X5LX73_CAEEL Loading...

PDZ domain-containing protein

AlphaFold DB , UniProt , Accession X5LX73, Species CAEEL (Caenorhabditis elegans), Gene afd-1, Length 1,131 aa.

						>X5LX73_CAEEL|X5LX73|afd-1
MQTEILRDGDHIRIGADHSFKFSTSSSQANQINSTNISNSNQRHFQQQTFYPEMADSRASTARCAPSDYCSLPQQNDYYPPSMSGSSVSSSRQEDLMMHSNNNILPPYSTKSAQEPLQLPLSIQIGDYNVWDFLAEVMSNRAATSSEMSTFRLSPAYSLYLALRSFHTHNKPYSVQFFSRIESNFKQIAQECSSKDDLIFWLANASEFNHLVERDTELKASRYGKISVEIERIFRRLVAVLQSVIRPAARALLDIHLNDHDATGDVIHLLDTTMRQARICGLNAALTIQLCGHLLHMVNAFVFNSLVSVNLPAAQLNTRLGKCLQYRIESIHRFCERMGVEMAAECHLDRSRQAANLLATQKNDVAALGSTCYKLNSLQVVHILSGFEPDDGEIPCDDDVVDRICRLAEKQADKLTLEDGQRVTLEESDELNLPFLIPQDGYFVEQFRTVPDGLWQYLQQLQHRRLCHTVSLTPAPPAAMTHSMHAMHIGASDAHYHQHQHQQQQNPIVRSVSQTTLTSIPTTQFGDSFGSAVSDTISKVTLRKNGGGIGLSIVAAQGVGDRQMGIYVKKVVEGTPAAHDGRLETGDQLLSVNGHSLIGISQEDAARLMTQSGNEVHFDVRKRAAHRNGLSNWLGSQTPTTSNFIAPSPSTVPPPSYSHVGRTPSYDGQPPPSYNHRNGGASGAGGSSGRNSAFVAPLSNSSSNASSSHMQQHYAHHNMMHNGNLSAAPGAPAGDPKHYRSSSASDLQHDPNASFSQSSMTGSARSSVFDKLPSHYRHSTRPTVIQPTRPSAQSPSALRKAAAASPVSNLYRPTSASNLFAPPRNSGGLVGYSSNAARESTQDIHRAEPAIVIRPVDLNMPKATPPASIRGAVPTAITQALQLQPNGGGAVLRQVRPASGLRERLQDADVRNLEKTNTALMSYEAVNEELDRLDAKQNTMTIDEQRRYRELLNVVAEQSRARKLLSEIRSPPTSYQEREIPIHVQKEQQQHRRETVIDDIPHSSSSVENVSPVSPPESRKVQFIDEVVQYQTPTSGANHAFFDDVPVLDSPGIVGTNEIYRDPRQRRLNELQDRNRSSENGAADGAKLGFRDKQRLFARQIGEDTAPRQRMNESSAQRLIETDIAATPQKP
					

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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	35.7	Very low	51.5	Low	242 Å²	242	136.9 Å²	136.9	100%	1.192	68%	0.682	S	S	*	*				0	140.8	0	-62.9	165.3	-179.4	0	0	107.2
2	Q	29.9	Very low	52.9	Low	197 Å²	197	130.4 Å²	130.4	92%	0.921	65%	0.65	S	S	*	*			trans	-96.8	138	164.8	-74.9	172.7	-78.8	0	0	107.8
3	T	38.7	Very low	52.7	Low	138 Å²	138	134.8 Å²	134.8	85%	0.847	66%	0.655	S	S	*	*			trans	-105.1	104.4	173.7	32.3	0	0	0	0	109
4	E	48.3	Very low	52.7	Low	184 Å²	184	133.2 Å²	133.2	86%	0.86	65%	0.649	S	S	*	*			trans	-83.2	143.9	168.1	-69.1	-168.9	119.1	0	0	110.4
5	I	59.7	Low	52.9	Low	152 Å²	152	128.7 Å²	128.7	78%	0.779	65%	0.651	S	S	*	*			trans	-96.6	104.8	178	-58.4	175.4	0	0	0	107.8
6	L	55.2	Low	52.9	Low	91 Å²	91	125.8 Å²	125.8	48%	0.476	65%	0.653	S	S	.	*			trans	-64.1	146.9	176.1	-68.7	152.6	0	0	0	111.1	D10 I12	L6-D10 WeakPolarHBondContact CA-OD2 3.21Å; L6-D10 HydrophobicContact CD2-CB 4.01Å; L6-I12 HydrophobicContact CD1-CD1 3.68Å; L6-I12 HydrophobicContact CD2-CD1 4.04Å; L6-I12 HydrophobicContact CD2-CG1 4.06Å; L6-I12 HydrophobicContact CG-CD1 4.5Å
7	R	61.4	Low	52.3	Low	187 Å²	187	126.9 Å²	126.9	71%	0.706	66%	0.66	S	S	*	*			trans	-123.3	164.7	-171.4	-54.1	-175.8	-171.2	-172.5	3.1	111.5	G9 D10	R7-G9 PolarHBondContact O-N 3.16Å; R7-G9 VanDerWaalsContact O-N 3.13Å; R7-D10 PolarHBondContact N-OD2 3.16Å; R7-D10 PolarHBondContact O-N 2.96Å; R7-D10 VanDerWaalsContact O-N 3.11Å
8	D	56	Low	52	Low	99 Å²	99	126.4 Å²	126.4	53%	0.529	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58	114.8	172.7	-165.7	8.6	0	0	0	110.2	S23 T24	D8-S23 WeakPolarHBondContact OD1-CA 3.4Å; D8-T24 WeakPolarHBondContact CB-OG1 3.38Å; D8-T24 PolarHBondContact OD1-N 2.92Å; D8-T24 PolarHBondContact OD2-OG1 3.03Å
9	G	57.9	Low	52.5	Low	26 Å²	26	123.3 Å²	123.3	27%	0.268	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	111.9	-16.5	-176.3	0	0	0	0	0	116	R7 H11 K21 F22	R7-G9 PolarHBondContact O-N 3.16Å; R7-G9 VanDerWaalsContact O-N 3.13Å; G9-H11 PolarHBondContact O-CD2 3.44Å; G9-K21 WeakPolarHBondContact O-CE 3.28Å; G9-F22 WeakPolarHBondContact CA-O 3.08Å; G9-F22 PolarHBondContact N-O 3.44Å
10	D	67.2	Low	52.5	Low	63 Å²	63	123.3 Å²	123.3	34%	0.337	64%	0.639	S	S	.	*			trans	-68.4	141.8	-173.5	-74.8	-20.9	0	0	0	112.9	L6 R7 K21 F22	L6-D10 WeakPolarHBondContact CA-OD2 3.21Å; L6-D10 HydrophobicContact CD2-CB 4.01Å; R7-D10 PolarHBondContact N-OD2 3.16Å; R7-D10 PolarHBondContact O-N 2.96Å; R7-D10 VanDerWaalsContact O-N 3.11Å; D10-K21 CarbonylContact O-C 3.56Å; D10-K21 WeakPolarHBondContact O-CA 3.25Å; D10-F22 PolarHBondContact O-N 2.94Å
11	H	57.1	Low	53	Low	127 Å²	127	123.3 Å²	123.3	59%	0.588	63%	0.634	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.8	118.9	179.6	-79.1	-96.4	0	0	0	111.6	G9 F20 K21	G9-H11 PolarHBondContact O-CD2 3.44Å; H11-F20 CarbonylContact C-O 3.58Å; H11-F20 WeakPolarHBondContact CA-O 3.34Å; H11-K21 VanDerWaalsContact NE2-CD 3.35Å; H11-K21 WeakPolarHBondContact NE2-CD 3.36Å; H11-K21 WeakPolarHBondContact NE2-CE 3.15Å
12	I	67.8	Low	53.8	Low	59 Å²	59	116.6 Å²	116.6	30%	0.303	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.6	127.5	179	-49	173.8	0	0	0	108.6	L6 I14 S19 F20	L6-I12 HydrophobicContact CD1-CD1 3.68Å; L6-I12 HydrophobicContact CD2-CD1 4.04Å; L6-I12 HydrophobicContact CD2-CG1 4.06Å; L6-I12 HydrophobicContact CG-CD1 4.5Å; I12-I14 HydrophobicContact CG2-CD1 4.4Å; I12-I14 HydrophobicContact CG2-CG1 4.04Å; I12-S19 CarbonylContact O-C 3.44Å; I12-S19 WeakPolarHBondContact O-CA 3.37Å; I12-F20 PolarHBondContact N-O 3.15Å; I12-F20 PolarHBondContact O-N 3.18Å
13	R	50.6	Low	54.9	Low	187 Å²	187	111.1 Å²	111.1	71%	0.706	58%	0.582	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.4	133.4	168	-92.3	-176.4	163.2	125.3	-0.2	110.5	H18	R13-H18 WeakPolarHBondContact CA-O 3.38Å
14	I	52.3	Low	55.2	Low	113 Å²	113	108.6 Å²	108.6	58%	0.579	57%	0.566	S	S	*	*			trans	-130.2	114	176	-54.6	-179.4	0	0	0	106.7	I12 H18	I12-I14 HydrophobicContact CG2-CD1 4.4Å; I12-I14 HydrophobicContact CG2-CG1 4.04Å; I14-H18 PolarHBondContact N-O 2.69Å
15	G	56.1	Low	54.7	Low	66 Å²	66	105.6 Å²	105.6	68%	0.68	57%	0.566	S	S	*	*	S	Bend	trans	72.1	-171.8	-165	0	0	0	0	0	113.1
16	A	52.4	Low	53.5	Low	81 Å²	81	103.7 Å²	103.7	67%	0.669	57%	0.566	S	S	*	*	S	Bend	trans	-75.5	-43.4	-177.5	0	0	0	0	0	113
17	D	43.6	Very low	52.4	Low	146 Å²	146	104.9 Å²	104.9	78%	0.781	58%	0.582	S	S	*	*	S	Bend	trans	-107.1	3	-161.7	-57.4	-52	0	0	0	114.3
18	H	46.3	Very low	51	Low	118 Å²	118	105.1 Å²	105.1	55%	0.546	59%	0.591	S	S	.	*			trans	-121.9	117.2	-177.7	-53.6	-25.2	0	0	0	111.6	R13 I14 F20	R13-H18 WeakPolarHBondContact CA-O 3.38Å; I14-H18 PolarHBondContact N-O 2.69Å; H18-F20 HydrophobicContact CB-CE2 3.77Å; H18-F20 HydrophobicContact CB-CZ 4.06Å
19	S	61.2	Low	49.7	Very low	67 Å²	67	105.1 Å²	105.1	47%	0.469	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.1	116.9	175.5	58.5	0	0	0	0	110.1	I12	I12-S19 CarbonylContact O-C 3.44Å; I12-S19 WeakPolarHBondContact O-CA 3.37Å
20	F	53	Low	48.5	Very low	122 Å²	122	111.2 Å²	111.2	54%	0.535	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104	142.1	179.4	-58	-82.2	0	0	0	109.7	H11 I12 H18	H11-F20 CarbonylContact C-O 3.58Å; H11-F20 WeakPolarHBondContact CA-O 3.34Å; I12-F20 PolarHBondContact N-O 3.15Å; I12-F20 PolarHBondContact O-N 3.18Å; H18-F20 HydrophobicContact CB-CE2 3.77Å; H18-F20 HydrophobicContact CB-CZ 4.06Å
21	K	63.4	Low	46.5	Very low	125 Å²	125	116.6 Å²	116.6	54%	0.543	65%	0.654	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.5	127.4	172.1	-167.2	178	-171.5	169.3	0	109	G9 D10 H11	G9-K21 WeakPolarHBondContact O-CE 3.28Å; D10-K21 CarbonylContact O-C 3.56Å; D10-K21 WeakPolarHBondContact O-CA 3.25Å; H11-K21 VanDerWaalsContact NE2-CD 3.35Å; H11-K21 WeakPolarHBondContact NE2-CD 3.36Å; H11-K21 WeakPolarHBondContact NE2-CE 3.15Å
22	F	51	Low	45.1	Very low	100 Å²	100	118.7 Å²	118.7	44%	0.439	67%	0.668	S	S	.	*			trans	-78.9	129.9	169.7	-158.9	-103.5	0	0	0	108.8	G9 D10 T24	G9-F22 WeakPolarHBondContact CA-O 3.08Å; G9-F22 PolarHBondContact N-O 3.44Å; D10-F22 PolarHBondContact O-N 2.94Å; F22-T24 HydrophobicContact CE1-CG2 4.08Å
23	S	53.9	Low	43.3	Very low	83 Å²	83	122.5 Å²	122.5	58%	0.58	69%	0.689	S	S	*	*			trans	-146.7	134.1	177.2	61.2	0	0	0	0	112.2	D8	D8-S23 WeakPolarHBondContact OD1-CA 3.4Å
24	T	45.9	Very low	42.1	Very low	85 Å²	85	118.4 Å²	118.4	52%	0.521	69%	0.689	S	S	.	*			trans	-109.6	115.7	179.2	48.5	0	0	0	0	111.3	D8 F22	D8-T24 WeakPolarHBondContact CB-OG1 3.38Å; D8-T24 PolarHBondContact OD1-N 2.92Å; D8-T24 PolarHBondContact OD2-OG1 3.03Å; F22-T24 HydrophobicContact CE1-CG2 4.08Å
25	S	37.5	Very low	40.8	Very low	121 Å²	121	118.9 Å²	118.9	85%	0.846	70%	0.697	S	S	*	*			trans	-144.3	139.9	172.8	61.1	0	0	0	0	112.5
26	S	33.3	Very low	39.6	Very low	111 Å²	111	122.3 Å²	122.3	78%	0.776	70%	0.7	S	S	*	*			trans	-141.2	137.4	161.7	56.9	0	0	0	0	108.4
27	S	32.8	Very low	38.4	Very low	116 Å²	116	125 Å²	125	81%	0.811	70%	0.702	S	S	*	*			trans	59.5	84.9	167.2	-55.9	0	0	0	0	118.6
28	Q	31.1	Very low	37.6	Very low	193 Å²	193	122.7 Å²	122.7	90%	0.902	70%	0.697	S	S	*	*				-165.3	139.7	119.8	-113.1	-177.8	35.8	0	0	116.7
29	A	29.8	Very low	36.8	Very low	98 Å²	98	124.2 Å²	124.2	81%	0.81	71%	0.709	S	S	*	*			trans	66	155.1	140.8	0	0	0	0	0	122.1
30	N	31.4	Very low	35.3	Very low	154 Å²	154	125 Å²	125	82%	0.824	71%	0.714	S	S	*	*			trans	-114.6	164.6	-173.9	-118.3	-34.5	0	0	0	110.2
31	Q	26.8	Very low	34	Very low	176 Å²	176	125 Å²	125	82%	0.822	72%	0.72	S	S	*	*			trans	69.8	119.4	165.5	-60.9	174.2	8.6	0	0	119.4
32	I	26.5	Very low	32.4	Very low	171 Å²	171	125.7 Å²	125.7	88%	0.877	73%	0.725	S	S	*	*				178.9	160.6	103.9	-86.4	157.4	0	0	0	108.7
33	N	29.5	Very low	31.3	Very low	139 Å²	139	130.8 Å²	130.8	74%	0.743	74%	0.742	S	S	*	*				-169.5	157.5	-68.8	-166.2	7.7	0	0	0	108.5
34	S	26.1	Very low	30.2	Very low	101 Å²	101	133.9 Å²	133.9	71%	0.706	75%	0.746	S	S	*	*			trans	68.9	154.4	174.4	-44.7	0	0	0	0	116.7
35	T	26	Very low	29.2	Very low	123 Å²	123	138.2 Å²	138.2	76%	0.755	76%	0.758	S	S	*	*			cis	-130.3	133.7	11.5	47.9	0	0	0	0	111.7
36	N	30.6	Very low	28.6	Very low	138 Å²	138	138.4 Å²	138.4	74%	0.738	75%	0.746	S	S	*	*				60.9	139.6	89.8	-94.8	-8.9	0	0	0	116
37	I	27.2	Very low	28.3	Very low	139 Å²	139	139.4 Å²	139.4	71%	0.713	74%	0.738	S	S	*	*			cis	-159.5	151.1	14.9	-137	151	0	0	0	108.8
38	S	27.3	Very low	28.1	Very low	97 Å²	97	141.6 Å²	141.6	68%	0.678	74%	0.736	S	S	*	*			cis	-127.7	-90	-21	-90.8	0	0	0	0	110
39	N	27.8	Very low	27.8	Very low	150 Å²	150	137.6 Å²	137.6	80%	0.802	72%	0.724	S	S	*	*			cis	-167.1	159.1	-17.8	-139.6	-2.6	0	0	0	107.2
40	S	29.7	Very low	27.5	Very low	83 Å²	83	142.4 Å²	142.4	58%	0.58	73%	0.728	S	S	*	*			cis	-158.5	-176.8	3.1	71.6	0	0	0	0	110.7
41	N	26.9	Very low	27.3	Very low	122 Å²	122	145.7 Å²	145.7	65%	0.652	73%	0.73	S	S	*	*			trans	48.1	96.5	161.9	-70.8	-15.9	0	0	0	119.8
42	Q	29.3	Very low	28.1	Very low	139 Å²	139	142.1 Å²	142.1	65%	0.65	72%	0.722	S	S	*	*				92.4	140.9	84.1	-84.8	-178.4	57.1	0	0	113.7
43	R	28.5	Very low	28	Very low	208 Å²	208	141.2 Å²	141.2	79%	0.785	71%	0.714	S	S	*	*			cis	-154.3	172.6	11.1	-146.5	-178.7	-78.9	177	-4.4	113.3
44	H	29.4	Very low	27.8	Very low	147 Å²	147	142.6 Å²	142.6	68%	0.681	72%	0.718	S	S	*	*			trans	-42.2	169	178.7	-67	-60	0	0	0	119.8
45	F	24.8	Very low	27.9	Very low	177 Å²	177	142.3 Å²	142.3	78%	0.776	72%	0.722	S	S	*	*			cis	-135.6	154.1	34.9	-96.9	-113.1	0	0	0	113
46	Q	26.3	Very low	27.9	Very low	124 Å²	124	143.4 Å²	143.4	58%	0.579	72%	0.723	S	S	*	*				70.3	139.8	53.4	-86	-169.9	9.1	0	0	114.2
47	Q	27.2	Very low	27.8	Very low	133 Å²	133	141.3 Å²	141.3	62%	0.621	72%	0.719	S	S	*	*			cis	-151.9	150.2	18.3	-110.7	163.1	42.8	0	0	110.5
48	Q	27.1	Very low	27.8	Very low	162 Å²	162	146.6 Å²	146.6	76%	0.757	73%	0.73	S	S	*	*				59.6	146.8	95.2	-62.5	-173.3	-23.8	0	0	117.3
49	T	26.4	Very low	27.8	Very low	108 Å²	108	146 Å²	146	66%	0.663	73%	0.731	S	S	*	*			cis	-172.6	173.8	-9.7	26.2	0	0	0	0	111.9
50	F	23.7	Very low	27.9	Very low	200 Å²	200	144.4 Å²	144.4	88%	0.877	73%	0.732	S	S	*	*			trans	89.8	150.5	153.1	-86.7	-76.9	0	0	0	123.7
51	Y	25.2	Very low	27.9	Very low	223 Å²	223	146.8 Å²	146.8	88%	0.875	74%	0.743	S	S	*	*			trans	-98.3	-173.3	169.6	-75.8	-95.7	0	0	0	110.2
52	P	43.8	Very low	27.9	Very low	100 Å²	100	145.1 Å²	145.1	65%	0.649	75%	0.746	S	S	*	*			cis	-140	-168.1	1.7	42.2	-20.8	0	0	0	117.2
53	E	25	Very low	27.9	Very low	153 Å²	153	149.6 Å²	149.6	72%	0.715	76%	0.757	S	S	*	*			trans	65.1	119.6	144.5	-82.8	178.2	112.1	0	0	127.3
54	M	25.6	Very low	27.7	Very low	167 Å²	167	145.3 Å²	145.3	82%	0.823	76%	0.757	S	S	*	*				63.8	155.3	126.6	-71	-160.8	-144.2	0	0	126.6
55	A	28.4	Very low	27.7	Very low	95 Å²	95	142.7 Å²	142.7	79%	0.785	76%	0.761	S	S	*	*			trans	81.7	148.6	158.5	0	0	0	0	0	118.6
56	D	26.7	Very low	29	Very low	146 Å²	146	140 Å²	140	78%	0.781	76%	0.761	S	S	*	*			cis	-154.1	156.3	1.9	-148.4	-6.8	0	0	0	117
57	S	28.5	Very low	29.1	Very low	94 Å²	94	138.7 Å²	138.7	66%	0.657	77%	0.766	S	S	*	*			trans	7.4	136.1	154.7	-62.3	0	0	0	0	125.6
58	R	26	Very low	29.1	Very low	251 Å²	251	138.6 Å²	138.6	95%	0.947	77%	0.77	S	S	*	*				159.6	165	122.1	-89.7	167.4	168.9	149.2	-2.6	113.5
59	A	27.9	Very low	29.1	Very low	85 Å²	85	140.7 Å²	140.7	70%	0.702	77%	0.772	S	S	*	*				-175.7	128.8	-55	0	0	0	0	0	112.2
60	S	29	Very low	29	Very low	116 Å²	116	140.9 Å²	140.9	81%	0.811	78%	0.776	S	S	*	*			trans	60.7	159.8	159.8	-61.4	0	0	0	0	118.8
61	T	29.9	Very low	29.2	Very low	133 Å²	133	136.6 Å²	136.6	82%	0.816	77%	0.772	S	S	*	*			cis	-160.9	164.6	-11	16	0	0	0	0	106.4
62	A	28.3	Very low	29.4	Very low	86 Å²	86	133.9 Å²	133.9	71%	0.711	77%	0.771	S	S	*	*			cis	-161.3	148.9	37.6	0	0	0	0	0	110.1
63	R	27.5	Very low	29.2	Very low	234 Å²	234	134.8 Å²	134.8	88%	0.883	78%	0.777	S	S	*	*				52.5	142.2	91.9	-60.1	-170.8	176.3	-169.8	-0.8	116.6
64	C	24.8	Very low	29.3	Very low	118 Å²	118	135.8 Å²	135.8	80%	0.797	78%	0.782	S	S	*	*			cis	-150	-167.6	7.2	-131.7	0	0	0	0	109.6
65	A	30.9	Very low	29.2	Very low	91 Å²	91	136.8 Å²	136.8	75%	0.752	78%	0.784	S	S	*	*			cis	-152.6	177.6	10.6	0	0	0	0	0	111.8
66	P	50.7	Low	29.2	Very low	121 Å²	121	138.9 Å²	138.9	79%	0.786	78%	0.782	S	S	*	*			trans	-131.7	-158.3	-171.9	45	-29.4	0	0	0	116.2
67	S	29.3	Very low	29.1	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	78%	0.777	S	S	*	*			trans	97.9	146.2	163.7	126.8	0	0	0	0	117.5
68	D	26.6	Very low	29	Very low	131 Å²	131	143.8 Å²	143.8	70%	0.701	79%	0.786	S	S	*	*			cis	-159	154	4.1	-103.7	-32.4	0	0	0	117.2
69	Y	26.4	Very low	28.9	Very low	206 Å²	206	142.2 Å²	142.2	81%	0.808	78%	0.782	S	S	*	*			trans	60.1	151.2	144.9	-91.4	-91	0	0	0	129.3
70	C	25.8	Very low	29.8	Very low	111 Å²	111	143.4 Å²	143.4	75%	0.75	78%	0.782	S	S	*	*			trans	75.2	159.7	156.1	-74.8	0	0	0	0	121
71	S	26.5	Very low	30	Very low	111 Å²	111	144 Å²	144	78%	0.776	78%	0.784	S	S	*	*			cis	179.8	156.2	-43.9	-97.8	0	0	0	0	110.5
72	L	30.4	Very low	29.8	Very low	165 Å²	165	142.6 Å²	142.6	86%	0.864	78%	0.779	S	S	*	*			trans	-65.3	167.3	179.5	-78.4	168.8	0	0	0	114.2
73	P	38.7	Very low	29.7	Very low	119 Å²	119	146.6 Å²	146.6	77%	0.773	79%	0.785	S	S	*	*			cis	-151.1	-139.9	44.1	45.6	-21.8	0	0	0	118.3
74	Q	28.1	Very low	29.7	Very low	174 Å²	174	141.1 Å²	141.1	81%	0.813	78%	0.783	S	S	*	*			trans	-110.7	167.2	-152.9	-50.8	151.3	-74.2	0	0	115.1
75	Q	23.7	Very low	29.8	Very low	188 Å²	188	138.6 Å²	138.6	88%	0.879	78%	0.777	S	S	*	*			trans	140.7	132.6	142.8	-78.1	175.5	-31.1	0	0	110.4
76	N	26.8	Very low	29.5	Very low	139 Å²	139	140.3 Å²	140.3	74%	0.743	78%	0.783	S	S	*	*			cis	95.8	137	34.9	-140.7	68.7	0	0	0	113.7
77	D	24.9	Very low	28.2	Very low	124 Å²	124	139.5 Å²	139.5	66%	0.663	78%	0.781	S	S	*	*			trans	87.4	130	162.1	-68.9	-52.2	0	0	0	124.6
78	Y	26.6	Very low	28	Very low	220 Å²	220	141 Å²	141	86%	0.863	79%	0.785	S	S	*	*			trans	87.4	137.5	145.3	-90.8	-117	0	0	0	125.4
79	Y	24.7	Very low	28	Very low	217 Å²	217	140.4 Å²	140.4	85%	0.851	79%	0.791	S	S	*	*			trans	-82.1	-179.7	166.2	-94.7	-106.3	0	0	0	111
80	P	47.3	Very low	27.8	Very low	110 Å²	110	136.5 Å²	136.5	71%	0.714	79%	0.794	S	S	*	*			cis	-129.9	-169.1	8.5	42.9	-24.7	0	0	0	114.2
81	P	33	Very low	28	Very low	129 Å²	129	136.5 Å²	136.5	84%	0.838	80%	0.795	S	S	*	*				-148.1	-173.6	90.2	39.7	-21.3	0	0	0	115.2
82	S	25.8	Very low	28.1	Very low	103 Å²	103	141.1 Å²	141.1	72%	0.72	80%	0.796	S	S	*	*			trans	-134.8	146.8	-171.4	58.6	0	0	0	0	114.3
83	M	25.4	Very low	28.3	Very low	171 Å²	171	141 Å²	141	84%	0.842	79%	0.791	S	S	*	*			trans	42.5	132.2	148.9	-57.7	-64.8	104.9	0	0	118.9
84	S	27.9	Very low	27.7	Very low	119 Å²	119	142.5 Å²	142.5	83%	0.832	79%	0.787	S	S	*	*			cis	-159.6	169.1	27	-42.5	0	0	0	0	109
85	G	25.6	Very low	27.8	Very low	65 Å²	65	140.2 Å²	140.2	67%	0.67	78%	0.781	S	S	*	*			cis	168.1	161.5	-3	0	0	0	0	0	110.9
86	S	25.4	Very low	28.1	Very low	127 Å²	127	138 Å²	138	89%	0.888	77%	0.774	S	S	*	*			trans	67.7	136.5	175.8	-60.2	0	0	0	0	117.6
87	S	24.3	Very low	28.3	Very low	104 Å²	104	138.3 Å²	138.3	73%	0.727	77%	0.773	S	S	*	*			cis	-166.5	173.2	-6.2	50	0	0	0	0	112.2
88	V	24.8	Very low	28.3	Very low	128 Å²	128	139.3 Å²	139.3	78%	0.776	78%	0.776	S	S	*	*			trans	93.1	103.2	165.6	-170.1	0	0	0	0	118.1
89	S	25.7	Very low	28.3	Very low	118 Å²	118	136 Å²	136	83%	0.825	77%	0.767	S	S	*	*			trans	65	104.1	145.1	-57.9	0	0	0	0	122
90	S	23.5	Very low	28.3	Very low	124 Å²	124	130 Å²	130	87%	0.867	76%	0.758	S	S	*	*			trans	-145.6	159.2	136.7	-168.1	0	0	0	0	110.2
91	S	29.7	Very low	27.2	Very low	111 Å²	111	131.1 Å²	131.1	78%	0.776	76%	0.757	S	S	*	*			trans	-70.5	145.3	-175.8	-49.3	0	0	0	0	113.2
92	R	27.8	Very low	26.9	Very low	208 Å²	208	131.4 Å²	131.4	79%	0.785	75%	0.752	S	S	*	*				-161.8	144.8	126.7	-113.8	-179.9	-157.4	-153.2	8.9	114.7	E94	R92-E94 IonicContact CZ-OE1 3.19Å; R92-E94 IonicContact NH1-OE1 3.39Å; R92-E94 PolarHBondContact NH1-OE1 2.59Å; R92-E94 IonicContact NH1-OE2 2.67Å
93	Q	33.9	Very low	26.9	Very low	162 Å²	162	133.7 Å²	133.7	76%	0.757	76%	0.756	S	S	*	*			trans	-73.9	136.3	149	162.1	-167.4	-5.9	0	0	108
94	E	26.6	Very low	27	Very low	151 Å²	151	132.7 Å²	132.7	71%	0.706	75%	0.753	S	S	*	*			trans	-164.2	145.9	147.9	-109.9	151.3	-135.4	0	0	111.2	R92	R92-E94 IonicContact CZ-OE1 3.19Å; R92-E94 IonicContact NH1-OE1 3.39Å; R92-E94 PolarHBondContact NH1-OE1 2.59Å; R92-E94 IonicContact NH1-OE2 2.67Å
