25Å; R623-A625 PolarHBondContact O-N 3.33Å; A625-G629 PolarHBondContact O-N 3.16Å; A625-L630 HydrophobicContact CB-CB 4.1Å; A625-L630 WeakPolarHBondContact O-CA 3.39Å; A625-L630 PolarHBondContact O-N 3.04Å; A625-S631 PolarHBondContact O-N 2.63Å; A625-S631 VanDerWaalsContact O-N 3.09Å; A625-L634 HydrophobicContact CB-CD1 3.27Å
626	H	78.8	Confident	78.7	Confident	140 Å²	140	58.5 Å²	58.5	65%	0.648	30%	0.298	S	S	*	.	H	α-helix	trans	-72.6	-35.1	176.6	-172.7	-55.2	0	0	0	111.6	R623 A624	R623-H626 WeakPolarHBondContact O-CB 3.45Å; R623-H626 PolarHBondContact O-N 3.34Å; A624-H626 PolarHBondContact O-N 2.87Å
627	R	73.7	Confident	76	Confident	144 Å²	144	66.9 Å²	66.9	54%	0.543	34%	0.338	S	S	.	.	H	α-helix	trans	-71	-36.1	176	-67.4	167.4	62.8	179.5	-2.1	111.2	D535 A624 G629	D535-R627 IonicContact OD1-CZ 2.7Å; D535-R627 IonicContact OD1-NH1 3.77Å; D535-R627 PolarHBondContact OD1-NH1 2.8Å; D535-R627 IonicContact OD1-NH2 3.73Å; D535-R627 PolarHBondContact OD1-NH2 3.37Å; A624-R627 WeakPolarHBondContact O-CB 3.49Å; A624-R627 PolarHBondContact O-N 3.37Å; R627-G629 VanDerWaalsContact C-N 3.35Å; R627-G629 PolarHBondContact O-N 3.33Å
628	N	80.3	Confident	73.1	Confident	23 Å²	23	67.8 Å²	67.8	12%	0.123	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	12.7	-171.5	-66.7	35.4	0	0	0	113	G558 V559 D561 Y567 A624 L630	G558-N628 CarbonylContact C-O 3.59Å; G558-N628 WeakPolarHBondContact CA-O 3.38Å; V559-N628 PolarHBondContact N-O 3.5Å; D561-N628 PolarHBondContact OD1-ND2 3.33Å; D561-N628 PolarHBondContact OD2-ND2 3.46Å; Y567-N628 PolarHBondContact OH-ND2 3.5Å; A624-N628 WeakPolarHBondContact O-CB 3.45Å; A624-N628 PolarHBondContact O-N 3.08Å; A624-N628 PolarHBondContact O-OD1 3.32Å; N628-L630 VanDerWaalsContact C-N 3.31Å; N628-L630 PolarHBondContact O-N 2.71Å
629	G	76.9	Confident	69.9	Low	50 Å²	50	73.9 Å²	73.9	52%	0.515	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	2.8	175.5	0	0	0	0	0	116.3	A625 R627	A625-G629 PolarHBondContact O-N 3.16Å; R627-G629 VanDerWaalsContact C-N 3.35Å; R627-G629 PolarHBondContact O-N 3.33Å
630	L	79.6	Confident	66.8	Low	20 Å²	20	77.6 Å²	77.6	11%	0.105	41%	0.413	C	S	.	.			trans	-91.8	-7.9	-172	-65.3	170.5	0	0	0	114.7	A556 Y567 A625 N628 N632 W633 L634	A556-L630 HydrophobicContact CB-CD1 3.77Å; A556-L630 HydrophobicContact CB-CD2 4.12Å; Y567-L630 HydrophobicContact CD2-CD1 3.95Å; Y567-L630 HydrophobicContact CE1-CD1 4.11Å; Y567-L630 HydrophobicContact CE2-CD1 3.48Å; Y567-L630 VanDerWaalsContact CE2-CD1 3.48Å; Y567-L630 HydrophobicContact CG-CD1 4.45Å; A625-L630 HydrophobicContact CB-CB 4.1Å; A625-L630 WeakPolarHBondContact O-CA 3.39Å; A625-L630 PolarHBondContact O-N 3.04Å; N628-L630 VanDerWaalsContact C-N 3.31Å; N628-L630 PolarHBondContact O-N 2.71Å; L630-N632 VanDerWaalsContact C-N 3.35Å; L630-N632 PolarHBondContact O-N 2.85Å; L630-W633 HydrophobicContact CD2-CE3 4.49Å; L630-W633 WeakPolarHBondContact O-CB 3.35Å; L630-W633 PolarHBondContact O-N 3.02Å; L630-L634 HydrophobicContact CB-CD1 3.98Å; L630-L634 PolarHBondContact O-N 2.93Å
631	S	75.6	Confident	63.6	Low	41 Å²	41	83.9 Å²	83.9	29%	0.287	45%	0.452	S	S	.	.	H	α-helix	trans	-51.7	-47.1	-177.1	41.3	0	0	0	0	113.5	A625 W633 L634 G635	A625-S631 PolarHBondContact O-N 2.63Å; A625-S631 VanDerWaalsContact O-N 3.09Å; S631-W633 VanDerWaalsContact C-N 3.31Å; S631-W633 PolarHBondContact O-N 3.37Å; S631-L634 PolarHBondContact O-N 2.81Å; S631-G635 PolarHBondContact O-N 3.18Å
632	N	70	Confident	60.5	Low	149 Å²	149	85.7 Å²	85.7	80%	0.797	47%	0.474	S	S	*	.	H	α-helix	trans	-66.9	-29.8	179.1	-68.9	-10.9	0	0	0	113.1	L630	L630-N632 VanDerWaalsContact C-N 3.35Å; L630-N632 PolarHBondContact O-N 2.85Å
633	W	69.1	Low	57.6	Low	122 Å²	122	90 Å²	90	46%	0.462	50%	0.5	S	S	.	.	H	α-helix	trans	-76.1	-40.2	178.8	-178.3	78.7	0	0	0	111.7	V554 A556 L630 S631 S636	V554-W633 HydrophobicContact CB-CH2 4.06Å; V554-W633 HydrophobicContact CB-CZ3 4.13Å; V554-W633 HydrophobicContact CG1-CH2 4.41Å; V554-W633 HydrophobicContact CG2-CH2 4.06Å; V554-W633 HydrophobicContact CG2-CZ3 3.6Å; A556-W633 HydrophobicContact CB-CE3 4.36Å; A556-W633 HydrophobicContact CB-CH2 4.16Å; A556-W633 HydrophobicContact CB-CZ3 3.69Å; L630-W633 HydrophobicContact CD2-CE3 4.49Å; L630-W633 WeakPolarHBondContact O-CB 3.35Å; L630-W633 PolarHBondContact O-N 3.02Å; S631-W633 VanDerWaalsContact C-N 3.31Å; S631-W633 PolarHBondContact O-N 3.37Å; W633-S636 PolarHBondContact O-OG 2.9Å
634	L	70.3	Confident	54.9	Low	8 Å²	8	92.1 Å²	92.1	4%	0.042	51%	0.514	C	S	.	.	H	α-helix	trans	-70	-32.3	175.3	-75.6	149	0	0	0	112.8	V554 K569 A625 L630 S631 S636	V554-L634 HydrophobicContact CG2-CD2 3.6Å; K569-L634 HydrophobicContact CB-CD2 3.75Å; K569-L634 HydrophobicContact CG-CD2 4.1Å; A625-L634 HydrophobicContact CB-CD1 3.27Å; L630-L634 HydrophobicContact CB-CD1 3.98Å; L630-L634 PolarHBondContact O-N 2.93Å; S631-L634 PolarHBondContact O-N 2.81Å; L634-S636 PolarHBondContact O-N 3.13Å; L634-S636 VanDerWaalsContact O-N 3.16Å
635	G	54.5	Low	52.2	Low	54 Å²	54	100 Å²	100	56%	0.557	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	6.6	178.8	0	0	0	0	0	116.6	S631 Q637	S631-G635 PolarHBondContact O-N 3.18Å; G635-Q637 PolarHBondContact O-N 2.9Å; G635-Q637 VanDerWaalsContact O-N 3.15Å
636	S	36.8	Very low	49.6	Very low	66 Å²	66	103.2 Å²	103.2	46%	0.462	58%	0.581	S	S	.	*			trans	-66.3	108	178.2	42.1	0	0	0	0	111.7	K569 W633 L634	K569-S636 PolarHBondContact NZ-OG 3.45Å; W633-S636 PolarHBondContact O-OG 2.9Å; L634-S636 PolarHBondContact O-N 3.13Å; L634-S636 VanDerWaalsContact O-N 3.16Å
637	Q	32	Very low	47.1	Very low	177 Å²	177	103 Å²	103	83%	0.827	59%	0.592	S	S	*	*			trans	-63.8	147	-175.1	-66.8	-164.8	20.6	0	0	113.2	G635	G635-Q637 PolarHBondContact O-N 2.9Å; G635-Q637 VanDerWaalsContact O-N 3.15Å
638	T	30	Very low	44.9	Very low	105 Å²	105	101.1 Å²	101.1	64%	0.644	60%	0.601	S	S	*	*			trans	-66.1	143.9	165.3	46.5	0	0	0	0	110.9	T640	T638-T640 PolarHBondContact O-N 2.72Å
639	P	26.2	Very low	42.6	Very low	131 Å²	131	105.7 Å²	105.7	85%	0.851	63%	0.632	S	S	*	*			trans	-67.2	100.4	169.3	29	-33.4	0	0	0	109.6
640	T	26.2	Very low	40.3	Very low	114 Å²	114	109.3 Å²	109.3	70%	0.699	65%	0.649	S	S	*	*			trans	-65.8	131.9	162.6	31.8	0	0	0	0	108.6	T638 S642	T638-T640 PolarHBondContact O-N 2.72Å; T640-S642 PolarHBondContact O-N 3.16Å
641	T	26.8	Very low	37.9	Very low	132 Å²	132	114.4 Å²	114.4	81%	0.81	68%	0.682	S	S	*	*			trans	-67.6	96.9	171.3	45.8	0	0	0	0	109.1	N643	T641-N643 PolarHBondContact O-N 2.9Å
642	S	26.4	Very low	35.8	Very low	103 Å²	103	118.6 Å²	118.6	72%	0.72	71%	0.705	S	S	*	*			trans	-63.2	116.1	162.3	40.9	0	0	0	0	108.3	T640 F644	T640-S642 PolarHBondContact O-N 3.16Å; S642-F644 PolarHBondContact O-N 2.74Å
643	N	28.9	Very low	34.3	Very low	148 Å²	148	116.8 Å²	116.8	79%	0.791	70%	0.702	S	S	*	*			trans	-59.9	128.5	167.8	-78.3	-22.7	0	0	0	108.4	T641 I645	T641-N643 PolarHBondContact O-N 2.9Å; N643-I645 PolarHBondContact O-N 3.44Å
644	F	24.9	Very low	32.5	Very low	207 Å²	207	116.6 Å²	116.6	91%	0.908	72%	0.716	S	S	*	*			trans	-62.5	104.9	169.7	-84.8	-106	0	0	0	109	S642 A646	S642-F644 PolarHBondContact O-N 2.74Å; F644-A646 PolarHBondContact O-N 3.04Å
645	I	26.4	Very low	30.8	Very low	164 Å²	164	122.2 Å²	122.2	84%	0.841	75%	0.753	S	S	*	*			trans	-79.2	108.7	156.2	-62.6	179.6	0	0	0	105.6	N643	N643-I645 PolarHBondContact O-N 3.44Å
646	A	27.6	Very low	29.6	Very low	70 Å²	70	124.8 Å²	124.8	58%	0.579	76%	0.763	S	S	*	*			trans	-68.4	139.6	-179.1	0	0	0	0	0	110.9	F644 S648	F644-A646 PolarHBondContact O-N 3.04Å; A646-S648 PolarHBondContact O-N 2.99Å
647	P	26.8	Very low	29.2	Very low	134 Å²	134	133 Å²	133	87%	0.87	79%	0.785	S	S	*	*			trans	-71.1	108.6	169.2	29.3	-32.3	0	0	0	109.6
648	S	28.8	Very low	29.1	Very low	106 Å²	106	128.7 Å²	128.7	74%	0.741	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-85.6	147.3	169.1	-64.8	0	0	0	0	110.3	A646	A646-S648 PolarHBondContact O-N 2.99Å
649	P	31.7	Very low	29	Very low	118 Å²	118	131.8 Å²	131.8	77%	0.766	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-77.3	153.9	-164	30.5	-36.9	0	0	0	114.3	T651	P649-T651 PolarHBondContact O-N 3.49Å
650	S	27.1	Very low	29.1	Very low	126 Å²	126	132.1 Å²	132.1	88%	0.881	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-69.2	117.7	169.8	-57.6	0	0	0	0	111.6
651	T	30.8	Very low	29	Very low	128 Å²	128	129.7 Å²	129.7	79%	0.785	78%	0.779	S	S	*	*			trans	-135.3	128.4	164.8	-59	0	0	0	0	109.1	P649	P649-T651 PolarHBondContact O-N 3.49Å
652	V	31.2	Very low	29.1	Very low	129 Å²	129	135.5 Å²	135.5	78%	0.782	79%	0.786	S	S	*	*			trans	-105.2	162.3	173.3	-134.8	0	0	0	0	109.1
653	P	37.9	Very low	29.1	Very low	110 Å²	110	136.8 Å²	136.8	71%	0.714	79%	0.789	S	S	*	*	P	Polyproline II helix		-101.1	170.3	-102	39	-27.3	0	0	0	113.5
654	P	31.9	Very low	30	Very low	119 Å²	119	134.6 Å²	134.6	77%	0.773	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-97	151.9	156.6	35.7	-29.5	0	0	0	112
655	P	34.9	Very low	30.3	Very low	126 Å²	126	129.3 Å²	129.3	82%	0.818	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-81.7	170.9	180	34.3	-36.6	0	0	0	113.8
656	S	28.2	Very low	30.6	Very low	108 Å²	108	131.8 Å²	131.8	76%	0.755	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-51.3	141.9	177	-40.3	0	0	0	0	114.8
657	Y	29.3	Very low	30.8	Very low	237 Å²	237	134.7 Å²	134.7	93%	0.929	78%	0.778	S	S	*	*				-160.7	-179.5	127.9	-108.1	-67.1	0	0	0	110.9
658	S	28.8	Very low	30.9	Very low	87 Å²	87	131 Å²	131	61%	0.608	76%	0.764	S	S	*	*			trans	-121.1	166	-153.2	55.3	0	0	0	0	115.9
659	H	28.6	Very low	30.9	Very low	171 Å²	171	134.3 Å²	134.3	79%	0.792	77%	0.768	S	S	*	*			trans	83.6	129.8	150.6	-79.7	-58.7	0	0	0	122.7
660	V	27.6	Very low	32	Very low	138 Å²	138	133.6 Å²	133.6	84%	0.836	76%	0.763	S	S	*	*			trans	74.6	123.9	140.2	174.8	0	0	0	0	119.6
661	G	25.7	Very low	33.5	Very low	63 Å²	63	132.8 Å²	132.8	65%	0.649	76%	0.755	S	S	*	*				141	89.7	124.4	0	0	0	0	0	121
662	R	27.7	Very low	34.3	Very low	254 Å²	254	132 Å²	132	96%	0.958	75%	0.752	S	S	*	*			trans	66.4	156.9	144.7	-63.8	-172.8	175.5	-147.6	-1.4	121.5
663	T	27.6	Very low	34.3	Very low	130 Å²	130	131.2 Å²	131.2	80%	0.798	75%	0.753	S	S	*	*			trans	-102.4	-159	171.4	56.6	0	0	0	0	108.6
664	P	46.8	Very low	33.9	Very low	101 Å²	101	136.2 Å²	136.2	66%	0.656	76%	0.759	S	S	*	*			cis	-142.9	-174.7	-5	34.8	-11.6	0	0	0	117
665	S	31.7	Very low	34	Very low	96 Å²	96	137 Å²	137	67%	0.671	76%	0.757	S	S	*	*			trans	64.1	162.5	144.1	59.2	0	0	0	0	119.8
666	Y	32.3	Very low	33.8	Very low	217 Å²	217	139.8 Å²	139.8	85%	0.851	76%	0.758	S	S	*	*			cis	-168.1	166.5	-6.8	-115.6	-169.6	0	0	0	107.6
667	D	30.8	Very low	33.7	Very low	131 Å²	131	144.9 Å²	144.9	70%	0.701	76%	0.761	S	S	*	*			cis	-139	-109.6	-15.6	-172.8	36.3	0	0	0	108.9
668	G	28.8	Very low	33.7	Very low	57 Å²	57	140.6 Å²	140.6	59%	0.588	75%	0.754	S	S	*	*			cis	173	104.4	-12.4	0	0	0	0	0	118
669	Q	29.9	Very low	33.7	Very low	175 Å²	175	140.2 Å²	140.2	82%	0.818	76%	0.764	S	S	*	*			trans	73.6	157.2	138.8	-71	-68.5	-63.1	0	0	121
670	P	54.4	Low	33.6	Very low	102 Å²	102	136 Å²	136	66%	0.662	77%	0.766	S	S	*	*			trans	-123.6	-111.7	-131.4	24.7	1.3	0	0	0	120.5
671	P	58.4	Low	33.7	Very low	110 Å²	110	133.9 Å²	133.9	71%	0.714	76%	0.763	S	S	*	*				-107.9	-159.4	-119.6	41.6	-26	0	0	0	113.2
672	P	48.3	Very low	34	Very low	110 Å²	110	137.1 Å²	137.1	71%	0.714	78%	0.776	S	S	*	*			cis	-148.7	-167.4	7.4	44.4	-22.2	0	0	0	119.1
673	S	30.5	Very low	34	Very low	114 Å²	114	128.6 Å²	128.6	80%	0.797	77%	0.767	S	S	*	*			trans	93.2	164.6	141.8	-72.6	0	0	0	0	123.6
674	Y	30.6	Very low	34.2	Very low	214 Å²	214	127.8 Å²	127.8	84%	0.839	77%	0.774	S	S	*	*			trans	-93.2	150.2	-155.8	-90.2	-102.8	0	0	0	117.9
675	N	33.8	Very low	33.3	Very low	137 Å²	137	126.8 Å²	126.8	73%	0.733	78%	0.782	S	S	*	*			trans	27.5	118.5	143.1	-71.9	-10.8	0	0	0	122.9
676	H	30	Very low	33.1	Very low	183 Å²	183	126.2 Å²	126.2	85%	0.847	79%	0.791	S	S	*	*			trans	-160.8	142	132.9	-98.2	-86.6	0	0	0	106.5
677	R	26.3	Very low	32.9	Very low	215 Å²	215	121.4 Å²	121.4	81%	0.811	79%	0.789	S	S	*	*			cis	92.5	130.3	24.8	-160.3	-177.1	-176.4	-172.4	3.5	114.8
678	N	30	Very low	32.8	Very low	147 Å²	147	121.4 Å²	121.4	79%	0.786	80%	0.799	S	S	*	*			trans	81.2	150.5	-176.9	-59.7	-10	0	0	0	115.7
679	G	27.4	Very low	32.8	Very low	80 Å²	80	121.6 Å²	121.6	83%	0.825	80%	0.802	S	S	*	*			cis	141.3	137.7	-14.2	0	0	0	0	0	115.8
680	G	27.1	Very low	32.9	Very low	81 Å²	81	124.9 Å²	124.9	84%	0.835	81%	0.807	S	S	*	*			trans	108.1	158.8	174.5	0	0	0	0	0	114.5
681	A	30.3	Very low	31.8	Very low	94 Å²	94	126.6 Å²	126.6	78%	0.777	81%	0.81	S	S	*	*			cis	-164.7	-178.8	-9.6	0	0	0	0	0	110.9
682	S	31	Very low	30.3	Very low	131 Å²	131	125.6 Å²	125.6	92%	0.916	81%	0.806	S	S	*	*			trans	90.5	130.8	179.4	-44.8	0	0	0	0	115.5
683	G	29.1	Very low	29.4	Very low	75 Å²	75	124 Å²	124	77%	0.773	80%	0.802	S	S	*	*			cis	-162.5	-171.5	0.8	0	0	0	0	0	114.8
684	A	29.8	Very low	29.2	Very low	113 Å²	113	127.9 Å²	127.9	93%	0.934	81%	0.805	S	S	*	*			trans	-36.5	161.1	-173.6	0	0	0	0	0	118.5
685	G	28.4	Very low	29.1	Very low	80 Å²	80	123.8 Å²	123.8	83%	0.825	80%	0.802	S	S	*	*			cis	167.9	177.2	5.7	0	0	0	0	0	108.3
686	G	27.5	Very low	28.8	Very low	84 Å²	84	121 Å²	121	87%	0.866	80%	0.798	S	S	*	*			cis	-163	177	-2.7	0	0	0	0	0	109.9
687	S	28.7	Very low	29.7	Very low	116 Å²	116	117.5 Å²	117.5	81%	0.811	79%	0.791	S	S	*	*			trans	-107.2	146	-164.4	58	0	0	0	0	116
688	S	29	Very low	29.6	Very low	131 Å²	131	114.7 Å²	114.7	92%	0.916	79%	0.791	S	S	*	*			trans	-157.2	146.7	151.3	-84.2	0	0	0	0	112.4
689	G	29.3	Very low	29.4	Very low	62 Å²	62	112.6 Å²	112.6	64%	0.639	79%	0.788	S	S	*	*			trans	-144.3	-155.6	171.5	0	0	0	0	0	109.6
690	R	32.2	Very low	29.3	Very low	243 Å²	243	115.8 Å²	115.8	92%	0.917	79%	0.786	S	S	*	*			trans	78	158.1	-169.3	-21.6	137.4	172.1	-165.5	-5.4	114
691	N	30.1	Very low	29.3	Very low	139 Å²	139	117.2 Å²	117.2	74%	0.743	78%	0.784	S	S	*	*			cis	-153.5	166.5	6.8	-118.6	14.9	0	0	0	108.4
692	S	27.7	Very low	29.3	Very low	88 Å²	88	117.4 Å²	117.4	62%	0.615	78%	0.779	S	S	*	*			cis	176.1	166.7	-21.5	51.2	0	0	0	0	111.8
693	A	27.8	Very low	29.4	Very low	76 Å²	76	115.7 Å²	115.7	63%	0.628	77%	0.768	S	S	*	*			trans	84.9	135.3	139.2	0	0	0	0	0	122.7
694	F	26.6	Very low	29.2	Very low	197 Å²	197	119.8 Å²	119.8	86%	0.864	77%	0.771	S	S	*	*			trans	69.1	156.7	140.2	-78.7	-134	0	0	0	118
695	V	29.5	Very low	29.2	Very low	128 Å²	128	118.8 Å²	118.8	78%	0.776	76%	0.763	S	S	*	*			cis	-153.8	176.5	-20	114.7	0	0	0	0	109.4
696	A	27.8	Very low	29.2	Very low	78 Å²	78	119.3 Å²	119.3	65%	0.645	76%	0.755	S	S	*	*			trans	-81.9	-166.7	179.4	0	0	0	0	0	113.5
697	P	48.6	Very low	29.5	Very low	110 Å²	110	120.1 Å²	120.1	71%	0.714	75%	0.747	S	S	*	*			cis	-133.6	-166.7	-44.7	29.8	-7.8	0	0	0	113.8
698	L	24	Very low	29.6	Very low	155 Å²	155	120.1 Å²	120.1	81%	0.812	75%	0.747	S	S	*	*			trans	92.7	120.3	150.3	-71.3	168.3	0	0	0	122.5
699	S	25	Very low	29.9	Very low	103 Å²	103	120.7 Å²	120.7	72%	0.72	74%	0.735	S	S	*	*				88.3	130.7	128.2	70.6	0	0	0	0	123.4
700	N	25.3	Very low	29.9	Very low	147 Å²	147	124.7 Å²	124.7	79%	0.786	74%	0.739	S	S	*	*			trans	76.3	134.7	145.7	-77.2	2.9	0	0	0	123.2
701	S	28.3	Very low	29.7	Very low	111 Å²	111	120.3 Å²	120.3	78%	0.776	73%	0.728	S	S	*	*			trans	69	141.8	153.4	-59.4	0	0	0	0	118.2
702	S	29.6	Very low	29.7	Very low	98 Å²	98	120.9 Å²	120.9	69%	0.685	73%	0.726	S	S	*	*			cis	-166.4	168.6	-12.7	46.8	0	0	0	0	109.9
703	S	32.9	Very low	29.7	Very low	96 Å²	96	123.9 Å²	123.9	67%	0.671	73%	0.73	S	S	*	*			trans	36.1	115.2	151.4	57.6	0	0	0	0	118.9
704	N	24.8	Very low	29.7	Very low	160 Å²	160	130.4 Å²	130.4	86%	0.856	74%	0.74	S	S	*	*			cis	59.8	72.1	18	-129.3	30.2	0	0	0	115.1
705	A	29.6	Very low	29.7	Very low	92 Å²	92	125 Å²	125	76%	0.76	73%	0.732	S	S	*	*			trans	-158	121.2	155.5	0	0	0	0	0	107.6
706	S	28.9	Very low	29.6	Very low	92 Å²	92	126.6 Å²	126.6	64%	0.643	73%	0.731	S	S	*	*			cis	92.8	134.5	10.6	-43.5	0	0	0	0	117
707	S	33	Very low	29.6	Very low	100 Å²	100	129.7 Å²	129.7	70%	0.699	73%	0.731	S	S	*	*			trans	66.9	171.4	175.8	87.9	0	0	0	0	114.3	H709	S707-H709 PolarHBondContact OG-ND1 3.44Å; S707-H709 VanDerWaalsContact OG-ND1 3.11Å
708	S	32.6	Very low	28.8	Very low	116 Å²	116	130.6 Å²	130.6	81%	0.811	73%	0.73	S	S	*	*	S	Bend	cis	-91.6	170.9	26.2	32.9	0	0	0	0	116.2
709	H	34.8	Very low	29.1	Very low	144 Å²	144	130.8 Å²	130.8	67%	0.667	73%	0.729	S	S	*	*			cis	-174.4	151.8	-37.1	-118.7	51.7	0	0	0	105.5	S707	S707-H709 PolarHBondContact OG-ND1 3.44Å; S707-H709 VanDerWaalsContact OG-ND1 3.11Å
710	M	28.4	Very low	29.4	Very low	146 Å²	146	132.9 Å²	132.9	72%	0.719	73%	0.729	S	S	*	*			cis	-143.7	-104.5	-8	-164.7	-140.9	-67.2	0	0	111.1
711	Q	28.6	Very low	29.8	Very low	151 Å²	151	133 Å²	133	71%	0.706	73%	0.725	S	S	*	*			trans	-157.8	158.5	-162.1	-163.9	105.9	-2.3	0	0	111.7
712	Q	29.4	Very low	30	Very low	150 Å²	150	134.9 Å²	134.9	70%	0.701	73%	0.726	S	S	*	*			trans	91.2	157.7	133.2	-124.6	161.8	17.7	0	0	123.2
713	H	28.8	Very low	30	Very low	151 Å²	151	133.9 Å²	133.9	70%	0.699	73%	0.731	S	S	*	*			trans	82.5	117.3	164.3	-73.6	-76.3	0	0	0	122.7