95	D	31.5	Very low	26.9	Very low	126 Å²	126	134.4 Å²	134.4	67%	0.674	75%	0.752	S	S	*	*			trans	-82.3	177.5	-170.4	-56.7	-87	0	0	0	114
96	L	28.3	Very low	27	Very low	141 Å²	141	137 Å²	137	74%	0.738	76%	0.757	S	S	*	*				155.4	127.1	112.1	-77.5	170.2	0	0	0	115.9
97	M	32	Very low	27.1	Very low	146 Å²	146	136.6 Å²	136.6	72%	0.719	75%	0.751	S	S	*	*			trans	60	142.8	136.1	-60.2	-171.6	-57.6	0	0	124.1
98	M	23.7	Very low	27.3	Very low	146 Å²	146	142.6 Å²	142.6	72%	0.719	76%	0.76	S	S	*	*				173.3	141.3	125.1	-79.4	-24.3	-176	0	0	108.1
99	H	27.3	Very low	27.3	Very low	149 Å²	149	141.2 Å²	141.2	69%	0.69	76%	0.755	S	S	*	*			cis	-161	155.2	-2.8	-107.6	130.6	0	0	0	109.4
100	S	25.1	Very low	27.4	Very low	92 Å²	92	142 Å²	142	64%	0.643	76%	0.755	S	S	*	*			trans	48.2	148.3	141.9	-69.1	0	0	0	0	123.4
101	N	24.3	Very low	27.8	Very low	133 Å²	133	144.6 Å²	144.6	71%	0.711	75%	0.751	S	S	*	*			cis	-157.2	152.1	0.4	-105.3	-4.9	0	0	0	111.7
102	N	27.3	Very low	27.7	Very low	135 Å²	135	143.7 Å²	143.7	72%	0.722	75%	0.745	S	S	*	*			trans	9.8	131.5	153.3	-50.5	-16.9	0	0	0	118.5
103	N	25.3	Very low	27.9	Very low	152 Å²	152	138.2 Å²	138.2	81%	0.813	74%	0.744	S	S	*	*				-176.9	174.7	64.1	-123.6	-21.5	0	0	0	113.7
104	I	26.2	Very low	28.5	Very low	149 Å²	149	137.3 Å²	137.3	76%	0.764	74%	0.74	S	S	*	*			trans	84.8	113.3	166.8	-59.8	156.9	0	0	0	118.6
105	L	26.3	Very low	29.6	Very low	156 Å²	156	138.7 Å²	138.7	82%	0.817	75%	0.746	S	S	*	*			trans	29.3	124.6	150.1	-65.9	166.8	0	0	0	121.6
106	P	27.9	Very low	30.8	Very low	120 Å²	120	137.2 Å²	137.2	78%	0.779	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-81.1	134.6	169.5	33.3	-32.8	0	0	0	112.7
107	P	27.8	Very low	32.5	Very low	118 Å²	118	131.4 Å²	131.4	77%	0.766	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-76.4	154.9	167.4	32.2	-33.9	0	0	0	111.7	S109	P107-S109 PolarHBondContact O-N 3.23Å
108	Y	27.6	Very low	34	Very low	230 Å²	230	130.9 Å²	130.9	90%	0.902	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-58.1	117.9	-174.9	-69.6	-94.1	0	0	0	113.4
109	S	25.2	Very low	36.3	Very low	98 Å²	98	125.1 Å²	125.1	69%	0.685	68%	0.681	S	S	*	*			trans	-105.6	100	164.5	-171.7	0	0	0	0	109.3	P107 K111	P107-S109 PolarHBondContact O-N 3.23Å; S109-K111 PolarHBondContact O-N 3.41Å
110	T	29.1	Very low	38.4	Very low	135 Å²	135	120.2 Å²	120.2	83%	0.828	66%	0.662	S	S	*	*			trans	-76.4	66.6	174.7	53.8	0	0	0	0	111	S112	T110-S112 PolarHBondContact O-N 3.43Å
111	K	30.1	Very low	41	Very low	179 Å²	179	116.3 Å²	116.3	78%	0.778	63%	0.634	S	S	*	*			trans	-63.6	123.2	155.7	-73	-176.4	177.2	179.8	0	107.2	S109 A113	S109-K111 PolarHBondContact O-N 3.41Å; K111-A113 VanDerWaalsContact C-N 3.33Å; K111-A113 PolarHBondContact O-N 3.39Å
112	S	28.3	Very low	43.8	Very low	92 Å²	92	112.2 Å²	112.2	64%	0.643	62%	0.616	S	S	*	*			trans	-67.6	94.4	166.4	55.7	0	0	0	0	108.4	T110 Q114	T110-S112 PolarHBondContact O-N 3.43Å; S112-Q114 PolarHBondContact O-N 3.39Å; S112-Q114 VanDerWaalsContact O-N 3.11Å
113	A	32.8	Very low	46.7	Very low	92 Å²	92	105.8 Å²	105.8	76%	0.76	58%	0.581	S	S	*	*			trans	-64.6	108.9	166.3	0	0	0	0	0	107.6	K111 E115	K111-A113 VanDerWaalsContact C-N 3.33Å; K111-A113 PolarHBondContact O-N 3.39Å; A113-E115 PolarHBondContact O-N 2.86Å
114	Q	46.6	Very low	49.5	Very low	144 Å²	144	103.6 Å²	103.6	67%	0.673	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-66	130.2	162.6	-73.6	170.6	-74.1	0	0	107	S112	S112-Q114 PolarHBondContact O-N 3.39Å; S112-Q114 VanDerWaalsContact O-N 3.11Å
115	E	48	Very low	52.3	Low	179 Å²	179	97.2 Å²	97.2	84%	0.836	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-62.3	146.9	176.4	-66.1	-175.5	134.6	0	0	110.1	A113	A113-E115 PolarHBondContact O-N 2.86Å
116	P	57.6	Low	54.6	Low	95 Å²	95	90.5 Å²	90.5	62%	0.617	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-60.6	142.6	177.7	26.4	-34.5	0	0	0	110.6	Q118	P116-Q118 PolarHBondContact O-N 3.35Å
117	L	63.8	Low	56.7	Low	20 Å²	20	90.6 Å²	90.6	11%	0.105	50%	0.496	C	S	.	.			trans	-73.8	70.8	-172.6	-168.4	124.9	0	0	0	112.3	L119 Y160 L211 R214 V444	L117-L119 PolarHBondContact O-N 2.96Å; L117-Y160 PolarHBondContact O-OH 3.22Å; L117-L211 HydrophobicContact CD2-CD2 3.77Å; L117-R214 HydrophobicContact CB-CB 4.37Å; L117-R214 HydrophobicContact CD1-CB 4.2Å; L117-V444 HydrophobicContact CD1-CB 3.94Å; L117-V444 HydrophobicContact CD1-CG1 3.73Å; L117-V444 HydrophobicContact CD1-CG2 4.25Å; L117-V444 HydrophobicContact CD2-CG1 4.32Å; L117-V444 HydrophobicContact CD2-CG2 4.39Å; L117-V444 HydrophobicContact CG-CG1 3.92Å
118	Q	64	Low	58.7	Low	134 Å²	134	93 Å²	93	63%	0.626	49%	0.491	S	S	*	.			trans	-93.2	95.7	179.3	-167.1	167.5	17.3	0	0	110.6	P116	P116-Q118 PolarHBondContact O-N 3.35Å
119	L	71.5	Confident	61.3	Low	25 Å²	25	83.2 Å²	83.2	13%	0.131	45%	0.454	C	S	.	.			trans	-57.2	136.7	165.3	-63.7	178.7	0	0	0	109	L117 L121 Y157 Y160 L161 V444	L117-L119 PolarHBondContact O-N 2.96Å; L119-L121 PolarHBondContact O-N 3.27Å; L119-Y157 HydrophobicContact CD1-CD1 3.69Å; L119-Y157 HydrophobicContact CD1-CE1 3.84Å; L119-Y157 HydrophobicContact CD2-CE1 4.36Å; L119-Y160 HydrophobicContact CD1-CD1 3.9Å; L119-Y160 HydrophobicContact CD1-CE1 3.76Å; L119-Y160 HydrophobicContact CG-CE1 4.26Å; L119-L161 HydrophobicContact CD1-CD2 4.22Å; L119-V444 HydrophobicContact CD2-CG1 3.72Å; L119-V444 HydrophobicContact CD2-CG2 4.26Å
120	P	71.6	Confident	64.2	Low	47 Å²	47	78.6 Å²	78.6	31%	0.305	42%	0.422	S	S	.	.	S	Bend	trans	-77.9	44.2	177	33.8	-36.3	0	0	0	111.4	V450 L472 T473	P120-V450 HydrophobicContact CG-CG2 3.97Å; P120-L472 CarbonylContact O-C 3.59Å; P120-L472 VanDerWaalsContact O-CA 3.29Å; P120-L472 WeakPolarHBondContact O-CA 3.22Å; P120-T473 PolarHBondContact O-N 3.15Å
121	L	79.9	Confident	67.1	Low	10 Å²	10	77.5 Å²	77.5	5%	0.052	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	143.4	177	-74.2	176	0	0	0	110.1	L119 L161 V450 L454 W455 L458 V470 S471 L472 T473	L119-L121 PolarHBondContact O-N 3.27Å; L121-L161 HydrophobicContact CB-CD1 4.01Å; L121-L161 HydrophobicContact CB-CD2 3.9Å; L121-L161 HydrophobicContact CD1-CD1 3.87Å; L121-L161 WeakPolarHBondContact O-CD2 3.32Å; L121-V450 HydrophobicContact CD1-CG1 3.8Å; L121-V450 HydrophobicContact CD1-CG2 3.95Å; L121-V450 HydrophobicContact CD2-CG1 4.36Å; L121-V450 HydrophobicContact CD2-CG2 3.91Å; L121-V450 HydrophobicContact CG-CG1 4.31Å; L121-V450 HydrophobicContact CG-CG2 3.63Å; L121-L454 HydrophobicContact CD1-CD2 4.07Å; L121-W455 HydrophobicContact CD2-CE3 3.78Å; L121-W455 HydrophobicContact CD2-CZ3 3.67Å; L121-L458 HydrophobicContact CD1-CD1 3.98Å; L121-V470 HydrophobicContact CD2-CG1 4.36Å; L121-S471 WeakPolarHBondContact CA-O 3.5Å; L121-L472 HydrophobicContact CD2-CD2 3.99Å; L121-T473 PolarHBondContact N-OG1 2.71Å
122	S	82.3	Confident	70	Confident	47 Å²	47	73.5 Å²	73.5	33%	0.329	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	145.3	158.6	67.3	0	0	0	0	110.4	S471	S122-S471 PolarHBondContact N-O 3.26Å; S122-S471 PolarHBondContact O-N 3.17Å; S122-S471 PolarHBondContact OG-OG 3.45Å
123	I	88.1	Confident	73	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	142.4	174.5	71.4	-179.4	0	0	0	110.6	I125 F133 L161 A162 S165 L458 T469 V470	I123-I125 HydrophobicContact CD1-CD1 4.02Å; I123-I125 HydrophobicContact CD1-CG1 4.39Å; I123-I125 HydrophobicContact CG1-CD1 4.4Å; I123-I125 HydrophobicContact CG1-CG1 4.43Å; I123-F133 HydrophobicContact CD1-CE2 4.16Å; I123-F133 HydrophobicContact CD1-CZ 3.84Å; I123-L161 HydrophobicContact CD1-CB 3.86Å; I123-L161 HydrophobicContact CG1-CB 3.94Å; I123-L161 HydrophobicContact CG2-CB 4.38Å; I123-L161 HydrophobicContact CG2-CD1 4.36Å; I123-A162 HydrophobicContact CD1-CB 4.13Å; I123-S165 VanDerWaalsContact O-CB 3.23Å; I123-S165 WeakPolarHBondContact O-CB 3.16Å; I123-S165 PolarHBondContact O-OG 2.77Å; I123-L458 HydrophobicContact CG2-CD1 4.46Å; I123-L458 HydrophobicContact CG2-CD2 4.31Å; I123-T469 CarbonylContact C-O 3.57Å; I123-T469 VanDerWaalsContact CA-O 3.31Å; I123-T469 WeakPolarHBondContact CA-O 3.48Å; I123-V470 HydrophobicContact CG2-CG1 4.23Å; I123-V470 HydrophobicContact CG2-CG2 4.18Å
124	Q	84.8	Confident	75.8	Confident	106 Å²	106	64.9 Å²	64.9	50%	0.495	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133	170.1	-68.2	-177.1	-12.8	0	0	109.4	C467 H468 T469	Q124-C467 CarbonylContact O-C 3.47Å; Q124-C467 WeakPolarHBondContact O-CA 3.47Å; Q124-C467 WeakPolarHBondContact O-CB 3.45Å; Q124-H468 PolarHBondContact O-N 3.46Å; Q124-T469 PolarHBondContact N-O 3.19Å
125	I	84.6	Confident	77.9	Confident	15 Å²	15	60.9 Å²	60.9	8%	0.077	32%	0.315	C	S	.	.			trans	-128.4	116.6	179.6	-56.4	168.8	0	0	0	106.3	I123 V130 F133 A162 F166 C467	I123-I125 HydrophobicContact CD1-CD1 4.02Å; I123-I125 HydrophobicContact CD1-CG1 4.39Å; I123-I125 HydrophobicContact CG1-CD1 4.4Å; I123-I125 HydrophobicContact CG1-CG1 4.43Å; I125-V130 HydrophobicContact CG2-CB 4.3Å; I125-V130 HydrophobicContact CG2-CG2 3.77Å; I125-F133 HydrophobicContact CD1-CD1 3.74Å; I125-F133 HydrophobicContact CD1-CD2 3.97Å; I125-F133 HydrophobicContact CD1-CE1 3.66Å; I125-F133 HydrophobicContact CD1-CE2 3.87Å; I125-F133 HydrophobicContact CD1-CG 3.91Å; I125-F133 HydrophobicContact CD1-CZ 3.72Å; I125-F133 HydrophobicContact CG1-CD2 4.35Å; I125-F133 HydrophobicContact CG1-CE2 4.41Å; I125-F133 HydrophobicContact CG2-CB 4.42Å; I125-A162 HydrophobicContact CD1-CB 3.53Å; I125-F166 HydrophobicContact CB-CE1 4.47Å; I125-F166 HydrophobicContact CB-CZ 4.05Å; I125-F166 HydrophobicContact CD1-CE2 4.35Å; I125-F166 HydrophobicContact CD1-CZ 4.08Å; I125-F166 HydrophobicContact CG2-CZ 4.34Å; I125-C467 HydrophobicContact CG1-CB 4.12Å
126	G	74.8	Confident	79.8	Confident	15 Å²	15	53.6 Å²	53.6	16%	0.155	28%	0.281	C	S	.	.			trans	-70.1	144.7	177	0	0	0	0	0	112.3	Y128 N129 H468	G126-Y128 PolarHBondContact O-N 2.9Å; G126-N129 PolarHBondContact O-N 3.31Å; G126-H468 VanDerWaalsContact CA-CE1 3.48Å; G126-H468 WeakPolarHBondContact CA-CE1 3.47Å; G126-H468 PolarHBondContact N-CE1 3.31Å; G126-H468 PolarHBondContact N-ND1 2.7Å
127	D	72.3	Confident	81.4	Confident	121 Å²	121	49.1 Å²	49.1	65%	0.647	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-28.7	-165.5	-50.6	-72.3	0	0	0	114.7
128	Y	70.9	Confident	82.7	Confident	168 Å²	168	48.8 Å²	48.8	66%	0.659	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-16.4	-178.2	58.1	-86.1	0	0	0	114.3	G126 H468	G126-Y128 PolarHBondContact O-N 2.9Å; Y128-H468 AromaticContact CZ-NE2 3.67Å; Y128-H468 PolarHBondContact OH-NE2 3.49Å
129	N	81	Confident	83.7	Confident	26 Å²	26	43.9 Å²	43.9	14%	0.139	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-1.2	-176.9	-76	-4.7	0	0	0	114.1	G126 W131 D132 F133 R465	G126-N129 PolarHBondContact O-N 3.31Å; N129-W131 PolarHBondContact O-N 3.07Å; N129-D132 PolarHBondContact O-N 2.8Å; N129-F133 WeakPolarHBondContact O-CB 3.41Å; N129-F133 PolarHBondContact O-N 3.09Å; N129-R465 PolarHBondContact ND2-O 3.16Å
130	V	87.3	Confident	83.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.8	-41.1	-170.3	-177	0	0	0	0	112.9	I125 L134 F166 Y173 F177	I125-V130 HydrophobicContact CG2-CB 4.3Å; I125-V130 HydrophobicContact CG2-CG2 3.77Å; V130-L134 WeakPolarHBondContact O-CB 3.35Å; V130-L134 PolarHBondContact O-N 3.08Å; V130-F166 HydrophobicContact CB-CZ 4.31Å; V130-F166 HydrophobicContact CG1-CE2 3.8Å; V130-F166 HydrophobicContact CG1-CZ 3.58Å; V130-F166 HydrophobicContact CG2-CE1 4.18Å; V130-F166 HydrophobicContact CG2-CZ 3.76Å; V130-Y173 HydrophobicContact CB-CE1 4.25Å; V130-Y173 WeakPolarHBondContact CB-OH 3.42Å; V130-Y173 HydrophobicContact CG1-CE1 3.85Å; V130-Y173 WeakPolarHBondContact CG1-OH 3.24Å; V130-Y173 HydrophobicContact CG2-CE1 3.91Å; V130-Y173 WeakPolarHBondContact CG2-OH 3.42Å; V130-F177 HydrophobicContact CG1-CD2 3.73Å; V130-F177 HydrophobicContact CG1-CE2 3.73Å
131	W	89.9	Confident	83.3	Confident	112 Å²	112	51.4 Å²	51.4	42%	0.424	26%	0.257	S	S	.	.	H	α-helix	trans	-75.1	-29.7	-179.2	-56.4	124	0	0	0	112.4	N129 L134 A135 Y173 F177 R180	N129-W131 PolarHBondContact O-N 3.07Å; W131-L134 HydrophobicContact CE3-CD2 3.68Å; W131-L134 HydrophobicContact CZ3-CD2 3.73Å; W131-L134 PolarHBondContact O-N 2.87Å; W131-A135 VanDerWaalsContact O-CB 3.25Å; W131-A135 WeakPolarHBondContact O-CB 3.29Å; W131-A135 PolarHBondContact O-N 3.04Å; W131-Y173 HydrophobicContact CZ2-CE2 4.06Å; W131-F177 HydrophobicContact CZ3-CD2 4.39Å; W131-R180 HydrophobicContact CE3-CG 4.26Å; W131-R180 HydrophobicContact CH2-CB 4.38Å; W131-R180 HydrophobicContact CZ3-CB 3.77Å; W131-R180 HydrophobicContact CZ3-CG 3.82Å
132	D	89.8	Confident	82.4	Confident	95 Å²	95	51.5 Å²	51.5	51%	0.508	26%	0.26	S	S	.	.	H	α-helix	trans	-72.9	-40	172.9	-63.4	-35.7	0	0	0	111.4	N129 L134 A135 E136 L466	N129-D132 PolarHBondContact O-N 2.8Å; D132-L134 VanDerWaalsContact C-N 3.33Å; D132-A135 PolarHBondContact O-N 2.88Å; D132-E136 WeakPolarHBondContact O-CB 3.5Å; D132-E136 PolarHBondContact O-N 3.19Å; D132-L466 HydrophobicContact CB-CD2 3.85Å
133	F	90.7	Very high	81.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-56.3	-49.2	168.6	171.8	-85.5	0	0	0	110.4	I123 I125 N129 A135 E136 V137 A162 F177 L461 L466	I123-F133 HydrophobicContact CD1-CE2 4.16Å; I123-F133 HydrophobicContact CD1-CZ 3.84Å; I125-F133 HydrophobicContact CD1-CD1 3.74Å; I125-F133 HydrophobicContact CD1-CD2 3.97Å; I125-F133 HydrophobicContact CD1-CE1 3.66Å; I125-F133 HydrophobicContact CD1-CE2 3.87Å; I125-F133 HydrophobicContact CD1-CG 3.91Å; I125-F133 HydrophobicContact CD1-CZ 3.72Å; I125-F133 HydrophobicContact CG1-CD2 4.35Å; I125-F133 HydrophobicContact CG1-CE2 4.41Å; I125-F133 HydrophobicContact CG2-CB 4.42Å; N129-F133 WeakPolarHBondContact O-CB 3.41Å; N129-F133 PolarHBondContact O-N 3.09Å; F133-A135 PolarHBondContact O-N 2.86Å; F133-E136 PolarHBondContact O-N 2.82Å; F133-V137 HydrophobicContact CD1-CG2 4.27Å; F133-V137 HydrophobicContact CD2-CG2 4.35Å; F133-V137 HydrophobicContact CE1-CG2 4.01Å; F133-V137 HydrophobicContact CE2-CG2 4.11Å; F133-V137 HydrophobicContact CG-CG2 4.42Å; F133-V137 HydrophobicContact CZ-CG2 3.93Å; F133-V137 WeakPolarHBondContact O-CB 3.5Å; F133-V137 VanDerWaalsContact O-CG2 3.22Å; F133-V137 WeakPolarHBondContact O-CG2 3.4Å; F133-V137 PolarHBondContact O-N 3.19Å; F133-A162 HydrophobicContact CE1-CB 3.7Å; F133-A162 HydrophobicContact CZ-CB 4.09Å; F133-F177 HydrophobicContact CD1-CZ 4.49Å; F133-F177 HydrophobicContact CE1-CZ 4.34Å; F133-L461 HydrophobicContact CD2-CD1 4.33Å; F133-L461 HydrophobicContact CE2-CD1 3.78Å; F133-L466 HydrophobicContact CB-CB 4.21Å; F133-L466 HydrophobicContact CD2-CB 4.18Å
134	L	92.1	Very high	79.8	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-63.4	-41.4	-179.5	-174	63.3	0	0	0	112.1	V130 W131 D132 M138 L159 F177 R180 I181	V130-L134 WeakPolarHBondContact O-CB 3.35Å; V130-L134 PolarHBondContact O-N 3.08Å; W131-L134 HydrophobicContact CE3-CD2 3.68Å; W131-L134 HydrophobicContact CZ3-CD2 3.73Å; W131-L134 PolarHBondContact O-N 2.87Å; D132-L134 VanDerWaalsContact C-N 3.33Å; L134-M138 HydrophobicContact CD1-CE 3.34Å; L134-M138 HydrophobicContact CD1-SD 4.19Å; L134-M138 HydrophobicContact CD2-CE 4.2Å; L134-M138 HydrophobicContact CG-CE 3.52Å; L134-M138 PolarHBondContact O-N 3.32Å; L134-M138 VanDerWaalsContact O-N 3.07Å; L134-L159 HydrophobicContact CD1-CD2 3.57Å; L134-F177 HydrophobicContact CB-CE2 4.18Å; L134-F177 HydrophobicContact CD1-CE2 3.87Å; L134-F177 HydrophobicContact CD1-CZ 4Å; L134-F177 HydrophobicContact CD2-CD2 4.39Å; L134-F177 HydrophobicContact CD2-CE2 4.27Å; L134-F177 HydrophobicContact CG-CE2 4.33Å; L134-R180 HydrophobicContact CD2-CB 3.81Å; L134-R180 HydrophobicContact CD2-CG 3.53Å; L134-I181 HydrophobicContact CD1-CD1 4.46Å; L134-I181 HydrophobicContact CD1-CG1 3.69Å
135	A	90.7	Very high	78.5	Confident	60 Å²	60	50.3 Å²	50.3	50%	0.496	26%	0.259	S	S	.	.	H	α-helix	trans	-70.1	-34.7	178.9	0	0	0	0	0	113.1	W131 D132 F133 S139	W131-A135 VanDerWaalsContact O-CB 3.25Å; W131-A135 WeakPolarHBondContact O-CB 3.29Å; W131-A135 PolarHBondContact O-N 3.04Å; D132-A135 PolarHBondContact O-N 2.88Å; F133-A135 PolarHBondContact O-N 2.86Å; A135-S139 WeakPolarHBondContact O-CB 3.09Å; A135-S139 PolarHBondContact O-N 3.09Å; A135-S139 VanDerWaalsContact O-N 3.15Å
136	E	89.3	Confident	77	Confident	26 Å²	26	54.2 Å²	54.2	12%	0.121	29%	0.288	C	S	.	.	H	α-helix	trans	-73.9	-45.4	174.4	-171.3	66.4	-153.7	0	0	111.5	D132 F133 M138 S139 L461 R464 L466	D132-E136 WeakPolarHBondContact O-CB 3.5Å; D132-E136 PolarHBondContact O-N 3.19Å; F133-E136 PolarHBondContact O-N 2.82Å; E136-M138 VanDerWaalsContact C-N 3.29Å; E136-M138 PolarHBondContact O-N 2.92Å; E136-S139 WeakPolarHBondContact O-CB 3.4Å; E136-S139 PolarHBondContact O-N 3.45Å; E136-S139 VanDerWaalsContact O-N 3.07Å; E136-L461 HydrophobicContact CG-CD2 4.25Å; E136-R464 VanDerWaalsContact CD-CZ 3.47Å; E136-R464 IonicContact OE1-CZ 3.52Å; E136-R464 IonicContact OE1-NH1 2.71Å; E136-R464 PolarHBondContact OE1-NH1 3.29Å; E136-R464 IonicContact OE1-NH2 2.8Å; E136-R464 IonicContact OE2-CZ 3.46Å; E136-R464 IonicContact OE2-NH1 3.45Å; E136-R464 PolarHBondContact OE2-NH1 3.09Å; E136-R464 IonicContact OE2-NH2 3.51Å; E136-R464 PolarHBondContact OE2-NH2 2.97Å; E136-L466 HydrophobicContact CB-CD1 3.68Å; E136-L466 HydrophobicContact CG-CD1 3.81Å
137	V	90.8	Very high	75.8	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.3	-35.1	-179.2	171	0	0	0	0	111.8	F133 P155 L159 L461	F133-V137 HydrophobicContact CD1-CG2 4.27Å; F133-V137 HydrophobicContact CD2-CG2 4.35Å; F133-V137 HydrophobicContact CE1-CG2 4.01Å; F133-V137 HydrophobicContact CE2-CG2 4.11Å; F133-V137 HydrophobicContact CG-CG2 4.42Å; F133-V137 HydrophobicContact CZ-CG2 3.93Å; F133-V137 WeakPolarHBondContact O-CB 3.5Å; F133-V137 VanDerWaalsContact O-CG2 3.22Å; F133-V137 WeakPolarHBondContact O-CG2 3.4Å; F133-V137 PolarHBondContact O-N 3.19Å; V137-P155 HydrophobicContact CG1-CB 3.92Å; V137-L159 HydrophobicContact CB-CD2 4.41Å; V137-L159 HydrophobicContact CG1-CD2 3.73Å; V137-L159 HydrophobicContact CG1-CG 3.82Å; V137-L461 HydrophobicContact CG2-CD1 3.75Å; V137-L461 HydrophobicContact CG2-CD2 4.4Å
138	M	90.9	Very high	74.9	Confident	14 Å²	14	58.1 Å²	58.1	7%	0.069	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	17.5	174.1	-62.9	-174	-53.1	0	0	113.9	L134 E136 L159 I181 N184 W201	L134-M138 HydrophobicContact CD1-CE 3.34Å; L134-M138 HydrophobicContact CD1-SD 4.19Å; L134-M138 HydrophobicContact CD2-CE 4.2Å; L134-M138 HydrophobicContact CG-CE 3.52Å; L134-M138 PolarHBondContact O-N 3.32Å; L134-M138 VanDerWaalsContact O-N 3.07Å; E136-M138 VanDerWaalsContact C-N 3.29Å; E136-M138 PolarHBondContact O-N 2.92Å; M138-L159 HydrophobicContact CG-CD1 4.04Å; M138-L159 HydrophobicContact CG-CD2 4.39Å; M138-L159 HydrophobicContact SD-CD1 3.95Å; M138-L159 HydrophobicContact SD-CD2 4.49Å; M138-I181 HydrophobicContact SD-CG1 4.48Å; M138-I181 HydrophobicContact SD-CG2 4.38Å; M138-N184 HydrophobicContact CE-CB 3.38Å; M138-N184 WeakPolarHBondContact CE-ND2 3.48Å; M138-N184 HydrophobicContact SD-CB 3.78Å; M138-W201 HydrophobicContact CB-CH2 4.36Å
139	S	85.2	Confident	74.5	Confident	31 Å²	31	50.9 Å²	50.9	22%	0.217	27%	0.273	C	S	.	.	S	Bend	trans	-73.3	142.5	174.5	-170.1	0	0	0	0	111.2	A135 E136 R141 A142	A135-S139 WeakPolarHBondContact O-CB 3.09Å; A135-S139 PolarHBondContact O-N 3.09Å; A135-S139 VanDerWaalsContact O-N 3.15Å; E136-S139 WeakPolarHBondContact O-CB 3.4Å; E136-S139 PolarHBondContact O-N 3.45Å; E136-S139 VanDerWaalsContact O-N 3.07Å; S139-R141 PolarHBondContact O-N 3.25Å; S139-R141 PolarHBondContact OG-N 2.93Å; S139-A142 WeakPolarHBondContact O-CB 3.44Å; S139-A142 PolarHBondContact O-N 3.26Å
140	N	69.2	Low	74.2	Confident	81 Å²	81	55 Å²	55	43%	0.433	30%	0.298	S	S	.	.	H	α-helix	trans	-59.1	-12.4	169	-70.4	-14	0	0	0	113.2	A142 A143 T144 W201	N140-A142 VanDerWaalsContact C-N 3.28Å; N140-A142 PolarHBondContact O-N 3.22Å; N140-A143 PolarHBondContact O-N 2.89Å; N140-T144 PolarHBondContact O-N 3.29Å; N140-T144 PolarHBondContact O-OG1 3.43Å; N140-W201 PolarHBondContact OD1-NE1 2.88Å
141	R	64.2	Low	74.1	Confident	149 Å²	149	56.2 Å²	56.2	56%	0.562	30%	0.304	S	S	*	.	H	α-helix	trans	-59.1	-36.3	166.2	-68.7	179.1	173.4	-180	-3.1	112.6	S139 A143 S145 M148	S139-R141 PolarHBondContact O-N 3.25Å; S139-R141 PolarHBondContact OG-N 2.93Å; R141-A143 VanDerWaalsContact C-N 3.32Å; R141-A143 PolarHBondContact O-N 3.22Å; R141-S145 WeakPolarHBondContact O-CB 3.34Å; R141-S145 PolarHBondContact O-N 3.34Å; R141-S145 PolarHBondContact O-OG 2.88Å; R141-M148 HydrophobicContact CB-CE 4.41Å
142	A	61.3	Low	74.1	Confident	12 Å²	12	53.1 Å²	53.1	10%	0.099	29%	0.292	C	S	.	.	H	α-helix	trans	-67.9	-31.1	177.6	0	0	0	0	0	112.7	S139 N140 P155 F200 W201	S139-A142 WeakPolarHBondContact O-CB 3.44Å; S139-A142 PolarHBondContact O-N 3.26Å; N140-A142 VanDerWaalsContact C-N 3.28Å; N140-A142 PolarHBondContact O-N 3.22Å; A142-P155 HydrophobicContact CB-CG 4.13Å; A142-F200 HydrophobicContact CB-CE1 4.3Å; A142-F200 HydrophobicContact CB-CZ 4.15Å; A142-F200 WeakPolarHBondContact O-CZ 3.25Å; A142-W201 HydrophobicContact CB-CH2 4.44Å
143	A	59.7	Low	74.1	Confident	5 Å²	5	48.7 Å²	48.7	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-77.5	-43.1	176.2	0	0	0	0	0	112.2	N140 R141 R152 D197 F200	N140-A143 PolarHBondContact O-N 2.89Å; R141-A143 VanDerWaalsContact C-N 3.32Å; R141-A143 PolarHBondContact O-N 3.22Å; A143-R152 PolarHBondContact O-NH1 2.81Å; A143-D197 HydrophobicContact CB-CB 4.37Å; A143-D197 WeakPolarHBondContact CB-OD1 3.35Å; A143-F200 HydrophobicContact CB-CB 4.21Å; A143-F200 HydrophobicContact CB-CD1 3.38Å; A143-F200 HydrophobicContact CB-CD2 4.47Å; A143-F200 HydrophobicContact CB-CE1 3.76Å; A143-F200 HydrophobicContact CB-CG 3.77Å; A143-F200 HydrophobicContact CB-CZ 4.44Å
144	T	57.3	Low	74	Confident	98 Å²	98	48.7 Å²	48.7	60%	0.601	27%	0.268	S	S	*	.	H	α-helix	trans	-85.6	-28.6	-172.1	49.8	0	0	0	0	115	N140	N140-T144 PolarHBondContact O-N 3.29Å; N140-T144 PolarHBondContact O-OG1 3.43Å
145	S	56.1	Low	74.1	Confident	24 Å²	24	48.7 Å²	48.7	17%	0.168	27%	0.269	C	S	.	.			trans	-87.4	119.8	-176.4	62.3	0	0	0	0	113.1	R141 E147 M148	R141-S145 WeakPolarHBondContact O-CB 3.34Å; R141-S145 PolarHBondContact O-N 3.34Å; R141-S145 PolarHBondContact O-OG 2.88Å; S145-E147 PolarHBondContact O-N 3.35Å; S145-M148 WeakPolarHBondContact OG-CB 3.47Å
146	S	54.3	Low	74.2	Confident	97 Å²	97	45.8 Å²	45.8	68%	0.678	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-10	167	-168.7	0	0	0	0	113
147	E	49.8	Very low	74.3	Confident	180 Å²	180	44.6 Å²	44.6	84%	0.841	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-29.9	-174.1	-57.8	178.6	150.3	0	0	113	S145	S145-E147 PolarHBondContact O-N 3.35Å
148	M	52.5	Low	74.3	Confident	39 Å²	39	44.6 Å²	44.6	19%	0.192	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-32.9	-171.3	-159.3	96.2	70	0	0	112.4	R141 S145 Y457 Q460	R141-M148 HydrophobicContact CB-CE 4.41Å; S145-M148 WeakPolarHBondContact OG-CB 3.47Å; M148-Y457 HydrophobicContact CG-CD2 4.07Å; M148-Y457 HydrophobicContact CG-CE2 3.9Å; M148-Y457 WeakPolarHBondContact O-CD2 3.46Å; M148-Q460 PolarHBondContact O-NE2 2.66Å; M148-Q460 PolarHBondContact O-OE1 3.34Å
149	S	61.9	Low	74.4	Confident	16 Å²	16	44 Å²	44	11%	0.112	24%	0.236	C	C	.	.			trans	-153.1	128.7	172.1	-169	0	0	0	0	113.5	F151 S154 G453	S149-F151 PolarHBondContact O-N 2.8Å; S149-F151 PolarHBondContact OG-N 2.67Å; S149-F151 PolarHBondContact OG-O 2.88Å; S149-S154 PolarHBondContact OG-OG 2.87Å; S149-G453 PolarHBondContact OG-O 2.97Å
150	T	75.2	Confident	74.8	Confident	111 Å²	111	42.8 Å²	42.8	68%	0.681	23%	0.227	S	C	*	.	S	Bend	trans	-69	-17	165.1	50.3	0	0	0	0	112.5	G453	T150-G453 WeakPolarHBondContact OG1-CA 3.46Å
151	F	86.3	Confident	75.9	Confident	27 Å²	27	39.3 Å²	39.3	12%	0.118	21%	0.208	C	C	.	.	S	Bend	trans	-108.7	103.2	178.1	178.6	-122.3	0	0	0	111.1	S149 L153 S154 Y157 F443 L454	S149-F151 PolarHBondContact O-N 2.8Å; S149-F151 PolarHBondContact OG-N 2.67Å; S149-F151 PolarHBondContact OG-O 2.88Å; F151-L153 VanDerWaalsContact C-N 3.26Å; F151-L153 HydrophobicContact CE1-CB 3.89Å; F151-L153 HydrophobicContact CE2-CB 4.07Å; F151-L153 HydrophobicContact CE2-CD1 4.3Å; F151-L153 HydrophobicContact CE2-CG 4.45Å; F151-L153 HydrophobicContact CZ-CB 3.57Å; F151-L153 HydrophobicContact CZ-CD1 4.18Å; F151-L153 HydrophobicContact CZ-CG 4.33Å; F151-L153 PolarHBondContact O-N 2.81Å; F151-L153 VanDerWaalsContact O-N 3.16Å; F151-S154 WeakPolarHBondContact CD1-OG 3.3Å; F151-S154 VanDerWaalsContact O-CB 3.32Å; F151-S154 WeakPolarHBondContact O-CB 3.46Å; F151-S154 PolarHBondContact O-N 3.25Å; F151-S154 PolarHBondContact O-OG 3.36Å; F151-Y157 AromaticContact CE1-CD2 3.74Å; F151-Y157 HydrophobicContact CE1-CD2 3.74Å; F151-Y157 HydrophobicContact CE1-CE2 4.16Å; F151-Y157 HydrophobicContact CE1-CG 4.33Å; F151-Y157 HydrophobicContact CZ-CD2 4.09Å; F151-Y157 HydrophobicContact CZ-CE2 4.03Å; F151-F443 HydrophobicContact CD1-CZ 4.21Å; F151-F443 AromaticContact CD2-CE2 3.84Å; F151-F443 HydrophobicContact CD2-CE2 3.84Å; F151-F443 HydrophobicContact CD2-CZ 4.22Å; F151-F443 AromaticContact CE1-CE1 3.93Å; F151-F443 HydrophobicContact CE1-CE1 3.93Å; F151-F443 AromaticContact CE1-CE2 4Å; F151-F443 HydrophobicContact CE1-CE2 4Å; F151-F443 AromaticContact CE1-CZ 3.54Å; F151-F443 HydrophobicContact CE1-CZ 3.54Å; F151-F443 AromaticContact CE2-CD2 3.49Å; F151-F443 HydrophobicContact CE2-CD2 3.49Å; F151-F443 VanDerWaalsContact CE2-CD2 3.49Å; F151-F443 HydrophobicContact CE2-CE1 4.41Å; F151-F443 AromaticContact CE2-CE2 3.09Å; F151-F443 HydrophobicContact CE2-CE2 3.09Å; F151-F443 HydrophobicContact CE2-CG 4.27Å; F151-F443 AromaticContact CE2-CZ 3.57Å; F151-F443 HydrophobicContact CE2-CZ 3.57Å; F151-F443 AromaticContact CZ-CD1 3.95Å; F151-F443 HydrophobicContact CZ-CD1 3.95Å; F151-F443 AromaticContact CZ-CD2 3.51Å; F151-F443 HydrophobicContact CZ-CD2 3.51Å; F151-F443 AromaticContact CZ-CE1 3.63Å; F151-F443 HydrophobicContact CZ-CE1 3.63Å; F151-F443 AromaticContact CZ-CE2 3.16Å; F151-F443 HydrophobicContact CZ-CE2 3.16Å; F151-F443 AromaticContact CZ-CG 3.85Å; F151-F443 HydrophobicContact CZ-CG 3.85Å; F151-F443 AromaticContact CZ-CZ 3.16Å; F151-F443 HydrophobicContact CZ-CZ 3.16Å; F151-L454 HydrophobicContact CD1-CB 3.8Å; F151-L454 HydrophobicContact CD1-CD1 4.42Å; F151-L454 HydrophobicContact CE1-CB 4.29Å
152	R	88.1	Confident	77.2	Confident	46 Å²	46	32.2 Å²	32.2	17%	0.174	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-19	-170.6	-68.4	-56.9	-153.4	143	7.6	115.9	A143 S154 F200 N204 I279	A143-R152 PolarHBondContact O-NH1 2.81Å; R152-S154 VanDerWaalsContact C-N 3.33Å; R152-F200 HydrophobicContact CB-CE2 4.3Å; R152-F200 WeakPolarHBondContact O-CE2 3.43Å; R152-N204 PolarHBondContact O-ND2 2.69Å; R152-I279 HydrophobicContact CG-CG2 4.45Å; R152-I279 VanDerWaalsContact CG-O 3.25Å; R152-I279 WeakPolarHBondContact CG-O 3.46Å
153	L	90.3	Very high	78.6	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.01	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	6.5	175.4	-57.7	168.8	0	0	0	113.1	F151 P155 A156 Y157 A203 N204 E207 C280 Y442	F151-L153 VanDerWaalsContact C-N 3.26Å; F151-L153 HydrophobicContact CE1-CB 3.89Å; F151-L153 HydrophobicContact CE2-CB 4.07Å; F151-L153 HydrophobicContact CE2-CD1 4.3Å; F151-L153 HydrophobicContact CE2-CG 4.45Å; F151-L153 HydrophobicContact CZ-CB 3.57Å; F151-L153 HydrophobicContact CZ-CD1 4.18Å; F151-L153 HydrophobicContact CZ-CG 4.33Å; F151-L153 PolarHBondContact O-N 2.81Å; F151-L153 VanDerWaalsContact O-N 3.16Å; L153-P155 VanDerWaalsContact C-CD 3.46Å; L153-P155 VanDerWaalsContact C-N 3.3Å; L153-A156 WeakPolarHBondContact O-CB 3.5Å; L153-A156 PolarHBondContact O-N 2.91Å; L153-Y157 HydrophobicContact CB-CD2 4.23Å; L153-Y157 HydrophobicContact CB-CE2 4.28Å; L153-Y157 WeakPolarHBondContact O-CD2 3.43Å; L153-Y157 PolarHBondContact O-N 3.08Å; L153-A203 HydrophobicContact CD2-CB 3.86Å; L153-N204 WeakPolarHBondContact CA-OD1 3.49Å; L153-N204 PolarHBondContact O-OD1 3.47Å; L153-E207 HydrophobicContact CD1-CG 4.14Å; L153-E207 HydrophobicContact CD2-CB 4.19Å; L153-C280 WeakPolarHBondContact CD2-O 3.49Å; L153-Y442 HydrophobicContact CD1-CD1 3.96Å; L153-Y442 HydrophobicContact CD1-CG 4.04Å
154	S	89.8	Confident	80.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-51.7	-37.4	-178.5	-67.8	0	0	0	0	115.1	S149 F151 R152 S158 Y457	S149-S154 PolarHBondContact OG-OG 2.87Å; F151-S154 WeakPolarHBondContact CD1-OG 3.3Å; F151-S154 VanDerWaalsContact O-CB 3.32Å; F151-S154 WeakPolarHBondContact O-CB 3.46Å; F151-S154 PolarHBondContact O-N 3.25Å; F151-S154 PolarHBondContact O-OG 3.36Å; R152-S154 VanDerWaalsContact C-N 3.33Å; S154-S158 WeakPolarHBondContact O-CB 3.24Å; S154-S158 PolarHBondContact O-N 2.92Å; S154-S158 PolarHBondContact O-OG 3.46Å; S154-Y457 VanDerWaalsContact CB-CD1 3.49Å
155	P	92.9	Very high	81.5	Confident	4 Å²	4	30 Å²	30	3%	0.026	16%	0.161	C	C	.	.	H	α-helix	trans	-58.8	-48.9	172.4	-26.8	35.1	0	0	0	113.8	V137 A142 L153 Y157 S158 L159 F200 W201 N204	V137-P155 HydrophobicContact CG1-CB 3.92Å; A142-P155 HydrophobicContact CB-CG 4.13Å; L153-P155 VanDerWaalsContact C-CD 3.46Å; L153-P155 VanDerWaalsContact C-N 3.3Å; P155-Y157 VanDerWaalsContact C-N 3.31Å; P155-Y157 PolarHBondContact O-N 2.82Å; P155-S158 PolarHBondContact O-N 2.86Å; P155-S158 VanDerWaalsContact O-N 3.09Å; P155-L159 WeakPolarHBondContact O-CG 3.27Å; P155-L159 PolarHBondContact O-N 2.79Å; P155-F200 HydrophobicContact CG-CE1 4.3Å; P155-F200 HydrophobicContact CG-CZ 3.88Å; P155-W201 HydrophobicContact CB-CH2 4.45Å; P155-W201 HydrophobicContact CB-CZ3 4.1Å; P155-W201 HydrophobicContact CG-CZ3 4.45Å; P155-N204 WeakPolarHBondContact CB-OD1 3.44Å; P155-N204 VanDerWaalsContact CD-OD1 3.3Å; P155-N204 WeakPolarHBondContact CD-OD1 3.39Å
156	A	92.6	Very high	83.1	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-55.3	-46	179.4	0	0	0	0	0	112.3	L153 Y160 N204 E207 F208	L153-A156 WeakPolarHBondContact O-CB 3.5Å; L153-A156 PolarHBondContact O-N 2.91Å; A156-Y160 WeakPolarHBondContact O-CB 3.23Å; A156-Y160 PolarHBondContact O-N 2.71Å; A156-N204 HydrophobicContact CB-CB 4.26Å; A156-N204 VanDerWaalsContact CB-O 3.29Å; A156-N204 WeakPolarHBondContact CB-O 3.5Å; A156-N204 PolarHBondContact N-OD1 3.31Å; A156-E207 HydrophobicContact CB-CB 4.11Å; A156-E207 HydrophobicContact CB-CG 4.23Å; A156-F208 HydrophobicContact CB-CB 4.09Å
157	Y	91.1	Very high	84.7	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-66.3	-38.8	177.1	-80.2	-90.9	0	0	0	112.6	L119 F151 L153 P155 Y160 L161 E207 L211 F443 V444 L454	L119-Y157 HydrophobicContact CD1-CD1 3.69Å; L119-Y157 HydrophobicContact CD1-CE1 3.84Å; L119-Y157 HydrophobicContact CD2-CE1 4.36Å; F151-Y157 AromaticContact CE1-CD2 3.74Å; F151-Y157 HydrophobicContact CE1-CD2 3.74Å; F151-Y157 HydrophobicContact CE1-CE2 4.16Å; F151-Y157 HydrophobicContact CE1-CG 4.33Å; F151-Y157 HydrophobicContact CZ-CD2 4.09Å; F151-Y157 HydrophobicContact CZ-CE2 4.03Å; L153-Y157 HydrophobicContact CB-CD2 4.23Å; L153-Y157 HydrophobicContact CB-CE2 4.28Å; L153-Y157 WeakPolarHBondContact O-CD2 3.43Å; L153-Y157 PolarHBondContact O-N 3.08Å; P155-Y157 VanDerWaalsContact C-N 3.31Å; P155-Y157 PolarHBondContact O-N 2.82Å; Y157-Y160 PolarHBondContact O-N 3.12Å; Y157-L161 WeakPolarHBondContact O-CB 3.16Å; Y157-L161 VanDerWaalsContact O-CG 3.24Å; Y157-L161 WeakPolarHBondContact O-CG 3.34Å; Y157-L161 PolarHBondContact O-N 2.88Å; Y157-E207 HydrophobicContact CE2-CG 3.68Å; Y157-E207 WeakPolarHBondContact CE2-OE1 3.4Å; Y157-E207 PolarHBondContact OH-OE1 2.9Å; Y157-L211 HydrophobicContact CD1-CD1 4.11Å; Y157-L211 HydrophobicContact CD2-CD1 4.31Å; Y157-L211 HydrophobicContact CE1-CD1 3.89Å; Y157-L211 HydrophobicContact CE1-CD2 3.93Å; Y157-L211 HydrophobicContact CE2-CD1 4.1Å; Y157-L211 HydrophobicContact CG-CD1 4.28Å; Y157-F443 HydrophobicContact CD1-CE1 4.44Å; Y157-F443 AromaticContact CE1-CD1 3.74Å; Y157-F443 HydrophobicContact CE1-CD1 3.74Å; Y157-F443 HydrophobicContact CE1-CE1 4.01Å; Y157-F443 HydrophobicContact CE2-CB 4.46Å; Y157-F443 AromaticContact CE2-CD1 3.88Å; Y157-F443 HydrophobicContact CE2-CD1 3.88Å; Y157-F443 HydrophobicContact CE2-CE1 4.28Å; Y157-F443 HydrophobicContact CE2-CG 4.42Å; Y157-F443 AromaticContact CZ-CD1 3.38Å; Y157-F443 AromaticContact CZ-CE1 3.97Å; Y157-F443 WeakPolarHBondContact OH-CB 3.33Å; Y157-F443 WeakPolarHBondContact OH-CD1 3.44Å; Y157-V444 HydrophobicContact CE1-CG2 4.02Å; Y157-V444 WeakPolarHBondContact OH-CG2 3.27Å; Y157-L454 HydrophobicContact CD1-CD2 3.94Å; Y157-L454 HydrophobicContact CG-CD1 4.42Å; Y157-L454 HydrophobicContact CG-CD2 3.96Å
158	S	91.9	Very high	86.5	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-68.8	-40	178.7	-57.4	0	0	0	0	112.1	S154 P155 A162 Y457 L458	S154-S158 WeakPolarHBondContact O-CB 3.24Å; S154-S158 PolarHBondContact O-N 2.92Å; S154-S158 PolarHBondContact O-OG 3.46Å; P155-S158 PolarHBondContact O-N 2.86Å; P155-S158 VanDerWaalsContact O-N 3.09Å; S158-A162 VanDerWaalsContact O-CB 3.31Å; S158-A162 WeakPolarHBondContact O-CB 3.37Å; S158-A162 PolarHBondContact O-N 3.41Å; S158-Y457 VanDerWaalsContact OG-CE1 3.31Å; S158-Y457 WeakPolarHBondContact OG-CE1 3.31Å; S158-L458 WeakPolarHBondContact OG-CD2 3.44Å
159	L	93.8	Very high	87.9	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-65.7	-41.3	173.5	-66	179.1	0	0	0	111.8	L134 V137 M138 P155 L163 F177 I181 F185 F208	L134-L159 HydrophobicContact CD1-CD2 3.57Å; V137-L159 HydrophobicContact CB-CD2 4.41Å; V137-L159 HydrophobicContact CG1-CD2 3.73Å; V137-L159 HydrophobicContact CG1-CG 3.82Å; M138-L159 HydrophobicContact CG-CD1 4.04Å; M138-L159 HydrophobicContact CG-CD2 4.39Å; M138-L159 HydrophobicContact SD-CD1 3.95Å; M138-L159 HydrophobicContact SD-CD2 4.49Å; P155-L159 WeakPolarHBondContact O-CG 3.27Å; P155-L159 PolarHBondContact O-N 2.79Å; L159-L163 VanDerWaalsContact O-CB 3.27Å; L159-L163 WeakPolarHBondContact O-CB 3.46Å; L159-L163 PolarHBondContact O-N 3.17Å; L159-F177 HydrophobicContact CD2-CZ 4.4Å; L159-I181 HydrophobicContact CB-CD1 4.17Å; L159-I181 HydrophobicContact CD1-CD1 4.48Å; L159-I181 HydrophobicContact CD1-CG1 4.41Å; L159-I181 HydrophobicContact CD1-CG2 4.18Å; L159-I181 HydrophobicContact CD2-CD1 4.06Å; L159-I181 HydrophobicContact CD2-CG1 4.14Å; L159-I181 HydrophobicContact CG-CD1 4.46Å; L159-F185 HydrophobicContact CD1-CE2 4.43Å; L159-F185 HydrophobicContact CD1-CZ 4.43Å; L159-F208 HydrophobicContact CB-CD2 3.8Å; L159-F208 HydrophobicContact CB-CE2 3.73Å
160	Y	92.6	Very high	89	Confident	6 Å²	6	27.5 Å²	27.5	2%	0.024	14%	0.141	C	C	.	.	H	α-helix	trans	-62.3	-49.8	175.1	170.6	-104	0	0	0	112	L117 L119 A156 Y157 A162 L163 R164 L211 V212 D215 L218	L117-Y160 PolarHBondContact O-OH 3.22Å; L119-Y160 HydrophobicContact CD1-CD1 3.9Å; L119-Y160 HydrophobicContact CD1-CE1 3.76Å; L119-Y160 HydrophobicContact CG-CE1 4.26Å; A156-Y160 WeakPolarHBondContact O-CB 3.23Å; A156-Y160 PolarHBondContact O-N 2.71Å; Y157-Y160 PolarHBondContact O-N 3.12Å; Y160-A162 VanDerWaalsContact C-N 3.32Å; Y160-A162 PolarHBondContact O-N 3.22Å; Y160-L163 PolarHBondContact O-N 3.29Å; Y160-R164 WeakPolarHBondContact O-CB 3.38Å; Y160-R164 PolarHBondContact O-N 2.87Å; Y160-L211 HydrophobicContact CD1-CD1 4.35Å; Y160-L211 HydrophobicContact CD2-CB 3.57Å; Y160-L211 HydrophobicContact CE2-CB 3.96Å; Y160-L211 HydrophobicContact CG-CB 3.88Å; Y160-L211 HydrophobicContact CG-CD1 4.01Å; Y160-L211 HydrophobicContact CG-CG 4.43Å; Y160-V212 HydrophobicContact CD2-CG2 4.46Å; Y160-D215 HydrophobicContact CE2-CB 4.07Å; Y160-D215 PolarHBondContact OH-OD2 3.5Å; Y160-L218 HydrophobicContact CD2-CD1 4.02Å; Y160-L218 HydrophobicContact CE2-CD1 3.72Å