714	Y	27.3	Very low	29.9	Very low	214 Å²	214	136.1 Å²	136.1	84%	0.839	74%	0.735	S	S	*	*			trans	14.9	128.4	141.2	-78.7	-97.6	0	0	0	122.3
715	A	26.4	Very low	30.2	Very low	82 Å²	82	135.3 Å²	135.3	68%	0.678	73%	0.731	S	S	*	*				83.5	133.2	126	0	0	0	0	0	123.1
716	H	27	Very low	30.3	Very low	163 Å²	163	136 Å²	136	76%	0.755	73%	0.73	S	S	*	*			trans	79.5	141.4	148.1	-90.1	-114.7	0	0	0	123.1
717	H	29.2	Very low	30.4	Very low	142 Å²	142	136.9 Å²	136.9	66%	0.657	74%	0.742	S	S	*	*			trans	66.5	114.2	154.2	-71.3	-56.4	0	0	0	124.4
718	N	30.4	Very low	30.5	Very low	130 Å²	130	136.6 Å²	136.6	70%	0.695	75%	0.746	S	S	*	*				45.1	125.2	114.7	-63.7	1	0	0	0	122.8
719	M	31.1	Very low	31.2	Very low	158 Å²	158	137.4 Å²	137.4	78%	0.778	75%	0.748	S	S	*	*				73.7	124.9	127.1	-75.4	-172	162.7	0	0	123.3
720	M	30	Very low	31	Very low	148 Å²	148	134.3 Å²	134.3	73%	0.729	76%	0.756	S	S	*	*				81.7	132.1	128.7	-67.7	-66.8	-172.2	0	0	123.5
721	H	34.2	Very low	31.1	Very low	150 Å²	150	132.1 Å²	132.1	69%	0.694	76%	0.761	S	S	*	*			trans	81.8	117	138.1	-85.3	-44.9	0	0	0	125.1
722	N	33.5	Very low	32.1	Very low	149 Å²	149	130.7 Å²	130.7	80%	0.797	77%	0.765	S	S	*	*				73	123.1	124.5	-75.6	16.3	0	0	0	124.8
723	G	28.3	Very low	32.1	Very low	77 Å²	77	128.7 Å²	128.7	79%	0.794	77%	0.774	S	S	*	*				107.6	160	128	0	0	0	0	0	117
724	N	32.3	Very low	32.2	Very low	143 Å²	143	125.3 Å²	125.3	77%	0.765	78%	0.78	S	S	*	*			cis	-167.6	169.1	-23	-166.3	12.7	0	0	0	108.7
725	L	30.6	Very low	32.5	Very low	144 Å²	144	122.7 Å²	122.7	75%	0.754	78%	0.78	S	S	*	*			trans	70	162.7	166	-53.9	167.4	0	0	0	117.5
726	S	32	Very low	33.3	Very low	106 Å²	106	124.1 Å²	124.1	74%	0.741	78%	0.782	S	S	*	*			cis	-177	128.4	-41.5	-92.2	0	0	0	0	110.3
727	A	30.3	Very low	33.5	Very low	110 Å²	110	124.7 Å²	124.7	91%	0.909	78%	0.783	S	S	*	*			trans	-168.8	162.6	158	0	0	0	0	0	111.4
728	A	34.5	Very low	33.6	Very low	94 Å²	94	125.7 Å²	125.7	78%	0.777	79%	0.788	S	S	*	*			trans	-153.3	-163.1	-177.4	0	0	0	0	0	109.5
729	P	47.8	Very low	33.5	Very low	133 Å²	133	128.3 Å²	128.3	86%	0.864	79%	0.789	S	S	*	*			cis	-124.8	173.3	-36.5	32.4	-15.4	0	0	0	112.9
730	G	30.6	Very low	33.3	Very low	80 Å²	80	130.2 Å²	130.2	83%	0.825	79%	0.787	S	S	*	*			trans	-173.7	145.8	168.4	0	0	0	0	0	112.8
731	A	31.7	Very low	33.2	Very low	100 Å²	100	127.9 Å²	127.9	83%	0.826	79%	0.786	S	S	*	*			trans	-136.9	-166.3	-173	0	0	0	0	0	111.5
732	P	47.7	Very low	32.9	Very low	120 Å²	120	125.8 Å²	125.8	78%	0.779	79%	0.788	S	S	*	*				-133.5	-175.6	-89.7	42.2	-26.1	0	0	0	115.5
733	A	30.4	Very low	32.6	Very low	109 Å²	109	124.4 Å²	124.4	90%	0.901	79%	0.79	S	S	*	*			trans	76.4	154.9	155.6	0	0	0	0	0	120.3
734	G	30.4	Very low	32.7	Very low	79 Å²	79	125.2 Å²	125.2	81%	0.814	79%	0.789	S	S	*	*			trans	134.2	100.5	159.3	0	0	0	0	0	117.8
735	D	33.4	Very low	32.7	Very low	160 Å²	160	123.9 Å²	123.9	86%	0.856	79%	0.791	S	S	*	*			trans	-87.2	149.7	140	-103.4	-51.7	0	0	0	107
736	P	44	Very low	32.6	Very low	111 Å²	111	124 Å²	124	72%	0.721	79%	0.793	S	S	*	*				-156.6	168.5	54.1	42.6	-21.6	0	0	0	119.6
737	K	31.5	Very low	32.6	Very low	176 Å²	176	125 Å²	125	77%	0.765	79%	0.789	S	S	*	*			trans	39.5	131.1	141.4	-67.1	-174	176.3	-174.8	0	123.8
738	H	29.8	Very low	32.7	Very low	163 Å²	163	127.6 Å²	127.6	76%	0.755	78%	0.782	S	S	*	*			trans	96.2	134.2	140.9	-69.5	-50.3	0	0	0	123.2
739	Y	28.8	Very low	32.6	Very low	185 Å²	185	132 Å²	132	73%	0.725	79%	0.786	S	S	*	*			trans	92.4	112.4	145.3	-107.9	-110.5	0	0	0	123.4
740	R	26.5	Very low	31.5	Very low	197 Å²	197	132.7 Å²	132.7	74%	0.743	78%	0.783	S	S	*	*			trans	60.9	110	138.2	-84.8	-166.4	-174.5	175.9	2	124.1
741	S	29.2	Very low	32	Very low	99 Å²	99	133.8 Å²	133.8	69%	0.692	78%	0.775	S	S	*	*				67.3	157.3	121.2	65.2	0	0	0	0	123.4
742	S	26.6	Very low	31.9	Very low	107 Å²	107	136 Å²	136	75%	0.748	77%	0.774	S	S	*	*			trans	80.9	131.2	-179.8	-45	0	0	0	0	113.3
743	S	28.7	Very low	31	Very low	120 Å²	120	134.2 Å²	134.2	84%	0.839	77%	0.769	S	S	*	*			cis	72.6	133.4	29.1	-45	0	0	0	0	114.1
744	A	30.6	Very low	30.8	Very low	93 Å²	93	133.6 Å²	133.6	77%	0.769	76%	0.758	S	S	*	*			cis	-164.1	151.6	-16.4	0	0	0	0	0	109.4
745	S	31.5	Very low	30.6	Very low	116 Å²	116	139.1 Å²	139.1	81%	0.811	76%	0.759	S	S	*	*			trans	-163.6	144.7	175.3	-33.7	0	0	0	0	108.8
746	D	29.3	Very low	30.2	Very low	147 Å²	147	136.3 Å²	136.3	79%	0.786	75%	0.753	S	S	*	*			cis	-164.4	-179.1	-3.9	-144.3	-35.1	0	0	0	111.9
747	L	30.5	Very low	29.3	Very low	127 Å²	127	139.3 Å²	139.3	67%	0.665	76%	0.757	S	S	*	*			trans	86.7	101.8	157.3	-62	152.8	0	0	0	121.5
748	Q	33.1	Very low	29.1	Very low	163 Å²	163	136.2 Å²	136.2	76%	0.762	76%	0.757	S	S	*	*				90.4	108.2	121.9	-72.3	174.1	-9.1	0	0	124.3
749	H	31.4	Very low	28.9	Very low	186 Å²	186	133.4 Å²	133.4	86%	0.861	76%	0.756	S	S	*	*				82.6	105.3	128.8	-85.4	32.5	0	0	0	122.9
750	D	25.4	Very low	28.7	Very low	149 Å²	149	132.4 Å²	132.4	80%	0.797	76%	0.76	S	S	*	*			trans	-54.3	-178.3	141.6	-91	-58.2	0	0	0	114.6
751	P	42.3	Very low	28.7	Very low	102 Å²	102	130 Å²	130	66%	0.662	77%	0.768	S	S	*	*			cis	-135.6	158	4.3	33.7	-14.2	0	0	0	118
752	N	29	Very low	28.5	Very low	148 Å²	148	129.2 Å²	129.2	79%	0.791	78%	0.775	S	S	*	*			trans	165.4	115.5	130.6	-88.1	-41.5	0	0	0	109
753	A	28.6	Very low	28.5	Very low	82 Å²	82	130.4 Å²	130.4	68%	0.678	78%	0.783	S	S	*	*				67	130	73.1	0	0	0	0	0	113.6
754	S	26.4	Very low	28.6	Very low	96 Å²	96	129 Å²	129	67%	0.671	78%	0.779	S	S	*	*			cis	-170.6	152.4	-0.2	-110.6	0	0	0	0	112.7
755	F	26	Very low	28.4	Very low	194 Å²	194	134.8 Å²	134.8	85%	0.851	78%	0.781	S	S	*	*			trans	66.4	158.3	155.7	-75.4	-132	0	0	0	116.5
756	S	25.4	Very low	28.3	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	78%	0.777	S	S	*	*			cis	-148.6	179.4	4.8	-143.3	0	0	0	0	113.8
757	Q	25.2	Very low	28.1	Very low	174 Å²	174	132.9 Å²	132.9	81%	0.813	78%	0.779	S	S	*	*			trans	-79.2	175.2	-171.9	-58.7	161.4	-19.2	0	0	115.7
758	S	26.7	Very low	28	Very low	110 Å²	110	132.8 Å²	132.8	77%	0.769	78%	0.784	S	S	*	*			trans	85.8	147.5	162.3	-79.3	0	0	0	0	119.1
759	S	25.9	Very low	27.7	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	79%	0.792	S	S	*	*			cis	-163	161.5	-15.2	-108.2	0	0	0	0	114.1
760	M	24.4	Very low	27.6	Very low	165 Å²	165	133.6 Å²	133.6	81%	0.813	79%	0.79	S	S	*	*			trans	13.5	121.3	154.4	-70.4	-71.3	141.7	0	0	120.7
761	T	26.8	Very low	27.9	Very low	147 Å²	147	136.4 Å²	136.4	90%	0.902	80%	0.795	S	S	*	*				174.1	158.3	109.1	31	0	0	0	0	112.4
762	G	25.7	Very low	27.4	Very low	82 Å²	82	139.5 Å²	139.5	85%	0.845	81%	0.805	S	S	*	*			trans	100.5	100.6	162	0	0	0	0	0	116.5
763	S	25.8	Very low	27.5	Very low	132 Å²	132	137.5 Å²	137.5	92%	0.923	80%	0.8	S	S	*	*			trans	-89.6	154.5	168.5	-167.9	0	0	0	0	111.5
764	A	30.7	Very low	27.6	Very low	91 Å²	91	138.8 Å²	138.8	75%	0.752	80%	0.804	S	S	*	*			trans	-87.6	156.6	-170.9	0	0	0	0	0	114.1
765	R	26.5	Very low	27.9	Very low	214 Å²	214	142.2 Å²	142.2	81%	0.808	81%	0.809	S	S	*	*			trans	-156	153.6	148.6	-117.6	168.2	-179.5	-165.1	-3.2	113.6	N1208	R765-N1208 PolarHBondContact NH1-O 2.69Å
766	S	29.2	Very low	28.1	Very low	105 Å²	105	144.2 Å²	144.2	73%	0.734	81%	0.813	S	S	*	*			trans	-86.8	152.2	-164.1	175.1	0	0	0	0	114.9
767	S	25.6	Very low	28.4	Very low	118 Å²	118	149.9 Å²	149.9	83%	0.825	82%	0.818	S	S	*	*			trans	-149.3	87.8	145	66.1	0	0	0	0	111.7
768	V	28.8	Very low	28.7	Very low	125 Å²	125	150.9 Å²	150.9	76%	0.758	82%	0.823	S	S	*	*			trans	-132.8	100.4	169.3	-174.4	0	0	0	0	109.6
769	F	25.6	Very low	28.7	Very low	212 Å²	212	151.4 Å²	151.4	93%	0.93	83%	0.827	S	S	*	*			trans	-155.7	83.2	170.4	-118.3	-75.7	0	0	0	109.4
770	D	29.2	Very low	29.3	Very low	153 Å²	153	152.7 Å²	152.7	82%	0.818	83%	0.83	S	S	*	*			trans	-163.9	98.3	164.2	-131.1	-19.2	0	0	0	112.6
771	K	32.4	Very low	29.6	Very low	208 Å²	208	155.9 Å²	155.9	90%	0.904	83%	0.833	S	S	*	*			trans	165.6	112.2	150.5	-93.2	153.6	-170.6	171.2	0	111.1
772	L	31.4	Very low	29.8	Very low	167 Å²	167	154.6 Å²	154.6	87%	0.874	83%	0.827	S	S	*	*			trans	-97.7	159.8	161.8	-80.4	166.2	0	0	0	110.6
773	P	31.2	Very low	30.1	Very low	107 Å²	107	156.7 Å²	156.7	70%	0.695	82%	0.824	S	S	*	*			trans	-62.1	159	-174.6	-26.1	36.7	0	0	0	116.2	H775	P773-H775 PolarHBondContact O-N 3.48Å
774	S	31.4	Very low	30	Very low	108 Å²	108	156.7 Å²	156.7	76%	0.755	82%	0.818	S	S	*	*	S	Bend	trans	-86.7	23.9	-159.2	52.7	0	0	0	0	117.1	Y776	S774-Y776 PolarHBondContact O-N 2.91Å
775	H	31.9	Very low	30	Very low	169 Å²	169	159.5 Å²	159.5	78%	0.782	82%	0.819	S	S	*	*			trans	-85.6	2.6	-169.7	-66.5	-78.2	0	0	0	115.8	P773	P773-H775 PolarHBondContact O-N 3.48Å
776	Y	31.4	Very low	29.9	Very low	235 Å²	235	157.7 Å²	157.7	92%	0.922	82%	0.82	S	S	*	*	S	Bend	trans	-114	51.6	178	-99.1	-82.5	0	0	0	114	S774	S774-Y776 PolarHBondContact O-N 2.91Å
777	R	30.1	Very low	29.9	Very low	221 Å²	221	156.1 Å²	156.1	83%	0.834	81%	0.806	S	S	*	*			trans	-147.1	109.9	161.6	-76.8	-166.9	177.5	-164.3	0.3	111.6
778	H	31.5	Very low	29.9	Very low	195 Å²	195	155.8 Å²	155.8	90%	0.903	80%	0.8	S	S	*	*			trans	-161.6	95.8	137.4	-88.8	-56.5	0	0	0	110.2
779	S	28	Very low	29.7	Very low	122 Å²	122	157.4 Å²	157.4	85%	0.853	79%	0.792	S	S	*	*			trans	-97.1	126.9	156.2	-177.7	0	0	0	0	106.9
780	T	36.9	Very low	30.1	Very low	130 Å²	130	152.4 Å²	152.4	80%	0.798	78%	0.781	S	S	*	*			trans	-83.2	129	-168.8	41.9	0	0	0	0	112.1
781	R	32.5	Very low	29.9	Very low	232 Å²	232	150.7 Å²	150.7	88%	0.875	78%	0.781	S	S	*	*			trans	-115.1	131.1	174.3	-157.8	178.7	-165.1	-148.2	4.3	108.3
782	P	29.5	Very low	29.6	Very low	121 Å²	121	144.5 Å²	144.5	79%	0.786	77%	0.769	S	S	*	*			trans	-75.5	137	-172.3	29.1	-34.9	0	0	0	112.5
783	T	32.9	Very low	29.2	Very low	126 Å²	126	145.4 Å²	145.4	77%	0.773	77%	0.769	S	S	*	*			trans	-99.7	128.4	172.7	-53.1	0	0	0	0	109.8	I785	T783-I785 HydrophobicContact CG2-CD1 4.4Å; T783-I785 HydrophobicContact CG2-CG1 4.14Å
784	V	24.4	Very low	28.8	Very low	131 Å²	131	145.5 Å²	145.5	79%	0.794	77%	0.772	S	S	*	*			trans	-109.1	136.9	173.8	179.3	0	0	0	0	108.6
785	I	29.1	Very low	29.3	Very low	150 Å²	150	145.5 Å²	145.5	77%	0.769	77%	0.769	S	S	*	*			trans	-132	136.1	178.7	-57.4	-178.1	0	0	0	109.4	T783	T783-I785 HydrophobicContact CG2-CD1 4.4Å; T783-I785 HydrophobicContact CG2-CG1 4.14Å
786	Q	25	Very low	29	Very low	177 Å²	177	143 Å²	143	83%	0.827	77%	0.771	S	S	*	*			trans	-129.6	174.8	178.3	-101	-153.9	17	0	0	110.4
787	P	29.2	Very low	28.9	Very low	71 Å²	71	135.4 Å²	135.4	46%	0.461	76%	0.757	S	S	.	*			trans	-104.5	174.3	-131.2	40.2	-42	0	0	0	119.3
788	T	24.5	Very low	28.8	Very low	112 Å²	112	132 Å²	132	69%	0.687	76%	0.755	S	S	*	*			trans	76.6	131.3	169.1	65.2	0	0	0	0	117.5	G546	G546-T788 PolarHBondContact O-N 3.39Å
789	R	24.8	Very low	28.7	Very low	158 Å²	158	133.2 Å²	133.2	60%	0.596	75%	0.751	S	S	*	*			cis	88.1	141.4	20	-150.2	-127.2	180	134.5	18.2	113	N614	N614-R789 PolarHBondContact OD1-NH2 2.96Å
790	P	35.8	Very low	28.6	Very low	108 Å²	108	136.3 Å²	136.3	70%	0.701	75%	0.749	S	S	*	*			cis	-123.5	176.4	4.6	45.8	-30.5	0	0	0	115.2
791	S	24.6	Very low	28	Very low	116 Å²	116	134.6 Å²	134.6	81%	0.811	75%	0.748	S	S	*	*				-161.6	167.8	82.8	60.2	0	0	0	0	116.2
792	A	24.7	Very low	27.6	Very low	79 Å²	79	128.5 Å²	128.5	65%	0.653	75%	0.748	S	S	*	*			trans	-35.9	163.1	167.6	0	0	0	0	0	118.4
793	Q	24.6	Very low	27.3	Very low	186 Å²	186	127.1 Å²	127.1	87%	0.869	75%	0.746	S	S	*	*			cis	-161.7	156.2	0.5	-120.6	158.2	-4.9	0	0	111.9
794	S	22.5	Very low	27	Very low	109 Å²	109	125.6 Å²	125.6	76%	0.762	75%	0.747	S	S	*	*			trans	-110.9	-172.8	160.7	-46.2	0	0	0	0	108.1
795	P	41.1	Very low	27.1	Very low	108 Å²	108	125 Å²	125	70%	0.701	75%	0.748	S	S	*	*			cis	-147.4	-174.6	4.9	46	-26.7	0	0	0	117.7
796	S	25.4	Very low	27.5	Very low	116 Å²	116	123.4 Å²	123.4	81%	0.811	75%	0.748	S	S	*	*			trans	69.6	174.6	151.1	-49.9	0	0	0	0	117.2
797	A	29.1	Very low	27.6	Very low	76 Å²	76	121.6 Å²	121.6	63%	0.628	75%	0.748	S	S	*	*			cis	-160.8	156.2	7.7	0	0	0	0	0	114.6
798	L	27.9	Very low	27.5	Very low	150 Å²	150	122.1 Å²	122.1	79%	0.785	75%	0.754	S	S	*	*			trans	64.1	171.1	143.2	-69.1	162.6	0	0	0	117.9
799	R	29.5	Very low	27.5	Very low	219 Å²	219	123.2 Å²	123.2	83%	0.826	76%	0.755	S	S	*	*			cis	-146.3	156.5	12.4	-128.9	175.4	-64.2	-177	1.9	106.7
800	K	25.9	Very low	27.5	Very low	187 Å²	187	122.3 Å²	122.3	81%	0.813	76%	0.761	S	S	*	*			cis	75.8	145.7	18	-151.8	171.3	-175.3	178.8	0	115.9
801	A	24.8	Very low	27	Very low	95 Å²	95	126.1 Å²	126.1	79%	0.785	76%	0.763	S	S	*	*			trans	78	147.5	-176.8	0	0	0	0	0	114.8
802	A	23.8	Very low	27	Very low	104 Å²	104	130.6 Å²	130.6	86%	0.86	76%	0.762	S	S	*	*			cis	-151.2	-178.5	-5.9	0	0	0	0	0	111.5
803	A	24.2	Very low	27.6	Very low	91 Å²	91	132.1 Å²	132.1	75%	0.752	77%	0.765	S	S	*	*			trans	-99	162.3	-177.8	0	0	0	0	0	114.1
804	A	26.3	Very low	27.6	Very low	95 Å²	95	129.1 Å²	129.1	79%	0.785	76%	0.76	S	S	*	*			trans	-161.2	150.7	156.2	0	0	0	0	0	111.9
805	S	26.9	Very low	27.8	Very low	117 Å²	117	129.2 Å²	129.2	82%	0.818	76%	0.761	S	S	*	*			trans	-155.6	133.3	167.3	-64	0	0	0	0	111.1
806	P	37.6	Very low	27.1	Very low	118 Å²	118	128.7 Å²	128.7	77%	0.766	77%	0.765	S	S	*	*			trans	-108.6	137.7	153	-2.9	24.8	0	0	0	110.3
807	V	25.5	Very low	27.2	Very low	138 Å²	138	127.9 Å²	127.9	84%	0.836	76%	0.76	S	S	*	*				73.4	127.7	67.4	169.8	0	0	0	0	111.9
808	S	27.8	Very low	27.1	Very low	83 Å²	83	131.3 Å²	131.3	58%	0.58	77%	0.768	S	S	*	*			cis	-164.8	166.4	-9.5	52.1	0	0	0	0	110.3
809	N	25.1	Very low	27	Very low	135 Å²	135	130.5 Å²	130.5	72%	0.722	76%	0.763	S	S	*	*				162.3	156.8	99.8	-91.1	-26.6	0	0	0	108.4
810	L	25.5	Very low	26.8	Very low	138 Å²	138	129 Å²	129	72%	0.723	76%	0.763	S	S	*	*			cis	-155.3	138.2	11.1	-118	156.1	0	0	0	111.3
811	Y	23.9	Very low	26.8	Very low	188 Å²	188	124 Å²	124	74%	0.737	76%	0.757	S	S	*	*			trans	33.9	127.8	149.4	-86.4	-136.5	0	0	0	123.1
812	R	24.5	Very low	28.3	Very low	210 Å²	210	124.8 Å²	124.8	79%	0.792	75%	0.754	S	S	*	*				80.5	152.3	72.9	-122.3	-165.1	172.3	-164.2	-0.2	113.7
813	P	38.4	Very low	29.3	Very low	111 Å²	111	125.6 Å²	125.6	72%	0.721	75%	0.75	S	S	*	*			cis	-133.6	-153	1.9	45.1	-25.8	0	0	0	115.4
814	T	23.9	Very low	29.5	Very low	123 Å²	123	131.7 Å²	131.7	76%	0.755	75%	0.754	S	S	*	*			trans	-115.5	168.9	-168	53.5	0	0	0	0	115.3
815	S	27.7	Very low	29.6	Very low	111 Å²	111	134.2 Å²	134.2	78%	0.776	75%	0.754	S	S	*	*			trans	68.3	116.6	139.5	58.4	0	0	0	0	122.6
816	A	25.2	Very low	29.7	Very low	97 Å²	97	134 Å²	134	80%	0.802	75%	0.753	S	S	*	*			trans	171.2	168.1	139.8	0	0	0	0	0	109.5
817	S	27.6	Very low	29.1	Very low	100 Å²	100	132 Å²	132	70%	0.699	75%	0.753	S	S	*	*			cis	-179.1	158.8	-42.2	-84.9	0	0	0	0	107.7
818	N	26.5	Very low	29.1	Very low	148 Å²	148	129 Å²	129	79%	0.791	75%	0.75	S	S	*	*			trans	70.6	153.2	164.6	-61.9	-15.8	0	0	0	117.2
819	L	25.5	Very low	29.1	Very low	132 Å²	132	132.8 Å²	132.8	69%	0.691	76%	0.763	S	S	*	*			cis	-162	167.5	-5.8	-118.7	171.4	0	0	0	112.6
820	F	25.4	Very low	29.2	Very low	187 Å²	187	132.3 Å²	132.3	82%	0.82	77%	0.765	S	S	*	*			trans	74.7	150.2	157.2	-83.2	-65.3	0	0	0	123.8
821	A	25.9	Very low	29.2	Very low	82 Å²	82	128.8 Å²	128.8	68%	0.678	76%	0.761	S	S	*	*			trans	-159.6	-156.7	174.2	0	0	0	0	0	106.7
822	P	56.7	Low	29.3	Very low	112 Å²	112	129.8 Å²	129.8	73%	0.727	77%	0.766	S	S	*	*				-108.9	-170	-64.3	40.6	-29.3	0	0	0	111.9
823	P	44.3	Very low	29.3	Very low	121 Å²	121	124.9 Å²	124.9	79%	0.786	76%	0.763	S	S	*	*				-150.8	-173.7	111	36.6	-18.7	0	0	0	114
824	R	29.1	Very low	28.8	Very low	220 Å²	220	123.9 Å²	123.9	83%	0.83	76%	0.759	S	S	*	*			cis	-167.4	145.3	-49.2	-101.7	-172.7	168.3	-166.7	-3.5	108.7
825	N	28.8	Very low	28.9	Very low	148 Å²	148	125 Å²	125	79%	0.791	76%	0.76	S	S	*	*			trans	61	170.2	160.5	-69.4	20.2	0	0	0	116.7
826	S	28.2	Very low	28.9	Very low	113 Å²	113	124.2 Å²	124.2	79%	0.79	76%	0.76	S	S	*	*			cis	-172	161.2	-27.5	50.8	0	0	0	0	107.8
827	G	25.5	Very low	29	Very low	74 Å²	74	124.3 Å²	124.3	76%	0.763	76%	0.761	S	S	*	*			cis	148.8	121.2	-1.3	0	0	0	0	0	111.8
828	G	25.7	Very low	28.9	Very low	75 Å²	75	129.4 Å²	129.4	77%	0.773	77%	0.765	S	S	*	*			trans	99.5	171.2	-170.6	0	0	0	0	0	113.5
829	L	27.6	Very low	28.9	Very low	164 Å²	164	129.6 Å²	129.6	86%	0.859	76%	0.761	S	S	*	*			cis	-167.1	148.9	-6.9	-104.4	158.2	0	0	0	109.9
830	V	27.2	Very low	29.1	Very low	125 Å²	125	127.7 Å²	127.7	76%	0.758	76%	0.759	S	S	*	*			trans	59.4	137.8	150.4	172.8	0	0	0	0	121.9	Y832	V830-Y832 HydrophobicContact CG1-CD2 4.45Å; V830-Y832 HydrophobicContact CG1-CE2 4.29Å
831	G	25.1	Very low	29.2	Very low	63 Å²	63	123.8 Å²	123.8	65%	0.649	75%	0.751	S	S	*	*			trans	152.8	93.2	138.9	0	0	0	0	0	120.4
832	Y	26.4	Very low	29.4	Very low	210 Å²	210	127.9 Å²	127.9	82%	0.824	76%	0.756	S	S	*	*			trans	32.9	124.5	136.6	-61.5	-68.8	0	0	0	121.7	V830	V830-Y832 HydrophobicContact CG1-CD2 4.45Å; V830-Y832 HydrophobicContact CG1-CE2 4.29Å
833	S	24.8	Very low	28.1	Very low	106 Å²	106	128.9 Å²	128.9	74%	0.741	76%	0.755	S	S	*	*				76.6	152.1	99.1	-63.2	0	0	0	0	116.2
834	S	28.1	Very low	27.5	Very low	91 Å²	91	129.3 Å²	129.3	64%	0.636	75%	0.749	S	S	*	*			cis	-174.7	168	-13.8	51.7	0	0	0	0	110.2
835	N	26	Very low	27.5	Very low	145 Å²	145	127.4 Å²	127.4	78%	0.775	75%	0.749	S	S	*	*			trans	68.5	110.6	149.2	-66.6	-11.1	0	0	0	121.8
836	A	26.3	Very low	27.4	Very low	95 Å²	95	131.7 Å²	131.7	79%	0.785	76%	0.755	S	S	*	*				81.8	157.7	113.8	0	0	0	0	0	122.3
837	A	28	Very low	27.6	Very low	99 Å²	99	130.2 Å²	130.2	82%	0.818	75%	0.749	S	S	*	*			trans	69.9	164.4	164.9	0	0	0	0	0	118.3
838	R	26.8	Very low	27.8	Very low	208 Å²	208	133.7 Å²	133.7	79%	0.785	75%	0.749	S	S	*	*			cis	177.5	153.5	-36.4	-167.8	173.2	170.3	133.3	-0.8	106.5
839	E	26.4	Very low	28.3	Very low	151 Å²	151	132.7 Å²	132.7	71%	0.706	73%	0.727	S	S	*	*			trans	60.1	178.1	169.5	-77	136.4	-144.4	0	0	116.2
840	S	27.8	Very low	28.8	Very low	92 Å²	92	129.6 Å²	129.6	64%	0.643	71%	0.711	S	S	*	*				-162.8	171.2	-57.5	69.4	0	0	0	0	110.1
841	T	27.6	Very low	29.3	Very low	105 Å²	105	128.2 Å²	128.2	64%	0.644	70%	0.699	S	S	*	*			trans	64.2	97.1	151.5	-45.4	0	0	0	0	116.9
842	Q	31.5	Very low	29.9	Very low	169 Å²	169	130.4 Å²	130.4	79%	0.79	69%	0.692	S	S	*	*				73.8	162	94	-69.2	-174.9	-81.1	0	0	116.5
843	D	29.9	Very low	30.6	Very low	133 Å²	133	126.9 Å²	126.9	71%	0.711	69%	0.687	S	S	*	*			trans	74.5	146.7	162.3	-67.3	-4.6	0	0	0	119.7
844	I	29.8	Very low	30.7	Very low	130 Å²	130	128.9 Å²	128.9	67%	0.667	69%	0.689	S	S	*	*			cis	-163.1	154.5	-26.7	-128.1	171.3	0	0	0	112.1
845	H	29.1	Very low	30.8	Very low	179 Å²	179	129.9 Å²	129.9	83%	0.829	70%	0.696	S	S	*	*			trans	75.4	153	154.5	-86.9	-144.6	0	0	0	126.9
846	R	28.1	Very low	32.3	Very low	239 Å²	239	128.3 Å²	128.3	90%	0.902	69%	0.694	S	S	*	*			trans	-78.1	169.5	169.5	-77.7	172.6	178.9	163.5	-1.3	112
847	A	32.5	Very low	32.4	Very low	82 Å²	82	131.7 Å²	131.7	68%	0.678	70%	0.698	S	S	*	*			cis	-174.3	179.2	-12	0	0	0	0	0	110.3
848	L	29.4	Very low	32.5	Very low	146 Å²	146	131.3 Å²	131.3	76%	0.764	69%	0.694	S	S	*	*			trans	134.9	168.8	146	-69.9	173.9	0	0	0	114.7
849	N	36.9	Very low	32.5	Very low	55 Å²	55	132.2 Å²	132.2	29%	0.294	70%	0.698	S	S	.	*				158.9	91.3	-57.9	165.1	30.4	0	0	0	113	P910 K911	N849-P910 HydrophobicContact CB-CG 4.17Å; N849-P910 WeakPolarHBondContact OD1-CB 3.36Å; N849-P910 WeakPolarHBondContact OD1-CD 3.39Å; N849-P910 WeakPolarHBondContact OD1-CG 3.27Å; N849-K911 WeakPolarHBondContact O-CD 3.49Å; N849-K911 WeakPolarHBondContact O-CE 3.41Å; N849-K911 PolarHBondContact O-NZ 3Å; N849-K911 WeakPolarHBondContact OD1-CG 3.43Å
850	D	37	Very low	32.4	Very low	99 Å²	99	129.2 Å²	129.2	53%	0.529	69%	0.694	S	S	.	*			trans	-165.3	152.4	-179.6	-77.6	-74.6	0	0	0	111.3	P910 K911	D850-P910 CarbonylContact C-O 3.56Å; D850-P910 WeakPolarHBondContact CA-O 3.3Å; D850-K911 VanDerWaalsContact OD1-CD 3.26Å; D850-K911 WeakPolarHBondContact OD1-CD 3.34Å; D850-K911 IonicContact OD1-NZ 3.3Å; D850-K911 PolarHBondContact OD1-NZ 3Å; D850-K911 IonicContact OD2-NZ 2.67Å; D850-K911 PolarHBondContact OD2-NZ 3.48Å
851	L	37	Very low	32.4	Very low	95 Å²	95	131 Å²	131	50%	0.497	70%	0.701	S	S	.	*			cis	-168	129.8	-13.2	-117.5	173.9	0	0	0	114.1	P910 K911	L851-P910 PolarHBondContact N-O 3.38Å; L851-K911 CarbonylContact C-O 3.57Å; L851-K911 WeakPolarHBondContact CA-O 3.09Å; L851-K911 HydrophobicContact CD2-CB 4.13Å; L851-K911 HydrophobicContact CG-CB 4.12Å; L851-K911 HydrophobicContact CG-CD 4.24Å
852	E	39.2	Very low	33.4	Very low	109 Å²	109	131.1 Å²	131.1	51%	0.509	70%	0.703	S	S	.	*			trans	62.3	165.1	149.3	-84.8	172.9	-162.1	0	0	122	K911 V913	E852-K911 PolarHBondContact N-O 3.37Å; E852-V913 PolarHBondContact OE1-N 3.08Å
853	L	39.5	Very low	33.3	Very low	136 Å²	136	128.9 Å²	128.9	71%	0.712	70%	0.697	S	S	*	*			cis	-160.2	178.2	4.9	-128.7	171	0	0	0	112.9
854	N	28.6	Very low	33.3	Very low	149 Å²	149	130 Å²	130	80%	0.797	70%	0.698	S	S	*	*			trans	93.5	157.7	158.4	-70.9	-34.5	0	0	0	124.1
855	S	30.3	Very low	33.2	Very low	112 Å²	112	130.8 Å²	130.8	78%	0.783	70%	0.699	S	S	*	*			trans	-142.2	-157.7	-163.5	-39.9	0	0	0	0	111.3
856	P	55.9	Low	33.2	Very low	111 Å²	111	131.7 Å²	131.7	72%	0.721	70%	0.696	S	S	*	*			cis	-139.9	-159.6	-16.2	30.7	-4	0	0	0	115.6
857	L	30.1	Very low	33.1	Very low	166 Å²	166	131.8 Å²	131.8	87%	0.869	70%	0.696	S	S	*	*			trans	78.6	147.2	172.4	-77.6	72.7	0	0	0	118
858	A	28.8	Very low	32.9	Very low	91 Å²	91	135.2 Å²	135.2	75%	0.752	70%	0.702	S	S	*	*			cis	-172.2	-175	-22.2	0	0	0	0	0	108
859	R	26.9	Very low	33.5	Very low	227 Å²	227	133.7 Å²	133.7	86%	0.857	70%	0.701	S	S	*	*			cis	-165	154.4	-1	-160	-176.6	179.2	162.6	0.5	110.9
860	S	25.2	Very low	34.1	Very low	88 Å²	88	136.7 Å²	136.7	62%	0.615	72%	0.723	S	S	*	*			trans	61.8	134.9	155.8	40.3	0	0	0	0	121
861	T	26.8	Very low	35	Very low	131 Å²	131	136.8 Å²	136.8	80%	0.804	73%	0.729	S	S	*	*			cis	86.6	152.2	24.5	71.5	0	0	0	0	116.1
862	P	49.9	Very low	34.5	Very low	106 Å²	106	143.2 Å²	143.2	69%	0.688	75%	0.747	S	S	*	*			cis	-145.3	-170.8	-9.7	33.5	-8.8	0	0	0	118.1
863	N	28.2	Very low	34.2	Very low	123 Å²	123	144.3 Å²	144.3	66%	0.658	76%	0.761	S	S	*	*			trans	73	127	146.2	-78.5	30.8	0	0	0	122.4
864	E	30.4	Very low	34.5	Very low	155 Å²	155	142.8 Å²	142.8	72%	0.724	76%	0.759	S	S	*	*				85	151	78.3	-72.8	-179.9	174	0	0	114
865	E	27.3	Very low	34.5	Very low	147 Å²	147	141 Å²	141	69%	0.687	75%	0.754	S	S	*	*			cis	-157.8	164.7	-10.3	-127.5	-164.9	162.9	0	0	110.8
866	Y	30.1	Very low	34.4	Very low	199 Å²	199	141.7 Å²	141.7	78%	0.78	75%	0.753	S	S	*	*			trans	52.5	149.7	158.7	-87.1	-81.3	0	0	0	125.1
867	R	25.9	Very low	33.2	Very low	240 Å²	240	142.5 Å²	142.5	91%	0.906	76%	0.756	S	S	*	*			trans	102.1	134.5	142.1	-122.4	179.1	-163.1	174.4	5.9	121.2
868	I	28.5	Very low	33.2	Very low	155 Å²	155	139.3 Å²	139.3	80%	0.795	75%	0.747	S	S	*	*			trans	-83.4	145	168.5	-47.4	160.1	0	0	0	106.3
869	P	40.4	Very low	33.2	Very low	114 Å²	114	140.9 Å²	140.9	74%	0.74	75%	0.748	S	S	*	*				-149.2	-135.7	55.8	48.2	-24	0	0	0	114.4
870	P	49.8	Very low	33.5	Very low	118 Å²	118	134.9 Å²	134.9	77%	0.766	74%	0.741	S	S	*	*			trans	-116	-115.6	-139.3	24.6	4.7	0	0	0	116.8
871	P	55.8	Low	33.9	Very low	101 Å²	101	135.3 Å²	135.3	66%	0.656	74%	0.744	S	S	*	*				-118	-172.2	-116.6	39.7	-24.1	0	0	0	116.3
872	R	27.1	Very low	34.3	Very low	229 Å²	229	135.2 Å²	135.2	86%	0.864	74%	0.738	S	S	*	*			trans	87.1	142.1	176.6	-48.6	172.8	178.2	-163.6	-2.2	113.2
873	V	32.4	Very low	33.6	Very low	132 Å²	132	141.1 Å²	141.1	80%	0.8	75%	0.748	S	S	*	*			cis	72.8	136.7	32.2	-174.9	0	0	0	0	112.1
874	P	45.8	Very low	34	Very low	105 Å²	105	139.5 Å²	139.5	68%	0.682	75%	0.752	S	S	*	*			cis	-90.5	-135.6	2.4	27	-9.1	0	0	0	111.8
875	T	29.1	Very low	35	Very low	112 Å²	112	137.3 Å²	137.3	69%	0.687	75%	0.752	S	S	*	*			cis	-162.1	135.7	12.3	-13.9	0	0	0	0	105.4
876	V	28.5	Very low	35.4	Very low	125 Å²	125	137.6 Å²	137.6	76%	0.758	76%	0.757	S	S	*	*				49.4	98.3	67.3	-169.8	0	0	0	0	110.3
877	T	29.6	Very low	35.4	Very low	129 Å²	129	136.2 Å²	136.2	79%	0.791	76%	0.757	S	S	*	*				-162.1	167.2	74.7	38.6	0	0	0	0	110.7
878	S	30.6	Very low	35.6	Very low	98 Å²	98	129 Å²	129	69%	0.685	74%	0.743	S	S	*	*			cis	-167	168	-12.6	49	0	0	0	0	111.2
879	T	30	Very low	35.6	Very low	124 Å²	124	129 Å²	129	76%	0.761	74%	0.744	S	S	*	*			trans	-22.4	153.4	149.6	51	0	0	0	0	117.1
880	S	32.3	Very low	35.1	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	75%	0.75	S	S	*	*			cis	173.9	167.5	-3.2	51.3	0	0	0	0	110.6
881	S	34.4	Very low	35.2	Very low	96 Å²	96	134.6 Å²	134.6	67%	0.671	75%	0.75	S	S	*	*			trans	69	142.2	145.9	165.7	0	0	0	0	118.6
882	N	34.9	Very low	33.9	Very low	130 Å²	130	134.3 Å²	134.3	70%	0.695	76%	0.756	S	S	*	*			cis	-168.3	170.9	-14.1	-103.2	-39.9	0	0	0	110.3
883	Y	33.8	Very low	34.1	Very low	229 Å²	229	128.3 Å²	128.3	90%	0.898	75%	0.749	S	S	*	*			trans	72.5	149	161.3	-75.8	-69.3	0	0	0	120.8
884	A	38.3	Very low	33.9	Very low	89 Å²	89	129.7 Å²	129.7	74%	0.736	75%	0.749	S	S	*	*			trans	-119.9	-173.3	179.6	0	0	0	0	0	110
885	P	50.7	Low	33	Very low	110 Å²	110	134.6 Å²	134.6	71%	0.714	76%	0.755	S	S	*	*				-161.7	162.3	73.8	42.4	-20.4	0	0	0	121
886	L	35.9	Very low	32.9	Very low	152 Å²	152	133 Å²	133	80%	0.796	76%	0.761	S	S	*	*			trans	76.5	159.4	137.9	-79.8	168.4	0	0	0	125.8
887	H	29.9	Very low	32.8	Very low	171 Å²	171	137.3 Å²	137.3	79%	0.792	77%	0.765	S	S	*	*			trans	79.1	143.9	174.1	-66.6	-72.3	0	0	0	117.9
888	S	30.3	Very low	32.6	Very low	87 Å²	87	140 Å²	140	61%	0.608	77%	0.769	S	S	*	*			cis	-166.8	161.7	-1.8	-120.1	0	0	0	0	115
889	I	28.9	Very low	32.6	Very low	157 Å²	157	140.8 Å²	140.8	81%	0.805	77%	0.774	S	S	*	*			trans	80.8	123.2	144.6	-67.3	162.5	0	0	0	124.1
890	R	28.5	Very low	33.1	Very low	232 Å²	232	140.4 Å²	140.4	88%	0.875	77%	0.773	S	S	*	*			trans	-20.5	-178.5	147.4	-79.8	-179.6	177.2	-177.5	-0.5	121.6
891	P	53.2	Low	32.8	Very low	117 Å²	117	140 Å²	140	76%	0.76	77%	0.771	S	S	*	*			cis	-141.7	-176.6	-34.1	39.5	-21.5	0	0	0	115.3
892	A	27.4	Very low	32.4	Very low	95 Å²	95	140.3 Å²	140.3	79%	0.785	77%	0.773	S	S	*	*				153.8	113.3	127.1	0	0	0	0	0	119.2
893	S	31.8	Very low	32.1	Very low	102 Å²	102	139.3 Å²	139.3	71%	0.713	78%	0.776	S	S	*	*				50.1	121.8	117.6	-167.7	0	0	0	0	126.9
894	M	27.6	Very low	31.8	Very low	161 Å²	161	134.6 Å²	134.6	79%	0.793	77%	0.771	S	S	*	*			trans	86.6	128.7	136	-81	-159.2	-62.3	0	0	126.3
895	Y	27.5	Very low	31.9	Very low	209 Å²	209	136.7 Å²	136.7	82%	0.82	78%	0.775	S	S	*	*			trans	22.4	135.1	146	-69.2	-72	0	0	0	124.7
896	G	26.2	Very low	30.7	Very low	78 Å²	78	137.4 Å²	137.4	80%	0.804	78%	0.777	S	S	*	*			trans	-156.5	146.6	152	0	0	0	0	0	110.5
897	Y	26.8	Very low	30.9	Very low	215 Å²	215	137.4 Å²	137.4	84%	0.843	78%	0.776	S	S	*	*			trans	-118.9	170.1	-174	-113.1	-90.4	0	0	0	112
898	Q	24.7	Very low	31.6	Very low	187 Å²	187	134.7 Å²	134.7	87%	0.874	77%	0.774	S	S	*	*			trans	91.1	127.3	166.5	-53.9	-173.9	-10.1	0	0	118.6
899	S	32.2	Very low	31.9	Very low	114 Å²	114	134.6 Å²	134.6	80%	0.797	78%	0.778	S	S	*	*			trans	-102.7	164.2	155	-41.8	0	0	0	0	108
900	P	40.9	Very low	33.4	Very low	115 Å²	115	130.1 Å²	130.1	75%	0.747	76%	0.759	S	S	*	*				-155.9	-177.3	85.7	38.2	-16.9	0	0	0	117.1
901	S	24.5	Very low	33.5	Very low	95 Å²	95	122.9 Å²	122.9	66%	0.664	73%	0.734	S	S	*	*			trans	56.4	98.8	145.8	60.9	0	0	0	0	121.6
902	S	26.5	Very low	32.5	Very low	101 Å²	101	119 Å²	119	71%	0.706	72%	0.715	S	S	*	*				33.5	127.6	118.1	60.4	0	0	0	0	122.4
903	S	29.6	Very low	32.7	Very low	109 Å²	109	120 Å²	120	76%	0.762	71%	0.711	S	S	*	*			trans	65.2	122.2	138.1	62.8	0	0	0	0	121.9
904	T	25.6	Very low	32.6	Very low	131 Å²	131	119.8 Å²	119.8	80%	0.804	72%	0.716	S	S	*	*			trans	-162.4	148.8	134.8	-77.9	0	0	0	0	109.1	V906	T904-V906 HydrophobicContact CG2-CG2 4.29Å
905	T	40.9	Very low	32.6	Very low	132 Å²	132	117.1 Å²	117.1	81%	0.81	71%	0.713	S	S	*	*			trans	-126.6	125.8	179.4	-56.1	0	0	0	0	110.3
906	V	25	Very low	32.6	Very low	125 Å²	125	112.2 Å²	112.2	76%	0.758	71%	0.709	S	S	*	*			trans	-144.5	139.1	169.2	-173.9	0	0	0	0	110.6	T904	T904-V906 HydrophobicContact CG2-CG2 4.29Å
907	I	41.1	Very low	32.6	Very low	153 Å²	153	112.7 Å²	112.7	79%	0.785	70%	0.701	S	S	*	*			trans	-142.6	128.2	174.2	-67.2	172.5	0	0	0	104.6
908	P	43.6	Very low	32.6	Very low	114 Å²	114	108.9 Å²	108.9	74%	0.74	70%	0.695	S	S	*	*				-157.7	-178.6	94.5	41.1	-19.9	0	0	0	117.8
909	A	38.3	Very low	32.8	Very low	84 Å²	84	106.3 Å²	106.3	69%	0.694	69%	0.687	S	S	*	*			trans	-93.6	-136.3	164.4	0	0	0	0	0	109.5
910	P	59.4	Low	32.6	Very low	63 Å²	63	107.1 Å²	107.1	41%	0.409	69%	0.687	S	S	.	*			cis	-140.3	-152.5	-6	18.2	13	0	0	0	115.8	N849 D850 L851	N849-P910 HydrophobicContact CB-CG 4.17Å; N849-P910 WeakPolarHBondContact OD1-CB 3.36Å; N849-P910 WeakPolarHBondContact OD1-CD 3.39Å; N849-P910 WeakPolarHBondContact OD1-CG 3.27Å; D850-P910 CarbonylContact C-O 3.56Å; D850-P910 WeakPolarHBondContact CA-O 3.3Å; L851-P910 PolarHBondContact N-O 3.38Å
911	K	29.8	Very low	32	Very low	81 Å²	81	106.3 Å²	106.3	35%	0.352	69%	0.685	S	S	.	*			trans	69.8	159.2	179.5	-96	-168.4	-155.2	153.8	0	116.9	N849 D850 L851 E852	N849-K911 WeakPolarHBondContact O-CD 3.49Å; N849-K911 WeakPolarHBondContact O-CE 3.41Å; N849-K911 PolarHBondContact O-NZ 3Å; N849-K911 WeakPolarHBondContact OD1-CG 3.43Å; D850-K911 VanDerWaalsContact OD1-CD 3.26Å; D850-K911 WeakPolarHBondContact OD1-CD 3.34Å; D850-K911 IonicContact OD1-NZ 3.3Å; D850-K911 PolarHBondContact OD1-NZ 3Å; D850-K911 IonicContact OD2-NZ 2.67Å; D850-K911 PolarHBondContact OD2-NZ 3.48Å; L851-K911 CarbonylContact C-O 3.57Å; L851-K911 WeakPolarHBondContact CA-O 3.09Å; L851-K911 HydrophobicContact CD2-CB 4.13Å; L851-K911 HydrophobicContact CG-CB 4.12Å; L851-K911 HydrophobicContact CG-CD 4.24Å; E852-K911 PolarHBondContact N-O 3.37Å
912	G	34.3	Very low	32.8	Very low	35 Å²	35	107.8 Å²	107.8	36%	0.361	69%	0.692	S	S	.	*			cis	96.6	123.2	-21.6	0	0	0	0	0	120.5
913	V	31.3	Very low	32.8	Very low	115 Å²	115	113.4 Å²	113.4	70%	0.697	70%	0.697	S	S	*	*			trans	-167.3	125.6	136.2	131.7	0	0	0	0	117.1	E852	E852-V913 PolarHBondContact OE1-N 3.08Å
914	A	29.2	Very low	32.6	Very low	99 Å²	99	113.4 Å²	113.4	82%	0.818	69%	0.692	S	S	*	*			trans	52.6	173.8	149.8	0	0	0	0	0	120.8
915	S	27.6	Very low	32.6	Very low	104 Å²	104	113.9 Å²	113.9	73%	0.727	69%	0.69	S	S	*	*			cis	-145.4	143.2	-1.3	65.7	0	0	0	0	110.1
916	S	26.1	Very low	32.1	Very low	106 Å²	106	112.6 Å²	112.6	74%	0.741	68%	0.682	S	S	*	*				143.9	169	91.5	57.3	0	0	0	0	108.7
917	S	27.8	Very low	32.4	Very low	89 Å²	89	111.5 Å²	111.5	62%	0.622	68%	0.675	S	S	*	*			cis	-169.7	160.6	-37.6	60.2	0	0	0	0	110.7
918	N	26.8	Very low	31.9	Very low	134 Å²	134	112 Å²	112	72%	0.717	68%	0.679	S	S	*	*			trans	71.5	148.4	159.8	-53.7	-24.4	0	0	0	119.2
919	N	28	Very low	31.2	Very low	133 Å²	133	110 Å²	110	71%	0.711	68%	0.679	S	S	*	*			cis	-167.4	178.5	-19.7	-96.8	-24.1	0	0	0	107.1
920	T	27.9	Very low	30.7	Very low	131 Å²	131	109.5 Å²	109.5	80%	0.804	68%	0.682	S	S	*	*			cis	-153.4	-171.2	16.2	-22.7	0	0	0	0	110.9
921	S	29.6	Very low	29.3	Very low	99 Å²	99	110.8 Å²	110.8	69%	0.692	70%	0.698	S	S	*	*			trans	-89.9	177.7	-177.4	-38.6	0	0	0	0	115.4
922	P	40.3	Very low	29.1	Very low	125 Å²	125	114.6 Å²	114.6	81%	0.812	72%	0.721	S	S	*	*	S	Bend		-125.8	161.1	85.6	37.9	-33.2	0	0	0	113
923	R	25.8	Very low	28.8	Very low	220 Å²	220	117.4 Å²	117.4	83%	0.83	74%	0.735	S	S	*	*			cis	-142.4	138.1	-6.4	-119.4	-175.1	163.6	166.1	-6.3	105.7
924	V	25.9	Very low	28.6	Very low	108 Å²	108	116.6 Å²	116.6	66%	0.655	74%	0.735	S	S	*	*				49.1	110.4	98.2	179.9	0	0	0	0	110.4
925	N	26.3	Very low	28.5	Very low	142 Å²	142	117.4 Å²	117.4	76%	0.759	73%	0.734	S	S	*	*			cis	-170.9	178.2	37.5	-123.3	2.5	0	0	0	109.6
926	V	30.9	Very low	28.6	Very low	104 Å²	104	123.5 Å²	123.5	63%	0.63	74%	0.741	S	S	*	*			cis	-150.4	141.3	1.6	87.8	0	0	0	0	111.3
927	T	29.6	Very low	28.7	Very low	102 Å²	102	123.1 Å²	123.1	63%	0.626	74%	0.739	S	S	*	*			trans	10.5	152	149.5	66.5	0	0	0	0	124.9
928	L	31.2	Very low	28.7	Very low	165 Å²	165	127.5 Å²	127.5	86%	0.864	75%	0.749	S	S	*	*			trans	64.3	137	153.6	-89	74.5	0	0	0	116.7
929	G	28.6	Very low	28.8	Very low	71 Å²	71	128.1 Å²	128.1	73%	0.732	75%	0.753	S	S	*	*			cis	110.3	137.2	1.6	0	0	0	0	0	113
930	G	27.8	Very low	28.8	Very low	74 Å²	74	126.6 Å²	126.6	76%	0.763	75%	0.752	S	S	*	*			trans	97.3	160.2	-176.4	0	0	0	0	0	113.5
931	A	29.4	Very low	28.7	Very low	90 Å²	90	128.8 Å²	128.8	74%	0.744	76%	0.758	S	S	*	*			trans	63.7	126.3	-169.7	0	0	0	0	0	113.4
932	L	26.8	Very low	28.7	Very low	160 Å²	160	129.1 Å²	129.1	84%	0.838	76%	0.761	S	S	*	*			cis	61.6	138.2	41	-43.3	167.9	0	0	0	110.2
933	S	28.4	Very low	28	Very low	94 Å²	94	132.8 Å²	132.8	66%	0.657	77%	0.767	S	S	*	*			cis	-146.2	163.9	15.5	-42.7	0	0	0	0	108.3
934	S	27.2	Very low	28.2	Very low	99 Å²	99	130.5 Å²	130.5	69%	0.692	77%	0.766	S	S	*	*				41.1	119.4	79.4	-24.9	0	0	0	0	111.7
935	S	27.3	Very low	29.3	Very low	115 Å²	115	130.9 Å²	130.9	80%	0.804	77%	0.771	S	S	*	*				121.4	155.3	58	-86.9	0	0	0	0	108.6
936	R	28.2	Very low	29.4	Very low	232 Å²	232	127.2 Å²	127.2	88%	0.875	76%	0.76	S	S	*	*			trans	-24.8	162.4	166.8	-75.7	171.8	160.9	162.3	-5.2	119.4
937	S	29.2	Very low	29.3	Very low	99 Å²	99	129.4 Å²	129.4	69%	0.692	77%	0.767	S	S	*	*			trans	71.7	151	159.2	46.1	0	0	0	0	115.5
938	H	26.6	Very low	29.3	Very low	180 Å²	180	130.7 Å²	130.7	83%	0.833	77%	0.774	S	S	*	*			cis	-124.4	169.7	23.5	-88	-98.9	0	0	0	116.4
939	N	30.1	Very low	29.2	Very low	148 Å²	148	130.6 Å²	130.6	79%	0.791	77%	0.772	S	S	*	*			trans	-77.8	163.1	170.6	-125.4	-3.9	0	0	0	111.5
940	S	28	Very low	29.4	Very low	101 Å²	101	138.3 Å²	138.3	71%	0.706	78%	0.78	S	S	*	*			trans	53.8	120.2	153	61.9	0	0	0	0	120.2
941	L	25.8	Very low	30.2	Very low	176 Å²	176	140 Å²	140	92%	0.921	78%	0.777	S	S	*	*				-155.4	153.4	110.6	-107.7	162.9	0	0	0	110.4
942	S	28.6	Very low	30.2	Very low	107 Å²	107	141.5 Å²	141.5	75%	0.748	78%	0.776	S	S	*	*			trans	-110.5	150.9	-167.8	-43.8	0	0	0	0	111.9
943	Q	27.1	Very low	30.3	Very low	201 Å²	201	140 Å²	140	94%	0.939	77%	0.769	S	S	*	*			trans	-157.6	140.4	140.3	-113.5	160.4	20.4	0	0	112.5
944	E	30	Very low	30.3	Very low	172 Å²	172	141.9 Å²	141.9	80%	0.804	77%	0.772	S	S	*	*			trans	-92.7	176.6	173	-123.8	-156.9	137.2	0	0	109.1
945	P	48.2	Very low	30.4	Very low	117 Å²	117	144.6 Å²	144.6	76%	0.76	78%	0.778	S	S	*	*			cis	-151.1	177.5	43.4	43.1	-21.8	0	0	0	119.6