161	L	91.4	Very high	89.3	Confident	8 Å²	8	27.7 Å²	27.7	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-62.9	-37.9	179.5	-69.7	170.1	0	0	0	111.9	L119 L121 I123 Y157 S165 L458	L119-L161 HydrophobicContact CD1-CD2 4.22Å; L121-L161 HydrophobicContact CB-CD1 4.01Å; L121-L161 HydrophobicContact CB-CD2 3.9Å; L121-L161 HydrophobicContact CD1-CD1 3.87Å; L121-L161 WeakPolarHBondContact O-CD2 3.32Å; I123-L161 HydrophobicContact CD1-CB 3.86Å; I123-L161 HydrophobicContact CG1-CB 3.94Å; I123-L161 HydrophobicContact CG2-CB 4.38Å; I123-L161 HydrophobicContact CG2-CD1 4.36Å; Y157-L161 WeakPolarHBondContact O-CB 3.16Å; Y157-L161 VanDerWaalsContact O-CG 3.24Å; Y157-L161 WeakPolarHBondContact O-CG 3.34Å; Y157-L161 PolarHBondContact O-N 2.88Å; L161-S165 WeakPolarHBondContact O-CB 3.48Å; L161-S165 PolarHBondContact O-N 3.08Å; L161-L458 HydrophobicContact CD1-CD1 3.96Å
162	A	91.7	Very high	89.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.5	-52.6	172.9	0	0	0	0	0	111.8	I123 I125 F133 S158 Y160 R164 S165 F166 F177	I123-A162 HydrophobicContact CD1-CB 4.13Å; I125-A162 HydrophobicContact CD1-CB 3.53Å; F133-A162 HydrophobicContact CE1-CB 3.7Å; F133-A162 HydrophobicContact CZ-CB 4.09Å; S158-A162 VanDerWaalsContact O-CB 3.31Å; S158-A162 WeakPolarHBondContact O-CB 3.37Å; S158-A162 PolarHBondContact O-N 3.41Å; Y160-A162 VanDerWaalsContact C-N 3.32Å; Y160-A162 PolarHBondContact O-N 3.22Å; A162-R164 VanDerWaalsContact C-N 3.29Å; A162-R164 PolarHBondContact O-N 3.41Å; A162-S165 WeakPolarHBondContact O-CB 3.25Å; A162-S165 PolarHBondContact O-N 2.9Å; A162-F166 HydrophobicContact CB-CE2 4.19Å; A162-F166 WeakPolarHBondContact O-CD2 3.41Å; A162-F166 WeakPolarHBondContact O-CG 3.46Å; A162-F166 PolarHBondContact O-N 3.18Å; A162-F177 HydrophobicContact CB-CE1 3.6Å; A162-F177 HydrophobicContact CB-CZ 3.54Å
163	L	92.3	Very high	88.9	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57.9	-41.5	178.9	179.6	68.3	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 3.46Å; L159-L163 PolarHBondContact O-N 3.17Å; Y160-L163 PolarHBondContact O-N 3.29Å; L163-F166 PolarHBondContact O-N 3.29Å; L163-H167 WeakPolarHBondContact O-CB 3.41Å; L163-H167 PolarHBondContact O-N 3.03Å; L163-S174 WeakPolarHBondContact CD1-O 3.31Å; L163-F177 HydrophobicContact CB-CD1 4.2Å; L163-F177 HydrophobicContact CB-CE1 4.27Å; L163-F177 HydrophobicContact CD1-CD1 4.18Å; L163-F178 HydrophobicContact CD1-CB 4.1Å; L163-F178 HydrophobicContact CD1-CD2 4.41Å; L163-F178 HydrophobicContact CD2-CD2 3.85Å; L163-F178 HydrophobicContact CD2-CE2 4.49Å; L163-F208 HydrophobicContact CD2-CE2 4.31Å; L163-F208 HydrophobicContact CD2-CZ 4.02Å; L163-V212 HydrophobicContact CD2-CG2 3.79Å; L163-L218 HydrophobicContact CD2-CD1 4.12Å; L163-L218 HydrophobicContact CD2-CD2 4.45Å; L163-L218 HydrophobicContact CG-CD1 4.42Å; L163-L218 HydrophobicContact CG-CD2 4.2Å; L163-Y223 HydrophobicContact CD1-CE1 4.29Å; L163-Y223 HydrophobicContact CD2-CE2 4.48Å
164	R	90	Very high	88.9	Confident	51 Å²	51	30.2 Å²	30.2	19%	0.192	15%	0.154	C	C	.	.	H	α-helix	trans	-66.6	-42.3	177.5	-170.7	50.8	156	125.7	-15	112.1	Y160 A162 H167 T168 D215 E217 L218	Y160-R164 WeakPolarHBondContact O-CB 3.38Å; Y160-R164 PolarHBondContact O-N 2.87Å; A162-R164 VanDerWaalsContact C-N 3.29Å; A162-R164 PolarHBondContact O-N 3.41Å; R164-H167 PolarHBondContact O-N 3Å; R164-T168 PolarHBondContact O-N 3.43Å; R164-T168 PolarHBondContact O-OG1 2.83Å; R164-D215 IonicContact CZ-OD1 3.64Å; R164-D215 IonicContact CZ-OD2 2.75Å; R164-D215 IonicContact NE-OD1 2.83Å; R164-D215 IonicContact NE-OD2 3.21Å; R164-D215 PolarHBondContact NE-OD2 3.17Å; R164-D215 IonicContact NH2-OD1 3.9Å; R164-D215 PolarHBondContact NH2-OD1 2.91Å; R164-D215 IonicContact NH2-OD2 2.97Å; R164-D215 PolarHBondContact NH2-OD2 3.34Å; R164-E217 IonicContact CZ-OE1 2.7Å; R164-E217 IonicContact CZ-OE2 3.35Å; R164-E217 IonicContact NH1-OE1 2.64Å; R164-E217 PolarHBondContact NH1-OE1 3.02Å; R164-E217 IonicContact NH1-OE2 2.69Å; R164-E217 PolarHBondContact NH1-OE2 3.25Å; R164-E217 IonicContact NH2-OE1 3.9Å; R164-E217 PolarHBondContact NH2-OE1 3.27Å; R164-E217 IonicContact NH2-OE2 2.7Å; R164-L218 HydrophobicContact CB-CD1 4.5Å
165	S	87.8	Confident	88.8	Confident	18 Å²	18	34 Å²	34	13%	0.126	18%	0.177	C	C	.	.	H	α-helix	trans	-60.8	-45	174.7	-163.1	0	0	0	0	111.6	I123 L161 A162 T168 H169	I123-S165 VanDerWaalsContact O-CB 3.23Å; I123-S165 WeakPolarHBondContact O-CB 3.16Å; I123-S165 PolarHBondContact O-OG 2.77Å; L161-S165 WeakPolarHBondContact O-CB 3.48Å; L161-S165 PolarHBondContact O-N 3.08Å; A162-S165 WeakPolarHBondContact O-CB 3.25Å; A162-S165 PolarHBondContact O-N 2.9Å; S165-T168 PolarHBondContact O-N 3.11Å; S165-H169 PolarHBondContact O-N 3Å; S165-H169 VanDerWaalsContact O-N 3.14Å; S165-H169 PolarHBondContact O-ND1 3.4Å
166	F	88.8	Confident	88.7	Confident	13 Å²	13	39.4 Å²	39.4	6%	0.057	20%	0.201	C	C	.	.	H	α-helix	trans	-67.5	-34.4	173.4	-60.2	-47.8	0	0	0	112.7	I125 V130 A162 L163 T168 H169 N170 K171 Y173 F177	I125-F166 HydrophobicContact CB-CE1 4.47Å; I125-F166 HydrophobicContact CB-CZ 4.05Å; I125-F166 HydrophobicContact CD1-CE2 4.35Å; I125-F166 HydrophobicContact CD1-CZ 4.08Å; I125-F166 HydrophobicContact CG2-CZ 4.34Å; V130-F166 HydrophobicContact CB-CZ 4.31Å; V130-F166 HydrophobicContact CG1-CE2 3.8Å; V130-F166 HydrophobicContact CG1-CZ 3.58Å; V130-F166 HydrophobicContact CG2-CE1 4.18Å; V130-F166 HydrophobicContact CG2-CZ 3.76Å; A162-F166 HydrophobicContact CB-CE2 4.19Å; A162-F166 WeakPolarHBondContact O-CD2 3.41Å; A162-F166 WeakPolarHBondContact O-CG 3.46Å; A162-F166 PolarHBondContact O-N 3.18Å; L163-F166 PolarHBondContact O-N 3.29Å; F166-T168 VanDerWaalsContact C-N 3.33Å; F166-T168 PolarHBondContact O-N 2.92Å; F166-H169 PolarHBondContact O-N 3.2Å; F166-N170 CarbonylContact O-C 3.48Å; F166-N170 VanDerWaalsContact O-CA 3.3Å; F166-N170 WeakPolarHBondContact O-CA 3.32Å; F166-N170 PolarHBondContact O-N 3.3Å; F166-N170 VanDerWaalsContact O-O 3.06Å; F166-K171 PolarHBondContact O-N 3.26Å; F166-Y173 AromaticContact CD1-CD1 3.79Å; F166-Y173 HydrophobicContact CD1-CD1 3.79Å; F166-Y173 HydrophobicContact CD1-CE1 4.13Å; F166-Y173 HydrophobicContact CD2-CD1 4.41Å; F166-Y173 HydrophobicContact CE1-CD1 4.04Å; F166-Y173 AromaticContact CE1-CE1 3.89Å; F166-Y173 HydrophobicContact CE1-CE1 3.89Å; F166-Y173 HydrophobicContact CE2-CE1 4.33Å; F166-Y173 HydrophobicContact CG-CD1 4.01Å; F166-Y173 HydrophobicContact CG-CE1 4.48Å; F166-Y173 HydrophobicContact CZ-CD1 4.45Å; F166-Y173 HydrophobicContact CZ-CE1 4.01Å; F166-F177 HydrophobicContact CD2-CB 4.26Å; F166-F177 AromaticContact CD2-CD1 3.87Å; F166-F177 HydrophobicContact CD2-CD1 3.87Å; F166-F177 HydrophobicContact CD2-CD2 4.2Å; F166-F177 HydrophobicContact CD2-CE1 4.22Å; F166-F177 AromaticContact CD2-CG 3.86Å; F166-F177 HydrophobicContact CD2-CG 3.86Å; F166-F177 HydrophobicContact CE2-CD1 4.1Å; F166-F177 AromaticContact CE2-CD2 3.78Å; F166-F177 HydrophobicContact CE2-CD2 3.78Å; F166-F177 HydrophobicContact CE2-CE1 4.13Å; F166-F177 AromaticContact CE2-CE2 3.82Å; F166-F177 HydrophobicContact CE2-CE2 3.82Å; F166-F177 AromaticContact CE2-CG 3.92Å; F166-F177 HydrophobicContact CE2-CG 3.92Å; F166-F177 HydrophobicContact CE2-CZ 4.01Å
167	H	88.4	Confident	88.6	Confident	7 Å²	7	39.4 Å²	39.4	3%	0.032	20%	0.201	C	C	.	.	H	α-helix	trans	-64.7	-38	176	-169.9	79.4	0	0	0	112.2	L163 R164 K171 E217 L218 S221 Y223	L163-H167 WeakPolarHBondContact O-CB 3.41Å; L163-H167 PolarHBondContact O-N 3.03Å; R164-H167 PolarHBondContact O-N 3Å; H167-K171 PolarHBondContact NE2-NZ 3.39Å; H167-K171 VanDerWaalsContact O-CE 3.3Å; H167-K171 WeakPolarHBondContact O-CE 3.33Å; H167-K171 WeakPolarHBondContact O-CG 3.37Å; H167-E217 IonicContact CD2-OE2 2.77Å; H167-L218 HydrophobicContact CB-CD2 3.54Å; H167-S221 PolarHBondContact CE1-OG 2.97Å; H167-S221 PolarHBondContact ND1-OG 3.31Å; H167-Y223 PolarHBondContact ND1-OH 3.4Å
168	T	86.9	Confident	88.8	Confident	80 Å²	80	39.6 Å²	39.6	49%	0.491	20%	0.202	S	C	.	.	H	α-helix	trans	-70.8	-41.4	178	-58.6	0	0	0	0	112.2	R164 S165 F166	R164-T168 PolarHBondContact O-N 3.43Å; R164-T168 PolarHBondContact O-OG1 2.83Å; S165-T168 PolarHBondContact O-N 3.11Å; F166-T168 VanDerWaalsContact C-N 3.33Å; F166-T168 PolarHBondContact O-N 2.92Å
169	H	82.9	Confident	88.8	Confident	141 Å²	141	42.4 Å²	42.4	65%	0.653	22%	0.222	S	C	*	.	H	α-helix	trans	-104.6	-27.4	-170	-55.3	96.9	0	0	0	115.2	S165 F166	S165-H169 PolarHBondContact O-N 3Å; S165-H169 VanDerWaalsContact O-N 3.14Å; S165-H169 PolarHBondContact O-ND1 3.4Å; F166-H169 PolarHBondContact O-N 3.2Å
170	N	84.3	Confident	88.7	Confident	62 Å²	62	48.1 Å²	48.1	33%	0.332	24%	0.243	S	C	.	.			trans	-151.5	70.3	-172.6	-167.7	-11.4	0	0	0	112.1	F166 P172 Y173 S174	F166-N170 CarbonylContact O-C 3.48Å; F166-N170 VanDerWaalsContact O-CA 3.3Å; F166-N170 WeakPolarHBondContact O-CA 3.32Å; F166-N170 PolarHBondContact O-N 3.3Å; F166-N170 VanDerWaalsContact O-O 3.06Å; N170-P172 VanDerWaalsContact C-CD 3.49Å; N170-P172 WeakPolarHBondContact OD1-CG 3.46Å; N170-Y173 VanDerWaalsContact CG-CB 3.42Å; N170-Y173 WeakPolarHBondContact O-CB 3.33Å; N170-Y173 PolarHBondContact O-N 3.17Å; N170-Y173 WeakPolarHBondContact OD1-CB 3.4Å; N170-S174 PolarHBondContact O-N 3.08Å; N170-S174 VanDerWaalsContact O-N 3.12Å
171	K	81.4	Confident	88.9	Confident	116 Å²	116	47.8 Å²	47.8	50%	0.504	24%	0.242	S	C	.	.	H	α-helix	trans	-49.6	-46.1	-176.3	-67.5	-171.7	-170.2	-130.8	0	116	F166 H167 Y173 S174	F166-K171 PolarHBondContact O-N 3.26Å; H167-K171 PolarHBondContact NE2-NZ 3.39Å; H167-K171 VanDerWaalsContact O-CE 3.3Å; H167-K171 WeakPolarHBondContact O-CE 3.33Å; H167-K171 WeakPolarHBondContact O-CG 3.37Å; K171-Y173 PolarHBondContact O-N 2.81Å; K171-S174 PolarHBondContact O-N 2.99Å; K171-S174 PolarHBondContact O-OG 3.44Å
172	P	82.4	Confident	89	Confident	93 Å²	93	49.6 Å²	49.6	60%	0.604	25%	0.25	S	S	*	.	H	α-helix	trans	-64.7	-29.7	179.4	25.9	-34.1	0	0	0	112.5	N170	N170-P172 VanDerWaalsContact C-CD 3.49Å; N170-P172 WeakPolarHBondContact OD1-CG 3.46Å
173	Y	84.3	Confident	89.1	Confident	33 Å²	33	52 Å²	52	13%	0.129	27%	0.267	C	S	.	.	H	α-helix	trans	-74.8	-34.1	176.7	-166	-113.1	0	0	0	112.6	V130 W131 F166 N170 K171 V175 Q176 F177	V130-Y173 HydrophobicContact CB-CE1 4.25Å; V130-Y173 WeakPolarHBondContact CB-OH 3.42Å; V130-Y173 HydrophobicContact CG1-CE1 3.85Å; V130-Y173 WeakPolarHBondContact CG1-OH 3.24Å; V130-Y173 HydrophobicContact CG2-CE1 3.91Å; V130-Y173 WeakPolarHBondContact CG2-OH 3.42Å; W131-Y173 HydrophobicContact CZ2-CE2 4.06Å; F166-Y173 AromaticContact CD1-CD1 3.79Å; F166-Y173 HydrophobicContact CD1-CD1 3.79Å; F166-Y173 HydrophobicContact CD1-CE1 4.13Å; F166-Y173 HydrophobicContact CD2-CD1 4.41Å; F166-Y173 HydrophobicContact CE1-CD1 4.04Å; F166-Y173 AromaticContact CE1-CE1 3.89Å; F166-Y173 HydrophobicContact CE1-CE1 3.89Å; F166-Y173 HydrophobicContact CE2-CE1 4.33Å; F166-Y173 HydrophobicContact CG-CD1 4.01Å; F166-Y173 HydrophobicContact CG-CE1 4.48Å; F166-Y173 HydrophobicContact CZ-CD1 4.45Å; F166-Y173 HydrophobicContact CZ-CE1 4.01Å; N170-Y173 VanDerWaalsContact CG-CB 3.42Å; N170-Y173 WeakPolarHBondContact O-CB 3.33Å; N170-Y173 PolarHBondContact O-N 3.17Å; N170-Y173 WeakPolarHBondContact OD1-CB 3.4Å; K171-Y173 PolarHBondContact O-N 2.81Å; Y173-V175 PolarHBondContact O-N 3Å; Y173-Q176 PolarHBondContact O-N 3.31Å; Y173-Q176 VanDerWaalsContact O-N 3.12Å; Y173-F177 WeakPolarHBondContact O-CB 3.36Å; Y173-F177 PolarHBondContact O-N 3.03Å
174	S	89	Confident	89.2	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.007	28%	0.275	C	S	.	.	H	α-helix	trans	-58.3	-32.7	174.3	78.6	0	0	0	0	113.2	L163 N170 K171 F178 Y223	L163-S174 WeakPolarHBondContact CD1-O 3.31Å; N170-S174 PolarHBondContact O-N 3.08Å; N170-S174 VanDerWaalsContact O-N 3.12Å; K171-S174 PolarHBondContact O-N 2.99Å; K171-S174 PolarHBondContact O-OG 3.44Å; S174-F178 WeakPolarHBondContact O-CB 3.27Å; S174-F178 PolarHBondContact O-N 3.21Å; S174-Y223 WeakPolarHBondContact CB-OH 3.44Å; S174-Y223 PolarHBondContact OG-OH 2.9Å
175	V	88.9	Confident	89.5	Confident	80 Å²	80	51 Å²	51	49%	0.485	27%	0.266	S	S	.	.	H	α-helix	trans	-70.3	-42.2	176.1	-179.5	0	0	0	0	111.4	Y173 F178 S179 Y223	Y173-V175 PolarHBondContact O-N 3Å; V175-F178 PolarHBondContact O-N 2.89Å; V175-S179 WeakPolarHBondContact O-CB 3.37Å; V175-S179 PolarHBondContact O-N 2.87Å; V175-Y223 HydrophobicContact CG2-CD1 4.47Å; V175-Y223 HydrophobicContact CG2-CE1 3.99Å
176	Q	89.3	Confident	89.8	Confident	117 Å²	117	54.5 Å²	54.5	55%	0.547	28%	0.279	S	S	.	.	H	α-helix	trans	-64.9	-42.6	175.7	-63.4	-178.5	4.4	0	0	111.3	Y173 S179 R180	Y173-Q176 PolarHBondContact O-N 3.31Å; Y173-Q176 VanDerWaalsContact O-N 3.12Å; Q176-S179 PolarHBondContact O-N 2.85Å; Q176-R180 PolarHBondContact O-N 3.01Å
177	F	92.1	Very high	90.1	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.2	-47.9	175.7	-171.3	-107.8	0	0	0	111.5	V130 W131 F133 L134 L159 A162 L163 F166 Y173 R180 I181	V130-F177 HydrophobicContact CG1-CD2 3.73Å; V130-F177 HydrophobicContact CG1-CE2 3.73Å; W131-F177 HydrophobicContact CZ3-CD2 4.39Å; F133-F177 HydrophobicContact CD1-CZ 4.49Å; F133-F177 HydrophobicContact CE1-CZ 4.34Å; L134-F177 HydrophobicContact CB-CE2 4.18Å; L134-F177 HydrophobicContact CD1-CE2 3.87Å; L134-F177 HydrophobicContact CD1-CZ 4Å; L134-F177 HydrophobicContact CD2-CD2 4.39Å; L134-F177 HydrophobicContact CD2-CE2 4.27Å; L134-F177 HydrophobicContact CG-CE2 4.33Å; L159-F177 HydrophobicContact CD2-CZ 4.4Å; A162-F177 HydrophobicContact CB-CE1 3.6Å; A162-F177 HydrophobicContact CB-CZ 3.54Å; L163-F177 HydrophobicContact CB-CD1 4.2Å; L163-F177 HydrophobicContact CB-CE1 4.27Å; L163-F177 HydrophobicContact CD1-CD1 4.18Å; F166-F177 HydrophobicContact CD2-CB 4.26Å; F166-F177 AromaticContact CD2-CD1 3.87Å; F166-F177 HydrophobicContact CD2-CD1 3.87Å; F166-F177 HydrophobicContact CD2-CD2 4.2Å; F166-F177 HydrophobicContact CD2-CE1 4.22Å; F166-F177 AromaticContact CD2-CG 3.86Å; F166-F177 HydrophobicContact CD2-CG 3.86Å; F166-F177 HydrophobicContact CE2-CD1 4.1Å; F166-F177 AromaticContact CE2-CD2 3.78Å; F166-F177 HydrophobicContact CE2-CD2 3.78Å; F166-F177 HydrophobicContact CE2-CE1 4.13Å; F166-F177 AromaticContact CE2-CE2 3.82Å; F166-F177 HydrophobicContact CE2-CE2 3.82Å; F166-F177 AromaticContact CE2-CG 3.92Å; F166-F177 HydrophobicContact CE2-CG 3.92Å; F166-F177 HydrophobicContact CE2-CZ 4.01Å; Y173-F177 WeakPolarHBondContact O-CB 3.36Å; Y173-F177 PolarHBondContact O-N 3.03Å; F177-R180 PolarHBondContact O-N 3Å; F177-I181 HydrophobicContact CD1-CD1 3.75Å; F177-I181 HydrophobicContact CE1-CD1 3.57Å; F177-I181 HydrophobicContact CZ-CD1 4.22Å; F177-I181 WeakPolarHBondContact O-CG1 3.46Å; F177-I181 PolarHBondContact O-N 3.08Å
178	F	93.8	Very high	90.4	Very high	5 Å²	5	58 Å²	58	2%	0.022	30%	0.295	C	S	.	.	H	α-helix	trans	-59.3	-48.3	175.4	-171.1	-79.3	0	0	0	112.5	L163 S174 V175 R180 I181 E182 F208 V212 Y223 G224 I226	L163-F178 HydrophobicContact CD1-CB 4.1Å; L163-F178 HydrophobicContact CD1-CD2 4.41Å; L163-F178 HydrophobicContact CD2-CD2 3.85Å; L163-F178 HydrophobicContact CD2-CE2 4.49Å; S174-F178 WeakPolarHBondContact O-CB 3.27Å; S174-F178 PolarHBondContact O-N 3.21Å; V175-F178 PolarHBondContact O-N 2.89Å; F178-R180 PolarHBondContact O-N 3.16Å; F178-I181 WeakPolarHBondContact O-CB 3.41Å; F178-I181 PolarHBondContact O-N 2.82Å; F178-E182 HydrophobicContact CE1-CB 4.41Å; F178-E182 PolarHBondContact O-N 2.64Å; F178-F208 HydrophobicContact CD2-CE1 4.4Å; F178-F208 HydrophobicContact CD2-CZ 4.22Å; F178-F208 AromaticContact CE2-CE1 3.88Å; F178-F208 HydrophobicContact CE2-CE1 3.88Å; F178-F208 HydrophobicContact CE2-CZ 4.1Å; F178-V212 HydrophobicContact CE2-CG1 4.28Å; F178-Y223 HydrophobicContact CB-CD1 3.77Å; F178-Y223 HydrophobicContact CB-CE1 4.21Å; F178-Y223 HydrophobicContact CB-CG 4.38Å; F178-Y223 HydrophobicContact CD1-CD1 4.43Å; F178-Y223 HydrophobicContact CD1-CG 4.45Å; F178-Y223 HydrophobicContact CD2-CD1 4.09Å; F178-Y223 HydrophobicContact CD2-CD2 4.31Å; F178-Y223 AromaticContact CD2-CG 3.82Å; F178-Y223 HydrophobicContact CD2-CG 3.82Å; F178-Y223 HydrophobicContact CE2-CG 4.24Å; F178-Y223 AromaticContact CG-CD1 3.83Å; F178-Y223 HydrophobicContact CG-CD1 3.83Å; F178-Y223 AromaticContact CG-CG 3.95Å; F178-Y223 HydrophobicContact CG-CG 3.95Å; F178-G224 VanDerWaalsContact CE1-O 3.25Å; F178-G224 WeakPolarHBondContact CE1-O 3.27Å; F178-G224 WeakPolarHBondContact CZ-O 3.32Å; F178-I226 HydrophobicContact CZ-CB 4.29Å; F178-I226 HydrophobicContact CZ-CG2 4.29Å
179	S	92.3	Very high	90.7	Very high	58 Å²	58	54.5 Å²	54.5	41%	0.406	28%	0.275	S	S	.	.	H	α-helix	trans	-62.3	-31.2	179.8	-174.9	0	0	0	0	112.3	V175 Q176 S183	V175-S179 WeakPolarHBondContact O-CB 3.37Å; V175-S179 PolarHBondContact O-N 2.87Å; Q176-S179 PolarHBondContact O-N 2.85Å; S179-S183 WeakPolarHBondContact O-CB 3.24Å; S179-S183 PolarHBondContact O-N 2.87Å; S179-S183 PolarHBondContact O-OG 2.94Å
180	R	93	Very high	91.2	Very high	121 Å²	121	53 Å²	53	46%	0.457	27%	0.268	S	S	.	.	H	α-helix	trans	-73.6	-35.6	173	-161.3	67.3	176.2	107.5	-0.1	112.4	W131 L134 Q176 F177 F178 S183 N184	W131-R180 HydrophobicContact CE3-CG 4.26Å; W131-R180 HydrophobicContact CH2-CB 4.38Å; W131-R180 HydrophobicContact CZ3-CB 3.77Å; W131-R180 HydrophobicContact CZ3-CG 3.82Å; L134-R180 HydrophobicContact CD2-CB 3.81Å; L134-R180 HydrophobicContact CD2-CG 3.53Å; Q176-R180 PolarHBondContact O-N 3.01Å; F177-R180 PolarHBondContact O-N 3Å; F178-R180 PolarHBondContact O-N 3.16Å; R180-S183 PolarHBondContact O-N 3.43Å; R180-N184 PolarHBondContact NH1-ND2 2.79Å; R180-N184 PolarHBondContact O-N 2.65Å; R180-N184 VanDerWaalsContact O-N 3.17Å; R180-N184 PolarHBondContact O-ND2 3.46Å