946	A	29.1	Very low	30.6	Very low	65 Å²	65	147 Å²	147	54%	0.537	78%	0.779	S	S	.	*			trans	104.2	115.7	132.5	0	0	0	0	0	121.7
947	I	28.1	Very low	31.4	Very low	150 Å²	150	141.1 Å²	141.1	77%	0.769	77%	0.771	S	S	*	*			trans	66.1	102.9	133.9	-57.3	168.5	0	0	0	116.5
948	V	29.8	Very low	31.4	Very low	129 Å²	129	145.5 Å²	145.5	78%	0.782	78%	0.777	S	S	*	*				72.5	120.1	57.4	-179.4	0	0	0	0	115
949	I	29	Very low	31.5	Very low	162 Å²	162	140.9 Å²	140.9	83%	0.831	77%	0.77	S	S	*	*			trans	-174.4	146.5	135.4	-96.6	155	0	0	0	111.2
950	R	33.1	Very low	31.5	Very low	234 Å²	234	139.9 Å²	139.9	88%	0.883	77%	0.77	S	S	*	*			trans	-121.5	163.2	166.9	-80.4	-173.4	176.3	-166.1	0.9	106.6
951	P	45	Very low	33.1	Very low	108 Å²	108	138.5 Å²	138.5	70%	0.701	76%	0.758	S	S	*	*			cis	-161.3	-162.5	47.1	40.4	-14	0	0	0	117.5
952	V	29.4	Very low	33.9	Very low	122 Å²	122	135 Å²	135	74%	0.739	75%	0.746	S	S	*	*			trans	62.5	143.1	139.5	154.9	0	0	0	0	119.7
953	D	27.4	Very low	34.1	Very low	128 Å²	128	134 Å²	134	68%	0.684	74%	0.744	S	S	*	*			cis	-162.4	165.5	-12	-115.4	-20.2	0	0	0	113.6
954	L	29.6	Very low	34.2	Very low	135 Å²	135	129.6 Å²	129.6	71%	0.707	74%	0.736	S	S	*	*			trans	37.8	130.8	145.5	-66.4	164.6	0	0	0	125.6
955	N	28.6	Very low	34.2	Very low	156 Å²	156	128.5 Å²	128.5	83%	0.834	73%	0.734	S	S	*	*			trans	98.7	149	130.7	-87.6	-18.1	0	0	0	125.6
956	M	31.9	Very low	33.1	Very low	165 Å²	165	134.6 Å²	134.6	81%	0.813	74%	0.742	S	S	*	*			trans	-88.1	179.2	-179.8	-123.8	-159.8	-176.4	0	0	112.1
957	P	45.6	Very low	32.8	Very low	109 Å²	109	135 Å²	135	71%	0.708	75%	0.752	S	S	*	*			cis	-155.4	163.9	41.7	43.4	-20.9	0	0	0	122
958	K	28.4	Very low	32.6	Very low	190 Å²	190	132.4 Å²	132.4	83%	0.826	75%	0.753	S	S	*	*			trans	58.7	120.3	137.4	-75.8	-178.6	176.1	-178.4	0	125.9
959	A	29.3	Very low	32.3	Very low	84 Å²	84	132.8 Å²	132.8	69%	0.694	76%	0.755	S	S	*	*				112.2	129	109.4	0	0	0	0	0	124.9
960	T	29.9	Very low	32.8	Very low	127 Å²	127	129.7 Å²	129.7	78%	0.779	75%	0.746	S	S	*	*			trans	77	145.6	146.1	39	0	0	0	0	124.1
961	P	60.9	Low	32.6	Very low	71 Å²	71	124.8 Å²	124.8	46%	0.461	74%	0.742	S	S	.	*			trans	-118.1	-173.3	-174.5	45.8	-33.5	0	0	0	114.9	V1124	P961-V1124 WeakPolarHBondContact CG-O 3.44Å
962	P	43.9	Very low	31.7	Very low	102 Å²	102	123.2 Å²	123.2	66%	0.662	74%	0.738	S	S	*	*				-156.9	-169.6	94.1	43.4	-23.2	0	0	0	117.5
963	A	32.6	Very low	31.6	Very low	87 Å²	87	125 Å²	125	72%	0.719	74%	0.742	S	S	*	*			trans	-14.6	167.2	157.5	0	0	0	0	0	121.8
964	S	29.5	Very low	31.6	Very low	109 Å²	109	123.8 Å²	123.8	76%	0.762	74%	0.739	S	S	*	*			cis	178.6	-171.9	-14.9	-179.4	0	0	0	0	109.6
965	I	28.3	Very low	31.6	Very low	148 Å²	148	126 Å²	126	76%	0.759	75%	0.746	S	S	*	*			trans	90.2	126.2	157.5	-57.9	178.2	0	0	0	121.5
966	R	25.1	Very low	31.6	Very low	246 Å²	246	122 Å²	122	93%	0.928	74%	0.735	S	S	*	*			trans	11.7	140.7	151.8	-58.8	173.4	172.3	173.9	-4	123.1
967	G	23.7	Very low	31.3	Very low	73 Å²	73	121 Å²	121	75%	0.753	73%	0.732	S	S	*	*			trans	154.1	95.6	152.6	0	0	0	0	0	111.7
968	A	23.5	Very low	30.5	Very low	95 Å²	95	123 Å²	123	79%	0.785	73%	0.732	S	S	*	*				78.4	111.4	76.6	0	0	0	0	0	115.4
969	V	23	Very low	30.4	Very low	137 Å²	137	121.1 Å²	121.1	83%	0.83	73%	0.73	S	S	*	*				54.5	137.5	127.5	179.4	0	0	0	0	119
970	P	41	Very low	30.2	Very low	97 Å²	97	125.5 Å²	125.5	63%	0.63	74%	0.736	S	S	*	*			cis	-138.9	-160.7	-11.7	38.7	-17.2	0	0	0	114.7
971	T	27.2	Very low	30.6	Very low	131 Å²	131	124.2 Å²	124.2	80%	0.804	73%	0.73	S	S	*	*			trans	67.6	154.9	150.5	48.3	0	0	0	0	120.4
972	A	28	Very low	29	Very low	76 Å²	76	128.2 Å²	128.2	63%	0.628	75%	0.748	S	S	*	*			cis	-178	-174.9	-29.4	0	0	0	0	0	108.3
973	I	26.7	Very low	28.3	Very low	159 Å²	159	127.2 Å²	127.2	82%	0.815	76%	0.756	S	S	*	*			trans	75.7	144.5	161	-60.7	169.5	0	0	0	115.1
974	T	27.6	Very low	28.1	Very low	102 Å²	102	127.1 Å²	127.1	63%	0.626	76%	0.763	S	S	*	*			cis	171.8	150.8	-38.8	-97.2	0	0	0	0	107.7
975	Q	29.2	Very low	28	Very low	182 Å²	182	125.4 Å²	125.4	85%	0.85	76%	0.762	S	S	*	*			trans	68	155	169.3	-77.2	159.5	17	0	0	116.5
976	A	29	Very low	27.9	Very low	72 Å²	72	122.5 Å²	122.5	60%	0.595	76%	0.761	S	S	*	*			cis	-168	-173.8	-15.5	0	0	0	0	0	111.3
977	L	25.5	Very low	28	Very low	145 Å²	145	116.9 Å²	116.9	76%	0.759	75%	0.754	S	S	*	*			trans	80.7	143.1	159.8	-43.4	-178	0	0	0	115.7
978	Q	28.5	Very low	28.2	Very low	149 Å²	149	121.1 Å²	121.1	70%	0.696	76%	0.758	S	S	*	*			cis	-162.9	160.8	-15.2	-121.8	170.7	-31.9	0	0	112
979	L	26.6	Very low	28.3	Very low	152 Å²	152	126.3 Å²	126.3	80%	0.796	76%	0.757	S	S	*	*			trans	71.1	132.9	149.2	-67.9	164.7	0	0	0	122.6
980	Q	24.2	Very low	28.5	Very low	175 Å²	175	129.1 Å²	129.1	82%	0.818	76%	0.761	S	S	*	*			trans	-58.7	-178.2	163.1	-72	179.9	-8.6	0	0	114
981	P	39.3	Very low	27.8	Very low	101 Å²	101	130.2 Å²	130.2	66%	0.656	77%	0.766	S	S	*	*			cis	-140.8	173.4	15.5	39.3	-18.6	0	0	0	119.2
982	N	27.7	Very low	27.7	Very low	155 Å²	155	135.4 Å²	135.4	83%	0.829	77%	0.771	S	S	*	*			trans	54.1	130.4	158	-56	-10.9	0	0	0	118.6
983	G	29.1	Very low	27.9	Very low	81 Å²	81	137.5 Å²	137.5	84%	0.835	78%	0.778	S	S	*	*			cis	94.2	120.4	6.5	0	0	0	0	0	112.8
984	G	26.7	Very low	27.9	Very low	84 Å²	84	133.7 Å²	133.7	87%	0.866	77%	0.77	S	S	*	*			cis	-176.9	174.7	-2.5	0	0	0	0	0	112
985	G	27.7	Very low	28.1	Very low	73 Å²	73	134.7 Å²	134.7	75%	0.753	78%	0.781	S	S	*	*			trans	-163.6	166.4	-176.3	0	0	0	0	0	115.4
986	A	26.5	Very low	28.2	Very low	87 Å²	87	128.6 Å²	128.6	72%	0.719	77%	0.767	S	S	*	*			trans	-165.3	163.6	-169.4	0	0	0	0	0	111.9
987	V	27.4	Very low	28.3	Very low	129 Å²	129	133.6 Å²	133.6	78%	0.782	78%	0.783	S	S	*	*			cis	-169.1	145.6	-17	134.3	0	0	0	0	107.6
988	L	27.5	Very low	28.8	Very low	161 Å²	161	138 Å²	138	84%	0.843	79%	0.789	S	S	*	*			trans	164	158.7	148.3	-92.2	172.1	0	0	0	110.7
989	R	26.6	Very low	29.2	Very low	205 Å²	205	139.3 Å²	139.3	77%	0.774	80%	0.796	S	S	*	*				-176.5	107.5	-60.4	174.5	-171	-168.7	-171.7	5.7	110.5	V991	R989-V991 HydrophobicContact CG-CG2 4Å
990	Q	27.4	Very low	29.8	Very low	196 Å²	196	143.6 Å²	143.6	92%	0.916	80%	0.801	S	S	*	*			trans	-165.9	109.2	157.7	-104.5	174.5	29.2	0	0	106.7
991	V	26.6	Very low	30.6	Very low	119 Å²	119	141.1 Å²	141.1	72%	0.721	79%	0.793	S	S	*	*			cis	84.2	86.6	41.8	-173.1	0	0	0	0	113.9	R989	R989-V991 HydrophobicContact CG-CG2 4Å
992	R	24.6	Very low	30.9	Very low	241 Å²	241	143.2 Å²	143.2	91%	0.909	79%	0.794	S	S	*	*			trans	-154.3	163.8	134.6	-103.7	-172.4	175.9	164.5	1.6	109.3
993	P	30.6	Very low	31.5	Very low	119 Å²	119	141.4 Å²	141.4	77%	0.773	78%	0.784	S	S	*	*			trans	-101.4	144.1	-136.9	36.5	-37.5	0	0	0	117.1
994	A	28.4	Very low	31.9	Very low	80 Å²	80	140 Å²	140	66%	0.661	77%	0.765	S	S	*	*			trans	-82.6	146.5	147.2	0	0	0	0	0	108.1
995	S	30.2	Very low	32.7	Very low	123 Å²	123	139.8 Å²	139.8	86%	0.86	74%	0.744	S	S	*	*			cis	57.8	137.3	48.7	77.8	0	0	0	0	113.7
996	G	33.2	Very low	33.6	Very low	53 Å²	53	138.7 Å²	138.7	55%	0.546	72%	0.722	S	S	.	*			trans	88.2	64.9	172.2	0	0	0	0	0	117.8	R998	G996-R998 PolarHBondContact O-N 2.81Å
997	L	30.3	Very low	34.3	Very low	178 Å²	178	141.6 Å²	141.6	93%	0.932	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	13.1	167.8	-133.3	170.8	0	0	0	113.6
998	R	35.9	Very low	35	Very low	237 Å²	237	140 Å²	140	89%	0.894	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	-13.6	-174.2	-165.6	173	-177.3	174.8	2.2	113.6	G996	G996-R998 PolarHBondContact O-N 2.81Å
999	E	37.8	Very low	35.7	Very low	177 Å²	177	137.8 Å²	137.8	83%	0.827	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	26.4	-166.4	-154.4	168.9	-135.2	0	0	113.1
1000	R	37.1	Very low	36.5	Very low	242 Å²	242	133.1 Å²	133.1	91%	0.913	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134	13.1	-178	-75.3	-166.2	174.6	-162.1	-1.6	115.6
1001	L	42	Very low	37.2	Very low	123 Å²	123	130.9 Å²	130.9	64%	0.644	66%	0.664	S	S	*	*	S	Bend	trans	-102.7	136.9	155.4	-68.7	169.9	0	0	0	106.5	V1006	L1001-V1006 HydrophobicContact CB-CG2 3.85Å; L1001-V1006 HydrophobicContact CD1-CG2 4.32Å
1002	Q	44.8	Very low	38.2	Very low	145 Å²	145	128.8 Å²	128.8	68%	0.678	65%	0.652	S	S	*	*			trans	-74	140	176.6	-59.2	-173.1	12.6	0	0	108.5	A1004 D1005 V1006	Q1002-A1004 PolarHBondContact O-N 3.09Å; Q1002-D1005 PolarHBondContact O-N 3.06Å; Q1002-V1006 PolarHBondContact O-N 3.5Å
1003	D	41.3	Very low	39.3	Very low	117 Å²	117	124.2 Å²	124.2	63%	0.626	65%	0.646	S	S	*	*	H	α-helix	trans	-59.7	-14.7	-177.9	-67	-43.2	0	0	0	113.3	R1007	D1003-R1007 VanDerWaalsContact CB-NH2 3.29Å; D1003-R1007 WeakPolarHBondContact O-CB 3.24Å; D1003-R1007 WeakPolarHBondContact O-CG 3.41Å; D1003-R1007 PolarHBondContact O-N 2.67Å; D1003-R1007 PolarHBondContact O-NE 3.46Å
1004	A	37.6	Very low	40.5	Very low	51 Å²	51	119.2 Å²	119.2	42%	0.421	61%	0.613	S	S	.	*	H	α-helix	trans	-71.8	-37.2	172.7	0	0	0	0	0	112.8	Q1002 N1008	Q1002-A1004 PolarHBondContact O-N 3.09Å; A1004-N1008 PolarHBondContact O-N 3.33Å; A1004-N1008 PolarHBondContact O-ND2 3.29Å
1005	D	43.9	Very low	41.7	Very low	80 Å²	80	116.9 Å²	116.9	43%	0.428	59%	0.593	S	S	.	*	H	α-helix	trans	-75.7	-45.1	-177.5	-56.9	-41.4	0	0	0	110.5	Q1002 R1007 N1008 L1009	Q1002-D1005 PolarHBondContact O-N 3.06Å; D1005-R1007 VanDerWaalsContact C-N 3.35Å; D1005-R1007 PolarHBondContact O-N 2.9Å; D1005-N1008 WeakPolarHBondContact O-CA 3.26Å; D1005-N1008 WeakPolarHBondContact O-CB 3.46Å; D1005-N1008 PolarHBondContact O-N 3.37Å; D1005-L1009 VanDerWaalsContact O-CD1 3.32Å; D1005-L1009 WeakPolarHBondContact O-CD1 3.44Å; D1005-L1009 PolarHBondContact O-N 2.82Å
1006	V	46.8	Very low	43	Very low	49 Å²	49	116.5 Å²	116.5	30%	0.297	58%	0.581	S	S	.	*	H	α-helix	trans	-57.4	-48.4	174.9	-176.6	0	0	0	0	110.4	L1001 Q1002 N1008 L1009 E1010	L1001-V1006 HydrophobicContact CB-CG2 3.85Å; L1001-V1006 HydrophobicContact CD1-CG2 4.32Å; Q1002-V1006 PolarHBondContact O-N 3.5Å; V1006-N1008 PolarHBondContact O-N 2.97Å; V1006-N1008 VanDerWaalsContact O-N 3.09Å; V1006-L1009 PolarHBondContact O-N 2.98Å; V1006-L1009 VanDerWaalsContact O-N 3.12Å; V1006-E1010 HydrophobicContact CG1-CG 4.31Å; V1006-E1010 WeakPolarHBondContact O-CG 3.31Å; V1006-E1010 PolarHBondContact O-N 3.21Å
1007	R	40.4	Very low	44.5	Very low	148 Å²	148	115.8 Å²	115.8	56%	0.558	56%	0.564	S	S	*	*	H	α-helix	trans	-71.4	2.3	175.8	-70.8	-179.3	-70.6	-175	-6.7	114.7	D1003 D1005 K1011	D1003-R1007 VanDerWaalsContact CB-NH2 3.29Å; D1003-R1007 WeakPolarHBondContact O-CB 3.24Å; D1003-R1007 WeakPolarHBondContact O-CG 3.41Å; D1003-R1007 PolarHBondContact O-N 2.67Å; D1003-R1007 PolarHBondContact O-NE 3.46Å; D1005-R1007 VanDerWaalsContact C-N 3.35Å; D1005-R1007 PolarHBondContact O-N 2.9Å; R1007-K1011 WeakPolarHBondContact O-CD 3.44Å; R1007-K1011 WeakPolarHBondContact O-CE 3.41Å; R1007-K1011 PolarHBondContact O-NZ 3.41Å; R1007-K1011 VanDerWaalsContact O-NZ 3.08Å
1008	N	41.6	Very low	46.6	Very low	95 Å²	95	110.6 Å²	110.6	51%	0.508	54%	0.542	S	S	.	.	H	α-helix	trans	-101.1	-34.8	166.2	-78.2	-27.9	0	0	0	112.1	A1004 D1005 V1006 K1011	A1004-N1008 PolarHBondContact O-N 3.33Å; A1004-N1008 PolarHBondContact O-ND2 3.29Å; D1005-N1008 WeakPolarHBondContact O-CA 3.26Å; D1005-N1008 WeakPolarHBondContact O-CB 3.46Å; D1005-N1008 PolarHBondContact O-N 3.37Å; V1006-N1008 PolarHBondContact O-N 2.97Å; V1006-N1008 VanDerWaalsContact O-N 3.09Å; N1008-K1011 PolarHBondContact OD1-NZ 3.07Å
1009	L	42.7	Very low	48.2	Very low	115 Å²	115	102.8 Å²	102.8	60%	0.602	51%	0.514	S	S	*	.	H	α-helix	trans	-66.7	-38.2	170	-86.4	74.3	0	0	0	112.1	D1005 V1006 K1011 A1015	D1005-L1009 VanDerWaalsContact O-CD1 3.32Å; D1005-L1009 WeakPolarHBondContact O-CD1 3.44Å; D1005-L1009 PolarHBondContact O-N 2.82Å; V1006-L1009 PolarHBondContact O-N 2.98Å; V1006-L1009 VanDerWaalsContact O-N 3.12Å; L1009-K1011 PolarHBondContact O-N 2.97Å; L1009-A1015 WeakPolarHBondContact O-CB 3.31Å
1010	E	42.5	Very low	49.9	Very low	108 Å²	108	100.1 Å²	100.1	51%	0.505	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	0	-177.6	-72.3	173.4	154.3	0	0	115.3	V1006 L1016	V1006-E1010 HydrophobicContact CG1-CG 4.31Å; V1006-E1010 WeakPolarHBondContact O-CG 3.31Å; V1006-E1010 PolarHBondContact O-N 3.21Å; E1010-L1016 HydrophobicContact CG-CD2 4.45Å
1011	K	42.1	Very low	51.8	Low	148 Å²	148	90 Å²	90	64%	0.643	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-6.4	-173.6	-74.6	172.6	-179.6	149.4	0	115.4	R1007 N1008 L1009	R1007-K1011 WeakPolarHBondContact O-CD 3.44Å; R1007-K1011 WeakPolarHBondContact O-CE 3.41Å; R1007-K1011 PolarHBondContact O-NZ 3.41Å; R1007-K1011 VanDerWaalsContact O-NZ 3.08Å; N1008-K1011 PolarHBondContact OD1-NZ 3.07Å; L1009-K1011 PolarHBondContact O-N 2.97Å
1012	T	48.1	Very low	53.7	Low	75 Å²	75	84.2 Å²	84.2	46%	0.46	44%	0.439	S	S	.	.	S	Bend	trans	-131.9	133.5	172.4	57.2	0	0	0	0	110.8	T1014 A1015	T1012-T1014 PolarHBondContact O-N 3.12Å; T1012-T1014 VanDerWaalsContact O-N 3.14Å; T1012-A1015 PolarHBondContact O-N 2.86Å; T1012-A1015 VanDerWaalsContact O-N 3.09Å
1013	N	47.3	Very low	55.5	Low	146 Å²	146	79.4 Å²	79.4	78%	0.781	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-58.4	-29	179.2	-80.2	-34.4	0	0	0	112.6	A1015 L1016	N1013-A1015 VanDerWaalsContact C-N 3.31Å; N1013-A1015 PolarHBondContact O-N 2.87Å; N1013-L1016 PolarHBondContact O-N 2.99Å
1014	T	57.2	Low	57.6	Low	14 Å²	14	80.5 Å²	80.5	9%	0.086	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-63.1	-32.8	177.9	-31.6	0	0	0	0	112.9	T1012 L1016 M1017 E1046 L1047 V1050	T1012-T1014 PolarHBondContact O-N 3.12Å; T1012-T1014 VanDerWaalsContact O-N 3.14Å; T1014-L1016 VanDerWaalsContact C-N 3.35Å; T1014-M1017 HydrophobicContact CG2-SD 4.48Å; T1014-E1046 VanDerWaalsContact CB-OE1 3.26Å; T1014-E1046 WeakPolarHBondContact CB-OE1 3.37Å; T1014-E1046 HydrophobicContact CG2-CG 4.28Å; T1014-E1046 PolarHBondContact OG1-OE1 3.3Å; T1014-L1047 HydrophobicContact CG2-CD2 3.69Å; T1014-L1047 HydrophobicContact CG2-CG 4.32Å; T1014-V1050 HydrophobicContact CG2-CG2 4.27Å
1015	A	53.9	Low	59.7	Low	30 Å²	30	80.4 Å²	80.4	25%	0.248	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-78.7	-16.9	-178.3	0	0	0	0	0	113.8	L1009 T1012 N1013	L1009-A1015 WeakPolarHBondContact O-CB 3.31Å; T1012-A1015 PolarHBondContact O-N 2.86Å; T1012-A1015 VanDerWaalsContact O-N 3.09Å; N1013-A1015 VanDerWaalsContact C-N 3.31Å; N1013-A1015 PolarHBondContact O-N 2.87Å
1016	L	57	Low	61.8	Low	115 Å²	115	77.3 Å²	77.3	60%	0.602	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-88.1	-4	176.5	-67.9	173.3	0	0	0	113.4	E1010 N1013 T1014	E1010-L1016 HydrophobicContact CG-CD2 4.45Å; N1013-L1016 PolarHBondContact O-N 2.99Å; T1014-L1016 VanDerWaalsContact C-N 3.35Å
1017	M	64.8	Low	63.7	Low	38 Å²	38	80.5 Å²	80.5	19%	0.187	41%	0.409	C	S	.	.	S	Bend	trans	-69.6	137	175.5	-66.2	-179.7	66.8	0	0	110.9	T1014 A1021 V1022 E1025 L1047 Q1054	T1014-M1017 HydrophobicContact CG2-SD 4.48Å; M1017-A1021 HydrophobicContact CE-CB 4.16Å; M1017-A1021 WeakPolarHBondContact CE-O 3.31Å; M1017-V1022 HydrophobicContact CB-CG2 3.46Å; M1017-V1022 VanDerWaalsContact CB-CG2 3.46Å; M1017-E1025 HydrophobicContact CE-CB 4.24Å; M1017-E1025 WeakPolarHBondContact CE-OE2 3.43Å; M1017-L1047 HydrophobicContact CE-CD2 4.33Å; M1017-L1047 HydrophobicContact SD-CD2 3.97Å; M1017-Q1054 PolarHBondContact O-NE2 3.08Å
1018	S	73.1	Confident	66	Low	69 Å²	69	82.4 Å²	82.4	48%	0.483	42%	0.416	S	S	.	.			trans	-64.9	152.7	174.3	69.8	0	0	0	0	110.7	E1020 A1021 V1022	S1018-E1020 PolarHBondContact O-N 2.72Å; S1018-E1020 VanDerWaalsContact O-N 3.09Å; S1018-A1021 PolarHBondContact O-N 2.7Å; S1018-A1021 WeakPolarHBondContact OG-CB 3.32Å; S1018-A1021 PolarHBondContact OG-N 2.95Å; S1018-A1021 VanDerWaalsContact OG-N 3.17Å; S1018-V1022 WeakPolarHBondContact O-CG2 3.48Å; S1018-V1022 PolarHBondContact O-N 3.35Å
1019	Y	71.2	Confident	68.2	Low	74 Å²	74	78.4 Å²	78.4	29%	0.29	40%	0.395	S	S	.	.	H	α-helix	trans	-53.1	-32.9	177.5	-174.6	-89.1	0	0	0	112.7	N1023 V1051 Q1054	Y1019-N1023 WeakPolarHBondContact CD1-ND2 3.24Å; Y1019-N1023 WeakPolarHBondContact CE1-ND2 3.14Å; Y1019-N1023 PolarHBondContact O-N 3.26Å; Y1019-N1023 PolarHBondContact O-ND2 3.21Å; Y1019-V1051 HydrophobicContact CE2-CG1 4.42Å; Y1019-Q1054 HydrophobicContact CD2-CB 4.35Å
1020	E	73.4	Confident	70.2	Confident	120 Å²	120	76.6 Å²	76.6	56%	0.561	39%	0.386	S	S	*	.	H	α-helix	trans	-71.7	-48.7	174.9	-66.4	177.8	128.1	0	0	111.5	R422 S1018 V1022 N1023 E1024	R422-E1020 IonicContact NH2-OE1 3.43Å; R422-E1020 PolarHBondContact NH2-OE1 3.43Å; S1018-E1020 PolarHBondContact O-N 2.72Å; S1018-E1020 VanDerWaalsContact O-N 3.09Å; E1020-V1022 VanDerWaalsContact C-N 3.32Å; E1020-V1022 PolarHBondContact O-N 2.78Å; E1020-N1023 PolarHBondContact O-N 3.44Å; E1020-N1023 VanDerWaalsContact O-N 3.13Å; E1020-E1024 PolarHBondContact O-N 2.9Å
1021	A	76.9	Confident	72.3	Confident	31 Å²	31	75.5 Å²	75.5	26%	0.256	40%	0.395	S	S	.	.	H	α-helix	trans	-64.4	-32.7	178.5	0	0	0	0	0	113.6	M1017 S1018 E1025	M1017-A1021 HydrophobicContact CE-CB 4.16Å; M1017-A1021 WeakPolarHBondContact CE-O 3.31Å; S1018-A1021 PolarHBondContact O-N 2.7Å; S1018-A1021 WeakPolarHBondContact OG-CB 3.32Å; S1018-A1021 PolarHBondContact OG-N 2.95Å; S1018-A1021 VanDerWaalsContact OG-N 3.17Å; A1021-E1025 PolarHBondContact O-N 2.97Å; A1021-E1025 VanDerWaalsContact O-N 3.1Å