181	I	95.1	Very high	91.5	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.9	-53.5	170.5	-69.6	165.1	0	0	0	110.4	L134 M138 L159 F177 F178 S183 N184 F185 F208 I226	L134-I181 HydrophobicContact CD1-CD1 4.46Å; L134-I181 HydrophobicContact CD1-CG1 3.69Å; M138-I181 HydrophobicContact SD-CG1 4.48Å; M138-I181 HydrophobicContact SD-CG2 4.38Å; L159-I181 HydrophobicContact CB-CD1 4.17Å; L159-I181 HydrophobicContact CD1-CD1 4.48Å; L159-I181 HydrophobicContact CD1-CG1 4.41Å; L159-I181 HydrophobicContact CD1-CG2 4.18Å; L159-I181 HydrophobicContact CD2-CD1 4.06Å; L159-I181 HydrophobicContact CD2-CG1 4.14Å; L159-I181 HydrophobicContact CG-CD1 4.46Å; F177-I181 HydrophobicContact CD1-CD1 3.75Å; F177-I181 HydrophobicContact CE1-CD1 3.57Å; F177-I181 HydrophobicContact CZ-CD1 4.22Å; F177-I181 WeakPolarHBondContact O-CG1 3.46Å; F177-I181 PolarHBondContact O-N 3.08Å; F178-I181 WeakPolarHBondContact O-CB 3.41Å; F178-I181 PolarHBondContact O-N 2.82Å; I181-S183 VanDerWaalsContact C-N 3.27Å; I181-S183 PolarHBondContact O-N 3.41Å; I181-N184 PolarHBondContact O-N 3.22Å; I181-F185 HydrophobicContact CG2-CD2 3.64Å; I181-F185 HydrophobicContact CG2-CE2 3.41Å; I181-F185 VanDerWaalsContact CG2-CE2 3.41Å; I181-F185 WeakPolarHBondContact O-CD2 3.42Å; I181-F185 PolarHBondContact O-N 3.12Å; I181-F208 HydrophobicContact CD1-CE2 4.29Å; I181-F208 HydrophobicContact CD1-CZ 3.89Å; I181-F208 HydrophobicContact CG2-CD1 4.44Å; I181-F208 HydrophobicContact CG2-CE1 3.88Å; I181-F208 HydrophobicContact CG2-CZ 4.13Å; I181-I226 HydrophobicContact CG2-CD1 4.3Å
182	E	94.5	Very high	92	Very high	46 Å²	46	51.3 Å²	51.3	22%	0.215	26%	0.261	C	S	.	.	H	α-helix	trans	-53.1	-44.3	176.3	-178.5	177.4	-144.7	0	0	111.7	F178 N184 F185 K186 E229	F178-E182 HydrophobicContact CE1-CB 4.41Å; F178-E182 PolarHBondContact O-N 2.64Å; E182-N184 VanDerWaalsContact C-N 3.31Å; E182-N184 PolarHBondContact O-N 2.77Å; E182-F185 PolarHBondContact O-N 2.84Å; E182-K186 WeakPolarHBondContact O-CB 3.36Å; E182-K186 PolarHBondContact O-N 2.98Å; E182-E229 HydrophobicContact CG-CG 4.29Å
183	S	94.1	Very high	92.4	Very high	50 Å²	50	51.3 Å²	51.3	35%	0.35	26%	0.263	S	S	.	.	H	α-helix	trans	-61.5	-33.5	176.2	-61.2	0	0	0	0	114	S179 R180 I181 Q187	S179-S183 WeakPolarHBondContact O-CB 3.24Å; S179-S183 PolarHBondContact O-N 2.87Å; S179-S183 PolarHBondContact O-OG 2.94Å; R180-S183 PolarHBondContact O-N 3.43Å; I181-S183 VanDerWaalsContact C-N 3.27Å; I181-S183 PolarHBondContact O-N 3.41Å; S183-Q187 PolarHBondContact O-N 2.89Å; S183-Q187 VanDerWaalsContact O-N 3.09Å
184	N	94.7	Very high	92.8	Very high	30 Å²	30	51.5 Å²	51.5	16%	0.16	27%	0.27	C	S	.	.	H	α-helix	trans	-79.8	-38.6	178.9	-79.7	-95.2	0	0	0	111.7	M138 R180 I181 E182 K186 Q187 I188	M138-N184 HydrophobicContact CE-CB 3.38Å; M138-N184 WeakPolarHBondContact CE-ND2 3.48Å; M138-N184 HydrophobicContact SD-CB 3.78Å; R180-N184 PolarHBondContact NH1-ND2 2.79Å; R180-N184 PolarHBondContact O-N 2.65Å; R180-N184 VanDerWaalsContact O-N 3.17Å; R180-N184 PolarHBondContact O-ND2 3.46Å; I181-N184 PolarHBondContact O-N 3.22Å; E182-N184 VanDerWaalsContact C-N 3.31Å; E182-N184 PolarHBondContact O-N 2.77Å; N184-K186 VanDerWaalsContact C-N 3.28Å; N184-K186 PolarHBondContact O-N 3.07Å; N184-Q187 WeakPolarHBondContact O-CB 3.36Å; N184-Q187 PolarHBondContact O-N 2.75Å; N184-Q187 VanDerWaalsContact O-N 3.1Å; N184-I188 WeakPolarHBondContact O-CG1 3.27Å; N184-I188 PolarHBondContact O-N 3.48Å
185	F	95.6	Very high	93	Very high	1 Å²	1	53.2 Å²	53.2	0%	0.004	28%	0.277	C	S	.	.	H	α-helix	trans	-62.1	-38	171.4	-74.7	-62.4	0	0	0	112.2	L159 I181 E182 I188 A189 W201 A205 F208 I226 E229 I233	L159-F185 HydrophobicContact CD1-CE2 4.43Å; L159-F185 HydrophobicContact CD1-CZ 4.43Å; I181-F185 HydrophobicContact CG2-CD2 3.64Å; I181-F185 HydrophobicContact CG2-CE2 3.41Å; I181-F185 VanDerWaalsContact CG2-CE2 3.41Å; I181-F185 WeakPolarHBondContact O-CD2 3.42Å; I181-F185 PolarHBondContact O-N 3.12Å; E182-F185 PolarHBondContact O-N 2.84Å; F185-I188 HydrophobicContact CD1-CD1 4.15Å; F185-I188 PolarHBondContact O-N 3.16Å; F185-A189 PolarHBondContact O-N 2.9Å; F185-W201 HydrophobicContact CE1-CE3 4.03Å; F185-A205 HydrophobicContact CD1-CB 3.74Å; F185-A205 HydrophobicContact CE1-CB 3.51Å; F185-A205 HydrophobicContact CE2-CB 4.48Å; F185-A205 HydrophobicContact CG-CB 4.34Å; F185-A205 HydrophobicContact CZ-CB 3.9Å; F185-F208 HydrophobicContact CE2-CD1 4.47Å; F185-I226 HydrophobicContact CD2-CD1 3.38Å; F185-I226 HydrophobicContact CD2-CG1 4.3Å; F185-I226 HydrophobicContact CE2-CD1 3.68Å; F185-I226 HydrophobicContact CG-CD1 4.28Å; F185-E229 HydrophobicContact CB-CB 4.14Å; F185-I233 HydrophobicContact CB-CD1 4.22Å; F185-I233 HydrophobicContact CD1-CD1 3.82Å; F185-I233 HydrophobicContact CG-CD1 4.44Å
186	K	94.8	Very high	93.2	Very high	91 Å²	91	52.2 Å²	52.2	40%	0.396	27%	0.269	S	S	.	.	H	α-helix	trans	-60.4	-42.4	169.6	-177.4	176.9	175.9	-177.1	0	112.6	E182 N184 A189 Q190 E229	E182-K186 WeakPolarHBondContact O-CB 3.36Å; E182-K186 PolarHBondContact O-N 2.98Å; N184-K186 VanDerWaalsContact C-N 3.28Å; N184-K186 PolarHBondContact O-N 3.07Å; K186-A189 PolarHBondContact O-N 2.97Å; K186-Q190 WeakPolarHBondContact O-CG 3.37Å; K186-Q190 PolarHBondContact O-N 2.91Å; K186-E229 WeakPolarHBondContact CA-OE2 3.48Å; K186-E229 HydrophobicContact CB-CG 4.28Å; K186-E229 WeakPolarHBondContact CB-OE2 3.36Å
187	Q	94.3	Very high	93.4	Very high	76 Å²	76	47.7 Å²	47.7	36%	0.355	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-45.7	176.2	-171.8	177.5	-13.1	0	0	111.4	S183 N184 A189 Q190 E191	S183-Q187 PolarHBondContact O-N 2.89Å; S183-Q187 VanDerWaalsContact O-N 3.09Å; N184-Q187 WeakPolarHBondContact O-CB 3.36Å; N184-Q187 PolarHBondContact O-N 2.75Å; N184-Q187 VanDerWaalsContact O-N 3.1Å; Q187-A189 VanDerWaalsContact C-N 3.31Å; Q187-A189 PolarHBondContact O-N 3.49Å; Q187-Q190 PolarHBondContact O-N 2.98Å; Q187-E191 VanDerWaalsContact CG-CD 3.41Å; Q187-E191 HydrophobicContact CG-CG 4.17Å; Q187-E191 VanDerWaalsContact CG-OE2 3.32Å; Q187-E191 WeakPolarHBondContact CG-OE2 3.28Å; Q187-E191 PolarHBondContact NE2-OE1 3.14Å; Q187-E191 PolarHBondContact NE2-OE2 2.82Å; Q187-E191 WeakPolarHBondContact O-CB 3.49Å; Q187-E191 PolarHBondContact O-N 3.45Å
188	I	93.9	Very high	93.6	Very high	17 Å²	17	47.7 Å²	47.7	9%	0.087	25%	0.249	C	C	.	.	H	α-helix	trans	-55.2	-45.6	174.6	-70.4	158.3	0	0	0	110.8	N184 F185 Q190 C192 L198 W201 I233	N184-I188 WeakPolarHBondContact O-CG1 3.27Å; N184-I188 PolarHBondContact O-N 3.48Å; F185-I188 HydrophobicContact CD1-CD1 4.15Å; F185-I188 PolarHBondContact O-N 3.16Å; I188-Q190 PolarHBondContact O-N 2.69Å; I188-C192 HydrophobicContact CG2-CB 4.24Å; I188-C192 WeakPolarHBondContact O-CB 3.27Å; I188-C192 PolarHBondContact O-N 3.42Å; I188-L198 HydrophobicContact CG2-CD2 4.41Å; I188-W201 HydrophobicContact CD1-CB 4.42Å; I188-W201 HydrophobicContact CD1-CD2 3.73Å; I188-W201 HydrophobicContact CD1-CE3 4.26Å; I188-W201 HydrophobicContact CD1-CG 3.78Å; I188-W201 HydrophobicContact CG1-CG 4.42Å; I188-W201 HydrophobicContact CG2-CB 3.84Å; I188-W201 HydrophobicContact CG2-CG 3.88Å; I188-I233 HydrophobicContact CG2-CD1 4.43Å; I188-I233 HydrophobicContact CG2-CG1 4.44Å
189	A	94.1	Very high	93.7	Very high	7 Å²	7	47.5 Å²	47.5	6%	0.058	25%	0.247	C	C	.	.	H	α-helix	trans	-64.4	-22.6	178.1	0	0	0	0	0	114.5	F185 K186 Q187 R232 I233 R236	F185-A189 PolarHBondContact O-N 2.9Å; K186-A189 PolarHBondContact O-N 2.97Å; Q187-A189 VanDerWaalsContact C-N 3.31Å; Q187-A189 PolarHBondContact O-N 3.49Å; A189-R232 HydrophobicContact CB-CB 3.73Å; A189-I233 HydrophobicContact CB-CG1 3.81Å; A189-R236 WeakPolarHBondContact O-CG 3.31Å
190	Q	93.3	Very high	93.8	Very high	110 Å²	110	44.8 Å²	44.8	51%	0.514	23%	0.229	S	C	.	.	H	α-helix	trans	-97.5	-41	-177.3	-71.1	179.7	-19.2	0	0	112.7	K186 Q187 I188 R236	K186-Q190 WeakPolarHBondContact O-CG 3.37Å; K186-Q190 PolarHBondContact O-N 2.91Å; Q187-Q190 PolarHBondContact O-N 2.98Å; I188-Q190 PolarHBondContact O-N 2.69Å; Q190-R236 PolarHBondContact O-NH1 2.77Å; Q190-R236 PolarHBondContact O-NH2 3.12Å
191	E	91.4	Very high	93.9	Very high	128 Å²	128	39 Å²	39	60%	0.598	21%	0.207	S	C	*	.	H	α-helix	trans	-99.3	-34.4	-170.3	-65.2	178.4	-176	0	0	113.1	Q187 R236	Q187-E191 VanDerWaalsContact CG-CD 3.41Å; Q187-E191 HydrophobicContact CG-CG 4.17Å; Q187-E191 VanDerWaalsContact CG-OE2 3.32Å; Q187-E191 WeakPolarHBondContact CG-OE2 3.28Å; Q187-E191 PolarHBondContact NE2-OE1 3.14Å; Q187-E191 PolarHBondContact NE2-OE2 2.82Å; Q187-E191 WeakPolarHBondContact O-CB 3.49Å; Q187-E191 PolarHBondContact O-N 3.45Å; E191-R236 PolarHBondContact O-NH2 2.8Å
192	C	91.1	Very high	93.9	Very high	14 Å²	14	39 Å²	39	10%	0.095	21%	0.207	C	C	.	.			trans	-68.9	137.2	-173.4	-166.3	0	0	0	0	112.4	I188 L198 R236	I188-C192 HydrophobicContact CG2-CB 4.24Å; I188-C192 WeakPolarHBondContact O-CB 3.27Å; I188-C192 PolarHBondContact O-N 3.42Å; C192-L198 HydrophobicContact CB-CD2 3.93Å; C192-L198 HydrophobicContact CB-CG 4.12Å; C192-R236 PolarHBondContact O-NE 3.32Å; C192-R236 PolarHBondContact O-NH2 3.18Å
193	S	91.3	Very high	93.9	Very high	92 Å²	92	36.9 Å²	36.9	64%	0.643	20%	0.197	S	C	*	.			trans	-122.3	-9.7	-179.2	54.8	0	0	0	0	113.7	V240	S193-V240 WeakPolarHBondContact O-CG1 3.43Å
194	S	93	Very high	93.9	Very high	38 Å²	38	34.5 Å²	34.5	27%	0.266	18%	0.18	S	C	.	.			trans	-81.4	125.2	178.9	166.2	0	0	0	0	110.1	D196 D197 L198	S194-D196 PolarHBondContact O-N 3.07Å; S194-D197 WeakPolarHBondContact CB-OD2 3.45Å; S194-D197 VanDerWaalsContact OG-CG 3.31Å; S194-D197 PolarHBondContact OG-N 2.98Å; S194-D197 PolarHBondContact OG-OD2 3.29Å; S194-L198 WeakPolarHBondContact O-CB 3.35Å; S194-L198 WeakPolarHBondContact O-CD1 3.33Å; S194-L198 VanDerWaalsContact O-CG 3.28Å; S194-L198 WeakPolarHBondContact O-CG 3.46Å; S194-L198 PolarHBondContact O-N 2.89Å
195	K	93.6	Very high	93.9	Very high	37 Å²	37	33.1 Å²	33.1	16%	0.161	17%	0.173	C	C	.	.	H	α-helix	trans	-60.7	-38.4	177.7	78.6	174	-168	166.7	0	111.1	L198 I199 L237 V240 L241 T272 T273	K195-L198 PolarHBondContact O-N 3.42Å; K195-I199 WeakPolarHBondContact O-CD1 3.45Å; K195-I199 WeakPolarHBondContact O-CG1 3.48Å; K195-I199 PolarHBondContact O-N 3.41Å; K195-L237 HydrophobicContact CB-CD1 4.13Å; K195-V240 HydrophobicContact CB-CG1 4.27Å; K195-L241 HydrophobicContact CB-CD2 4.1Å; K195-L241 HydrophobicContact CD-CD2 3.89Å; K195-T272 PolarHBondContact NZ-OG1 3.3Å; K195-T273 PolarHBondContact NZ-OG1 2.75Å
196	D	92.6	Very high	93.8	Very high	59 Å²	59	33.7 Å²	33.7	32%	0.316	18%	0.177	S	C	.	.	H	α-helix	trans	-78.7	-34.4	-169.8	-59.2	-53.7	0	0	0	111.4	S194 F200 Q276	S194-D196 PolarHBondContact O-N 3.07Å; D196-F200 WeakPolarHBondContact O-CB 3.48Å; D196-F200 PolarHBondContact O-N 2.91Å; D196-Q276 HydrophobicContact CB-CG 4.13Å; D196-Q276 WeakPolarHBondContact OD1-CG 2.94Å
197	D	93.1	Very high	93.7	Very high	22 Å²	22	29.7 Å²	29.7	12%	0.118	16%	0.159	C	C	.	.	H	α-helix	trans	-70.9	-38.9	170.6	-61.1	-49.4	0	0	0	111.4	A143 S194 F200 W201	A143-D197 HydrophobicContact CB-CB 4.37Å; A143-D197 WeakPolarHBondContact CB-OD1 3.35Å; S194-D197 WeakPolarHBondContact CB-OD2 3.45Å; S194-D197 VanDerWaalsContact OG-CG 3.31Å; S194-D197 PolarHBondContact OG-N 2.98Å; S194-D197 PolarHBondContact OG-OD2 3.29Å; D197-F200 PolarHBondContact O-N 3.34Å; D197-W201 WeakPolarHBondContact O-CB 3.42Å; D197-W201 PolarHBondContact O-N 3.5Å
198	L	95.6	Very high	93.7	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.5	-38.8	175.1	-77.7	165.4	0	0	0	112.1	I188 C192 S194 K195 L202 I233 R236 L237 V240	I188-L198 HydrophobicContact CG2-CD2 4.41Å; C192-L198 HydrophobicContact CB-CD2 3.93Å; C192-L198 HydrophobicContact CB-CG 4.12Å; S194-L198 WeakPolarHBondContact O-CB 3.35Å; S194-L198 WeakPolarHBondContact O-CD1 3.33Å; S194-L198 VanDerWaalsContact O-CG 3.28Å; S194-L198 WeakPolarHBondContact O-CG 3.46Å; S194-L198 PolarHBondContact O-N 2.89Å; K195-L198 PolarHBondContact O-N 3.42Å; L198-L202 WeakPolarHBondContact O-CB 3.43Å; L198-L202 PolarHBondContact O-N 2.88Å; L198-I233 HydrophobicContact CD2-CG2 4.07Å; L198-R236 HydrophobicContact CD1-CG 3.89Å; L198-R236 HydrophobicContact CD2-CB 4.31Å; L198-R236 HydrophobicContact CD2-CG 3.86Å; L198-L237 HydrophobicContact CB-CB 4.17Å; L198-L237 HydrophobicContact CB-CD1 3.94Å; L198-V240 HydrophobicContact CD1-CB 4.42Å; L198-V240 HydrophobicContact CD1-CG2 3.88Å
199	I	95.5	Very high	93.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.2	-46.5	172.7	-70.9	161.3	0	0	0	110.9	K195 W201 L202 A203 L237 T273 Q276 A277 C280	K195-I199 WeakPolarHBondContact O-CD1 3.45Å; K195-I199 WeakPolarHBondContact O-CG1 3.48Å; K195-I199 PolarHBondContact O-N 3.41Å; I199-W201 PolarHBondContact O-N 3.23Å; I199-L202 PolarHBondContact O-N 2.61Å; I199-A203 PolarHBondContact O-N 2.98Å; I199-L237 HydrophobicContact CD1-CD1 4.34Å; I199-L237 HydrophobicContact CG1-CD1 3.88Å; I199-L237 HydrophobicContact CG1-CD2 3.6Å; I199-L237 HydrophobicContact CG1-CG 4.4Å; I199-T273 HydrophobicContact CD1-CG2 3.94Å; I199-Q276 HydrophobicContact CB-CG 4.3Å; I199-Q276 HydrophobicContact CD1-CB 4.21Å; I199-Q276 HydrophobicContact CD1-CG 4.04Å; I199-Q276 HydrophobicContact CG2-CG 4.02Å; I199-A277 HydrophobicContact CG2-CB 4.23Å; I199-C280 HydrophobicContact CG2-CB 4.1Å
200	F	94.4	Very high	93.3	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.009	14%	0.142	C	C	.	.	H	α-helix	trans	-60.2	-44.4	177.8	174.9	-91.7	0	0	0	112.4	A142 A143 R152 P155 D196 D197 N204	A142-F200 HydrophobicContact CB-CE1 4.3Å; A142-F200 HydrophobicContact CB-CZ 4.15Å; A142-F200 WeakPolarHBondContact O-CZ 3.25Å; A143-F200 HydrophobicContact CB-CB 4.21Å; A143-F200 HydrophobicContact CB-CD1 3.38Å; A143-F200 HydrophobicContact CB-CD2 4.47Å; A143-F200 HydrophobicContact CB-CE1 3.76Å; A143-F200 HydrophobicContact CB-CG 3.77Å; A143-F200 HydrophobicContact CB-CZ 4.44Å; R152-F200 HydrophobicContact CB-CE2 4.3Å; R152-F200 WeakPolarHBondContact O-CE2 3.43Å; P155-F200 HydrophobicContact CG-CE1 4.3Å; P155-F200 HydrophobicContact CG-CZ 3.88Å; D196-F200 WeakPolarHBondContact O-CB 3.48Å; D196-F200 PolarHBondContact O-N 2.91Å; D197-F200 PolarHBondContact O-N 3.34Å; F200-N204 PolarHBondContact O-N 2.78Å; F200-N204 PolarHBondContact O-ND2 3.34Å
201	W	95.3	Very high	93.1	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-74.1	-31.8	178.3	-73.2	126.2	0	0	0	113.2	M138 N140 A142 P155 F185 I188 D197 I199 N204 A205	M138-W201 HydrophobicContact CB-CH2 4.36Å; N140-W201 PolarHBondContact OD1-NE1 2.88Å; A142-W201 HydrophobicContact CB-CH2 4.44Å; P155-W201 HydrophobicContact CB-CH2 4.45Å; P155-W201 HydrophobicContact CB-CZ3 4.1Å; P155-W201 HydrophobicContact CG-CZ3 4.45Å; F185-W201 HydrophobicContact CE1-CE3 4.03Å; I188-W201 HydrophobicContact CD1-CB 4.42Å; I188-W201 HydrophobicContact CD1-CD2 3.73Å; I188-W201 HydrophobicContact CD1-CE3 4.26Å; I188-W201 HydrophobicContact CD1-CG 3.78Å; I188-W201 HydrophobicContact CG1-CG 4.42Å; I188-W201 HydrophobicContact CG2-CB 3.84Å; I188-W201 HydrophobicContact CG2-CG 3.88Å; D197-W201 WeakPolarHBondContact O-CB 3.42Å; D197-W201 PolarHBondContact O-N 3.5Å; I199-W201 PolarHBondContact O-N 3.23Å; W201-N204 HydrophobicContact CE3-CB 4.13Å; W201-N204 HydrophobicContact CZ3-CB 4.37Å; W201-N204 PolarHBondContact O-N 3.21Å; W201-A205 WeakPolarHBondContact O-CB 3.12Å; W201-A205 PolarHBondContact O-N 2.92Å
202	L	95.8	Very high	93	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62.7	-44.1	171.4	-177.9	67.7	0	0	0	111.5	L198 I199 S206 I230 I233 F234 L237 L282 L286	L198-L202 WeakPolarHBondContact O-CB 3.43Å; L198-L202 PolarHBondContact O-N 2.88Å; I199-L202 PolarHBondContact O-N 2.61Å; L202-S206 WeakPolarHBondContact O-CB 3.47Å; L202-S206 PolarHBondContact O-N 3.11Å; L202-S206 PolarHBondContact O-OG 2.77Å; L202-I230 HydrophobicContact CD1-CG2 3.94Å; L202-I233 HydrophobicContact CB-CG2 3.88Å; L202-I233 HydrophobicContact CD1-CB 4.41Å; L202-I233 HydrophobicContact CD1-CG2 4.23Å; L202-F234 HydrophobicContact CD1-CB 4.03Å; L202-F234 HydrophobicContact CD2-CD2 3.91Å; L202-L237 HydrophobicContact CD2-CD2 4.24Å; L202-L282 HydrophobicContact CB-CD1 4.32Å; L202-L282 HydrophobicContact CD2-CD1 3.82Å; L202-L282 HydrophobicContact CD2-CD2 4.12Å; L202-L282 HydrophobicContact CG-CD1 3.8Å; L202-L286 HydrophobicContact CG-CD1 4.5Å
203	A	94.3	Very high	92.8	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.9	-48.9	176	0	0	0	0	0	111.1	L153 I199 S206 E207 C280 L282	L153-A203 HydrophobicContact CD2-CB 3.86Å; I199-A203 PolarHBondContact O-N 2.98Å; A203-S206 PolarHBondContact O-OG 3.45Å; A203-S206 VanDerWaalsContact O-OG 3.11Å; A203-E207 WeakPolarHBondContact O-CB 3.36Å; A203-E207 PolarHBondContact O-N 3.31Å; A203-C280 HydrophobicContact CB-CB 4.14Å; A203-C280 WeakPolarHBondContact CB-O 3.39Å; A203-L282 HydrophobicContact CB-CB 4.2Å; A203-L282 HydrophobicContact CB-CD1 4.04Å
204	N	93.9	Very high	92.5	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-66.6	-37.7	178.6	-82.8	-86.2	0	0	0	113.6	R152 L153 P155 A156 F200 W201 F208	R152-N204 PolarHBondContact O-ND2 2.69Å; L153-N204 WeakPolarHBondContact CA-OD1 3.49Å; L153-N204 PolarHBondContact O-OD1 3.47Å; P155-N204 WeakPolarHBondContact CB-OD1 3.44Å; P155-N204 VanDerWaalsContact CD-OD1 3.3Å; P155-N204 WeakPolarHBondContact CD-OD1 3.39Å; A156-N204 HydrophobicContact CB-CB 4.26Å; A156-N204 VanDerWaalsContact CB-O 3.29Å; A156-N204 WeakPolarHBondContact CB-O 3.5Å; A156-N204 PolarHBondContact N-OD1 3.31Å; F200-N204 PolarHBondContact O-N 2.78Å; F200-N204 PolarHBondContact O-ND2 3.34Å; W201-N204 HydrophobicContact CE3-CB 4.13Å; W201-N204 HydrophobicContact CZ3-CB 4.37Å; W201-N204 PolarHBondContact O-N 3.21Å; N204-F208 VanDerWaalsContact O-CB 3.24Å; N204-F208 WeakPolarHBondContact O-CB 3.3Å; N204-F208 PolarHBondContact O-N 3.34Å
205	A	95	Very high	92.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-67.4	-44	178	0	0	0	0	0	112	F185 W201 F208 N209 I230 I233	F185-A205 HydrophobicContact CD1-CB 3.74Å; F185-A205 HydrophobicContact CE1-CB 3.51Å; F185-A205 HydrophobicContact CE2-CB 4.48Å; F185-A205 HydrophobicContact CG-CB 4.34Å; F185-A205 HydrophobicContact CZ-CB 3.9Å; W201-A205 WeakPolarHBondContact O-CB 3.12Å; W201-A205 PolarHBondContact O-N 2.92Å; A205-F208 PolarHBondContact O-N 3.15Å; A205-N209 PolarHBondContact O-N 2.65Å; A205-I230 HydrophobicContact CB-CG1 3.74Å; A205-I233 HydrophobicContact CB-CD1 4.15Å
206	S	94.4	Very high	91.8	Very high	13 Å²	13	19.2 Å²	19.2	9%	0.091	10%	0.099	C	C	.	.	H	α-helix	trans	-68.4	-42.4	180	57.7	0	0	0	0	112.5	L202 A203 N209 H210	L202-S206 WeakPolarHBondContact O-CB 3.47Å; L202-S206 PolarHBondContact O-N 3.11Å; L202-S206 PolarHBondContact O-OG 2.77Å; A203-S206 PolarHBondContact O-OG 3.45Å; A203-S206 VanDerWaalsContact O-OG 3.11Å; S206-N209 PolarHBondContact O-N 3.14Å; S206-H210 PolarHBondContact O-N 2.73Å
207	E	92.4	Very high	91.4	Very high	7 Å²	7	20.3 Å²	20.3	3%	0.033	10%	0.102	C	C	.	.	H	α-helix	trans	-64.8	-41.3	174.1	-173.4	73.8	168.7	0	0	111.9	L153 A156 Y157 A203 N209 H210 L211 G441 Y442	L153-E207 HydrophobicContact CD1-CG 4.14Å; L153-E207 HydrophobicContact CD2-CB 4.19Å; A156-E207 HydrophobicContact CB-CB 4.11Å; A156-E207 HydrophobicContact CB-CG 4.23Å; Y157-E207 HydrophobicContact CE2-CG 3.68Å; Y157-E207 WeakPolarHBondContact CE2-OE1 3.4Å; Y157-E207 PolarHBondContact OH-OE1 2.9Å; A203-E207 WeakPolarHBondContact O-CB 3.36Å; A203-E207 PolarHBondContact O-N 3.31Å; E207-N209 PolarHBondContact O-N 3.18Å; E207-H210 WeakPolarHBondContact O-CB 3.42Å; E207-H210 PolarHBondContact O-N 3.38Å; E207-L211 HydrophobicContact CG-CD1 4.44Å; E207-L211 WeakPolarHBondContact O-CG 3.37Å; E207-L211 PolarHBondContact O-N 2.98Å; E207-G441 VanDerWaalsContact OE2-CA 3.23Å; E207-G441 WeakPolarHBondContact OE2-CA 3.2Å; E207-Y442 PolarHBondContact OE2-N 3.48Å
208	F	92.9	Very high	91.1	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62	-41.6	175.2	173.7	-100.4	0	0	0	112.1	A156 L159 L163 F178 I181 F185 N204 A205 L211 V212 I226	A156-F208 HydrophobicContact CB-CB 4.09Å; L159-F208 HydrophobicContact CB-CD2 3.8Å; L159-F208 HydrophobicContact CB-CE2 3.73Å; L163-F208 HydrophobicContact CD2-CE2 4.31Å; L163-F208 HydrophobicContact CD2-CZ 4.02Å; F178-F208 HydrophobicContact CD2-CE1 4.4Å; F178-F208 HydrophobicContact CD2-CZ 4.22Å; F178-F208 AromaticContact CE2-CE1 3.88Å; F178-F208 HydrophobicContact CE2-CE1 3.88Å; F178-F208 HydrophobicContact CE2-CZ 4.1Å; I181-F208 HydrophobicContact CD1-CE2 4.29Å; I181-F208 HydrophobicContact CD1-CZ 3.89Å; I181-F208 HydrophobicContact CG2-CD1 4.44Å; I181-F208 HydrophobicContact CG2-CE1 3.88Å; I181-F208 HydrophobicContact CG2-CZ 4.13Å; F185-F208 HydrophobicContact CE2-CD1 4.47Å; N204-F208 VanDerWaalsContact O-CB 3.24Å; N204-F208 WeakPolarHBondContact O-CB 3.3Å; N204-F208 PolarHBondContact O-N 3.34Å; A205-F208 PolarHBondContact O-N 3.15Å; F208-L211 PolarHBondContact O-N 3.03Å; F208-V212 HydrophobicContact CD2-CG2 4.34Å; F208-V212 HydrophobicContact CE1-CG2 4.15Å; F208-V212 HydrophobicContact CE2-CG2 3.92Å; F208-V212 HydrophobicContact CZ-CG2 3.83Å; F208-V212 WeakPolarHBondContact O-CG2 3.49Å; F208-V212 PolarHBondContact O-N 3.1Å; F208-I226 HydrophobicContact CD1-CD1 3.8Å; F208-I226 HydrophobicContact CE1-CD1 3.91Å
209	N	91.9	Very high	90.5	Very high	13 Å²	13	24.7 Å²	24.7	7%	0.07	12%	0.12	C	C	.	.	H	α-helix	trans	-60.7	-45.8	173	-174.7	90.6	0	0	0	111.4	A205 S206 E207 L211 V212 E213 I226 I230	A205-N209 PolarHBondContact O-N 2.65Å; S206-N209 PolarHBondContact O-N 3.14Å; E207-N209 PolarHBondContact O-N 3.18Å; N209-L211 PolarHBondContact O-N 3.24Å; N209-V212 PolarHBondContact O-N 2.86Å; N209-E213 PolarHBondContact ND2-OE1 3.02Å; N209-E213 VanDerWaalsContact O-CB 3.28Å; N209-E213 WeakPolarHBondContact O-CB 3.29Å; N209-E213 WeakPolarHBondContact O-CG 3.5Å; N209-E213 PolarHBondContact O-N 2.93Å; N209-I226 HydrophobicContact CB-CG2 3.94Å; N209-I226 WeakPolarHBondContact OD1-CG2 3.33Å; N209-I230 HydrophobicContact CB-CD1 3.61Å
210	H	89	Confident	89.7	Confident	14 Å²	14	28.2 Å²	28.2	7%	0.065	15%	0.15	C	C	.	.	H	α-helix	trans	-58.1	-45.5	177.6	-180	81.9	0	0	0	112.3	S206 E207 E213 R214 Q439 G441	S206-H210 PolarHBondContact O-N 2.73Å; E207-H210 WeakPolarHBondContact O-CB 3.42Å; E207-H210 PolarHBondContact O-N 3.38Å; H210-E213 PolarHBondContact O-N 3.22Å; H210-R214 WeakPolarHBondContact CE1-CD 3.3Å; H210-R214 WeakPolarHBondContact NE2-CD 3.45Å; H210-R214 WeakPolarHBondContact O-CB 3.49Å; H210-R214 WeakPolarHBondContact O-CG 3.45Å; H210-R214 PolarHBondContact O-N 3.49Å; H210-Q439 PolarHBondContact CE1-O 3.23Å; H210-Q439 PolarHBondContact ND1-O 3.23Å; H210-G441 VanDerWaalsContact CD2-CA 3.42Å; H210-G441 WeakPolarHBondContact CD2-CA 3.32Å; H210-G441 PolarHBondContact CE1-N 3.12Å; H210-G441 PolarHBondContact ND1-N 3.37Å; H210-G441 PolarHBondContact NE2-N 3.15Å; H210-G441 VanDerWaalsContact NE2-N 3.17Å
211	L	89.1	Confident	88.9	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-47.6	177.1	-69.1	170	0	0	0	112.1	L117 Y157 Y160 E207 F208 N209 E213 R214 D215 V444	L117-L211 HydrophobicContact CD2-CD2 3.77Å; Y157-L211 HydrophobicContact CD1-CD1 4.11Å; Y157-L211 HydrophobicContact CD2-CD1 4.31Å; Y157-L211 HydrophobicContact CE1-CD1 3.89Å; Y157-L211 HydrophobicContact CE1-CD2 3.93Å; Y157-L211 HydrophobicContact CE2-CD1 4.1Å; Y157-L211 HydrophobicContact CG-CD1 4.28Å; Y160-L211 HydrophobicContact CD1-CD1 4.35Å; Y160-L211 HydrophobicContact CD2-CB 3.57Å; Y160-L211 HydrophobicContact CE2-CB 3.96Å; Y160-L211 HydrophobicContact CG-CB 3.88Å; Y160-L211 HydrophobicContact CG-CD1 4.01Å; Y160-L211 HydrophobicContact CG-CG 4.43Å; E207-L211 HydrophobicContact CG-CD1 4.44Å; E207-L211 WeakPolarHBondContact O-CG 3.37Å; E207-L211 PolarHBondContact O-N 2.98Å; F208-L211 PolarHBondContact O-N 3.03Å; N209-L211 PolarHBondContact O-N 3.24Å; L211-E213 VanDerWaalsContact C-N 3.34Å; L211-E213 PolarHBondContact O-N 2.89Å; L211-R214 PolarHBondContact O-N 2.85Å; L211-D215 PolarHBondContact O-N 3.42Å; L211-D215 VanDerWaalsContact O-N 3.09Å; L211-V444 HydrophobicContact CD2-CG2 3.69Å
212	V	89.3	Confident	87.7	Confident	13 Å²	13	41.3 Å²	41.3	8%	0.079	21%	0.205	C	C	.	.	H	α-helix	trans	-67	-33.9	178.4	173	0	0	0	0	112.2	Y160 L163 F178 F208 N209 R214 L218 Y223	Y160-V212 HydrophobicContact CD2-CG2 4.46Å; L163-V212 HydrophobicContact CD2-CG2 3.79Å; F178-V212 HydrophobicContact CE2-CG1 4.28Å; F208-V212 HydrophobicContact CD2-CG2 4.34Å; F208-V212 HydrophobicContact CE1-CG2 4.15Å; F208-V212 HydrophobicContact CE2-CG2 3.92Å; F208-V212 HydrophobicContact CZ-CG2 3.83Å; F208-V212 WeakPolarHBondContact O-CG2 3.49Å; F208-V212 PolarHBondContact O-N 3.1Å; N209-V212 PolarHBondContact O-N 2.86Å; V212-R214 VanDerWaalsContact C-N 3.32Å; V212-L218 HydrophobicContact CG1-CB 4.27Å; V212-L218 HydrophobicContact CG2-CD1 4.44Å; V212-Y223 HydrophobicContact CG1-CD2 4.43Å
213	E	87.1	Confident	86.8	Confident	89 Å²	89	42.7 Å²	42.7	42%	0.416	21%	0.211	S	C	.	.	H	α-helix	trans	-76.5	-14	175.8	-81	-148.9	-127.2	0	0	114.3	N209 H210 L211 K219	N209-E213 PolarHBondContact ND2-OE1 3.02Å; N209-E213 VanDerWaalsContact O-CB 3.28Å; N209-E213 WeakPolarHBondContact O-CB 3.29Å; N209-E213 WeakPolarHBondContact O-CG 3.5Å; N209-E213 PolarHBondContact O-N 2.93Å; H210-E213 PolarHBondContact O-N 3.22Å; L211-E213 VanDerWaalsContact C-N 3.34Å; L211-E213 PolarHBondContact O-N 2.89Å; E213-K219 VanDerWaalsContact O-CD 3.31Å; E213-K219 WeakPolarHBondContact O-CD 3.2Å; E213-K219 PolarHBondContact O-NZ 2.88Å; E213-K219 IonicContact OE2-NZ 2.76Å; E213-K219 PolarHBondContact OE2-NZ 2.97Å
214	R	84.3	Confident	85.7	Confident	67 Å²	67	44.3 Å²	44.3	25%	0.253	23%	0.228	S	C	.	.	H	α-helix	trans	-100.2	-28.2	176.5	-74.4	-171.9	69.6	153.1	6	114.2	L117 H210 L211 V212 T216 E445	L117-R214 HydrophobicContact CB-CB 4.37Å; L117-R214 HydrophobicContact CD1-CB 4.2Å; H210-R214 WeakPolarHBondContact CE1-CD 3.3Å; H210-R214 WeakPolarHBondContact NE2-CD 3.45Å; H210-R214 WeakPolarHBondContact O-CB 3.49Å; H210-R214 WeakPolarHBondContact O-CG 3.45Å; H210-R214 PolarHBondContact O-N 3.49Å; L211-R214 PolarHBondContact O-N 2.85Å; V212-R214 VanDerWaalsContact C-N 3.32Å; R214-T216 PolarHBondContact O-N 3.17Å; R214-E445 IonicContact CZ-OE1 3.3Å; R214-E445 IonicContact NH1-OE1 3.34Å; R214-E445 PolarHBondContact NH1-OE1 2.84Å; R214-E445 IonicContact NH2-OE1 2.67Å; R214-E445 PolarHBondContact NH2-OE1 3.39Å
215	D	87.4	Confident	84.9	Confident	7 Å²	7	52 Å²	52	4%	0.037	26%	0.261	C	S	.	.	S	Bend	trans	-68.9	120.5	169.3	-174.8	-70.5	0	0	0	110.1	Y160 R164 L211 E217 L218 K219	Y160-D215 HydrophobicContact CE2-CB 4.07Å; Y160-D215 PolarHBondContact OH-OD2 3.5Å; R164-D215 IonicContact CZ-OD1 3.64Å; R164-D215 IonicContact CZ-OD2 2.75Å; R164-D215 IonicContact NE-OD1 2.83Å; R164-D215 IonicContact NE-OD2 3.21Å; R164-D215 PolarHBondContact NE-OD2 3.17Å; R164-D215 IonicContact NH2-OD1 3.9Å; R164-D215 PolarHBondContact NH2-OD1 2.91Å; R164-D215 IonicContact NH2-OD2 2.97Å; R164-D215 PolarHBondContact NH2-OD2 3.34Å; L211-D215 PolarHBondContact O-N 3.42Å; L211-D215 VanDerWaalsContact O-N 3.09Å; D215-E217 VanDerWaalsContact C-N 3.34Å; D215-E217 PolarHBondContact O-N 2.79Å; D215-E217 WeakPolarHBondContact OD1-CA 3.44Å; D215-E217 WeakPolarHBondContact OD1-CB 3.43Å; D215-E217 PolarHBondContact OD1-N 3.47Å; D215-L218 HydrophobicContact CB-CB 4.06Å; D215-L218 HydrophobicContact CB-CD1 3.98Å; D215-L218 HydrophobicContact CB-CG 4.01Å; D215-L218 PolarHBondContact OD1-N 2.81Å; D215-K219 VanDerWaalsContact O-CB 3.22Å; D215-K219 WeakPolarHBondContact O-CB 3.15Å; D215-K219 PolarHBondContact O-N 3.49Å
216	T	84.3	Confident	84.6	Confident	96 Å²	96	52.1 Å²	52.1	59%	0.589	26%	0.261	S	S	*	.	H	α-helix	trans	-69.9	-27.5	-173.4	46.7	0	0	0	0	113.5	R214 A220	R214-T216 PolarHBondContact O-N 3.17Å; T216-A220 VanDerWaalsContact O-CB 3.28Å; T216-A220 WeakPolarHBondContact O-CB 3.46Å; T216-A220 PolarHBondContact O-N 3.44Å
217	E	85.1	Confident	84.3	Confident	82 Å²	82	52.9 Å²	52.9	38%	0.383	27%	0.267	S	S	.	.	H	α-helix	trans	-81	-43.3	177.3	-69.1	171.9	-121	0	0	111	R164 H167 D215 A220 S221	R164-E217 IonicContact CZ-OE1 2.7Å; R164-E217 IonicContact CZ-OE2 3.35Å; R164-E217 IonicContact NH1-OE1 2.64Å; R164-E217 PolarHBondContact NH1-OE1 3.02Å; R164-E217 IonicContact NH1-OE2 2.69Å; R164-E217 PolarHBondContact NH1-OE2 3.25Å; R164-E217 IonicContact NH2-OE1 3.9Å; R164-E217 PolarHBondContact NH2-OE1 3.27Å; R164-E217 IonicContact NH2-OE2 2.7Å; H167-E217 IonicContact CD2-OE2 2.77Å; D215-E217 VanDerWaalsContact C-N 3.34Å; D215-E217 PolarHBondContact O-N 2.79Å; D215-E217 WeakPolarHBondContact OD1-CA 3.44Å; D215-E217 WeakPolarHBondContact OD1-CB 3.43Å; D215-E217 PolarHBondContact OD1-N 3.47Å; E217-A220 PolarHBondContact O-N 2.6Å; E217-S221 PolarHBondContact O-N 3.32Å; E217-S221 PolarHBondContact O-OG 2.79Å
218	L	86.3	Confident	84.3	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-65	-42.7	175.6	-59.8	-178.6	0	0	0	110.8	Y160 L163 R164 H167 V212 D215 A220 S221 Y223	Y160-L218 HydrophobicContact CD2-CD1 4.02Å; Y160-L218 HydrophobicContact CE2-CD1 3.72Å; L163-L218 HydrophobicContact CD2-CD1 4.12Å; L163-L218 HydrophobicContact CD2-CD2 4.45Å; L163-L218 HydrophobicContact CG-CD1 4.42Å; L163-L218 HydrophobicContact CG-CD2 4.2Å; R164-L218 HydrophobicContact CB-CD1 4.5Å; H167-L218 HydrophobicContact CB-CD2 3.54Å; V212-L218 HydrophobicContact CG1-CB 4.27Å; V212-L218 HydrophobicContact CG2-CD1 4.44Å; D215-L218 HydrophobicContact CB-CB 4.06Å; D215-L218 HydrophobicContact CB-CD1 3.98Å; D215-L218 HydrophobicContact CB-CG 4.01Å; D215-L218 PolarHBondContact OD1-N 2.81Å; L218-A220 VanDerWaalsContact C-N 3.34Å; L218-A220 PolarHBondContact O-N 3.05Å; L218-S221 VanDerWaalsContact O-CB 3.31Å; L218-S221 WeakPolarHBondContact O-CB 3.27Å; L218-S221 PolarHBondContact O-N 3.15Å; L218-S221 VanDerWaalsContact O-N 3.11Å; L218-Y223 HydrophobicContact CB-CE2 4Å; L218-Y223 HydrophobicContact CD2-CE2 3.81Å; L218-Y223 HydrophobicContact CG-CE2 4.5Å; L218-Y223 WeakPolarHBondContact O-CD2 3.46Å; L218-Y223 WeakPolarHBondContact O-CE2 3.5Å
219	K	83.2	Confident	84.4	Confident	113 Å²	113	56 Å²	56	49%	0.491	29%	0.286	S	S	.	.	H	α-helix	trans	-61.1	-40.2	174.4	-165.4	174.9	-150.1	130.9	0	112.5	E213 D215 S221	E213-K219 VanDerWaalsContact O-CD 3.31Å; E213-K219 WeakPolarHBondContact O-CD 3.2Å; E213-K219 PolarHBondContact O-NZ 2.88Å; E213-K219 IonicContact OE2-NZ 2.76Å; E213-K219 PolarHBondContact OE2-NZ 2.97Å; D215-K219 VanDerWaalsContact O-CB 3.22Å; D215-K219 WeakPolarHBondContact O-CB 3.15Å; D215-K219 PolarHBondContact O-N 3.49Å; K219-S221 PolarHBondContact O-N 3.15Å
220	A	78.8	Confident	84.5	Confident	75 Å²	75	55.4 Å²	55.4	62%	0.62	28%	0.282	S	S	*	.	H	α-helix	trans	-66	-21.4	176.8	0	0	0	0	0	113.5	T216 E217 L218 R222	T216-A220 VanDerWaalsContact O-CB 3.28Å; T216-A220 WeakPolarHBondContact O-CB 3.46Å; T216-A220 PolarHBondContact O-N 3.44Å; E217-A220 PolarHBondContact O-N 2.6Å; L218-A220 VanDerWaalsContact C-N 3.34Å; L218-A220 PolarHBondContact O-N 3.05Å; A220-R222 VanDerWaalsContact C-N 3.28Å; A220-R222 PolarHBondContact O-N 3.08Å
221	S	76.9	Confident	84.8	Confident	42 Å²	42	57.3 Å²	57.3	29%	0.294	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-5.8	-174	-60.2	0	0	0	0	115.2	H167 E217 L218 K219 Y223	H167-S221 PolarHBondContact CE1-OG 2.97Å; H167-S221 PolarHBondContact ND1-OG 3.31Å; E217-S221 PolarHBondContact O-N 3.32Å; E217-S221 PolarHBondContact O-OG 2.79Å; L218-S221 VanDerWaalsContact O-CB 3.31Å; L218-S221 WeakPolarHBondContact O-CB 3.27Å; L218-S221 PolarHBondContact O-N 3.15Å; L218-S221 VanDerWaalsContact O-N 3.11Å; K219-S221 PolarHBondContact O-N 3.15Å; S221-Y223 PolarHBondContact O-N 3.12Å
222	R	71.2	Confident	85.2	Confident	234 Å²	234	62 Å²	62	88%	0.883	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	45	179.3	-51.5	-173	-171.2	-137.6	5.3	114.1	A220	A220-R222 VanDerWaalsContact C-N 3.28Å; A220-R222 PolarHBondContact O-N 3.08Å
223	Y	76.9	Confident	85.5	Confident	29 Å²	29	61.4 Å²	61.4	11%	0.114	31%	0.305	C	S	.	.			trans	-59.2	165.2	168	-61.7	-65.8	0	0	0	112.1	L163 H167 S174 V175 F178 V212 L218 S221	L163-Y223 HydrophobicContact CD1-CE1 4.29Å; L163-Y223 HydrophobicContact CD2-CE2 4.48Å; H167-Y223 PolarHBondContact ND1-OH 3.4Å; S174-Y223 WeakPolarHBondContact CB-OH 3.44Å; S174-Y223 PolarHBondContact OG-OH 2.9Å; V175-Y223 HydrophobicContact CG2-CD1 4.47Å; V175-Y223 HydrophobicContact CG2-CE1 3.99Å; F178-Y223 HydrophobicContact CB-CD1 3.77Å; F178-Y223 HydrophobicContact CB-CE1 4.21Å; F178-Y223 HydrophobicContact CB-CG 4.38Å; F178-Y223 HydrophobicContact CD1-CD1 4.43Å; F178-Y223 HydrophobicContact CD1-CG 4.45Å; F178-Y223 HydrophobicContact CD2-CD1 4.09Å; F178-Y223 HydrophobicContact CD2-CD2 4.31Å; F178-Y223 AromaticContact CD2-CG 3.82Å; F178-Y223 HydrophobicContact CD2-CG 3.82Å; F178-Y223 HydrophobicContact CE2-CG 4.24Å; F178-Y223 AromaticContact CG-CD1 3.83Å; F178-Y223 HydrophobicContact CG-CD1 3.83Å; F178-Y223 AromaticContact CG-CG 3.95Å; F178-Y223 HydrophobicContact CG-CG 3.95Å; V212-Y223 HydrophobicContact CG1-CD2 4.43Å; L218-Y223 HydrophobicContact CB-CE2 4Å; L218-Y223 HydrophobicContact CD2-CE2 3.81Å; L218-Y223 HydrophobicContact CG-CE2 4.5Å; L218-Y223 WeakPolarHBondContact O-CD2 3.46Å; L218-Y223 WeakPolarHBondContact O-CE2 3.5Å; S221-Y223 PolarHBondContact O-N 3.12Å
224	G	69.5	Low	86	Confident	34 Å²	34	57.5 Å²	57.5	35%	0.351	29%	0.287	S	S	.	.			trans	-59.7	154.7	178	0	0	0	0	0	113.3	F178 I226	F178-G224 VanDerWaalsContact CE1-O 3.25Å; F178-G224 WeakPolarHBondContact CE1-O 3.27Å; F178-G224 WeakPolarHBondContact CZ-O 3.32Å; G224-I226 PolarHBondContact O-N 3.5Å; G224-I226 VanDerWaalsContact O-N 3.16Å
225	K	77.1	Confident	86.5	Confident	163 Å²	163	62 Å²	62	71%	0.709	30%	0.304	S	S	*	.			trans	-87.7	82.6	-179.5	-80.9	-162.6	175.7	-169.3	0	111.5	S227 V228	K225-S227 PolarHBondContact O-N 2.99Å; K225-S227 PolarHBondContact O-OG 3.04Å; K225-V228 PolarHBondContact O-N 3.42Å; K225-V228 VanDerWaalsContact O-N 3.16Å
226	I	88.6	Confident	86.9	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.01	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-14.6	173.1	-168.2	165.4	0	0	0	114	F178 I181 F185 F208 N209 G224 V228 E229 I230	F178-I226 HydrophobicContact CZ-CB 4.29Å; F178-I226 HydrophobicContact CZ-CG2 4.29Å; I181-I226 HydrophobicContact CG2-CD1 4.3Å; F185-I226 HydrophobicContact CD2-CD1 3.38Å; F185-I226 HydrophobicContact CD2-CG1 4.3Å; F185-I226 HydrophobicContact CE2-CD1 3.68Å; F185-I226 HydrophobicContact CG-CD1 4.28Å; F208-I226 HydrophobicContact CD1-CD1 3.8Å; F208-I226 HydrophobicContact CE1-CD1 3.91Å; N209-I226 HydrophobicContact CB-CG2 3.94Å; N209-I226 WeakPolarHBondContact OD1-CG2 3.33Å; G224-I226 PolarHBondContact O-N 3.5Å; G224-I226 VanDerWaalsContact O-N 3.16Å; I226-V228 PolarHBondContact O-N 3.09Å; I226-V228 VanDerWaalsContact O-N 3.13Å; I226-E229 PolarHBondContact O-N 2.94Å; I226-I230 WeakPolarHBondContact O-CG1 3.45Å; I226-I230 PolarHBondContact O-N 3.03Å