1022	V	81.9	Confident	74.2	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-64.8	-41.9	173.3	175	0	0	0	0	110.8	M1017 S1018 E1020 L1026 L1047 V1050 V1051	M1017-V1022 HydrophobicContact CB-CG2 3.46Å; M1017-V1022 VanDerWaalsContact CB-CG2 3.46Å; S1018-V1022 WeakPolarHBondContact O-CG2 3.48Å; S1018-V1022 PolarHBondContact O-N 3.35Å; E1020-V1022 VanDerWaalsContact C-N 3.32Å; E1020-V1022 PolarHBondContact O-N 2.78Å; V1022-L1026 HydrophobicContact CG1-CD1 4.19Å; V1022-L1026 WeakPolarHBondContact O-CB 2.95Å; V1022-L1026 WeakPolarHBondContact O-CG 3.49Å; V1022-L1026 PolarHBondContact O-N 3.46Å; V1022-L1047 HydrophobicContact CB-CD2 4.49Å; V1022-L1047 HydrophobicContact CG1-CB 4.25Å; V1022-L1047 HydrophobicContact CG1-CD2 3.97Å; V1022-L1047 HydrophobicContact CG2-CD2 4.37Å; V1022-V1050 HydrophobicContact CG2-CG1 4.16Å; V1022-V1051 HydrophobicContact CB-CG2 4.5Å; V1022-V1051 HydrophobicContact CG1-CG2 3.38Å
1023	N	82.4	Confident	75.6	Confident	45 Å²	45	75.4 Å²	75.4	24%	0.241	39%	0.391	C	S	.	.	H	α-helix	trans	-72	-42.6	178.2	-65.5	-24.8	0	0	0	111.7	Y1019 E1020 E1025 L1026 D1027	Y1019-N1023 WeakPolarHBondContact CD1-ND2 3.24Å; Y1019-N1023 WeakPolarHBondContact CE1-ND2 3.14Å; Y1019-N1023 PolarHBondContact O-N 3.26Å; Y1019-N1023 PolarHBondContact O-ND2 3.21Å; E1020-N1023 PolarHBondContact O-N 3.44Å; E1020-N1023 VanDerWaalsContact O-N 3.13Å; N1023-E1025 VanDerWaalsContact C-N 3.28Å; N1023-E1025 PolarHBondContact O-N 2.9Å; N1023-L1026 WeakPolarHBondContact O-CB 3.35Å; N1023-L1026 PolarHBondContact O-N 3.41Å; N1023-L1026 VanDerWaalsContact O-N 3.12Å; N1023-D1027 PolarHBondContact O-N 3.09Å
1024	E	84.9	Confident	76.8	Confident	140 Å²	140	76.3 Å²	76.3	65%	0.654	40%	0.395	S	S	*	.	H	α-helix	trans	-58.7	-38.8	175.7	-73.8	-179	176.5	0	0	112.4	E1020 R1028	E1020-E1024 PolarHBondContact O-N 2.9Å; E1024-R1028 VanDerWaalsContact O-CB 3.24Å; E1024-R1028 WeakPolarHBondContact O-CB 3.38Å; E1024-R1028 PolarHBondContact O-N 3.21Å
1025	E	82.1	Confident	78.1	Confident	49 Å²	49	81 Å²	81	23%	0.229	42%	0.424	C	S	.	.	H	α-helix	trans	-78.6	-26.5	176.5	-164.6	156.5	-150.5	0	0	113.1	M1017 A1021 N1023 L1029 R1043 L1047	M1017-E1025 HydrophobicContact CE-CB 4.24Å; M1017-E1025 WeakPolarHBondContact CE-OE2 3.43Å; A1021-E1025 PolarHBondContact O-N 2.97Å; A1021-E1025 VanDerWaalsContact O-N 3.1Å; N1023-E1025 VanDerWaalsContact C-N 3.28Å; N1023-E1025 PolarHBondContact O-N 2.9Å; E1025-L1029 HydrophobicContact CG-CD1 4.43Å; E1025-L1029 WeakPolarHBondContact O-CB 3.46Å; E1025-L1029 WeakPolarHBondContact O-CG 3.09Å; E1025-L1029 PolarHBondContact O-N 2.83Å; E1025-R1043 IonicContact OE1-CZ 2.72Å; E1025-R1043 IonicContact OE1-NH1 3.23Å; E1025-R1043 PolarHBondContact OE1-NH1 3.04Å; E1025-R1043 IonicContact OE1-NH2 3.99Å; E1025-R1043 PolarHBondContact OE1-NH2 3Å; E1025-R1043 IonicContact OE2-CZ 2.62Å; E1025-R1043 IonicContact OE2-NH1 2.88Å; E1025-R1043 PolarHBondContact OE2-NH1 3.47Å; E1025-R1043 IonicContact OE2-NH2 3.64Å; E1025-R1043 PolarHBondContact OE2-NH2 2.92Å; E1025-L1047 HydrophobicContact CB-CD1 4.16Å; E1025-L1047 HydrophobicContact CG-CD1 4.03Å
1026	L	87.5	Confident	79.6	Confident	14 Å²	14	80.5 Å²	80.5	7%	0.073	42%	0.417	C	S	.	.	H	α-helix	trans	-65.4	-51.6	166.7	-81.1	168.4	0	0	0	111.6	V1022 N1023 R1028 L1029 D1030 Y1044 L1047 L1048 V1051	V1022-L1026 HydrophobicContact CG1-CD1 4.19Å; V1022-L1026 WeakPolarHBondContact O-CB 2.95Å; V1022-L1026 WeakPolarHBondContact O-CG 3.49Å; V1022-L1026 PolarHBondContact O-N 3.46Å; N1023-L1026 WeakPolarHBondContact O-CB 3.35Å; N1023-L1026 PolarHBondContact O-N 3.41Å; N1023-L1026 VanDerWaalsContact O-N 3.12Å; L1026-R1028 VanDerWaalsContact C-N 3.28Å; L1026-R1028 PolarHBondContact O-N 3.04Å; L1026-L1029 CarbonylContact O-C 2.96Å; L1026-L1029 PolarHBondContact O-N 3.1Å; L1026-D1030 WeakPolarHBondContact O-CB 3.23Å; L1026-D1030 PolarHBondContact O-N 3.03Å; L1026-Y1044 HydrophobicContact CD2-CD2 3.68Å; L1026-Y1044 HydrophobicContact CD2-CE2 3.94Å; L1026-Y1044 HydrophobicContact CD2-CG 4.2Å; L1026-L1047 HydrophobicContact CD1-CB 4.2Å; L1026-L1047 HydrophobicContact CD2-CB 3.68Å; L1026-L1047 HydrophobicContact CD2-CD1 4.5Å; L1026-L1047 HydrophobicContact CG-CB 3.76Å; L1026-L1047 HydrophobicContact CG-CD1 4.42Å; L1026-L1048 HydrophobicContact CD1-CD2 4.13Å; L1026-L1048 HydrophobicContact CD2-CD2 3.99Å; L1026-L1048 HydrophobicContact CD2-CG 3.88Å; L1026-V1051 HydrophobicContact CD1-CG2 3.57Å
1027	D	87.8	Confident	81.1	Confident	117 Å²	117	78.9 Å²	78.9	63%	0.626	41%	0.412	S	S	*	.	H	α-helix	trans	-58.4	-41.5	179.3	-70.2	-20.1	0	0	0	111.2	N1023 L1029 D1030 A1031	N1023-D1027 PolarHBondContact O-N 3.09Å; D1027-L1029 VanDerWaalsContact C-N 3.27Å; D1027-L1029 PolarHBondContact O-N 2.93Å; D1027-D1030 PolarHBondContact O-N 3.27Å; D1027-A1031 VanDerWaalsContact O-CB 3.3Å; D1027-A1031 WeakPolarHBondContact O-CB 3.45Å; D1027-A1031 PolarHBondContact O-N 3.45Å
1028	R	88.6	Confident	81.9	Confident	188 Å²	188	83.3 Å²	83.3	71%	0.709	44%	0.435	S	S	*	.	H	α-helix	trans	-63	-30.5	175.7	-176.3	-179.7	-179.2	119.5	3.3	113.4	E1024 L1026	E1024-R1028 VanDerWaalsContact O-CB 3.24Å; E1024-R1028 WeakPolarHBondContact O-CB 3.38Å; E1024-R1028 PolarHBondContact O-N 3.21Å; L1026-R1028 VanDerWaalsContact C-N 3.28Å; L1026-R1028 PolarHBondContact O-N 3.04Å
1029	L	86.5	Confident	81.9	Confident	11 Å²	11	84.8 Å²	84.8	6%	0.058	44%	0.438	C	S	.	.	H	α-helix	trans	-86.7	-38.2	177.5	-73.2	176.7	0	0	0	111.7	E1025 L1026 D1027 A1031 K1032 M1036 E1040 Y1044 L1047	E1025-L1029 HydrophobicContact CG-CD1 4.43Å; E1025-L1029 WeakPolarHBondContact O-CB 3.46Å; E1025-L1029 WeakPolarHBondContact O-CG 3.09Å; E1025-L1029 PolarHBondContact O-N 2.83Å; L1026-L1029 CarbonylContact O-C 2.96Å; L1026-L1029 PolarHBondContact O-N 3.1Å; D1027-L1029 VanDerWaalsContact C-N 3.27Å; D1027-L1029 PolarHBondContact O-N 2.93Å; L1029-A1031 VanDerWaalsContact C-N 3.31Å; L1029-A1031 PolarHBondContact O-N 3.34Å; L1029-K1032 WeakPolarHBondContact O-CB 3.47Å; L1029-K1032 PolarHBondContact O-N 3.32Å; L1029-M1036 HydrophobicContact CB-SD 3.82Å; L1029-M1036 HydrophobicContact CD2-SD 3.99Å; L1029-M1036 HydrophobicContact CG-SD 4.37Å; L1029-E1040 HydrophobicContact CD2-CB 3.95Å; L1029-E1040 HydrophobicContact CD2-CG 4.09Å; L1029-Y1044 HydrophobicContact CB-CD2 3.79Å; L1029-L1047 HydrophobicContact CD1-CD1 4.1Å
1030	D	85.9	Confident	82.4	Confident	76 Å²	76	83.5 Å²	83.5	41%	0.406	43%	0.434	S	S	.	.	H	α-helix	trans	-62.5	-39.6	175.9	-152.5	71.2	0	0	0	111.5	L1026 D1027 K1032 Q1033 Y1044	L1026-D1030 WeakPolarHBondContact O-CB 3.23Å; L1026-D1030 PolarHBondContact O-N 3.03Å; D1027-D1030 PolarHBondContact O-N 3.27Å; D1030-K1032 PolarHBondContact O-N 2.98Å; D1030-Q1033 WeakPolarHBondContact O-CG 3.38Å; D1030-Q1033 PolarHBondContact O-N 3.34Å; D1030-Y1044 HydrophobicContact CB-CE2 3.99Å; D1030-Y1044 WeakPolarHBondContact OD1-CE2 3.45Å; D1030-Y1044 VanDerWaalsContact OD1-CZ 3.31Å; D1030-Y1044 PolarHBondContact OD1-OH 2.94Å
1031	A	85.5	Confident	82.9	Confident	86 Å²	86	81.6 Å²	81.6	71%	0.711	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-15.1	173.1	0	0	0	0	0	114.6	D1027 L1029	D1027-A1031 VanDerWaalsContact O-CB 3.3Å; D1027-A1031 WeakPolarHBondContact O-CB 3.45Å; D1027-A1031 PolarHBondContact O-N 3.45Å; L1029-A1031 VanDerWaalsContact C-N 3.31Å; L1029-A1031 PolarHBondContact O-N 3.34Å
1032	K	81.7	Confident	83.1	Confident	78 Å²	78	87.7 Å²	87.7	34%	0.339	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-21.4	173.2	-62.8	-171.2	172.4	-165.9	0	113.6	L1029 D1030 N1034 T1035 M1036 E1040	L1029-K1032 WeakPolarHBondContact O-CB 3.47Å; L1029-K1032 PolarHBondContact O-N 3.32Å; D1030-K1032 PolarHBondContact O-N 2.98Å; K1032-N1034 PolarHBondContact O-N 3.04Å; K1032-T1035 PolarHBondContact O-N 3.4Å; K1032-T1035 PolarHBondContact O-OG1 3.03Å; K1032-M1036 HydrophobicContact CB-CB 4.14Å; K1032-E1040 IonicContact NZ-OE1 3.77Å; K1032-E1040 PolarHBondContact NZ-OE1 2.89Å; K1032-E1040 IonicContact NZ-OE2 3.79Å
1033	Q	77.2	Confident	82.9	Confident	143 Å²	143	92.1 Å²	92.1	67%	0.668	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	41	-120.2	-176.7	-59.2	-172.5	-17.2	0	0	112.3	D1030 T1035 M1036	D1030-Q1033 WeakPolarHBondContact O-CG 3.38Å; D1030-Q1033 PolarHBondContact O-N 3.34Å; Q1033-T1035 PolarHBondContact O-N 3.26Å; Q1033-T1035 VanDerWaalsContact O-N 3.14Å; Q1033-M1036 WeakPolarHBondContact O-CB 3.46Å; Q1033-M1036 PolarHBondContact O-N 2.82Å
1034	N	73.3	Confident	83.1	Confident	164 Å²	164	92.6 Å²	92.6	88%	0.877	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-70.8	-3.9	-176.8	-66.2	-13.3	0	0	0	114.9	K1032	K1032-N1034 PolarHBondContact O-N 3.04Å
1035	T	84.3	Confident	83.1	Confident	112 Å²	112	94.2 Å²	94.2	69%	0.687	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-93.4	-3.5	176.1	68.8	0	0	0	0	113.5	K1032 Q1033 T1037	K1032-T1035 PolarHBondContact O-N 3.4Å; K1032-T1035 PolarHBondContact O-OG1 3.03Å; Q1033-T1035 PolarHBondContact O-N 3.26Å; Q1033-T1035 VanDerWaalsContact O-N 3.14Å; T1035-T1037 PolarHBondContact O-N 3.26Å
1036	M	85.1	Confident	83	Confident	20 Å²	20	95.5 Å²	95.5	10%	0.099	46%	0.464	C	S	.	.			trans	-68.3	127.8	-177.3	-172.5	162.1	42.5	0	0	112.1	L1029 K1032 Q1033 E1040 Q1041 Y1044	L1029-M1036 HydrophobicContact CB-SD 3.82Å; L1029-M1036 HydrophobicContact CD2-SD 3.99Å; L1029-M1036 HydrophobicContact CG-SD 4.37Å; K1032-M1036 HydrophobicContact CB-CB 4.14Å; Q1033-M1036 WeakPolarHBondContact O-CB 3.46Å; Q1033-M1036 PolarHBondContact O-N 2.82Å; M1036-E1040 HydrophobicContact CG-CB 3.33Å; M1036-E1040 HydrophobicContact SD-CB 3.94Å; M1036-Q1041 HydrophobicContact CB-CG 4.12Å; M1036-Q1041 HydrophobicContact CE-CG 4.07Å; M1036-Q1041 HydrophobicContact CG-CG 3.88Å; M1036-Q1041 PolarHBondContact O-NE2 3.01Å; M1036-Q1041 HydrophobicContact SD-CG 4.48Å; M1036-Y1044 HydrophobicContact CE-CD1 4.37Å; M1036-Y1044 HydrophobicContact CE-CD2 4.23Å; M1036-Y1044 HydrophobicContact CE-CG 3.99Å; M1036-Y1044 HydrophobicContact SD-CG 4.43Å
1037	T	89.5	Confident	82.8	Confident	82 Å²	82	94.9 Å²	94.9	50%	0.503	46%	0.46	S	S	.	.			trans	-70.1	164.4	-178.6	62.8	0	0	0	0	112.6	T1035 D1039 E1040 Q1041	T1035-T1037 PolarHBondContact O-N 3.26Å; T1037-D1039 VanDerWaalsContact C-N 3.3Å; T1037-D1039 PolarHBondContact O-N 3.21Å; T1037-E1040 WeakPolarHBondContact CB-OE2 3.33Å; T1037-E1040 WeakPolarHBondContact CG2-OE2 3.48Å; T1037-E1040 PolarHBondContact N-OE2 3.39Å; T1037-E1040 PolarHBondContact O-N 3.17Å; T1037-E1040 VanDerWaalsContact O-N 3.14Å; T1037-E1040 VanDerWaalsContact OG1-CD 3.23Å; T1037-E1040 VanDerWaalsContact OG1-CG 3.23Å; T1037-E1040 WeakPolarHBondContact OG1-CG 3.42Å; T1037-E1040 PolarHBondContact OG1-OE2 3.45Å; T1037-Q1041 WeakPolarHBondContact O-CG 3.34Å; T1037-Q1041 PolarHBondContact O-N 3.02Å
1038	I	82	Confident	82.6	Confident	131 Å²	131	93 Å²	93	67%	0.672	45%	0.45	S	S	*	.	H	α-helix	trans	-58.7	-38.7	-174.4	-63.2	174.5	0	0	0	112.5	R1042	I1038-R1042 PolarHBondContact O-N 3.36Å
1039	D	72.9	Confident	82.3	Confident	100 Å²	100	89.7 Å²	89.7	54%	0.535	45%	0.446	S	S	.	.	H	α-helix	trans	-79.6	-28.9	179.4	-64.2	-48.9	0	0	0	112.7	T1037 R1042 R1043	T1037-D1039 VanDerWaalsContact C-N 3.3Å; T1037-D1039 PolarHBondContact O-N 3.21Å; D1039-R1042 WeakPolarHBondContact O-CB 3.31Å; D1039-R1042 PolarHBondContact O-N 2.84Å; D1039-R1042 IonicContact OD1-CZ 3.19Å; D1039-R1042 IonicContact OD1-NE 3.62Å; D1039-R1042 PolarHBondContact OD1-NE 3.44Å; D1039-R1042 IonicContact OD1-NH2 2.87Å; D1039-R1042 PolarHBondContact OD1-NH2 3.3Å; D1039-R1043 WeakPolarHBondContact O-CB 3.44Å; D1039-R1043 PolarHBondContact O-N 3.33Å
1040	E	81.7	Confident	81.9	Confident	47 Å²	47	90.1 Å²	90.1	22%	0.22	45%	0.449	C	S	.	.	H	α-helix	trans	-68.5	-41.2	168.4	-69.9	173	131	0	0	111.7	L1029 K1032 M1036 T1037 R1042 R1043 Y1044	L1029-E1040 HydrophobicContact CD2-CB 3.95Å; L1029-E1040 HydrophobicContact CD2-CG 4.09Å; K1032-E1040 IonicContact NZ-OE1 3.77Å; K1032-E1040 PolarHBondContact NZ-OE1 2.89Å; K1032-E1040 IonicContact NZ-OE2 3.79Å; M1036-E1040 HydrophobicContact CG-CB 3.33Å; M1036-E1040 HydrophobicContact SD-CB 3.94Å; T1037-E1040 WeakPolarHBondContact CB-OE2 3.33Å; T1037-E1040 WeakPolarHBondContact CG2-OE2 3.48Å; T1037-E1040 PolarHBondContact N-OE2 3.39Å; T1037-E1040 PolarHBondContact O-N 3.17Å; T1037-E1040 VanDerWaalsContact O-N 3.14Å; T1037-E1040 VanDerWaalsContact OG1-CD 3.23Å; T1037-E1040 VanDerWaalsContact OG1-CG 3.23Å; T1037-E1040 WeakPolarHBondContact OG1-CG 3.42Å; T1037-E1040 PolarHBondContact OG1-OE2 3.45Å; E1040-R1042 PolarHBondContact O-N 3.35Å; E1040-R1043 PolarHBondContact O-N 2.8Å; E1040-R1043 VanDerWaalsContact O-N 3.13Å; E1040-Y1044 WeakPolarHBondContact O-CB 3.2Å; E1040-Y1044 PolarHBondContact O-N 3.41Å
1041	Q	83.4	Confident	81.6	Confident	80 Å²	80	87.7 Å²	87.7	37%	0.374	44%	0.437	S	S	.	.	H	α-helix	trans	-61	-34.5	172.4	-70.8	179.8	27.5	0	0	111.7	M1036 T1037 R1045	M1036-Q1041 HydrophobicContact CB-CG 4.12Å; M1036-Q1041 HydrophobicContact CE-CG 4.07Å; M1036-Q1041 HydrophobicContact CG-CG 3.88Å; M1036-Q1041 PolarHBondContact O-NE2 3.01Å; M1036-Q1041 HydrophobicContact SD-CG 4.48Å; T1037-Q1041 WeakPolarHBondContact O-CG 3.34Å; T1037-Q1041 PolarHBondContact O-N 3.02Å; Q1041-R1045 WeakPolarHBondContact O-CG 3.44Å; Q1041-R1045 PolarHBondContact O-N 3.28Å
1042	R	80.6	Confident	81.3	Confident	158 Å²	158	85.6 Å²	85.6	60%	0.596	42%	0.42	S	S	*	.	H	α-helix	trans	-65.7	-48.7	172.1	-165.3	-168	-48.4	-150.5	8.7	110.9	I1038 D1039 E1040 R1045 E1046	I1038-R1042 PolarHBondContact O-N 3.36Å; D1039-R1042 WeakPolarHBondContact O-CB 3.31Å; D1039-R1042 PolarHBondContact O-N 2.84Å; D1039-R1042 IonicContact OD1-CZ 3.19Å; D1039-R1042 IonicContact OD1-NE 3.62Å; D1039-R1042 PolarHBondContact OD1-NE 3.44Å; D1039-R1042 IonicContact OD1-NH2 2.87Å; D1039-R1042 PolarHBondContact OD1-NH2 3.3Å; E1040-R1042 PolarHBondContact O-N 3.35Å; R1042-R1045 PolarHBondContact O-N 3Å; R1042-E1046 PolarHBondContact O-N 3.07Å
1043	R	77.9	Confident	80.8	Confident	94 Å²	94	88.2 Å²	88.2	36%	0.355	43%	0.433	S	S	.	.	H	α-helix	trans	-68.8	-35.2	-177.2	-167.2	150.5	177.8	-100.1	-15.3	113	E1025 D1039 E1040 E1046 L1047	E1025-R1043 IonicContact OE1-CZ 2.72Å; E1025-R1043 IonicContact OE1-NH1 3.23Å; E1025-R1043 PolarHBondContact OE1-NH1 3.04Å; E1025-R1043 IonicContact OE1-NH2 3.99Å; E1025-R1043 PolarHBondContact OE1-NH2 3Å; E1025-R1043 IonicContact OE2-CZ 2.62Å; E1025-R1043 IonicContact OE2-NH1 2.88Å; E1025-R1043 PolarHBondContact OE2-NH1 3.47Å; E1025-R1043 IonicContact OE2-NH2 3.64Å; E1025-R1043 PolarHBondContact OE2-NH2 2.92Å; D1039-R1043 WeakPolarHBondContact O-CB 3.44Å; D1039-R1043 PolarHBondContact O-N 3.33Å; E1040-R1043 PolarHBondContact O-N 2.8Å; E1040-R1043 VanDerWaalsContact O-N 3.13Å; R1043-E1046 WeakPolarHBondContact O-CB 3.11Å; R1043-E1046 PolarHBondContact O-N 3.41Å; R1043-L1047 HydrophobicContact CG-CD1 4.33Å; R1043-L1047 WeakPolarHBondContact O-CG 3.43Å; R1043-L1047 PolarHBondContact O-N 2.87Å
1044	Y	86.9	Confident	80.5	Confident	55 Å²	55	83.8 Å²	83.8	22%	0.216	41%	0.412	C	S	.	.	H	α-helix	trans	-58.5	-46.7	170	178.7	-91.8	0	0	0	111.7	L1026 L1029 D1030 M1036 E1040 E1046 L1047 L1048	L1026-Y1044 HydrophobicContact CD2-CD2 3.68Å; L1026-Y1044 HydrophobicContact CD2-CE2 3.94Å; L1026-Y1044 HydrophobicContact CD2-CG 4.2Å; L1029-Y1044 HydrophobicContact CB-CD2 3.79Å; D1030-Y1044 HydrophobicContact CB-CE2 3.99Å; D1030-Y1044 WeakPolarHBondContact OD1-CE2 3.45Å; D1030-Y1044 VanDerWaalsContact OD1-CZ 3.31Å; D1030-Y1044 PolarHBondContact OD1-OH 2.94Å; M1036-Y1044 HydrophobicContact CE-CD1 4.37Å; M1036-Y1044 HydrophobicContact CE-CD2 4.23Å; M1036-Y1044 HydrophobicContact CE-CG 3.99Å; M1036-Y1044 HydrophobicContact SD-CG 4.43Å; E1040-Y1044 WeakPolarHBondContact O-CB 3.2Å; E1040-Y1044 PolarHBondContact O-N 3.41Å; Y1044-E1046 VanDerWaalsContact C-N 3.32Å; Y1044-E1046 PolarHBondContact O-N 3.02Å; Y1044-L1047 PolarHBondContact O-N 2.88Å; Y1044-L1048 HydrophobicContact CD1-CD1 3.9Å; Y1044-L1048 HydrophobicContact CD1-CG 4.48Å; Y1044-L1048 HydrophobicContact CE1-CD1 3.49Å; Y1044-L1048 VanDerWaalsContact CE1-CD1 3.49Å; Y1044-L1048 HydrophobicContact CE1-CG 4.27Å; Y1044-L1048 WeakPolarHBondContact O-CG 3.33Å; Y1044-L1048 PolarHBondContact O-N 3.39Å
1045	R	84.1	Confident	80.5	Confident	173 Å²	173	78.3 Å²	78.3	65%	0.653	39%	0.387	S	S	*	.	H	α-helix	trans	-65.1	-33.4	174.9	-69.8	175.7	-175.4	176.4	4.6	113.2	Q1041 R1042 N1049	Q1041-R1045 WeakPolarHBondContact O-CG 3.44Å; Q1041-R1045 PolarHBondContact O-N 3.28Å; R1042-R1045 PolarHBondContact O-N 3Å; R1045-N1049 PolarHBondContact O-N 3.1Å
1046	E	80.3	Confident	79.7	Confident	77 Å²	77	81.2 Å²	81.2	36%	0.36	39%	0.386	S	S	.	.	H	α-helix	trans	-66.7	-48.2	175.4	-163.6	-179	137.8	0	0	111.2	T1014 R1042 R1043 Y1044 L1048 N1049 V1050	T1014-E1046 VanDerWaalsContact CB-OE1 3.26Å; T1014-E1046 WeakPolarHBondContact CB-OE1 3.37Å; T1014-E1046 HydrophobicContact CG2-CG 4.28Å; T1014-E1046 PolarHBondContact OG1-OE1 3.3Å; R1042-E1046 PolarHBondContact O-N 3.07Å; R1043-E1046 WeakPolarHBondContact O-CB 3.11Å; R1043-E1046 PolarHBondContact O-N 3.41Å; Y1044-E1046 VanDerWaalsContact C-N 3.32Å; Y1044-E1046 PolarHBondContact O-N 3.02Å; E1046-L1048 PolarHBondContact O-N 3.48Å; E1046-N1049 WeakPolarHBondContact O-CB 3.44Å; E1046-N1049 PolarHBondContact O-N 2.87Å; E1046-V1050 PolarHBondContact O-N 3.48Å; E1046-V1050 VanDerWaalsContact O-N 3.13Å