227	S	89.9	Confident	87.5	Confident	30 Å²	30	60.8 Å²	60.8	21%	0.21	29%	0.288	C	S	.	.	H	α-helix	trans	-44.7	-39.3	166.6	61.5	0	0	0	0	114.1	K225 E231	K225-S227 PolarHBondContact O-N 2.99Å; K225-S227 PolarHBondContact O-OG 3.04Å; S227-E231 PolarHBondContact O-N 2.98Å; S227-E231 VanDerWaalsContact O-N 3.13Å
228	V	91.8	Very high	87.9	Confident	60 Å²	60	57.9 Å²	57.9	36%	0.364	28%	0.276	S	S	.	.	H	α-helix	trans	-69.7	-36.3	-179.9	-177.9	0	0	0	0	111.3	K225 I226 R232	K225-V228 PolarHBondContact O-N 3.42Å; K225-V228 VanDerWaalsContact O-N 3.16Å; I226-V228 PolarHBondContact O-N 3.09Å; I226-V228 VanDerWaalsContact O-N 3.13Å; V228-R232 WeakPolarHBondContact O-CG 3.46Å; V228-R232 PolarHBondContact O-N 3.07Å; V228-R232 VanDerWaalsContact O-N 3.08Å
229	E	94.3	Very high	88.3	Confident	13 Å²	13	60.3 Å²	60.3	6%	0.061	30%	0.296	C	S	.	.	H	α-helix	trans	-77.6	-34.5	179.3	-50.1	-52.8	154.3	0	0	111.3	E182 F185 K186 I226 E231 R232 I233	E182-E229 HydrophobicContact CG-CG 4.29Å; F185-E229 HydrophobicContact CB-CB 4.14Å; K186-E229 WeakPolarHBondContact CA-OE2 3.48Å; K186-E229 HydrophobicContact CB-CG 4.28Å; K186-E229 WeakPolarHBondContact CB-OE2 3.36Å; I226-E229 PolarHBondContact O-N 2.94Å; E229-E231 VanDerWaalsContact C-N 3.32Å; E229-E231 PolarHBondContact O-N 3.4Å; E229-R232 PolarHBondContact O-N 3.29Å; E229-R232 IonicContact OE1-CZ 2.7Å; E229-R232 IonicContact OE1-NH1 3.98Å; E229-R232 PolarHBondContact OE1-NH1 3.3Å; E229-R232 IonicContact OE1-NH2 3.1Å; E229-R232 WeakPolarHBondContact OE2-CD 3.42Å; E229-R232 IonicContact OE2-CZ 2.74Å; E229-R232 IonicContact OE2-NE 2.68Å; E229-R232 IonicContact OE2-NH1 2.85Å; E229-R232 PolarHBondContact OE2-NH1 3.03Å; E229-I233 WeakPolarHBondContact O-CG1 3.5Å; E229-I233 PolarHBondContact O-N 3.15Å
230	I	95.4	Very high	88.9	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-56.2	-47.2	169.2	-66	163.9	0	0	0	110.4	L202 A205 N209 I226 R232 I233 F234 F435	L202-I230 HydrophobicContact CD1-CG2 3.94Å; A205-I230 HydrophobicContact CB-CG1 3.74Å; N209-I230 HydrophobicContact CB-CD1 3.61Å; I226-I230 WeakPolarHBondContact O-CG1 3.45Å; I226-I230 PolarHBondContact O-N 3.03Å; I230-R232 PolarHBondContact O-N 2.91Å; I230-I233 PolarHBondContact O-N 2.83Å; I230-F234 PolarHBondContact O-N 3.06Å; I230-F435 HydrophobicContact CG2-CE1 3.99Å; I230-F435 HydrophobicContact CG2-CZ 3.92Å
231	E	95.3	Very high	89.6	Confident	54 Å²	54	52.6 Å²	52.6	25%	0.252	25%	0.251	S	S	.	.	H	α-helix	trans	-62.4	-40.6	176.4	-173.3	-179.6	172.5	0	0	112	S227 E229 F234 R235 F435	S227-E231 PolarHBondContact O-N 2.98Å; S227-E231 VanDerWaalsContact O-N 3.13Å; E229-E231 VanDerWaalsContact C-N 3.32Å; E229-E231 PolarHBondContact O-N 3.4Å; E231-F234 PolarHBondContact O-N 3.24Å; E231-R235 HydrophobicContact CG-CG 4.39Å; E231-R235 WeakPolarHBondContact O-CB 3.49Å; E231-R235 WeakPolarHBondContact O-CG 3.48Å; E231-R235 PolarHBondContact O-N 3.01Å; E231-R235 IonicContact OE1-CZ 3.49Å; E231-R235 IonicContact OE1-NE 2.72Å; E231-R235 PolarHBondContact OE1-NE 2.86Å; E231-R235 IonicContact OE1-NH2 3.82Å; E231-R235 PolarHBondContact OE1-NH2 3.26Å; E231-F435 HydrophobicContact CB-CD1 3.53Å; E231-F435 HydrophobicContact CB-CE1 3.73Å; E231-F435 HydrophobicContact CB-CG 4.27Å; E231-F435 HydrophobicContact CG-CB 3.96Å; E231-F435 HydrophobicContact CG-CD1 3.56Å; E231-F435 HydrophobicContact CG-CE1 4.2Å; E231-F435 HydrophobicContact CG-CG 3.81Å
232	R	95.7	Very high	90.4	Very high	99 Å²	99	53.3 Å²	53.3	37%	0.374	25%	0.249	S	C	.	.	H	α-helix	trans	-66.1	-38.5	176.2	-70.4	-179	-165.7	143.2	8.2	112.6	A189 V228 E229 I230 F234 R235 R236	A189-R232 HydrophobicContact CB-CB 3.73Å; V228-R232 WeakPolarHBondContact O-CG 3.46Å; V228-R232 PolarHBondContact O-N 3.07Å; V228-R232 VanDerWaalsContact O-N 3.08Å; E229-R232 PolarHBondContact O-N 3.29Å; E229-R232 IonicContact OE1-CZ 2.7Å; E229-R232 IonicContact OE1-NH1 3.98Å; E229-R232 PolarHBondContact OE1-NH1 3.3Å; E229-R232 IonicContact OE1-NH2 3.1Å; E229-R232 WeakPolarHBondContact OE2-CD 3.42Å; E229-R232 IonicContact OE2-CZ 2.74Å; E229-R232 IonicContact OE2-NE 2.68Å; E229-R232 IonicContact OE2-NH1 2.85Å; E229-R232 PolarHBondContact OE2-NH1 3.03Å; I230-R232 PolarHBondContact O-N 2.91Å; R232-F234 VanDerWaalsContact C-N 3.35Å; R232-R235 PolarHBondContact O-N 3.2Å; R232-R236 VanDerWaalsContact O-CB 3.25Å; R232-R236 WeakPolarHBondContact O-CB 3.4Å; R232-R236 PolarHBondContact O-N 2.97Å
233	I	97	Very high	91.3	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-44.8	172.9	-64.5	169.2	0	0	0	109.9	F185 I188 A189 L198 L202 A205 E229 I230 R236 L237	F185-I233 HydrophobicContact CB-CD1 4.22Å; F185-I233 HydrophobicContact CD1-CD1 3.82Å; F185-I233 HydrophobicContact CG-CD1 4.44Å; I188-I233 HydrophobicContact CG2-CD1 4.43Å; I188-I233 HydrophobicContact CG2-CG1 4.44Å; A189-I233 HydrophobicContact CB-CG1 3.81Å; L198-I233 HydrophobicContact CD2-CG2 4.07Å; L202-I233 HydrophobicContact CB-CG2 3.88Å; L202-I233 HydrophobicContact CD1-CB 4.41Å; L202-I233 HydrophobicContact CD1-CG2 4.23Å; A205-I233 HydrophobicContact CB-CD1 4.15Å; E229-I233 WeakPolarHBondContact O-CG1 3.5Å; E229-I233 PolarHBondContact O-N 3.15Å; I230-I233 PolarHBondContact O-N 2.83Å; I233-R236 PolarHBondContact O-N 3.32Å; I233-L237 WeakPolarHBondContact O-CB 3.3Å; I233-L237 PolarHBondContact O-N 2.82Å
234	F	96.8	Very high	92.1	Very high	6 Å²	6	48 Å²	48	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-50.1	176.6	-177.6	-90.3	0	0	0	112.3	L202 I230 E231 R232 R236 L237 V238 Q289 L290 H293 F435	L202-F234 HydrophobicContact CD1-CB 4.03Å; L202-F234 HydrophobicContact CD2-CD2 3.91Å; I230-F234 PolarHBondContact O-N 3.06Å; E231-F234 PolarHBondContact O-N 3.24Å; R232-F234 VanDerWaalsContact C-N 3.35Å; F234-R236 VanDerWaalsContact C-N 3.29Å; F234-R236 PolarHBondContact O-N 2.73Å; F234-L237 WeakPolarHBondContact O-CB 3.23Å; F234-L237 PolarHBondContact O-N 3.09Å; F234-L237 VanDerWaalsContact O-N 3.17Å; F234-V238 HydrophobicContact CD1-CG2 4.17Å; F234-V238 HydrophobicContact CE1-CG2 3.72Å; F234-V238 HydrophobicContact CZ-CG2 4.02Å; F234-V238 WeakPolarHBondContact O-CG2 3.43Å; F234-V238 PolarHBondContact O-N 2.99Å; F234-Q289 HydrophobicContact CE2-CB 4.19Å; F234-Q289 HydrophobicContact CZ-CB 4.02Å; F234-L290 HydrophobicContact CE2-CB 4.08Å; F234-L290 HydrophobicContact CE2-CD1 4.41Å; F234-H293 AromaticContact CE1-CE1 3.6Å; F234-H293 AromaticContact CE1-ND1 3.83Å; F234-H293 AromaticContact CE1-NE2 3.84Å; F234-H293 AromaticContact CZ-CE1 3.81Å; F234-H293 AromaticContact CZ-ND1 3.63Å; F234-F435 HydrophobicContact CB-CD2 4.42Å; F234-F435 HydrophobicContact CB-CE2 3.71Å; F234-F435 HydrophobicContact CB-CZ 4.01Å; F234-F435 AromaticContact CD1-CD2 3.85Å; F234-F435 HydrophobicContact CD1-CD2 3.85Å; F234-F435 AromaticContact CD1-CE2 3.81Å; F234-F435 HydrophobicContact CD1-CE2 3.81Å; F234-F435 AromaticContact CD2-CE2 3.81Å; F234-F435 HydrophobicContact CD2-CE2 3.81Å; F234-F435 HydrophobicContact CE1-CD2 4.28Å; F234-F435 HydrophobicContact CE1-CE2 4.41Å; F234-F435 HydrophobicContact CE2-CE2 4.4Å; F234-F435 HydrophobicContact CG-CD2 4.03Å; F234-F435 AromaticContact CG-CE2 3.48Å; F234-F435 HydrophobicContact CG-CE2 3.48Å; F234-F435 VanDerWaalsContact CG-CE2 3.48Å; F234-F435 HydrophobicContact CG-CZ 4.27Å
235	R	94.7	Very high	93.3	Very high	163 Å²	163	46.4 Å²	46.4	62%	0.615	23%	0.233	S	C	*	.	H	α-helix	trans	-58.7	-39.3	176.2	-71.6	172.9	178.5	-121.9	10.5	111.8	E231 R232 V238 A239	E231-R235 HydrophobicContact CG-CG 4.39Å; E231-R235 WeakPolarHBondContact O-CB 3.49Å; E231-R235 WeakPolarHBondContact O-CG 3.48Å; E231-R235 PolarHBondContact O-N 3.01Å; E231-R235 IonicContact OE1-CZ 3.49Å; E231-R235 IonicContact OE1-NE 2.72Å; E231-R235 PolarHBondContact OE1-NE 2.86Å; E231-R235 IonicContact OE1-NH2 3.82Å; E231-R235 PolarHBondContact OE1-NH2 3.26Å; R232-R235 PolarHBondContact O-N 3.2Å; R235-V238 PolarHBondContact O-N 3.22Å; R235-A239 WeakPolarHBondContact O-CB 3.45Å; R235-A239 PolarHBondContact O-N 3.11Å
236	R	95.9	Very high	94	Very high	76 Å²	76	42.7 Å²	42.7	29%	0.287	21%	0.214	S	C	.	.	H	α-helix	trans	-65.3	-42.4	175.4	179.8	59.2	169.8	-125.6	-13.5	112.1	A189 Q190 E191 C192 L198 R232 I233 F234 A239 V240	A189-R236 WeakPolarHBondContact O-CG 3.31Å; Q190-R236 PolarHBondContact O-NH1 2.77Å; Q190-R236 PolarHBondContact O-NH2 3.12Å; E191-R236 PolarHBondContact O-NH2 2.8Å; C192-R236 PolarHBondContact O-NE 3.32Å; C192-R236 PolarHBondContact O-NH2 3.18Å; L198-R236 HydrophobicContact CD1-CG 3.89Å; L198-R236 HydrophobicContact CD2-CB 4.31Å; L198-R236 HydrophobicContact CD2-CG 3.86Å; R232-R236 VanDerWaalsContact O-CB 3.25Å; R232-R236 WeakPolarHBondContact O-CB 3.4Å; R232-R236 PolarHBondContact O-N 2.97Å; I233-R236 PolarHBondContact O-N 3.32Å; F234-R236 VanDerWaalsContact C-N 3.29Å; F234-R236 PolarHBondContact O-N 2.73Å; R236-A239 PolarHBondContact O-N 3.41Å; R236-V240 WeakPolarHBondContact O-CG2 3.36Å; R236-V240 PolarHBondContact O-N 2.89Å
237	L	96.7	Very high	94.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.7	-45.8	174.7	176.7	59.9	0	0	0	111.6	K195 L198 I199 L202 I233 F234 A239 V240 L241 L290	K195-L237 HydrophobicContact CB-CD1 4.13Å; L198-L237 HydrophobicContact CB-CB 4.17Å; L198-L237 HydrophobicContact CB-CD1 3.94Å; I199-L237 HydrophobicContact CD1-CD1 4.34Å; I199-L237 HydrophobicContact CG1-CD1 3.88Å; I199-L237 HydrophobicContact CG1-CD2 3.6Å; I199-L237 HydrophobicContact CG1-CG 4.4Å; L202-L237 HydrophobicContact CD2-CD2 4.24Å; I233-L237 WeakPolarHBondContact O-CB 3.3Å; I233-L237 PolarHBondContact O-N 2.82Å; F234-L237 WeakPolarHBondContact O-CB 3.23Å; F234-L237 PolarHBondContact O-N 3.09Å; F234-L237 VanDerWaalsContact O-N 3.17Å; L237-A239 PolarHBondContact O-N 3.12Å; L237-V240 PolarHBondContact O-N 2.81Å; L237-L241 HydrophobicContact CD1-CD1 3.71Å; L237-L241 HydrophobicContact CD1-CG 4.15Å; L237-L241 HydrophobicContact CG-CD1 3.83Å; L237-L241 WeakPolarHBondContact O-CB 3.47Å; L237-L241 VanDerWaalsContact O-CG 3.31Å; L237-L241 WeakPolarHBondContact O-CG 3.29Å; L237-L241 PolarHBondContact O-N 2.6Å; L237-L290 HydrophobicContact CD2-CD1 3.83Å; L237-L290 HydrophobicContact CD2-CD2 3.95Å; L237-L290 HydrophobicContact CG-CD1 4.09Å
238	V	95	Very high	94.3	Very high	21 Å²	21	44.4 Å²	44.4	13%	0.127	23%	0.226	C	C	.	.	H	α-helix	trans	-59.8	-46.4	175.4	173.4	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 3.72Å; F234-V238 HydrophobicContact CZ-CG2 4.02Å; F234-V238 WeakPolarHBondContact O-CG2 3.43Å; F234-V238 PolarHBondContact O-N 2.99Å; R235-V238 PolarHBondContact O-N 3.22Å; V238-V240 PolarHBondContact O-N 2.68Å; V238-L241 PolarHBondContact O-N 2.67Å; V238-Q242 WeakPolarHBondContact O-CB 3.28Å; V238-Q242 PolarHBondContact O-N 3.17Å; V238-L290 HydrophobicContact CG2-CD1 4.48Å; V238-H293 HydrophobicContact CG1-CB 4.31Å; V238-H293 HydrophobicContact CG2-CB 4.02Å; V238-M297 HydrophobicContact CG1-CE 4.07Å; V238-M297 HydrophobicContact CG1-SD 4.17Å
239	A	93.7	Very high	94.5	Very high	52 Å²	52	41.6 Å²	41.6	43%	0.43	21%	0.208	S	C	.	.	H	α-helix	trans	-63.2	-38.3	178.4	0	0	0	0	0	113.5	R235 R236 L237	R235-A239 WeakPolarHBondContact O-CB 3.45Å; R235-A239 PolarHBondContact O-N 3.11Å; R236-A239 PolarHBondContact O-N 3.41Å; L237-A239 PolarHBondContact O-N 3.12Å
240	V	95.1	Very high	94.5	Very high	26 Å²	26	48 Å²	48	16%	0.158	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-48.6	172.4	166.8	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 4.27Å; L198-V240 HydrophobicContact CD1-CB 4.42Å; L198-V240 HydrophobicContact CD1-CG2 3.88Å; R236-V240 WeakPolarHBondContact O-CG2 3.36Å; R236-V240 PolarHBondContact O-N 2.89Å; L237-V240 PolarHBondContact O-N 2.81Å; V238-V240 PolarHBondContact O-N 2.68Å; V240-Q242 VanDerWaalsContact C-N 3.35Å; V240-Q242 PolarHBondContact O-N 3.13Å; V240-S243 PolarHBondContact O-N 3.44Å; V240-S243 PolarHBondContact O-OG 3.47Å
241	L	95.2	Very high	94.4	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-67.3	-32.6	-179	-68.5	165.5	0	0	0	112.9	K195 L237 V238 S243 V244 I245 L269 T273 L290 L294	K195-L241 HydrophobicContact CB-CD2 4.1Å; K195-L241 HydrophobicContact CD-CD2 3.89Å; L237-L241 HydrophobicContact CD1-CD1 3.71Å; L237-L241 HydrophobicContact CD1-CG 4.15Å; L237-L241 HydrophobicContact CG-CD1 3.83Å; L237-L241 WeakPolarHBondContact O-CB 3.47Å; L237-L241 VanDerWaalsContact O-CG 3.31Å; L237-L241 WeakPolarHBondContact O-CG 3.29Å; L237-L241 PolarHBondContact O-N 2.6Å; V238-L241 PolarHBondContact O-N 2.67Å; L241-S243 PolarHBondContact O-N 2.94Å; L241-V244 PolarHBondContact O-N 3.46Å; L241-I245 WeakPolarHBondContact O-CG2 3.24Å; L241-I245 PolarHBondContact O-N 3.18Å; L241-L269 HydrophobicContact CD2-CD1 4.23Å; L241-T273 HydrophobicContact CD1-CG2 3.91Å; L241-T273 HydrophobicContact CD2-CG2 4.13Å; L241-L290 HydrophobicContact CD1-CD1 3.86Å; L241-L294 HydrophobicContact CB-CD2 3.81Å; L241-L294 HydrophobicContact CD1-CD1 4.47Å; L241-L294 HydrophobicContact CD1-CD2 3.98Å; L241-L294 HydrophobicContact CG-CD2 4.34Å
242	Q	92.4	Very high	94.4	Very high	56 Å²	56	46.4 Å²	46.4	26%	0.262	23%	0.228	S	C	.	.	H	α-helix	trans	-54.8	-39.3	174.7	-168.3	177.1	24.2	0	0	111.9	V238 V240 V244 R246 M297	V238-Q242 WeakPolarHBondContact O-CB 3.28Å; V238-Q242 PolarHBondContact O-N 3.17Å; V240-Q242 VanDerWaalsContact C-N 3.35Å; V240-Q242 PolarHBondContact O-N 3.13Å; Q242-V244 PolarHBondContact O-N 3.03Å; Q242-R246 WeakPolarHBondContact O-CB 3.13Å; Q242-R246 PolarHBondContact O-N 2.75Å; Q242-M297 HydrophobicContact CB-SD 3.48Å; Q242-M297 WeakPolarHBondContact CB-SD 3.39Å; Q242-M297 HydrophobicContact CG-SD 3.58Å; Q242-M297 VanDerWaalsContact CG-SD 3.58Å
243	S	90.8	Very high	94.3	Very high	81 Å²	81	42.3 Å²	42.3	57%	0.566	21%	0.213	S	C	*	.	H	α-helix	trans	-66.6	-23.2	179.1	76.4	0	0	0	0	114	V240 L241 P247	V240-S243 PolarHBondContact O-N 3.44Å; V240-S243 PolarHBondContact O-OG 3.47Å; L241-S243 PolarHBondContact O-N 2.94Å; S243-P247 WeakPolarHBondContact O-CD 3.24Å; S243-P247 WeakPolarHBondContact O-CG 3.22Å
244	V	93.8	Very high	94.1	Very high	71 Å²	71	45.3 Å²	45.3	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-100.6	-39.7	-177.6	-170.7	0	0	0	0	111.7	L241 Q242 P247 A248 L269	L241-V244 PolarHBondContact O-N 3.46Å; Q242-V244 PolarHBondContact O-N 3.03Å; V244-P247 WeakPolarHBondContact O-CD 3.28Å; V244-A248 PolarHBondContact O-N 2.87Å; V244-L269 HydrophobicContact CB-CD2 4.18Å; V244-L269 HydrophobicContact CG1-CD1 4.1Å; V244-L269 HydrophobicContact CG1-CD2 4.01Å
245	I	94.4	Very high	93.8	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-71.6	-32.6	-177.1	-159.1	158.7	0	0	0	112.8	L241 A248 A249 L269 L294 M297 V298	L241-I245 WeakPolarHBondContact O-CG2 3.24Å; L241-I245 PolarHBondContact O-N 3.18Å; I245-A248 PolarHBondContact O-N 3.3Å; I245-A249 VanDerWaalsContact O-CB 3.28Å; I245-A249 WeakPolarHBondContact O-CB 3.07Å; I245-A249 PolarHBondContact O-N 2.85Å; I245-L269 HydrophobicContact CB-CD2 3.6Å; I245-L269 HydrophobicContact CD1-CD2 4.24Å; I245-L269 HydrophobicContact CG1-CD2 3.89Å; I245-L294 HydrophobicContact CD1-CB 3.92Å; I245-L294 HydrophobicContact CD1-CD2 3.68Å; I245-L294 HydrophobicContact CD1-CG 4.44Å; I245-L294 WeakPolarHBondContact CD1-O 3.29Å; I245-M297 HydrophobicContact CG2-CB 3.88Å; I245-M297 HydrophobicContact CG2-CE 4.17Å; I245-M297 HydrophobicContact CG2-SD 4.23Å; I245-V298 HydrophobicContact CD1-CG2 3.68Å; I245-V298 HydrophobicContact CG1-CG2 3.78Å
246	R	91.3	Very high	93.6	Very high	85 Å²	85	46.2 Å²	46.2	32%	0.321	24%	0.241	S	C	.	.	H	α-helix	trans	-65.6	-44.6	177.8	174.3	175.2	-69.5	172.5	-0.5	112.4	Q242 F301 D429	Q242-R246 WeakPolarHBondContact O-CB 3.13Å; Q242-R246 PolarHBondContact O-N 2.75Å; R246-F301 HydrophobicContact CG-CD2 3.78Å; R246-F301 HydrophobicContact CG-CE2 4.16Å; R246-F301 HydrophobicContact CG-CG 4.42Å; R246-D429 IonicContact CZ-OD1 2.77Å; R246-D429 IonicContact CZ-OD2 2.88Å; R246-D429 IonicContact NH1-OD2 3.7Å; R246-D429 IonicContact NH2-OD1 2.72Å; R246-D429 PolarHBondContact NH2-OD1 2.88Å; R246-D429 IonicContact NH2-OD2 3.73Å; R246-D429 PolarHBondContact NH2-OD2 3.33Å
247	P	92.1	Very high	93.4	Very high	60 Å²	60	45.7 Å²	45.7	39%	0.39	24%	0.244	S	C	.	.	H	α-helix	trans	-56.8	-50.9	166.2	-29	35.2	0	0	0	113.8	S243 V244 A249 R250	S243-P247 WeakPolarHBondContact O-CD 3.24Å; S243-P247 WeakPolarHBondContact O-CG 3.22Å; V244-P247 WeakPolarHBondContact O-CD 3.28Å; P247-A249 VanDerWaalsContact C-N 3.31Å; P247-A249 PolarHBondContact O-N 3.18Å; P247-R250 VanDerWaalsContact O-CB 3.32Å; P247-R250 WeakPolarHBondContact O-CB 3.45Å; P247-R250 PolarHBondContact O-N 2.57Å; P247-R250 VanDerWaalsContact O-N 3.13Å
248	A	93.9	Very high	93.3	Very high	8 Å²	8	49.5 Å²	49.5	7%	0.066	26%	0.264	C	S	.	.	H	α-helix	trans	-58.2	-41	-178.3	0	0	0	0	0	112.8	V244 I245 R250 A251 D265 V266	V244-A248 PolarHBondContact O-N 2.87Å; I245-A248 PolarHBondContact O-N 3.3Å; A248-R250 PolarHBondContact O-N 3.1Å; A248-A251 PolarHBondContact O-N 3.48Å; A248-D265 HydrophobicContact CB-CB 3.67Å; A248-V266 HydrophobicContact CB-CG2 3.92Å
249	A	95.1	Very high	93.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-70.3	-10.1	-179	0	0	0	0	0	114.3	I245 P247 A251 L252 V266 F301	I245-A249 VanDerWaalsContact O-CB 3.28Å; I245-A249 WeakPolarHBondContact O-CB 3.07Å; I245-A249 PolarHBondContact O-N 2.85Å; P247-A249 VanDerWaalsContact C-N 3.31Å; P247-A249 PolarHBondContact O-N 3.18Å; A249-A251 VanDerWaalsContact C-N 3.34Å; A249-A251 PolarHBondContact O-N 2.82Å; A249-L252 HydrophobicContact CB-CD1 4.13Å; A249-L252 WeakPolarHBondContact O-CB 3.48Å; A249-L252 PolarHBondContact O-N 3.41Å; A249-V266 HydrophobicContact CB-CG2 4.33Å; A249-F301 HydrophobicContact CB-CD1 3.49Å; A249-F301 VanDerWaalsContact CB-CD1 3.49Å; A249-F301 HydrophobicContact CB-CE1 4.12Å; A249-F301 HydrophobicContact CB-CG 4.28Å; A249-F301 WeakPolarHBondContact O-CE1 3.48Å