1047	L	84.5	Confident	78.6	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-61.9	-40.2	176.9	-69.1	164.9	0	0	0	112.2	T1014 M1017 V1022 E1025 L1026 L1029 R1043 Y1044 N1049 V1050 V1051	T1014-L1047 HydrophobicContact CG2-CD2 3.69Å; T1014-L1047 HydrophobicContact CG2-CG 4.32Å; M1017-L1047 HydrophobicContact CE-CD2 4.33Å; M1017-L1047 HydrophobicContact SD-CD2 3.97Å; V1022-L1047 HydrophobicContact CB-CD2 4.49Å; V1022-L1047 HydrophobicContact CG1-CB 4.25Å; V1022-L1047 HydrophobicContact CG1-CD2 3.97Å; V1022-L1047 HydrophobicContact CG2-CD2 4.37Å; E1025-L1047 HydrophobicContact CB-CD1 4.16Å; E1025-L1047 HydrophobicContact CG-CD1 4.03Å; L1026-L1047 HydrophobicContact CD1-CB 4.2Å; L1026-L1047 HydrophobicContact CD2-CB 3.68Å; L1026-L1047 HydrophobicContact CD2-CD1 4.5Å; L1026-L1047 HydrophobicContact CG-CB 3.76Å; L1026-L1047 HydrophobicContact CG-CD1 4.42Å; L1029-L1047 HydrophobicContact CD1-CD1 4.1Å; R1043-L1047 HydrophobicContact CG-CD1 4.33Å; R1043-L1047 WeakPolarHBondContact O-CG 3.43Å; R1043-L1047 PolarHBondContact O-N 2.87Å; Y1044-L1047 PolarHBondContact O-N 2.88Å; L1047-N1049 VanDerWaalsContact C-N 3.3Å; L1047-N1049 PolarHBondContact O-N 3.06Å; L1047-V1050 WeakPolarHBondContact O-CB 3.37Å; L1047-V1050 PolarHBondContact O-N 3.48Å; L1047-V1050 VanDerWaalsContact O-N 3.1Å; L1047-V1051 PolarHBondContact O-N 3.35Å
1048	L	83.8	Confident	77.4	Confident	79 Å²	79	85.6 Å²	85.6	41%	0.414	40%	0.402	S	S	.	.	H	α-helix	trans	-58.9	-38.6	174.2	-76.8	177.9	0	0	0	113	L1026 Y1044 E1046 V1051 A1052	L1026-L1048 HydrophobicContact CD1-CD2 4.13Å; L1026-L1048 HydrophobicContact CD2-CD2 3.99Å; L1026-L1048 HydrophobicContact CD2-CG 3.88Å; Y1044-L1048 HydrophobicContact CD1-CD1 3.9Å; Y1044-L1048 HydrophobicContact CD1-CG 4.48Å; Y1044-L1048 HydrophobicContact CE1-CD1 3.49Å; Y1044-L1048 VanDerWaalsContact CE1-CD1 3.49Å; Y1044-L1048 HydrophobicContact CE1-CG 4.27Å; Y1044-L1048 WeakPolarHBondContact O-CG 3.33Å; Y1044-L1048 PolarHBondContact O-N 3.39Å; E1046-L1048 PolarHBondContact O-N 3.48Å; L1048-V1051 PolarHBondContact O-N 3.38Å; L1048-A1052 PolarHBondContact O-N 3.02Å; L1048-A1052 VanDerWaalsContact O-N 3.08Å
1049	N	80.4	Confident	76.3	Confident	117 Å²	117	85.6 Å²	85.6	63%	0.626	40%	0.398	S	S	*	.	H	α-helix	trans	-66.8	-40.4	174.2	-78	-28	0	0	0	111.6	R1045 E1046 L1047 A1052 E1053	R1045-N1049 PolarHBondContact O-N 3.1Å; E1046-N1049 WeakPolarHBondContact O-CB 3.44Å; E1046-N1049 PolarHBondContact O-N 2.87Å; L1047-N1049 VanDerWaalsContact C-N 3.3Å; L1047-N1049 PolarHBondContact O-N 3.06Å; N1049-A1052 PolarHBondContact O-N 2.97Å; N1049-E1053 WeakPolarHBondContact O-CB 3.48Å; N1049-E1053 PolarHBondContact O-N 2.86Å
1050	V	79.3	Confident	75.4	Confident	20 Å²	20	85.9 Å²	85.9	12%	0.121	40%	0.398	C	S	.	.	H	α-helix	trans	-61.3	-43.5	175.5	175.7	0	0	0	0	111.2	T1014 V1022 E1046 L1047 A1052 E1053 Q1054	T1014-V1050 HydrophobicContact CG2-CG2 4.27Å; V1022-V1050 HydrophobicContact CG2-CG1 4.16Å; E1046-V1050 PolarHBondContact O-N 3.48Å; E1046-V1050 VanDerWaalsContact O-N 3.13Å; L1047-V1050 WeakPolarHBondContact O-CB 3.37Å; L1047-V1050 PolarHBondContact O-N 3.48Å; L1047-V1050 VanDerWaalsContact O-N 3.1Å; V1050-A1052 PolarHBondContact O-N 2.98Å; V1050-E1053 PolarHBondContact O-N 2.69Å; V1050-Q1054 HydrophobicContact CG1-CG 4.25Å; V1050-Q1054 WeakPolarHBondContact O-CB 3.23Å; V1050-Q1054 WeakPolarHBondContact O-CG 3.49Å; V1050-Q1054 PolarHBondContact O-N 3.34Å
1051	V	79.7	Confident	73.7	Confident	26 Å²	26	89 Å²	89	16%	0.158	42%	0.416	C	S	.	.	H	α-helix	trans	-60.6	-44.7	174.3	177.2	0	0	0	0	111.4	Y1019 V1022 L1026 L1047 L1048 E1053 S1055	Y1019-V1051 HydrophobicContact CE2-CG1 4.42Å; V1022-V1051 HydrophobicContact CB-CG2 4.5Å; V1022-V1051 HydrophobicContact CG1-CG2 3.38Å; L1026-V1051 HydrophobicContact CD1-CG2 3.57Å; L1047-V1051 PolarHBondContact O-N 3.35Å; L1048-V1051 PolarHBondContact O-N 3.38Å; V1051-E1053 VanDerWaalsContact C-N 3.31Å; V1051-E1053 PolarHBondContact O-N 2.66Å; V1051-S1055 VanDerWaalsContact O-CB 3.24Å; V1051-S1055 WeakPolarHBondContact O-CB 3.34Å; V1051-S1055 PolarHBondContact O-N 3.1Å; V1051-S1055 PolarHBondContact O-OG 3.04Å
1052	A	77.9	Confident	72	Confident	42 Å²	42	88.5 Å²	88.5	35%	0.347	42%	0.422	S	S	.	.	H	α-helix	trans	-62.9	-36.8	179.1	0	0	0	0	0	112.4	L1048 N1049 V1050 R1056	L1048-A1052 PolarHBondContact O-N 3.02Å; L1048-A1052 VanDerWaalsContact O-N 3.08Å; N1049-A1052 PolarHBondContact O-N 2.97Å; V1050-A1052 PolarHBondContact O-N 2.98Å; A1052-R1056 WeakPolarHBondContact O-CG 3.3Å; A1052-R1056 PolarHBondContact O-N 3.34Å; A1052-R1056 VanDerWaalsContact O-N 3.14Å
1053	E	72.2	Confident	70.3	Confident	133 Å²	133	85.8 Å²	85.8	62%	0.621	42%	0.416	S	S	*	.	H	α-helix	trans	-75.6	-45.5	178.8	-168.9	150.4	-128.9	0	0	112.5	N1049 V1050 V1051 S1055 R1056 A1057	N1049-E1053 WeakPolarHBondContact O-CB 3.48Å; N1049-E1053 PolarHBondContact O-N 2.86Å; V1050-E1053 PolarHBondContact O-N 2.69Å; V1051-E1053 VanDerWaalsContact C-N 3.31Å; V1051-E1053 PolarHBondContact O-N 2.66Å; E1053-S1055 PolarHBondContact O-N 3.12Å; E1053-R1056 PolarHBondContact O-N 3.27Å; E1053-R1056 VanDerWaalsContact O-N 3.15Å; E1053-A1057 PolarHBondContact O-N 2.95Å
1054	Q	70.3	Confident	68.8	Low	49 Å²	49	88 Å²	88	23%	0.229	43%	0.433	C	S	.	.	H	α-helix	trans	-59.4	-34.3	171.9	-69.6	-173.3	10	0	0	111.9	M1017 Y1019 V1050 A1057 R1058	M1017-Q1054 PolarHBondContact O-NE2 3.08Å; Y1019-Q1054 HydrophobicContact CD2-CB 4.35Å; V1050-Q1054 HydrophobicContact CG1-CG 4.25Å; V1050-Q1054 WeakPolarHBondContact O-CB 3.23Å; V1050-Q1054 WeakPolarHBondContact O-CG 3.49Å; V1050-Q1054 PolarHBondContact O-N 3.34Å; Q1054-A1057 PolarHBondContact O-N 3.32Å; Q1054-R1058 PolarHBondContact O-N 2.95Å
1055	S	72.8	Confident	66.3	Low	50 Å²	50	96.1 Å²	96.1	35%	0.35	46%	0.463	S	S	.	.	H	α-helix	trans	-67.9	-40.9	174.9	-61.5	0	0	0	0	112.8	V1051 E1053 R1058 K1059	V1051-S1055 VanDerWaalsContact O-CB 3.24Å; V1051-S1055 WeakPolarHBondContact O-CB 3.34Å; V1051-S1055 PolarHBondContact O-N 3.1Å; V1051-S1055 PolarHBondContact O-OG 3.04Å; E1053-S1055 PolarHBondContact O-N 3.12Å; S1055-R1058 PolarHBondContact O-N 3.11Å; S1055-K1059 PolarHBondContact O-N 3.13Å
1056	R	68.8	Low	63.9	Low	173 Å²	173	91.9 Å²	91.9	65%	0.653	46%	0.46	S	S	*	.	H	α-helix	trans	-62.8	-43.7	173.6	-73	169	-176.8	160.7	2.6	111.7	A1052 E1053 K1059 L1060	A1052-R1056 WeakPolarHBondContact O-CG 3.3Å; A1052-R1056 PolarHBondContact O-N 3.34Å; A1052-R1056 VanDerWaalsContact O-N 3.14Å; E1053-R1056 PolarHBondContact O-N 3.27Å; E1053-R1056 VanDerWaalsContact O-N 3.15Å; R1056-K1059 PolarHBondContact O-N 2.77Å; R1056-L1060 PolarHBondContact O-N 2.91Å; R1056-L1060 VanDerWaalsContact O-N 3.09Å
1057	A	62.3	Low	61.7	Low	50 Å²	50	93.3 Å²	93.3	41%	0.413	48%	0.476	S	S	.	.	H	α-helix	trans	-61.2	-44.4	176.4	0	0	0	0	0	112	E1053 Q1054 K1059 L1060 L1061	E1053-A1057 PolarHBondContact O-N 2.95Å; Q1054-A1057 PolarHBondContact O-N 3.32Å; A1057-K1059 VanDerWaalsContact C-N 3.33Å; A1057-K1059 PolarHBondContact O-N 3.38Å; A1057-L1060 PolarHBondContact O-N 2.63Å; A1057-L1061 WeakPolarHBondContact O-CG 3.34Å; A1057-L1061 PolarHBondContact O-N 3.44Å; A1057-L1061 VanDerWaalsContact O-N 3.07Å
1058	R	63.2	Low	59.2	Low	143 Å²	143	99.5 Å²	99.5	54%	0.54	52%	0.516	S	S	.	.	H	α-helix	trans	-60.7	-38.8	173.4	-80.8	-178.9	167.3	175.3	-2.6	112.7	Q1054 S1055 L1061 S1062	Q1054-R1058 PolarHBondContact O-N 2.95Å; S1055-R1058 PolarHBondContact O-N 3.11Å; R1058-L1061 PolarHBondContact O-N 3.47Å; R1058-S1062 PolarHBondContact O-N 3.28Å
1059	K	60.1	Low	56.7	Low	131 Å²	131	102.6 Å²	102.6	57%	0.57	54%	0.538	S	S	*	.	H	α-helix	trans	-63.4	-48.1	177.3	-162.8	-171.9	-177.7	-139.7	0	111.9	S1055 R1056 A1057 L1061 S1062 E1063	S1055-K1059 PolarHBondContact O-N 3.13Å; R1056-K1059 PolarHBondContact O-N 2.77Å; A1057-K1059 VanDerWaalsContact C-N 3.33Å; A1057-K1059 PolarHBondContact O-N 3.38Å; K1059-L1061 VanDerWaalsContact C-N 3.29Å; K1059-L1061 PolarHBondContact O-N 3.29Å; K1059-S1062 WeakPolarHBondContact O-CA 3.25Å; K1059-S1062 WeakPolarHBondContact O-CB 3.31Å; K1059-S1062 PolarHBondContact O-N 3.05Å; K1059-S1062 PolarHBondContact O-OG 3.17Å; K1059-E1063 WeakPolarHBondContact CE-OE1 3.45Å; K1059-E1063 IonicContact NZ-OE1 3.87Å; K1059-E1063 PolarHBondContact NZ-OE1 2.86Å; K1059-E1063 PolarHBondContact O-N 3.41Å
1060	L	53.7	Low	54.4	Low	106 Å²	106	101.6 Å²	101.6	56%	0.555	54%	0.541	S	S	*	.	H	α-helix	trans	-59.4	-39.5	176.1	-70.9	166.5	0	0	0	112	R1056 A1057 S1062 E1063 I1064	R1056-L1060 PolarHBondContact O-N 2.91Å; R1056-L1060 VanDerWaalsContact O-N 3.09Å; A1057-L1060 PolarHBondContact O-N 2.63Å; L1060-S1062 VanDerWaalsContact C-N 3.29Å; L1060-S1062 PolarHBondContact O-N 3.19Å; L1060-E1063 PolarHBondContact O-N 2.98Å; L1060-I1064 WeakPolarHBondContact O-CD1 3.37Å; L1060-I1064 VanDerWaalsContact O-CG1 3.31Å; L1060-I1064 WeakPolarHBondContact O-CG1 3.36Å; L1060-I1064 PolarHBondContact O-N 2.76Å
1061	L	46.3	Very low	52	Low	114 Å²	114	111.3 Å²	111.3	60%	0.597	58%	0.577	S	S	*	*	H	α-helix	trans	-65.5	-28.4	174.2	-71.6	168.1	0	0	0	113.4	A1057 R1058 K1059	A1057-L1061 WeakPolarHBondContact O-CG 3.34Å; A1057-L1061 PolarHBondContact O-N 3.44Å; A1057-L1061 VanDerWaalsContact O-N 3.07Å; R1058-L1061 PolarHBondContact O-N 3.47Å; K1059-L1061 VanDerWaalsContact C-N 3.29Å; K1059-L1061 PolarHBondContact O-N 3.29Å
1062	S	47.4	Very low	49.5	Very low	69 Å²	69	117.7 Å²	117.7	48%	0.483	61%	0.605	S	S	.	*	H	α-helix	trans	-75	-41.1	174.5	74.9	0	0	0	0	112.6	R1058 K1059 L1060 I1064 R1065	R1058-S1062 PolarHBondContact O-N 3.28Å; K1059-S1062 WeakPolarHBondContact O-CA 3.25Å; K1059-S1062 WeakPolarHBondContact O-CB 3.31Å; K1059-S1062 PolarHBondContact O-N 3.05Å; K1059-S1062 PolarHBondContact O-OG 3.17Å; L1060-S1062 VanDerWaalsContact C-N 3.29Å; L1060-S1062 PolarHBondContact O-N 3.19Å; S1062-I1064 PolarHBondContact O-N 3.48Å; S1062-R1065 WeakPolarHBondContact O-CB 3.41Å; S1062-R1065 PolarHBondContact O-N 2.67Å
1063	E	45.5	Very low	47.1	Very low	101 Å²	101	123.4 Å²	123.4	47%	0.472	62%	0.624	S	S	.	*	H	α-helix	trans	-66.1	-26.6	178.7	-68.2	169.6	-177.4	0	0	111.9	K1059 L1060 R1065 S1066	K1059-E1063 WeakPolarHBondContact CE-OE1 3.45Å; K1059-E1063 IonicContact NZ-OE1 3.87Å; K1059-E1063 PolarHBondContact NZ-OE1 2.86Å; K1059-E1063 PolarHBondContact O-N 3.41Å; L1060-E1063 PolarHBondContact O-N 2.98Å; E1063-R1065 VanDerWaalsContact C-N 3.31Å; E1063-R1065 PolarHBondContact O-N 3.15Å; E1063-S1066 PolarHBondContact O-OG 3.13Å
1064	I	45.3	Very low	45	Very low	140 Å²	140	127.3 Å²	127.3	72%	0.718	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-16.1	173.2	-68.9	165.4	0	0	0	112.9	L1060 S1062	L1060-I1064 WeakPolarHBondContact O-CD1 3.37Å; L1060-I1064 VanDerWaalsContact O-CG1 3.31Å; L1060-I1064 WeakPolarHBondContact O-CG1 3.36Å; L1060-I1064 PolarHBondContact O-N 2.76Å; S1062-I1064 PolarHBondContact O-N 3.48Å
1065	R	35.7	Very low	42.7	Very low	226 Å²	226	134.5 Å²	134.5	85%	0.853	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-12.9	-171	-159.2	172.9	-178.8	-170.8	-1.2	114.6	S1062 E1063	S1062-R1065 WeakPolarHBondContact O-CB 3.41Å; S1062-R1065 PolarHBondContact O-N 2.67Å; E1063-R1065 VanDerWaalsContact C-N 3.31Å; E1063-R1065 PolarHBondContact O-N 3.15Å
1066	S	33.6	Very low	40.7	Very low	84 Å²	84	138.5 Å²	138.5	59%	0.587	68%	0.683	S	S	*	*	S	Bend	trans	-86.1	129.7	178.4	46.7	0	0	0	0	112.9	E1063	E1063-S1066 PolarHBondContact O-OG 3.13Å
1067	P	32.9	Very low	39	Very low	107 Å²	107	135.7 Å²	135.7	70%	0.695	69%	0.687	S	S	*	*			trans	-76.2	152	173	32.8	-34.8	0	0	0	111.7	T1069	P1067-T1069 PolarHBondContact O-N 2.91Å
1068	P	33	Very low	37.1	Very low	129 Å²	129	140.1 Å²	140.1	84%	0.838	70%	0.702	S	S	*	*			trans	-79	114	179.3	30.7	-33.4	0	0	0	112.1
1069	T	29.7	Very low	35.3	Very low	144 Å²	144	141.4 Å²	141.4	88%	0.883	71%	0.714	S	S	*	*			trans	-75.8	147.6	161.3	45.8	0	0	0	0	110.6	P1067	P1067-T1069 PolarHBondContact O-N 2.91Å
1070	S	32.2	Very low	33.5	Very low	96 Å²	96	140 Å²	140	67%	0.671	72%	0.717	S	S	*	*			trans	-128.7	128.6	-165.2	66.1	0	0	0	0	115.4
1071	Y	29.5	Very low	32.1	Very low	225 Å²	225	141.8 Å²	141.8	88%	0.882	72%	0.722	S	S	*	*			trans	77.6	156.1	159.5	-66.1	-68.7	0	0	0	120.7
1072	Q	28	Very low	31.2	Very low	159 Å²	159	144.9 Å²	144.9	74%	0.743	73%	0.731	S	S	*	*			trans	67.6	130.5	179.7	-56.9	-166.2	-84.4	0	0	115.5
1073	E	27.2	Very low	30.1	Very low	163 Å²	163	149.3 Å²	149.3	76%	0.762	74%	0.744	S	S	*	*			cis	-150.5	169.4	-8.6	-147.6	126.2	-115.6	0	0	110.4
1074	R	27	Very low	29.2	Very low	214 Å²	214	151.2 Å²	151.2	81%	0.808	75%	0.753	S	S	*	*			trans	-113.8	132.1	175.7	-79.4	-171.5	180	-176.3	1.8	111.3
1075	E	23.5	Very low	28.3	Very low	200 Å²	200	153 Å²	153	94%	0.935	76%	0.758	S	S	*	*			trans	-122.3	143.2	152.7	-67.6	-162	138.3	0	0	111
1076	I	29.5	Very low	28.2	Very low	134 Å²	134	149.4 Å²	149.4	69%	0.687	75%	0.751	S	S	*	*			trans	-155.8	139.8	-175.8	-56.3	178.1	0	0	0	103.9
1077	P	33.9	Very low	28.1	Very low	114 Å²	114	151.7 Å²	151.7	74%	0.74	75%	0.752	S	S	*	*			cis	-120.3	-155.6	32.1	24.8	1.3	0	0	0	111.7
1078	I	21.9	Very low	28	Very low	143 Å²	143	153.9 Å²	153.9	73%	0.733	75%	0.747	S	S	*	*			cis	-142.2	128.6	11.8	-47.6	165.7	0	0	0	105
1079	H	24.8	Very low	27.8	Very low	170 Å²	170	158.8 Å²	158.8	79%	0.787	75%	0.748	S	S	*	*				68.7	157.6	60.8	-151.9	74.9	0	0	0	115.2
1080	V	23.2	Very low	27.9	Very low	103 Å²	103	157 Å²	157	62%	0.624	73%	0.73	S	S	*	*			trans	82.1	126.2	-177.9	-177	0	0	0	0	115.1
1081	Q	24	Very low	27.8	Very low	143 Å²	143	158 Å²	158	67%	0.668	73%	0.732	S	S	*	*			cis	-155.1	148.3	-14.4	-115.9	174	37.2	0	0	112.5
1082	K	27.1	Very low	27.8	Very low	178 Å²	178	153 Å²	153	77%	0.774	73%	0.725	S	S	*	*			trans	22.7	138.1	146	-61.3	171.5	179.1	177	0	121.6
1083	E	25.2	Very low	27.8	Very low	163 Å²	163	151.8 Å²	151.8	76%	0.762	72%	0.722	S	S	*	*				177.3	156.7	102	-79.2	-141.8	127.3	0	0	109.2
1084	Q	26.6	Very low	27.9	Very low	141 Å²	141	150.5 Å²	150.5	66%	0.659	72%	0.72	S	S	*	*			cis	-157.2	179.5	-26.3	-112.9	-152.9	67.3	0	0	109.7
1085	Q	26	Very low	27.9	Very low	177 Å²	177	146.9 Å²	146.9	83%	0.827	72%	0.717	S	S	*	*			trans	70.7	111.9	-178.5	-51.4	-177.7	6.5	0	0	114.6
1086	Q	32.4	Very low	27.9	Very low	151 Å²	151	144.5 Å²	144.5	71%	0.706	71%	0.709	S	S	*	*			cis	76.4	139.6	41.7	-59	-162.1	-2.1	0	0	114.2
1087	H	31.6	Very low	28.5	Very low	131 Å²	131	142.6 Å²	142.6	61%	0.606	71%	0.706	S	S	*	*			cis	-168.9	170.9	-2.1	-113.5	10.9	0	0	0	108.2
1088	R	31.7	Very low	28	Very low	154 Å²	154	145.1 Å²	145.1	58%	0.581	71%	0.707	S	S	*	*			cis	170.4	138.5	-20	159.5	-178	168	176.1	3.7	109.9	E1090	R1088-E1090 HydrophobicContact CG-CG 4.42Å; R1088-E1090 VanDerWaalsContact CG-OE2 3.32Å; R1088-E1090 WeakPolarHBondContact CG-OE2 3.13Å; R1088-E1090 IonicContact CZ-OE1 2.71Å; R1088-E1090 VanDerWaalsContact CZ-OE1 3.25Å; R1088-E1090 IonicContact CZ-OE2 2.95Å; R1088-E1090 IonicContact NE-OE1 2.69Å; R1088-E1090 PolarHBondContact NE-OE1 2.96Å; R1088-E1090 IonicContact NE-OE2 3.57Å; R1088-E1090 PolarHBondContact NE-OE2 3.26Å; R1088-E1090 IonicContact NH2-OE1 3.41Å; R1088-E1090 PolarHBondContact NH2-OE1 2.98Å; R1088-E1090 IonicContact NH2-OE2 3.54Å
1089	R	29.1	Very low	28.2	Very low	231 Å²	231	143 Å²	143	87%	0.872	71%	0.705	S	S	*	*			trans	172.8	133.9	143.4	-94.3	149.9	-175	-177.4	0.9	110.9
1090	E	31.1	Very low	28.2	Very low	106 Å²	106	140.3 Å²	140.3	50%	0.495	71%	0.705	S	S	.	*			cis	98.6	150.4	31.8	-75.3	171.4	134.5	0	0	113.2	R1088	R1088-E1090 HydrophobicContact CG-CG 4.42Å; R1088-E1090 VanDerWaalsContact CG-OE2 3.32Å; R1088-E1090 WeakPolarHBondContact CG-OE2 3.13Å; R1088-E1090 IonicContact CZ-OE1 2.71Å; R1088-E1090 VanDerWaalsContact CZ-OE1 3.25Å; R1088-E1090 IonicContact CZ-OE2 2.95Å; R1088-E1090 IonicContact NE-OE1 2.69Å; R1088-E1090 PolarHBondContact NE-OE1 2.96Å; R1088-E1090 IonicContact NE-OE2 3.57Å; R1088-E1090 PolarHBondContact NE-OE2 3.26Å; R1088-E1090 IonicContact NH2-OE1 3.41Å; R1088-E1090 PolarHBondContact NH2-OE1 2.98Å; R1088-E1090 IonicContact NH2-OE2 3.54Å
1091	T	30.4	Very low	28.4	Very low	119 Å²	119	140.1 Å²	140.1	73%	0.73	71%	0.709	S	S	*	*			cis	-163	163.5	13	7	0	0	0	0	107.6
1092	V	29.2	Very low	28.7	Very low	120 Å²	120	137.1 Å²	137.1	73%	0.727	70%	0.704	S	S	*	*			cis	179.9	-179.3	-28.8	66	0	0	0	0	109
1093	I	29.2	Very low	28.7	Very low	132 Å²	132	134.5 Å²	134.5	68%	0.677	70%	0.702	S	S	*	*			trans	88.4	106.6	161.4	-76.3	162.6	0	0	0	120.3
1094	D	27.7	Very low	28.8	Very low	136 Å²	136	134.3 Å²	134.3	73%	0.727	70%	0.701	S	S	*	*				64.1	150.6	126.9	-46.2	-21	0	0	0	127.4
1095	D	26.8	Very low	28.9	Very low	139 Å²	139	133.5 Å²	133.5	74%	0.743	70%	0.701	S	S	*	*			trans	73.4	111.9	154.8	-67.7	-17.6	0	0	0	125.7
1096	I	24	Very low	28.9	Very low	150 Å²	150	130.8 Å²	130.8	77%	0.769	70%	0.696	S	S	*	*				42.6	139.4	109.2	-66.9	168.7	0	0	0	118.8
1097	P	41.7	Very low	28.4	Very low	94 Å²	94	128.8 Å²	128.8	61%	0.61	70%	0.699	S	S	*	*			cis	-146.9	-171.4	-13.1	45	-25.6	0	0	0	118.3
1098	H	25.2	Very low	28.6	Very low	167 Å²	167	128 Å²	128	77%	0.773	71%	0.706	S	S	*	*			trans	80.7	114.1	145.8	-67.8	-36.7	0	0	0	126.9
1099	S	24.7	Very low	28.2	Very low	97 Å²	97	127.5 Å²	127.5	68%	0.678	72%	0.72	S	S	*	*				80.9	121.9	119.4	-52.9	0	0	0	0	127
1100	S	25	Very low	27.9	Very low	114 Å²	114	121.5 Å²	121.5	80%	0.797	71%	0.713	S	S	*	*			trans	52.3	161	135.4	58.2	0	0	0	0	124.2
1101	S	27.7	Very low	28.4	Very low	100 Å²	100	122.2 Å²	122.2	70%	0.699	73%	0.727	S	S	*	*			cis	179.9	176.1	-29.2	61	0	0	0	0	111.7
1102	S	29.6	Very low	28.8	Very low	80 Å²	80	121.3 Å²	121.3	56%	0.559	72%	0.723	S	S	*	*			trans	75.8	161.1	156.2	6.4	0	0	0	0	120.1
1103	V	27.4	Very low	28.6	Very low	123 Å²	123	124.8 Å²	124.8	75%	0.745	73%	0.731	S	S	*	*			cis	-169.4	148.8	-16.9	118.1	0	0	0	0	114.5
1104	E	27.8	Very low	28.5	Very low	158 Å²	158	123.9 Å²	123.9	74%	0.738	74%	0.737	S	S	*	*			trans	56.8	135	149	-69.8	-169.2	125.8	0	0	131.3
1105	N	28.2	Very low	28.5	Very low	125 Å²	125	128.9 Å²	128.9	67%	0.668	75%	0.745	S	S	*	*				81.3	114.6	124.2	-65.6	-15.5	0	0	0	130.1
1106	V	26.4	Very low	28.3	Very low	119 Å²	119	132.3 Å²	132.3	72%	0.721	75%	0.754	S	S	*	*				88.2	112.5	116.9	174.9	0	0	0	0	125.5
1107	S	22.2	Very low	28.3	Very low	110 Å²	110	131 Å²	131	77%	0.769	75%	0.753	S	S	*	*			trans	63.2	172.5	142.9	-65.7	0	0	0	0	121.9
1108	P	35.3	Very low	27.6	Very low	114 Å²	114	134.1 Å²	134.1	74%	0.74	76%	0.759	S	S	*	*			cis	-139.7	167.3	3.5	43	-24.4	0	0	0	120.4
1109	V	23.5	Very low	27.5	Very low	144 Å²	144	134.7 Å²	134.7	87%	0.873	76%	0.76	S	S	*	*			trans	71.1	147.5	141.7	167.4	0	0	0	0	124.1
1110	S	23.3	Very low	27.5	Very low	105 Å²	105	137.6 Å²	137.6	73%	0.734	77%	0.766	S	S	*	*			trans	-98.1	-162.6	-175.2	-22.3	0	0	0	0	113.9
1111	P	41	Very low	27.7	Very low	120 Å²	120	139.1 Å²	139.1	78%	0.779	77%	0.765	S	S	*	*			cis	-127.5	-130.1	-5.1	39	-15.6	0	0	0	111.1
1112	P	38.3	Very low	27.8	Very low	101 Å²	101	141.8 Å²	141.8	66%	0.656	77%	0.767	S	S	*	*			cis	-133.7	174.7	-33.1	38.7	-20.8	0	0	0	117.1
1113	E	26.2	Very low	27.6	Very low	192 Å²	192	143 Å²	143	90%	0.897	77%	0.771	S	S	*	*			trans	58.7	158.4	146.4	-80.1	179.7	-169	0	0	122.6
1114	S	26.1	Very low	27.9	Very low	114 Å²	114	140.9 Å²	140.9	80%	0.797	76%	0.758	S	S	*	*			cis	-147.5	-176.3	7.9	62.1	0	0	0	0	113.4
1115	R	27.5	Very low	27.9	Very low	240 Å²	240	138.6 Å²	138.6	91%	0.906	75%	0.747	S	S	*	*			trans	-112.6	154	-179.4	-72.7	173.5	166	160.2	-6.8	113.7
1116	K	24.2	Very low	27.9	Very low	211 Å²	211	140.1 Å²	140.1	92%	0.917	75%	0.745	S	S	*	*			trans	-164	175.5	138.3	-112.9	164.8	-173.6	177.3	0	114.9
1117	V	23.6	Very low	27.9	Very low	124 Å²	124	142.1 Å²	142.1	75%	0.752	75%	0.746	S	S	*	*			trans	-138.6	159.8	-165.8	-162.8	0	0	0	0	106.4
1118	Q	25.8	Very low	28.5	Very low	159 Å²	159	143.2 Å²	143.2	74%	0.743	75%	0.748	S	S	*	*				171.5	144.1	65.6	-165.7	152.2	12	0	0	115
1119	F	23.5	Very low	28.4	Very low	178 Å²	178	143.7 Å²	143.7	78%	0.781	75%	0.751	S	S	*	*			trans	21.8	153.6	159.2	-62.7	-58.9	0	0	0	128
1120	I	26.1	Very low	28.5	Very low	159 Å²	159	143.2 Å²	143.2	82%	0.815	75%	0.749	S	S	*	*			trans	135.4	145.5	136.3	-64.4	-174.8	0	0	0	115.6
1121	D	28	Very low	28.7	Very low	146 Å²	146	144 Å²	144	78%	0.781	75%	0.754	S	S	*	*			trans	-102.9	-162.5	-158.3	-46.3	-94.6	0	0	0	115
1122	E	29.1	Very low	27.9	Very low	155 Å²	155	142 Å²	142	72%	0.724	76%	0.756	S	S	*	*			cis	-165.5	-161.4	19.8	-156.1	-108.4	-70.3	0	0	111.6	V1124	E1122-V1124 VanDerWaalsContact OE2-CG2 3.3Å; E1122-V1124 WeakPolarHBondContact OE2-CG2 3.45Å
1123	V	26.9	Very low	27.4	Very low	106 Å²	106	141.5 Å²	141.5	64%	0.642	76%	0.76	S	S	*	*			trans	88.5	150.5	162.3	-175.8	0	0	0	0	119
1124	V	33.7	Very low	27.5	Very low	78 Å²	78	139.2 Å²	139.2	47%	0.473	75%	0.754	S	S	.	*				179.2	163.7	-56.2	142.7	0	0	0	0	111.8	P961 E1122	P961-V1124 WeakPolarHBondContact CG-O 3.44Å; E1122-V1124 VanDerWaalsContact OE2-CG2 3.3Å; E1122-V1124 WeakPolarHBondContact OE2-CG2 3.45Å
1125	Q	27.8	Very low	27.4	Very low	111 Å²	111	142.5 Å²	142.5	52%	0.519	76%	0.756	S	S	.	*			trans	76.1	163.3	166.6	-87.7	168	-4.8	0	0	119.7
1126	Y	28.5	Very low	27.3	Very low	157 Å²	157	134.5 Å²	134.5	62%	0.616	74%	0.742	S	S	*	*			cis	-159	145.3	6.6	-126.1	-35.6	0	0	0	115.5
1127	Q	25.3	Very low	27.3	Very low	161 Å²	161	133.3 Å²	133.3	75%	0.752	74%	0.737	S	S	*	*			trans	58.7	165.4	142.7	-91.2	169.3	3.9	0	0	127.4
1128	T	36	Very low	27.4	Very low	132 Å²	132	135.4 Å²	135.4	81%	0.81	74%	0.736	S	S	*	*			trans	-151.1	169.3	-163.8	52.6	0	0	0	0	114.5
1129	P	32	Very low	27.3	Very low	125 Å²	125	134.3 Å²	134.3	81%	0.812	74%	0.735	S	S	*	*			trans	-129.8	-178.1	169.7	40.3	-25.5	0	0	0	117.4
1130	T	25.1	Very low	27.4	Very low	134 Å²	134	132.7 Å²	132.7	82%	0.822	74%	0.735	S	S	*	*			trans	-151.9	175.9	-159	47.6	0	0	0	0	113.2
1131	S	28.1	Very low	27.4	Very low	120 Å²	120	131.1 Å²	131.1	84%	0.839	73%	0.733	S	S	*	*			cis	-175.8	157.6	-29.1	-80.3	0	0	0	0	111.9
1132	G	24.5	Very low	27.5	Very low	79 Å²	79	129.6 Å²	129.6	81%	0.814	73%	0.73	S	S	*	*			trans	122.2	166.1	166.2	0	0	0	0	0	116.8
1133	A	27.4	Very low	27.3	Very low	91 Å²	91	128.9 Å²	128.9	75%	0.752	74%	0.736	S	S	*	*			cis	-169.3	160.6	-15.5	0	0	0	0	0	113.9
1134	N	28.4	Very low	27.3	Very low	144 Å²	144	131.7 Å²	131.7	77%	0.77	75%	0.747	S	S	*	*			trans	79.1	113.8	155.3	-63.3	-9.9	0	0	0	125.1
1135	H	24.5	Very low	27.1	Very low	182 Å²	182	135.8 Å²	135.8	84%	0.843	77%	0.766	S	S	*	*			trans	49.7	145.1	130.1	-69.6	-76.1	0	0	0	123.5
1136	A	25.1	Very low	27	Very low	72 Å²	72	135.6 Å²	135.6	60%	0.595	78%	0.777	S	S	*	*			cis	-170.3	175.1	-6.7	0	0	0	0	0	113.4
1137	F	24.2	Very low	27.3	Very low	186 Å²	186	134.5 Å²	134.5	82%	0.816	79%	0.789	S	S	*	*			trans	105.4	133.2	156.7	-74.5	-77.2	0	0	0	122.6
1138	F	24.9	Very low	27.3	Very low	168 Å²	168	130.3 Å²	130.3	74%	0.737	79%	0.789	S	S	*	*			trans	67.8	119.4	155.6	-75.7	-67.1	0	0	0	124.5
1139	D	24.6	Very low	26.9	Very low	136 Å²	136	132 Å²	132	73%	0.727	79%	0.791	S	S	*	*			trans	58.6	137.3	138.7	-61.8	-4.7	0	0	0	127.3
1140	D	25.7	Very low	26.8	Very low	145 Å²	145	133.2 Å²	133.2	78%	0.775	80%	0.796	S	S	*	*			trans	82.4	107.8	138.9	-98.3	-0.3	0	0	0	125.5
1141	V	25.8	Very low	26.9	Very low	126 Å²	126	129.6 Å²	129.6	76%	0.764	79%	0.786	S	S	*	*			trans	65	167.9	147	-106.4	0	0	0	0	119.4
1142	P	28.8	Very low	27.3	Very low	113 Å²	113	130.5 Å²	130.5	73%	0.734	79%	0.786	S	S	*	*				-119.8	159.2	-122.7	41.1	-25.5	0	0	0	115.9
1143	V	26.6	Very low	27.6	Very low	141 Å²	141	134.4 Å²	134.4	86%	0.855	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-103.9	137.3	170.3	178.2	0	0	0	0	110
1144	L	26.4	Very low	27.9	Very low	165 Å²	165	139.7 Å²	139.7	86%	0.864	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-80.4	127.8	169	-77.2	99.4	0	0	0	110.4
1145	D	28.9	Very low	28.3	Very low	163 Å²	163	139.2 Å²	139.2	87%	0.872	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-83.8	150.3	169.4	-122.7	-29	0	0	0	111.6
1146	S	26.7	Very low	28.6	Very low	107 Å²	107	140.2 Å²	140.2	75%	0.748	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-102.1	136.1	177.7	-66.6	0	0	0	0	111
1147	P	34.3	Very low	29.3	Very low	135 Å²	135	146.7 Å²	146.7	88%	0.877	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78.9	140.4	-168.6	30.4	-35.4	0	0	0	114
1148	G	25.6	Very low	30.5	Very low	72 Å²	72	139.7 Å²	139.7	74%	0.742	77%	0.772	S	S	*	*			trans	-144.6	47.5	-172.8	0	0	0	0	0	116
1149	I	28.2	Very low	31.1	Very low	167 Å²	167	135.5 Å²	135.5	86%	0.856	76%	0.761	S	S	*	*			trans	55.4	87.1	155.7	-47.5	176.4	0	0	0	118
1150	V	28.1	Very low	32.2	Very low	151 Å²	151	137.7 Å²	137.7	92%	0.915	76%	0.759	S	S	*	*			trans	-152.5	142.6	144.9	-174.7	0	0	0	0	107.5
1151	G	28.7	Very low	33.3	Very low	59 Å²	59	136.8 Å²	136.8	61%	0.608	75%	0.75	S	S	*	*			cis	162.6	131.6	-9.4	0	0	0	0	0	112.9
1152	T	35.6	Very low	34.6	Very low	138 Å²	138	139.3 Å²	139.3	85%	0.847	75%	0.746	S	S	*	*			trans	36	88.4	165.6	58.2	0	0	0	0	119.2
1153	N	31.3	Very low	35.6	Very low	162 Å²	162	141.8 Å²	141.8	87%	0.866	74%	0.741	S	S	*	*			trans	-172.9	68.7	145	-103.6	-28.3	0	0	0	111.6	I1155	N1153-I1155 PolarHBondContact O-N 3.45Å
1154	E	34.5	Very low	37	Very low	201 Å²	201	139.5 Å²	139.5	94%	0.939	72%	0.724	S	S	*	*			trans	-83.3	97.4	-179.6	-63.7	-157.8	164.8	0	0	112.3	Y1156	E1154-Y1156 PolarHBondContact O-N 3.02Å
1155	I	35.4	Very low	38.4	Very low	134 Å²	134	135.5 Å²	135.5	69%	0.687	70%	0.703	S	S	*	*			trans	-70.8	117	168.4	-61.2	170	0	0	0	108.3	N1153 R1157	N1153-I1155 PolarHBondContact O-N 3.45Å; I1155-R1157 PolarHBondContact O-N 2.76Å; I1155-R1157 VanDerWaalsContact O-N 3.07Å
1156	Y	31.7	Very low	39.7	Very low	203 Å²	203	132.3 Å²	132.3	80%	0.796	68%	0.683	S	S	*	*			trans	-58	112.3	173.2	-176	-91.5	0	0	0	110.7	E1154	E1154-Y1156 PolarHBondContact O-N 3.02Å
1157	R	38.8	Very low	41.1	Very low	208 Å²	208	130.8 Å²	130.8	79%	0.785	67%	0.666	S	S	*	*			trans	-108.7	119.3	178.6	-72.5	178.1	177.7	-171.9	-0.4	109.7	I1155 P1159	I1155-R1157 PolarHBondContact O-N 2.76Å; I1155-R1157 VanDerWaalsContact O-N 3.07Å; R1157-P1159 WeakPolarHBondContact O-CD 3.37Å
1158	D	49	Very low	41.9	Very low	39 Å²	39	129.6 Å²	129.6	21%	0.209	65%	0.649	C	S	.	*			trans	-61.6	120.7	-178.6	-170.6	-32.3	0	0	0	111.4	R1160 Q1161 R1162	D1158-R1160 PolarHBondContact O-N 3.08Å; D1158-R1160 VanDerWaalsContact O-N 3.1Å; D1158-R1160 WeakPolarHBondContact OD1-CB 3.49Å; D1158-R1160 WeakPolarHBondContact OD1-CG 3.45Å; D1158-R1160 IonicContact OD1-CZ 3.58Å; D1158-R1160 PolarHBondContact OD1-N 2.97Å; D1158-R1160 IonicContact OD1-NE 2.79Å; D1158-R1160 PolarHBondContact OD1-NE 2.98Å; D1158-R1160 IonicContact OD1-NH2 3.08Å; D1158-R1160 IonicContact OD2-CZ 3.47Å; D1158-R1160 IonicContact OD2-NE 3.46Å; D1158-R1160 PolarHBondContact OD2-NE 3.15Å; D1158-R1160 IonicContact OD2-NH2 2.74Å; D1158-R1160 PolarHBondContact OD2-NH2 3.45Å; D1158-Q1161 HydrophobicContact CB-CB 4.24Å; D1158-Q1161 WeakPolarHBondContact O-CB 3.4Å; D1158-Q1161 PolarHBondContact O-N 3.49Å; D1158-R1162 PolarHBondContact O-N 3.13Å
1159	P	38.3	Very low	43	Very low	80 Å²	80	130.7 Å²	130.7	52%	0.519	64%	0.638	S	S	.	*	H	α-helix	trans	-58.3	-24.2	178.2	-26.2	35.7	0	0	0	114.1	R1157 Q1161 R1163	R1157-P1159 WeakPolarHBondContact O-CD 3.37Å; P1159-Q1161 VanDerWaalsContact C-N 3.35Å; P1159-R1163 WeakPolarHBondContact O-CB 3.12Å; P1159-R1163 PolarHBondContact O-N 2.81Å; P1159-R1163 VanDerWaalsContact O-N 3.08Å
1160	R	47	Very low	43.9	Very low	183 Å²	183	130.5 Å²	130.5	69%	0.691	63%	0.626	S	S	*	*	H	α-helix	trans	-68.8	-34.7	174.1	-60.6	171.2	-72.7	-164.7	-2.6	111.6	D1158 R1163 L1164	D1158-R1160 PolarHBondContact O-N 3.08Å; D1158-R1160 VanDerWaalsContact O-N 3.1Å; D1158-R1160 WeakPolarHBondContact OD1-CB 3.49Å; D1158-R1160 WeakPolarHBondContact OD1-CG 3.45Å; D1158-R1160 IonicContact OD1-CZ 3.58Å; D1158-R1160 PolarHBondContact OD1-N 2.97Å; D1158-R1160 IonicContact OD1-NE 2.79Å; D1158-R1160 PolarHBondContact OD1-NE 2.98Å; D1158-R1160 IonicContact OD1-NH2 3.08Å; D1158-R1160 IonicContact OD2-CZ 3.47Å; D1158-R1160 IonicContact OD2-NE 3.46Å; D1158-R1160 PolarHBondContact OD2-NE 3.15Å; D1158-R1160 IonicContact OD2-NH2 2.74Å; D1158-R1160 PolarHBondContact OD2-NH2 3.45Å; R1160-R1163 PolarHBondContact O-N 2.93Å; R1160-L1164 VanDerWaalsContact O-CB 3.3Å; R1160-L1164 WeakPolarHBondContact O-CB 3.32Å; R1160-L1164 PolarHBondContact O-N 2.88Å
1161	Q	50.1	Low	44.7	Very low	125 Å²	125	128.4 Å²	128.4	58%	0.584	61%	0.61	S	S	*	*	H	α-helix	trans	-73.5	-38.2	179.8	-159.6	168.5	14.5	0	0	111	D1158 P1159 L1164 N1165	D1158-Q1161 HydrophobicContact CB-CB 4.24Å; D1158-Q1161 WeakPolarHBondContact O-CB 3.4Å; D1158-Q1161 PolarHBondContact O-N 3.49Å; P1159-Q1161 VanDerWaalsContact C-N 3.35Å; Q1161-L1164 PolarHBondContact O-N 2.85Å; Q1161-N1165 PolarHBondContact O-N 2.7Å; Q1161-N1165 PolarHBondContact O-OD1 2.89Å
1162	R	53.4	Low	45.3	Very low	179 Å²	179	134 Å²	134	68%	0.675	61%	0.612	S	S	*	*	H	α-helix	trans	-56.7	-51.4	166.4	176.7	176.3	175.6	163.9	3.9	111.5	D1158 L1164 N1165 E1166	D1158-R1162 PolarHBondContact O-N 3.13Å; R1162-L1164 VanDerWaalsContact C-N 3.27Å; R1162-L1164 PolarHBondContact O-N 2.84Å; R1162-N1165 PolarHBondContact O-N 2.98Å; R1162-E1166 HydrophobicContact CG-CG 4.45Å; R1162-E1166 WeakPolarHBondContact CG-OE1 3.19Å; R1162-E1166 IonicContact CZ-OE1 3.47Å; R1162-E1166 IonicContact NE-OE1 3.48Å; R1162-E1166 PolarHBondContact NE-OE1 3.12Å; R1162-E1166 IonicContact NH2-OE1 2.66Å; R1162-E1166 PolarHBondContact NH2-OE1 3.13Å; R1162-E1166 WeakPolarHBondContact O-CG 3.4Å; R1162-E1166 PolarHBondContact O-N 3.47Å
1163	R	48.3	Very low	45.6	Very low	165 Å²	165	131.5 Å²	131.5	62%	0.623	60%	0.601	S	S	*	*	H	α-helix	trans	-64.7	-29.8	-179.6	-160.4	-177	-60.6	170.3	1.9	113	P1159 R1160 L1167	P1159-R1163 WeakPolarHBondContact O-CB 3.12Å; P1159-R1163 PolarHBondContact O-N 2.81Å; P1159-R1163 VanDerWaalsContact O-N 3.08Å; R1160-R1163 PolarHBondContact O-N 2.93Å; R1163-L1167 WeakPolarHBondContact O-CB 3.46Å; R1163-L1167 WeakPolarHBondContact O-CD1 3.46Å; R1163-L1167 VanDerWaalsContact O-CG 3.28Å; R1163-L1167 WeakPolarHBondContact O-CG 3.3Å; R1163-L1167 PolarHBondContact O-N 2.97Å; R1163-L1167 VanDerWaalsContact O-N 3.12Å
1164	L	55.7	Low	46.2	Very low	94 Å²	94	128.3 Å²	128.3	49%	0.492	59%	0.591	S	S	.	*	H	α-helix	trans	-72.6	-42	174.8	-173.9	64.6	0	0	0	111.6	R1160 Q1161 R1162 L1167 Q1168	R1160-L1164 VanDerWaalsContact O-CB 3.3Å; R1160-L1164 WeakPolarHBondContact O-CB 3.32Å; R1160-L1164 PolarHBondContact O-N 2.88Å; Q1161-L1164 PolarHBondContact O-N 2.85Å; R1162-L1164 VanDerWaalsContact C-N 3.27Å; R1162-L1164 PolarHBondContact O-N 2.84Å; L1164-L1167 PolarHBondContact O-N 3.47Å; L1164-Q1168 WeakPolarHBondContact O-CG 3.21Å; L1164-Q1168 PolarHBondContact O-N 2.93Å
1165	N	56.2	Low	46.5	Very low	81 Å²	81	126.5 Å²	126.5	43%	0.433	58%	0.583	S	S	.	*	H	α-helix	trans	-64	-46.2	173.2	-70.2	14.9	0	0	0	110.9	Q1161 R1162 L1167 Q1168 D1169	Q1161-N1165 PolarHBondContact O-N 2.7Å; Q1161-N1165 PolarHBondContact O-OD1 2.89Å; R1162-N1165 PolarHBondContact O-N 2.98Å; N1165-L1167 PolarHBondContact O-N 3.37Å; N1165-Q1168 PolarHBondContact O-N 2.97Å; N1165-D1169 PolarHBondContact O-N 2.99Å
1166	E	56.5	Low	46.6	Very low	96 Å²	96	127 Å²	127	45%	0.449	59%	0.587	S	S	.	*	H	α-helix	trans	-57.6	-30	174.2	-72.2	167.9	176.5	0	0	112.6	R1162 R1170	R1162-E1166 HydrophobicContact CG-CG 4.45Å; R1162-E1166 WeakPolarHBondContact CG-OE1 3.19Å; R1162-E1166 IonicContact CZ-OE1 3.47Å; R1162-E1166 IonicContact NE-OE1 3.48Å; R1162-E1166 PolarHBondContact NE-OE1 3.12Å; R1162-E1166 IonicContact NH2-OE1 2.66Å; R1162-E1166 PolarHBondContact NH2-OE1 3.13Å; R1162-E1166 WeakPolarHBondContact O-CG 3.4Å; R1162-E1166 PolarHBondContact O-N 3.47Å; E1166-R1170 VanDerWaalsContact O-CB 3.25Å; E1166-R1170 WeakPolarHBondContact O-CB 3.43Å; E1166-R1170 PolarHBondContact O-N 2.88Å
1167	L	57.1	Low	47.4	Very low	75 Å²	75	121.3 Å²	121.3	39%	0.393	59%	0.589	S	S	.	*	H	α-helix	trans	-78.2	-37	171.8	-77.3	166.5	0	0	0	113.2	R1163 L1164 N1165 N1171	R1163-L1167 WeakPolarHBondContact O-CB 3.46Å; R1163-L1167 WeakPolarHBondContact O-CD1 3.46Å; R1163-L1167 VanDerWaalsContact O-CG 3.28Å; R1163-L1167 WeakPolarHBondContact O-CG 3.3Å; R1163-L1167 PolarHBondContact O-N 2.97Å; R1163-L1167 VanDerWaalsContact O-N 3.12Å; L1164-L1167 PolarHBondContact O-N 3.47Å; N1165-L1167 PolarHBondContact O-N 3.37Å; L1167-N1171 VanDerWaalsContact O-CG 3.31Å; L1167-N1171 PolarHBondContact O-N 3.32Å; L1167-N1171 VanDerWaalsContact O-N 3.08Å; L1167-N1171 PolarHBondContact O-OD1 3.48Å
1168	Q	50.5	Low	47.7	Very low	110 Å²	110	116 Å²	116	51%	0.514	59%	0.59	S	S	.	*	H	α-helix	trans	-70.1	-42.1	176.8	-75.1	-177.2	-5	0	0	112.1	L1164 N1165 N1171 R1172	L1164-Q1168 WeakPolarHBondContact O-CG 3.21Å; L1164-Q1168 PolarHBondContact O-N 2.93Å; N1165-Q1168 PolarHBondContact O-N 2.97Å; Q1168-N1171 PolarHBondContact O-N 3.34Å; Q1168-R1172 PolarHBondContact O-N 3.07Å
1169	D	48.9	Very low	47.3	Very low	95 Å²	95	119 Å²	119	51%	0.508	62%	0.621	S	S	.	*	H	α-helix	trans	-67.1	-37.6	176.5	-69.1	-33.5	0	0	0	111.2	N1165 N1171 R1172 S1173	N1165-D1169 PolarHBondContact O-N 2.99Å; D1169-N1171 VanDerWaalsContact C-N 3.31Å; D1169-N1171 PolarHBondContact O-N 2.7Å; D1169-R1172 PolarHBondContact O-N 3.11Å; D1169-S1173 WeakPolarHBondContact O-CB 3.45Å; D1169-S1173 PolarHBondContact O-N 3.11Å; D1169-S1173 PolarHBondContact O-OG 2.64Å; D1169-S1173 VanDerWaalsContact O-OG 3.12Å
1170	R	47.6	Very low	47.7	Very low	163 Å²	163	121.8 Å²	121.8	62%	0.615	63%	0.631	S	S	*	*	H	α-helix	trans	-68.7	-27.5	174.2	-165.3	168.5	69.4	-171.1	1.9	113.4	E1166 S1173 S1174	E1166-R1170 VanDerWaalsContact O-CB 3.25Å; E1166-R1170 WeakPolarHBondContact O-CB 3.43Å; E1166-R1170 PolarHBondContact O-N 2.88Å; R1170-S1173 WeakPolarHBondContact CA-OG 3.4Å; R1170-S1173 PolarHBondContact O-OG 3.03Å; R1170-S1173 VanDerWaalsContact O-OG 3.11Å; R1170-S1174 PolarHBondContact O-OG 3.41Å
1171	N	45	Very low	47.8	Very low	106 Å²	106	114.4 Å²	114.4	57%	0.567	61%	0.612	S	S	*	*	H	α-helix	trans	-74.9	-45.5	170.2	-75.1	1	0	0	0	111.1	L1167 Q1168 D1169 S1173 S1174	L1167-N1171 VanDerWaalsContact O-CG 3.31Å; L1167-N1171 PolarHBondContact O-N 3.32Å; L1167-N1171 VanDerWaalsContact O-N 3.08Å; L1167-N1171 PolarHBondContact O-OD1 3.48Å; Q1168-N1171 PolarHBondContact O-N 3.34Å; D1169-N1171 VanDerWaalsContact C-N 3.31Å; D1169-N1171 PolarHBondContact O-N 2.7Å; N1171-S1173 VanDerWaalsContact C-N 3.31Å; N1171-S1173 PolarHBondContact O-N 3.46Å; N1171-S1174 WeakPolarHBondContact O-CA 3.42Å; N1171-S1174 VanDerWaalsContact O-CB 3.29Å; N1171-S1174 WeakPolarHBondContact O-CB 3.31Å; N1171-S1174 PolarHBondContact O-N 3.32Å
1172	R	40.7	Very low	48.1	Very low	176 Å²	176	111.5 Å²	111.5	66%	0.664	61%	0.61	S	S	*	*	H	α-helix	trans	-59.2	-38.7	175.8	-79.6	177.4	157.7	-175.4	-7.3	112.9	Q1168 D1169 S1174 E1175	Q1168-R1172 PolarHBondContact O-N 3.07Å; D1169-R1172 PolarHBondContact O-N 3.11Å; R1172-S1174 PolarHBondContact O-N 2.99Å; R1172-E1175 PolarHBondContact O-N 3.43Å
1173	S	41.7	Very low	48	Very low	86 Å²	86	112.9 Å²	112.9	60%	0.601	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-2.9	173.4	62.2	0	0	0	0	114.3	D1169 R1170 N1171	D1169-S1173 WeakPolarHBondContact O-CB 3.45Å; D1169-S1173 PolarHBondContact O-N 3.11Å; D1169-S1173 PolarHBondContact O-OG 2.64Å; D1169-S1173 VanDerWaalsContact O-OG 3.12Å; R1170-S1173 WeakPolarHBondContact CA-OG 3.4Å; R1170-S1173 PolarHBondContact O-OG 3.03Å; R1170-S1173 VanDerWaalsContact O-OG 3.11Å; N1171-S1173 VanDerWaalsContact C-N 3.31Å; N1171-S1173 PolarHBondContact O-N 3.46Å
1174	S	43.3	Very low	48.3	Very low	96 Å²	96	108 Å²	108	67%	0.671	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-11.8	172.8	-56.2	0	0	0	0	113.5	R1170 N1171 R1172	R1170-S1174 PolarHBondContact O-OG 3.41Å; N1171-S1174 WeakPolarHBondContact O-CA 3.42Å; N1171-S1174 VanDerWaalsContact O-CB 3.29Å; N1171-S1174 WeakPolarHBondContact O-CB 3.31Å; N1171-S1174 PolarHBondContact O-N 3.32Å; R1172-S1174 PolarHBondContact O-N 2.99Å
1175	E	41.3	Very low	48.8	Very low	163 Å²	163	105.5 Å²	105.5	76%	0.762	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-28.8	-178.7	-66.3	-177	137.8	0	0	112.9	R1172 G1177	R1172-E1175 PolarHBondContact O-N 3.43Å; E1175-G1177 PolarHBondContact O-N 3.45Å
1176	N	37.4	Very low	48.5	Very low	145 Å²	145	109.7 Å²	109.7	78%	0.775	62%	0.618	S	S	*	*	S	Bend	trans	-85.5	88.4	171.9	-78.2	-17.5	0	0	0	110.9	A1178	N1176-A1178 PolarHBondContact O-N 2.91Å
1177	G	47.7	Very low	48.4	Very low	82 Å²	82	113.4 Å²	113.4	85%	0.845	63%	0.628	S	S	*	*			trans	-71.5	86.7	-172.6	0	0	0	0	0	116	E1175	E1175-G1177 PolarHBondContact O-N 3.45Å
1178	A	46.7	Very low	48.5	Very low	97 Å²	97	113.4 Å²	113.4	80%	0.802	63%	0.628	S	S	*	*			trans	-158.1	70	160.5	0	0	0	0	0	111.2	N1176 D1180	N1176-A1178 PolarHBondContact O-N 2.91Å; A1178-D1180 PolarHBondContact O-N 2.86Å
1179	A	39.9	Very low	49.4	Very low	103 Å²	103	111.9 Å²	111.9	85%	0.851	62%	0.62	S	S	*	*			trans	-87.1	105	-174.3	0	0	0	0	0	113	G1181	A1179-G1181 PolarHBondContact O-N 3.48Å
1180	D	47.6	Very low	49.9	Very low	137 Å²	137	113 Å²	113	73%	0.733	62%	0.622	S	S	*	*			trans	-64.7	122.4	166.8	178	3.3	0	0	0	110.6	A1178 A1182	A1178-D1180 PolarHBondContact O-N 2.86Å; D1180-A1182 PolarHBondContact O-N 3.4Å; D1180-A1182 VanDerWaalsContact O-N 3.17Å; D1180-A1182 PolarHBondContact OD1-N 3.5Å
1181	G	49.2	Very low	50.5	Low	29 Å²	29	112.7 Å²	112.7	30%	0.299	62%	0.621	S	S	.	*	G	3₁₀ helix	trans	-68.6	-10.6	-172.7	0	0	0	0	0	115.2	A1179 K1183 L1184 K1189	A1179-G1181 PolarHBondContact O-N 3.48Å; G1181-K1183 VanDerWaalsContact C-N 3.33Å; G1181-K1183 PolarHBondContact O-N 2.8Å; G1181-L1184 PolarHBondContact O-N 2.81Å; G1181-K1189 WeakPolarHBondContact O-CE 3.32Å
1182	A	55.9	Low	51.3	Low	64 Å²	64	112.1 Å²	112.1	53%	0.529	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-50.7	-47.5	-175.3	0	0	0	0	0	113.5	D1180 K1189	D1180-A1182 PolarHBondContact O-N 3.4Å; D1180-A1182 VanDerWaalsContact O-N 3.17Å; D1180-A1182 PolarHBondContact OD1-N 3.5Å; A1182-K1189 PolarHBondContact O-NZ 3.21Å
1183	K	50	Low	51.9	Low	208 Å²	208	109.9 Å²	109.9	90%	0.904	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-90	1.9	-169.9	-67.2	-177.3	179.5	176.2	0	115.9	G1181	G1181-K1183 VanDerWaalsContact C-N 3.33Å; G1181-K1183 PolarHBondContact O-N 2.8Å
1184	L	56.1	Low	52.5	Low	63 Å²	63	107.6 Å²	107.6	33%	0.33	60%	0.599	S	S	.	*			trans	-72.3	139.8	177.9	-70.7	174.1	0	0	0	112.4	G1181 D1188 K1189 L1192	G1181-L1184 PolarHBondContact O-N 2.81Å; L1184-D1188 HydrophobicContact CD2-CB 4.49Å; L1184-K1189 HydrophobicContact CB-CD 4.38Å; L1184-K1189 HydrophobicContact CB-CG 3.62Å; L1184-K1189 VanDerWaalsContact O-CD 3.32Å; L1184-K1189 WeakPolarHBondContact O-CD 3.49Å; L1184-K1189 WeakPolarHBondContact O-CE 3.47Å; L1184-K1189 PolarHBondContact O-NZ 3.35Å; L1184-L1192 HydrophobicContact CD1-CD1 4.45Å; L1184-L1192 HydrophobicContact CD1-CD2 4.12Å
1185	G	65.9	Low	53.2	Low	41 Å²	41	112.7 Å²	112.7	42%	0.423	60%	0.603	S	S	.	*			trans	-71.7	159.4	174	0	0	0	0	0	112.7	R1187 D1188 K1189	G1185-R1187 PolarHBondContact O-N 2.86Å; G1185-D1188 PolarHBondContact O-N 2.96Å; G1185-K1189 PolarHBondContact O-N 3.45Å
1186	F	49.3	Very low	53.6	Low	168 Å²	168	112.1 Å²	112.1	74%	0.737	60%	0.601	S	S	*	*	H	α-helix	trans	-51.9	-48.2	-170.9	-176	-95.2	0	0	0	113.9	D1188 K1189 Q1190	F1186-D1188 VanDerWaalsContact C-N 3.27Å; F1186-D1188 PolarHBondContact O-N 3.42Å; F1186-K1189 PolarHBondContact O-N 2.94Å; F1186-Q1190 WeakPolarHBondContact O-CB 3.45Å; F1186-Q1190 PolarHBondContact O-N 2.71Å
1187	R	53.8	Low	54.5	Low	174 Å²	174	111.4 Å²	111.4	66%	0.657	60%	0.595	S	S	*	*	H	α-helix	trans	-64	-28.5	179	-106.3	174.3	61.1	165.7	-1.6	114	G1185 R1191	G1185-R1187 PolarHBondContact O-N 2.86Å; R1187-R1191 WeakPolarHBondContact O-CD 2.98Å; R1187-R1191 WeakPolarHBondContact O-CG 3.41Å; R1187-R1191 PolarHBondContact O-N 2.72Å
1188	D	60.7	Low	54.3	Low	76 Å²	76	110.3 Å²	110.3	41%	0.406	59%	0.585	S	S	.	*	H	α-helix	trans	-90.9	-31.2	-178.7	-59.1	-52.4	0	0	0	111.4	L1184 G1185 F1186 R1191 L1192	L1184-D1188 HydrophobicContact CD2-CB 4.49Å; G1185-D1188 PolarHBondContact O-N 2.96Å; F1186-D1188 VanDerWaalsContact C-N 3.27Å; F1186-D1188 PolarHBondContact O-N 3.42Å; D1188-R1191 PolarHBondContact O-N 2.91Å; D1188-R1191 IonicContact OD1-NH1 2.9Å; D1188-L1192 WeakPolarHBondContact O-CB 3.35Å; D1188-L1192 PolarHBondContact O-N 3.48Å
1189	K	69.3	Low	54.4	Low	78 Å²	78	112.3 Å²	112.3	34%	0.339	58%	0.577	S	S	.	*	H	α-helix	trans	-58.7	-47	162.6	-76	179	167.4	139.1	0	111.2	G1181 A1182 L1184 G1185 F1186 R1191 L1192 F1193	G1181-K1189 WeakPolarHBondContact O-CE 3.32Å; A1182-K1189 PolarHBondContact O-NZ 3.21Å; L1184-K1189 HydrophobicContact CB-CD 4.38Å; L1184-K1189 HydrophobicContact CB-CG 3.62Å; L1184-K1189 VanDerWaalsContact O-CD 3.32Å; L1184-K1189 WeakPolarHBondContact O-CD 3.49Å; L1184-K1189 WeakPolarHBondContact O-CE 3.47Å; L1184-K1189 PolarHBondContact O-NZ 3.35Å; G1185-K1189 PolarHBondContact O-N 3.45Å; F1186-K1189 PolarHBondContact O-N 2.94Å; K1189-R1191 VanDerWaalsContact C-N 3.28Å; K1189-R1191 PolarHBondContact O-N 3.22Å; K1189-L1192 WeakPolarHBondContact O-CB 3.05Å; K1189-L1192 PolarHBondContact O-N 3.21Å; K1189-L1192 VanDerWaalsContact O-N 3.09Å; K1189-F1193 WeakPolarHBondContact O-CD2 3.48Å; K1189-F1193 PolarHBondContact O-N 3.46Å
1190	Q	58.6	Low	54.5	Low	119 Å²	119	114.4 Å²	114.4	56%	0.556	57%	0.574	S	S	*	*	H	α-helix	trans	-61.2	-36	178.5	-164.7	175.3	20.7	0	0	112.5	F1186 A1194	F1186-Q1190 WeakPolarHBondContact O-CB 3.45Å; F1186-Q1190 PolarHBondContact O-N 2.71Å; Q1190-A1194 PolarHBondContact O-N 3.09Å; Q1190-A1194 VanDerWaalsContact O-N 3.12Å
1191	R	60.8	Low	54.1	Low	156 Å²	156	113.6 Å²	113.6	59%	0.589	57%	0.574	S	S	*	*	H	α-helix	trans	-69.5	-39	171.8	-77.1	167.1	160.3	-171.4	-12.5	113.3	R1187 D1188 K1189 A1194 R1195	R1187-R1191 WeakPolarHBondContact O-CD 2.98Å; R1187-R1191 WeakPolarHBondContact O-CG 3.41Å; R1187-R1191 PolarHBondContact O-N 2.72Å; D1188-R1191 PolarHBondContact O-N 2.91Å; D1188-R1191 IonicContact OD1-NH1 2.9Å; K1189-R1191 VanDerWaalsContact C-N 3.28Å; K1189-R1191 PolarHBondContact O-N 3.22Å; R1191-A1194 PolarHBondContact O-N 3.4Å; R1191-R1195 WeakPolarHBondContact O-CB 3.46Å; R1191-R1195 PolarHBondContact O-N 3.01Å; R1191-R1195 VanDerWaalsContact O-N 3.11Å
1192	L	62.3	Low	53.4	Low	93 Å²	93	116.8 Å²	116.8	49%	0.487	60%	0.598	S	S	.	*	H	α-helix	trans	-60.4	-47.1	176.4	-153	81.5	0	0	0	110.4	L1184 D1188 K1189 R1195 Q1196	L1184-L1192 HydrophobicContact CD1-CD1 4.45Å; L1184-L1192 HydrophobicContact CD1-CD2 4.12Å; D1188-L1192 WeakPolarHBondContact O-CB 3.35Å; D1188-L1192 PolarHBondContact O-N 3.48Å; K1189-L1192 WeakPolarHBondContact O-CB 3.05Å; K1189-L1192 PolarHBondContact O-N 3.21Å; K1189-L1192 VanDerWaalsContact O-N 3.09Å; L1192-R1195 PolarHBondContact O-N 3Å; L1192-Q1196 WeakPolarHBondContact O-CB 2.89Å; L1192-Q1196 PolarHBondContact O-N 3.33Å; L1192-Q1196 VanDerWaalsContact O-N 3.09Å
1193	F	53.5	Low	52.5	Low	129 Å²	129	119.8 Å²	119.8	57%	0.566	61%	0.612	S	S	*	*	H	α-helix	trans	-61.2	-48.7	175.8	-86.3	-73.7	0	0	0	113	K1189 R1195 Q1196 I1197	K1189-F1193 WeakPolarHBondContact O-CD2 3.48Å; K1189-F1193 PolarHBondContact O-N 3.46Å; F1193-R1195 VanDerWaalsContact C-N 3.26Å; F1193-R1195 PolarHBondContact O-N 2.84Å; F1193-Q1196 PolarHBondContact O-N 3.28Å; F1193-I1197 WeakPolarHBondContact O-CD1 3.34Å; F1193-I1197 WeakPolarHBondContact O-CG1 3.26Å; F1193-I1197 PolarHBondContact O-N 3.03Å; F1193-I1197 VanDerWaalsContact O-N 3.08Å
1194	A	53.7	Low	51.9	Low	38 Å²	38	120.7 Å²	120.7	31%	0.314	61%	0.61	S	S	.	*	H	α-helix	trans	-56.5	-41.8	178.1	0	0	0	0	0	112.2	Q1190 R1191 Q1196 I1197 G1198 E1199	Q1190-A1194 PolarHBondContact O-N 3.09Å; Q1190-A1194 VanDerWaalsContact O-N 3.12Å; R1191-A1194 PolarHBondContact O-N 3.4Å; A1194-Q1196 VanDerWaalsContact C-N 3.28Å; A1194-Q1196 PolarHBondContact O-N 2.89Å; A1194-I1197 PolarHBondContact O-N 3.33Å; A1194-G1198 PolarHBondContact O-N 2.81Å; A1194-G1198 VanDerWaalsContact O-N 3.15Å; A1194-E1199 PolarHBondContact O-N 3.4Å
1195	R	57.2	Low	51.2	Low	204 Å²	204	126.7 Å²	126.7	77%	0.77	64%	0.636	S	S	*	*	H	α-helix	trans	-69	-24.4	177.5	-149.6	178.2	-158.8	-173.9	3.3	113.6	R1191 L1192 F1193	R1191-R1195 WeakPolarHBondContact O-CB 3.46Å; R1191-R1195 PolarHBondContact O-N 3.01Å; R1191-R1195 VanDerWaalsContact O-N 3.11Å; L1192-R1195 PolarHBondContact O-N 3Å; F1193-R1195 VanDerWaalsContact C-N 3.26Å; F1193-R1195 PolarHBondContact O-N 2.84Å
1196	Q	50.3	Low	49.6	Very low	151 Å²	151	135.7 Å²	135.7	71%	0.706	66%	0.657	S	S	*	*	H	α-helix	trans	-86.1	-14.2	177.1	-161.4	167.1	12.4	0	0	112.8	L1192 F1193 A1194	L1192-Q1196 WeakPolarHBondContact O-CB 2.89Å; L1192-Q1196 PolarHBondContact O-N 3.33Å; L1192-Q1196 VanDerWaalsContact O-N 3.09Å; F1193-Q1196 PolarHBondContact O-N 3.28Å; A1194-Q1196 VanDerWaalsContact C-N 3.28Å; A1194-Q1196 PolarHBondContact O-N 2.89Å
1197	I	56.3	Low	48.9	Very low	129 Å²	129	134 Å²	134	66%	0.662	65%	0.653	S	S	*	*	H	α-helix	trans	-96.1	-20.2	175.3	-63	161.9	0	0	0	111.6	F1193 A1194	F1193-I1197 WeakPolarHBondContact O-CD1 3.34Å; F1193-I1197 WeakPolarHBondContact O-CG1 3.26Å; F1193-I1197 PolarHBondContact O-N 3.03Å; F1193-I1197 VanDerWaalsContact O-N 3.08Å; A1194-I1197 PolarHBondContact O-N 3.33Å
1198	G	42.8	Very low	48	Very low	60 Å²	60	132.5 Å²	132.5	62%	0.619	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	99.1	11.3	171.8	0	0	0	0	0	115.8	A1194 D1200	A1194-G1198 PolarHBondContact O-N 2.81Å; A1194-G1198 VanDerWaalsContact O-N 3.15Å; G1198-D1200 PolarHBondContact O-N 3.26Å
1199	E	48.6	Very low	46.9	Very low	139 Å²	139	134.2 Å²	134.2	65%	0.65	66%	0.664	S	S	*	*			trans	-85.8	85.7	177.2	-68.2	-168.1	127.7	0	0	112.1	A1194 T1201	A1194-E1199 PolarHBondContact O-N 3.4Å; E1199-T1201 PolarHBondContact O-N 2.93Å
1200	D	42	Very low	45.4	Very low	146 Å²	146	134.2 Å²	134.2	78%	0.781	67%	0.673	S	S	*	*			trans	-75.4	24	177.7	-99.8	-30.1	0	0	0	114.5	G1198	G1198-D1200 PolarHBondContact O-N 3.26Å
1201	T	39.6	Very low	44.5	Very low	120 Å²	120	133.4 Å²	133.4	74%	0.736	68%	0.681	S	S	*	*			trans	-126.9	87.7	175.4	55.4	0	0	0	0	112.6	E1199 P1203	E1199-T1201 PolarHBondContact O-N 2.93Å; T1201-P1203 WeakPolarHBondContact O-CD 3.03Å
1202	A	35.3	Very low	43.5	Very low	96 Å²	96	129.5 Å²	129.5	79%	0.793	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-64.6	121.9	169.4	0	0	0	0	0	110.7
1203	P	36.6	Very low	42.7	Very low	128 Å²	128	130.7 Å²	130.7	83%	0.831	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-69.9	133.4	-172.5	25.9	-34	0	0	0	112.7	T1201	T1201-P1203 WeakPolarHBondContact O-CD 3.03Å
1204	R	36.5	Very low	42.4	Very low	227 Å²	227	132.3 Å²	132.3	86%	0.857	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-77.8	136.4	171.4	-81.5	179.2	163.5	175.8	-5.9	111.1
1205	Q	41.7	Very low	41.8	Very low	188 Å²	188	136.9 Å²	136.9	88%	0.879	71%	0.706	S	S	*	*			trans	42.9	79	154.9	-66.7	177.1	-57.5	0	0	117.3
1206	R	31.9	Very low	41.4	Very low	230 Å²	230	132.7 Å²	132.7	87%	0.868	70%	0.698	S	S	*	*			trans	-141.4	106.1	149.8	-72.2	-163.7	-176	-165.2	3.1	111.6
1207	M	35.9	Very low	40.9	Very low	133 Å²	133	132.6 Å²	132.6	66%	0.655	70%	0.697	S	S	*	*			trans	175.8	112.2	136.8	-101.8	-175.2	69.1	0	0	108.7
1208	N	34.2	Very low	40.4	Very low	142 Å²	142	131 Å²	131	76%	0.759	69%	0.693	S	S	*	*			trans	-149	49.7	160.6	-131	1	0	0	0	108.2	R765	R765-N1208 PolarHBondContact NH1-O 2.69Å
1209	E	36.9	Very low	40.3	Very low	113 Å²	113	134.4 Å²	134.4	53%	0.528	70%	0.698	S	S	.	*			trans	-106.1	125.1	-175.6	-73.2	158	-158.1	0	0	108.6
1210	S	38.3	Very low	39.9	Very low	77 Å²	77	134.2 Å²	134.2	54%	0.538	70%	0.699	S	S	.	*			trans	-83.9	148.4	-177.3	-56	0	0	0	0	111.1	A1212 Q1213	S1210-A1212 PolarHBondContact O-N 3.37Å; S1210-Q1213 PolarHBondContact O-N 3.36Å
1211	S	39.2	Very low	39.6	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-17.2	-176.9	-52.7	0	0	0	0	115.6	Q1213	S1211-Q1213 PolarHBondContact O-N 2.86Å
1212	A	40	Very low	39.7	Very low	73 Å²	73	130.1 Å²	130.1	60%	0.603	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-29	174.4	0	0	0	0	0	114.3	S1210	S1210-A1212 PolarHBondContact O-N 3.37Å
1213	Q	46.1	Very low	39.7	Very low	118 Å²	118	131.9 Å²	131.9	55%	0.551	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-75.4	-28.9	179.5	-79.3	178.7	-85.8	0	0	113	S1210 S1211 L1215 I1216	S1210-Q1213 PolarHBondContact O-N 3.36Å; S1211-Q1213 PolarHBondContact O-N 2.86Å; Q1213-L1215 PolarHBondContact O-N 3.33Å; Q1213-I1216 PolarHBondContact O-N 2.82Å
1214	R	47.8	Very low	40.1	Very low	164 Å²	164	130.9 Å²	130.9	62%	0.619	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-70.1	-9.6	179.1	-70.4	-172.2	178.4	-177.4	-0.3	114.6
1215	L	41.1	Very low	40	Very low	133 Å²	133	127.4 Å²	127.4	70%	0.696	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-99.3	2.6	178.8	-80.2	164.2	0	0	0	113.6	Q1213	Q1213-L1215 PolarHBondContact O-N 3.33Å
1216	I	47.6	Very low	39.5	Very low	117 Å²	117	126.3 Å²	126.3	60%	0.6	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	-31.6	179.4	-60	177.6	0	0	0	111	Q1213 T1218	Q1213-I1216 PolarHBondContact O-N 2.82Å; I1216-T1218 VanDerWaalsContact C-N 3.27Å; I1216-T1218 PolarHBondContact O-N 2.74Å
1217	E	41.5	Very low	40.3	Very low	149 Å²	149	124.4 Å²	124.4	70%	0.696	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-15.6	177.2	-64.4	-175.8	146.8	0	0	113.6	D1219	E1217-D1219 PolarHBondContact O-N 2.67Å
1218	T	44.5	Very low	40.5	Very low	94 Å²	94	124 Å²	124	58%	0.577	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-25.4	179.7	44.7	0	0	0	0	114.3	I1216	I1216-T1218 VanDerWaalsContact C-N 3.27Å; I1216-T1218 PolarHBondContact O-N 2.74Å
1219	D	40.9	Very low	40.8	Very low	133 Å²	133	123.1 Å²	123.1	71%	0.711	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-8.4	-168.2	-71.6	14.8	0	0	0	113.5	E1217	E1217-D1219 PolarHBondContact O-N 2.67Å
1220	I	40.5	Very low	41.1	Very low	134 Å²	134	123.6 Å²	123.6	69%	0.687	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	-18.6	-169.3	-63	179	0	0	0	113.1	A1222	I1220-A1222 VanDerWaalsContact C-N 3.3Å; I1220-A1222 PolarHBondContact O-N 2.92Å
1221	A	36.2	Very low	41.2	Very low	93 Å²	93	126.4 Å²	126.4	77%	0.769	71%	0.714	S	S	*	*			trans	-86.7	20.6	-174	0	0	0	0	0	115.4
1222	A	40.6	Very low	41.3	Very low	88 Å²	88	127.8 Å²	127.8	73%	0.727	71%	0.714	S	S	*	*			trans	-105.8	52.9	-171.2	0	0	0	0	0	114.7	I1220	I1220-A1222 VanDerWaalsContact C-N 3.3Å; I1220-A1222 PolarHBondContact O-N 2.92Å
1223	T	35.1	Very low	41.4	Very low	132 Å²	132	131.5 Å²	131.5	81%	0.81	72%	0.721	S	S	*	*			trans	-150.6	130.6	169.1	11.7	0	0	0	0	112
1224	P	46.7	Very low	41.1	Very low	107 Å²	107	132.4 Å²	132.4	70%	0.695	73%	0.733	S	S	*	*			trans	-118	163.7	-173.9	42.8	-34.8	0	0	0	115.2
1225	Q	33	Very low	40.6	Very low	155 Å²	155	130 Å²	130	72%	0.724	74%	0.742	S	S	*	*			trans	70.8	154.3	165.1	-62.7	-173.5	41.6	0	0	115.4
1226	K	31.7	Very low	40.5	Very low	165 Å²	165	129.8 Å²	129.8	72%	0.717	75%	0.746	S	S	*	*			cis	-167.5	-175.9	-6.1	-114.4	-179.1	-174.3	152.6	0	107.8
1227	P	48.3	Very low	39.9	Very low	190 Å²	190	130.9 Å²	130.9	100%	1.234	76%	0.759	S	S	*	*			cis	-99.9	0	-1	36.8	-28.1	0	0	0	114.9

Retrieved 1,227 of 1,227 residues in 196.3 ms (Link to these results)

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