250	R	93.8	Very high	93.3	Very high	147 Å²	147	55.8 Å²	55.8	56%	0.555	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-63	-39.3	174.5	-72.1	173.6	173.7	138.3	-0.5	112.4	P247 A248 L252 L253 F301	P247-R250 VanDerWaalsContact O-CB 3.32Å; P247-R250 WeakPolarHBondContact O-CB 3.45Å; P247-R250 PolarHBondContact O-N 2.57Å; P247-R250 VanDerWaalsContact O-N 3.13Å; A248-R250 PolarHBondContact O-N 3.1Å; R250-L252 PolarHBondContact O-N 3.1Å; R250-L252 VanDerWaalsContact O-N 3.15Å; R250-L253 PolarHBondContact O-N 3.31Å; R250-L253 VanDerWaalsContact O-N 3.07Å; R250-F301 HydrophobicContact CB-CZ 4.49Å; R250-F301 HydrophobicContact CG-CE1 4.03Å; R250-F301 HydrophobicContact CG-CE2 4.43Å; R250-F301 HydrophobicContact CG-CZ 3.59Å
251	A	93.6	Very high	93.3	Very high	20 Å²	20	58.9 Å²	58.9	17%	0.165	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-60.8	-26.2	-178.2	0	0	0	0	0	112.5	A248 A249 L253 D254 L257 A262 R327	A248-A251 PolarHBondContact O-N 3.48Å; A249-A251 VanDerWaalsContact C-N 3.34Å; A249-A251 PolarHBondContact O-N 2.82Å; A251-L253 PolarHBondContact O-N 2.88Å; A251-D254 PolarHBondContact O-N 3.16Å; A251-L257 HydrophobicContact CB-CD1 3.79Å; A251-A262 WeakPolarHBondContact O-CB 3.42Å; A251-R327 PolarHBondContact O-NH1 3.04Å
252	L	95.6	Very high	93.3	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.005	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-61	-27.4	176.3	-59.9	172.4	0	0	0	113.4	A249 R250 A262 T263 V266 V298 V302 L324 R327 I331	A249-L252 HydrophobicContact CB-CD1 4.13Å; A249-L252 WeakPolarHBondContact O-CB 3.48Å; A249-L252 PolarHBondContact O-N 3.41Å; R250-L252 PolarHBondContact O-N 3.1Å; R250-L252 VanDerWaalsContact O-N 3.15Å; L252-A262 VanDerWaalsContact CD2-O 3.26Å; L252-A262 WeakPolarHBondContact CD2-O 3.26Å; L252-T263 HydrophobicContact CD2-CG2 3.7Å; L252-V266 HydrophobicContact CD1-CG2 4.21Å; L252-V266 HydrophobicContact CG-CG2 4.42Å; L252-V298 HydrophobicContact CD1-CG1 3.81Å; L252-V302 HydrophobicContact CB-CG2 4.3Å; L252-V302 HydrophobicContact CD1-CG2 3.72Å; L252-L324 HydrophobicContact CB-CD2 4.41Å; L252-L324 VanDerWaalsContact O-CD2 3.29Å; L252-L324 WeakPolarHBondContact O-CD2 3.43Å; L252-R327 VanDerWaalsContact C-NH1 3.34Å; L252-R327 HydrophobicContact CD2-CB 4.1Å; L252-R327 WeakPolarHBondContact O-CD 3.42Å; L252-R327 PolarHBondContact O-NH1 2.72Å; L252-I331 HydrophobicContact CD1-CD1 4.1Å; L252-I331 HydrophobicContact CD2-CD1 3.88Å
253	L	94	Very high	93.5	Very high	13 Å²	13	56.2 Å²	56.2	7%	0.068	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-91.5	-13.4	-178	-64.3	162.6	0	0	0	113.3	R250 A251 I255 F301 V302 L306 L320 L324	R250-L253 PolarHBondContact O-N 3.31Å; R250-L253 VanDerWaalsContact O-N 3.07Å; A251-L253 PolarHBondContact O-N 2.88Å; L253-I255 PolarHBondContact O-N 3.35Å; L253-F301 HydrophobicContact CD1-CE1 3.79Å; L253-F301 HydrophobicContact CD1-CZ 4.13Å; L253-V302 HydrophobicContact CD2-CG1 4.21Å; L253-L306 HydrophobicContact CD2-CD2 4.08Å; L253-L306 HydrophobicContact CD2-CG 4.38Å; L253-L320 WeakPolarHBondContact O-CD1 3.48Å; L253-L324 HydrophobicContact CD2-CD1 4.37Å; L253-L324 HydrophobicContact CD2-CD2 4.35Å
254	D	91.3	Very high	93.8	Very high	64 Å²	64	53.7 Å²	53.7	34%	0.342	28%	0.275	S	S	.	.			trans	-78.1	111.6	-175.8	-171.8	-35.2	0	0	0	111.1	A251 H256 L257 R327	A251-D254 PolarHBondContact O-N 3.16Å; D254-H256 PolarHBondContact O-N 2.76Å; D254-H256 WeakPolarHBondContact OD1-CA 3.42Å; D254-H256 VanDerWaalsContact OD1-CB 3.31Å; D254-H256 WeakPolarHBondContact OD1-CB 3.37Å; D254-H256 IonicContact OD1-CD2 3.24Å; D254-H256 IonicContact OD1-CG 2.87Å; D254-H256 PolarHBondContact OD1-N 3.11Å; D254-L257 HydrophobicContact CB-CB 4.37Å; D254-L257 HydrophobicContact CB-CD1 3.93Å; D254-L257 HydrophobicContact CB-CG 3.96Å; D254-L257 PolarHBondContact OD1-N 2.72Å; D254-R327 VanDerWaalsContact O-CZ 3.28Å; D254-R327 PolarHBondContact O-NH1 2.89Å; D254-R327 PolarHBondContact O-NH2 3.3Å
255	I	90.7	Very high	93.9	Very high	31 Å²	31	55.1 Å²	55.1	16%	0.159	28%	0.28	C	S	.	.	S	Bend	trans	-74.2	-6.6	-178.5	63.7	170.4	0	0	0	114.3	L253 R319 L320	L253-I255 PolarHBondContact O-N 3.35Å; I255-R319 PolarHBondContact O-NE 3.18Å; I255-R319 PolarHBondContact O-NH2 3.23Å; I255-L320 HydrophobicContact CG2-CB 3.92Å; I255-L320 HydrophobicContact CG2-CD1 3.87Å; I255-L320 HydrophobicContact CG2-CG 4.49Å
256	H	90.6	Very high	94.1	Very high	156 Å²	156	55 Å²	55	72%	0.722	28%	0.28	S	S	*	.	S	Bend	trans	-98.7	-26.8	179.8	-53.9	-79	0	0	0	112.7	D254	D254-H256 PolarHBondContact O-N 2.76Å; D254-H256 WeakPolarHBondContact OD1-CA 3.42Å; D254-H256 VanDerWaalsContact OD1-CB 3.31Å; D254-H256 WeakPolarHBondContact OD1-CB 3.37Å; D254-H256 IonicContact OD1-CD2 3.24Å; D254-H256 IonicContact OD1-CG 2.87Å; D254-H256 PolarHBondContact OD1-N 3.11Å
257	L	93.3	Very high	94.4	Very high	65 Å²	65	52.6 Å²	52.6	34%	0.34	27%	0.273	S	S	.	.	S	Bend	trans	-65.4	150.7	168	-66	-179.1	0	0	0	111.4	A251 D254 A262 R327	A251-L257 HydrophobicContact CB-CD1 3.79Å; D254-L257 HydrophobicContact CB-CB 4.37Å; D254-L257 HydrophobicContact CB-CD1 3.93Å; D254-L257 HydrophobicContact CB-CG 3.96Å; D254-L257 PolarHBondContact OD1-N 2.72Å; L257-A262 HydrophobicContact CB-CB 4.12Å; L257-A262 HydrophobicContact CD1-CB 4.46Å; L257-R327 PolarHBondContact O-NH2 2.89Å
258	N	94.4	Very high	94.6	Very high	81 Å²	81	55.5 Å²	55.5	43%	0.433	28%	0.281	S	S	.	.			trans	-77.3	160.7	165.8	71	64.4	0	0	0	110.5	H260 D261 A262	N258-H260 PolarHBondContact O-N 3.45Å; N258-H260 WeakPolarHBondContact OD1-CB 3.43Å; N258-H260 PolarHBondContact OD1-N 3.38Å; N258-D261 PolarHBondContact ND2-OD2 2.76Å; N258-D261 PolarHBondContact O-N 3.31Å; N258-D261 PolarHBondContact OD1-N 3.01Å; N258-A262 WeakPolarHBondContact O-CB 3.15Å; N258-A262 PolarHBondContact O-N 2.88Å
259	D	94.1	Very high	94.7	Very high	59 Å²	59	55.8 Å²	55.8	32%	0.316	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-17.2	-172.4	-57	-42.6	0	0	0	114.2	T263 R327	D259-T263 WeakPolarHBondContact O-CG2 3.28Å; D259-T263 PolarHBondContact O-N 2.89Å; D259-T263 PolarHBondContact O-OG1 2.81Å; D259-R327 HydrophobicContact CB-CG 3.99Å; D259-R327 IonicContact OD1-CZ 3.9Å; D259-R327 IonicContact OD1-NE 3.61Å; D259-R327 PolarHBondContact OD1-NE 3.14Å; D259-R327 IonicContact OD1-NH2 2.72Å; D259-R327 PolarHBondContact OD1-NH2 3.27Å
260	H	93.8	Very high	94.7	Very high	145 Å²	145	55.9 Å²	55.9	67%	0.671	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-54.9	175.2	-174	43.7	0	0	0	110.6	N258 A262 T263 G264	N258-H260 PolarHBondContact O-N 3.45Å; N258-H260 WeakPolarHBondContact OD1-CB 3.43Å; N258-H260 PolarHBondContact OD1-N 3.38Å; H260-A262 VanDerWaalsContact C-N 3.29Å; H260-A262 PolarHBondContact O-N 3.22Å; H260-T263 PolarHBondContact O-N 3.04Å; H260-T263 VanDerWaalsContact O-N 3.1Å; H260-T263 PolarHBondContact O-OG1 3.38Å; H260-G264 PolarHBondContact O-N 3.48Å
261	D	94.9	Very high	94.8	Very high	91 Å²	91	50.3 Å²	50.3	49%	0.487	26%	0.263	S	S	.	.	H	α-helix	trans	-62.9	-39.6	178.8	-59.1	-19.1	0	0	0	110.6	N258 T263 G264	N258-D261 PolarHBondContact ND2-OD2 2.76Å; N258-D261 PolarHBondContact O-N 3.31Å; N258-D261 PolarHBondContact OD1-N 3.01Å; D261-T263 PolarHBondContact O-N 3.01Å; D261-G264 PolarHBondContact O-N 3.37Å
262	A	95	Very high	94.9	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-62	-25.2	175.9	0	0	0	0	0	114.4	A251 L252 L257 N258 H260 R327	A251-A262 WeakPolarHBondContact O-CB 3.42Å; L252-A262 VanDerWaalsContact CD2-O 3.26Å; L252-A262 WeakPolarHBondContact CD2-O 3.26Å; L257-A262 HydrophobicContact CB-CB 4.12Å; L257-A262 HydrophobicContact CD1-CB 4.46Å; N258-A262 WeakPolarHBondContact O-CB 3.15Å; N258-A262 PolarHBondContact O-N 2.88Å; H260-A262 VanDerWaalsContact C-N 3.29Å; H260-A262 PolarHBondContact O-N 3.22Å; A262-R327 HydrophobicContact CB-CG 4.42Å; A262-R327 VanDerWaalsContact CB-CZ 3.45Å
263	T	97.3	Very high	94.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-104	-13.3	177.8	54.7	0	0	0	0	113.9	L252 D259 H260 D261 D265 V266 I267 R327 I331	L252-T263 HydrophobicContact CD2-CG2 3.7Å; D259-T263 WeakPolarHBondContact O-CG2 3.28Å; D259-T263 PolarHBondContact O-N 2.89Å; D259-T263 PolarHBondContact O-OG1 2.81Å; H260-T263 PolarHBondContact O-N 3.04Å; H260-T263 VanDerWaalsContact O-N 3.1Å; H260-T263 PolarHBondContact O-OG1 3.38Å; D261-T263 PolarHBondContact O-N 3.01Å; T263-D265 PolarHBondContact O-N 3.11Å; T263-V266 PolarHBondContact O-N 3.41Å; T263-I267 WeakPolarHBondContact O-CB 3.4Å; T263-I267 WeakPolarHBondContact O-CG1 3.32Å; T263-I267 PolarHBondContact O-N 2.82Å; T263-R327 HydrophobicContact CG2-CB 3.6Å; T263-R327 HydrophobicContact CG2-CG 3.87Å; T263-R327 WeakPolarHBondContact CG2-O 3.36Å; T263-I331 HydrophobicContact CG2-CG1 4.4Å
264	G	96.6	Very high	94.9	Very high	28 Å²	28	50.7 Å²	50.7	29%	0.289	26%	0.264	S	S	.	.	H	α-helix	trans	-53.8	-56.7	-172.1	0	0	0	0	0	113.7	H260 D261 V266 I267 H268	H260-G264 PolarHBondContact O-N 3.48Å; D261-G264 PolarHBondContact O-N 3.37Å; G264-V266 VanDerWaalsContact C-N 3.34Å; G264-V266 PolarHBondContact O-N 2.88Å; G264-I267 PolarHBondContact O-N 3.31Å; G264-H268 VanDerWaalsContact O-CB 3.23Å; G264-H268 WeakPolarHBondContact O-CB 3.25Å; G264-H268 PolarHBondContact O-N 2.66Å
265	D	96.7	Very high	95	Very high	101 Å²	101	53.9 Å²	53.9	54%	0.54	27%	0.271	S	S	.	.	H	α-helix	trans	-61.9	-39.6	-177.2	-76.1	-19	0	0	0	112.9	A248 T263 L269	A248-D265 HydrophobicContact CB-CB 3.67Å; T263-D265 PolarHBondContact O-N 3.11Å; D265-L269 VanDerWaalsContact O-CB 3.29Å; D265-L269 WeakPolarHBondContact O-CB 3.41Å; D265-L269 PolarHBondContact O-N 2.82Å
266	V	97.6	Very high	95.1	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-68.6	-45.8	179.4	178.9	0	0	0	0	110.4	A248 A249 L252 T263 G264 L269 L270 V298 I331	A248-V266 HydrophobicContact CB-CG2 3.92Å; A249-V266 HydrophobicContact CB-CG2 4.33Å; L252-V266 HydrophobicContact CD1-CG2 4.21Å; L252-V266 HydrophobicContact CG-CG2 4.42Å; T263-V266 PolarHBondContact O-N 3.41Å; G264-V266 VanDerWaalsContact C-N 3.34Å; G264-V266 PolarHBondContact O-N 2.88Å; V266-L269 PolarHBondContact O-N 3.35Å; V266-L270 HydrophobicContact CG1-CD1 4.13Å; V266-L270 WeakPolarHBondContact O-CB 3.48Å; V266-L270 VanDerWaalsContact O-CG 3.27Å; V266-L270 WeakPolarHBondContact O-CG 3.22Å; V266-L270 PolarHBondContact O-N 3.49Å; V266-V298 HydrophobicContact CG1-CG2 3.93Å; V266-I331 HydrophobicContact CG1-CD1 3.98Å; V266-I331 HydrophobicContact CG1-CG1 4.45Å
267	I	97.4	Very high	95.2	Very high	33 Å²	33	46.5 Å²	46.5	17%	0.169	24%	0.236	C	C	.	.	H	α-helix	trans	-65.3	-40.7	177.6	-71.5	174.8	0	0	0	110.9	T263 G264 L270 D271 I331 F334	T263-I267 WeakPolarHBondContact O-CB 3.4Å; T263-I267 WeakPolarHBondContact O-CG1 3.32Å; T263-I267 PolarHBondContact O-N 2.82Å; G264-I267 PolarHBondContact O-N 3.31Å; I267-L270 PolarHBondContact O-N 3.36Å; I267-D271 WeakPolarHBondContact O-CB 3.31Å; I267-D271 PolarHBondContact O-N 2.89Å; I267-I331 HydrophobicContact CD1-CG1 4.47Å; I267-I331 HydrophobicContact CG1-CG1 4.19Å; I267-F334 HydrophobicContact CD1-CB 4.41Å; I267-F334 HydrophobicContact CG1-CB 4.33Å; I267-F334 HydrophobicContact CG1-CG 4.41Å; I267-F334 HydrophobicContact CG2-CB 4.44Å; I267-F334 HydrophobicContact CG2-CD1 4.45Å; I267-F334 HydrophobicContact CG2-CD2 3.61Å; I267-F334 HydrophobicContact CG2-CE2 3.99Å; I267-F334 HydrophobicContact CG2-CG 3.87Å
268	H	96.5	Very high	95	Very high	121 Å²	121	48.7 Å²	48.7	56%	0.56	24%	0.24	S	C	*	.	H	α-helix	trans	-67	-39.7	177.1	178	-116.5	0	0	0	112.6	G264 D271 T272	G264-H268 VanDerWaalsContact O-CB 3.23Å; G264-H268 WeakPolarHBondContact O-CB 3.25Å; G264-H268 PolarHBondContact O-N 2.66Å; H268-D271 PolarHBondContact O-N 3.06Å; H268-T272 WeakPolarHBondContact NE2-CG2 3.39Å; H268-T272 WeakPolarHBondContact O-CB 3.42Å; H268-T272 WeakPolarHBondContact O-CG2 3.45Å; H268-T272 PolarHBondContact O-N 3Å; H268-T272 PolarHBondContact O-OG1 3.47Å
269	L	96.5	Very high	94.7	Very high	14 Å²	14	49.2 Å²	49.2	7%	0.073	24%	0.242	C	C	.	.	H	α-helix	trans	-65.2	-40.8	173.9	-178.3	60.6	0	0	0	111.5	L241 V244 I245 D265 V266 T272 T273	L241-L269 HydrophobicContact CD2-CD1 4.23Å; V244-L269 HydrophobicContact CB-CD2 4.18Å; V244-L269 HydrophobicContact CG1-CD1 4.1Å; V244-L269 HydrophobicContact CG1-CD2 4.01Å; I245-L269 HydrophobicContact CB-CD2 3.6Å; I245-L269 HydrophobicContact CD1-CD2 4.24Å; I245-L269 HydrophobicContact CG1-CD2 3.89Å; D265-L269 VanDerWaalsContact O-CB 3.29Å; D265-L269 WeakPolarHBondContact O-CB 3.41Å; D265-L269 PolarHBondContact O-N 2.82Å; V266-L269 PolarHBondContact O-N 3.35Å; L269-T272 PolarHBondContact O-OG1 3.4Å; L269-T273 WeakPolarHBondContact O-CB 3.35Å; L269-T273 PolarHBondContact O-N 2.99Å; L269-T273 PolarHBondContact O-OG1 3.36Å
270	L	96.2	Very high	94.6	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-65	-48.3	174.8	-70.9	168.7	0	0	0	111.4	V266 I267 M274 L294 L295 I331 F334	V266-L270 HydrophobicContact CG1-CD1 4.13Å; V266-L270 WeakPolarHBondContact O-CB 3.48Å; V266-L270 VanDerWaalsContact O-CG 3.27Å; V266-L270 WeakPolarHBondContact O-CG 3.22Å; V266-L270 PolarHBondContact O-N 3.49Å; I267-L270 PolarHBondContact O-N 3.36Å; L270-M274 VanDerWaalsContact O-CB 3.28Å; L270-M274 WeakPolarHBondContact O-CB 3.3Å; L270-M274 WeakPolarHBondContact O-CG 3.2Å; L270-M274 PolarHBondContact O-N 2.75Å; L270-L294 HydrophobicContact CD2-CB 3.81Å; L270-L294 HydrophobicContact CD2-CD1 4.13Å; L270-L295 HydrophobicContact CD1-CD2 4.42Å; L270-I331 HydrophobicContact CD1-CG2 4.06Å; L270-F334 HydrophobicContact CB-CD1 4.24Å; L270-F334 HydrophobicContact CB-CE1 3.66Å; L270-F334 HydrophobicContact CD1-CD1 4.38Å
271	D	95.5	Very high	94.3	Very high	31 Å²	31	39.9 Å²	39.9	17%	0.166	20%	0.199	C	C	.	.	H	α-helix	trans	-59.6	-56.5	178.9	-175.5	82.6	0	0	0	112	I267 H268 T273 M274 R275 F334	I267-D271 WeakPolarHBondContact O-CB 3.31Å; I267-D271 PolarHBondContact O-N 2.89Å; H268-D271 PolarHBondContact O-N 3.06Å; D271-T273 VanDerWaalsContact C-N 3.26Å; D271-T273 PolarHBondContact O-N 3.3Å; D271-M274 PolarHBondContact O-N 3.35Å; D271-R275 WeakPolarHBondContact O-CB 3.49Å; D271-R275 PolarHBondContact O-N 2.98Å; D271-R275 IonicContact OD1-CZ 3.54Å; D271-R275 IonicContact OD1-NE 3.58Å; D271-R275 IonicContact OD1-NH2 4Å; D271-R275 PolarHBondContact OD1-NH2 2.84Å; D271-R275 IonicContact OD2-CZ 3.65Å; D271-R275 VanDerWaalsContact OD2-CZ 3.24Å; D271-R275 IonicContact OD2-NE 3.13Å; D271-R275 PolarHBondContact OD2-NE 3.21Å; D271-R275 IonicContact OD2-NH2 3.07Å; D271-R275 PolarHBondContact OD2-NH2 3.05Å; D271-F334 HydrophobicContact CB-CE2 4.01Å; D271-F334 HydrophobicContact CB-CZ 3.6Å
272	T	95.9	Very high	94.1	Very high	39 Å²	39	35.8 Å²	35.8	24%	0.239	18%	0.177	C	C	.	.	H	α-helix	trans	-59.2	-39.3	-176.1	54	0	0	0	0	112.1	K195 H268 L269 Q276	K195-T272 PolarHBondContact NZ-OG1 3.3Å; H268-T272 WeakPolarHBondContact NE2-CG2 3.39Å; H268-T272 WeakPolarHBondContact O-CB 3.42Å; H268-T272 WeakPolarHBondContact O-CG2 3.45Å; H268-T272 PolarHBondContact O-N 3Å; H268-T272 PolarHBondContact O-OG1 3.47Å; L269-T272 PolarHBondContact O-OG1 3.4Å; T272-Q276 WeakPolarHBondContact O-CB 3.29Å; T272-Q276 PolarHBondContact O-N 2.98Å
273	T	95.7	Very high	93.9	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-71.8	-44.2	-179.4	-53.6	0	0	0	0	111.8	K195 I199 L241 L269 D271 Q276 A277 L290 L294	K195-T273 PolarHBondContact NZ-OG1 2.75Å; I199-T273 HydrophobicContact CD1-CG2 3.94Å; L241-T273 HydrophobicContact CD1-CG2 3.91Å; L241-T273 HydrophobicContact CD2-CG2 4.13Å; L269-T273 WeakPolarHBondContact O-CB 3.35Å; L269-T273 PolarHBondContact O-N 2.99Å; L269-T273 PolarHBondContact O-OG1 3.36Å; D271-T273 VanDerWaalsContact C-N 3.26Å; D271-T273 PolarHBondContact O-N 3.3Å; T273-Q276 PolarHBondContact O-N 2.98Å; T273-A277 PolarHBondContact O-N 3.22Å; T273-L290 HydrophobicContact CG2-CD2 4.16Å; T273-L294 HydrophobicContact CG2-CD1 4.19Å
274	M	93.7	Very high	93.4	Very high	2 Å²	2	40 Å²	40	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-72.8	-32.4	178.3	-64.6	-69.8	-78	0	0	112.2	L270 D271 A277 R278 T287 C291 M338 V340	L270-M274 VanDerWaalsContact O-CB 3.28Å; L270-M274 WeakPolarHBondContact O-CB 3.3Å; L270-M274 WeakPolarHBondContact O-CG 3.2Å; L270-M274 PolarHBondContact O-N 2.75Å; D271-M274 PolarHBondContact O-N 3.35Å; M274-A277 PolarHBondContact O-N 2.77Å; M274-R278 WeakPolarHBondContact O-CG 2.88Å; M274-R278 PolarHBondContact O-N 3.09Å; M274-R278 VanDerWaalsContact O-N 3.11Å; M274-T287 HydrophobicContact CE-CG2 3.52Å; M274-T287 HydrophobicContact SD-CG2 3.92Å; M274-C291 HydrophobicContact CE-CB 3.7Å; M274-C291 HydrophobicContact SD-CB 3.84Å; M274-M338 HydrophobicContact CB-CE 3.48Å; M274-M338 VanDerWaalsContact CB-CE 3.48Å; M274-M338 HydrophobicContact CG-CE 4.29Å; M274-V340 HydrophobicContact CE-CG1 3.91Å; M274-V340 HydrophobicContact CE-CG2 4.27Å
275	R	92.6	Very high	93.1	Very high	132 Å²	132	40 Å²	40	50%	0.498	21%	0.206	S	C	.	.	H	α-helix	trans	-64.6	-46.8	171.8	-175.7	-178.8	-59.4	-85.2	-8.1	110.8	D271 A277 R278 I279	D271-R275 WeakPolarHBondContact O-CB 3.49Å; D271-R275 PolarHBondContact O-N 2.98Å; D271-R275 IonicContact OD1-CZ 3.54Å; D271-R275 IonicContact OD1-NE 3.58Å; D271-R275 IonicContact OD1-NH2 4Å; D271-R275 PolarHBondContact OD1-NH2 2.84Å; D271-R275 IonicContact OD2-CZ 3.65Å; D271-R275 VanDerWaalsContact OD2-CZ 3.24Å; D271-R275 IonicContact OD2-NE 3.13Å; D271-R275 PolarHBondContact OD2-NE 3.21Å; D271-R275 IonicContact OD2-NH2 3.07Å; D271-R275 PolarHBondContact OD2-NH2 3.05Å; R275-A277 VanDerWaalsContact C-N 3.35Å; R275-A277 PolarHBondContact O-N 3.05Å; R275-R278 PolarHBondContact O-N 3.5Å; R275-I279 HydrophobicContact CG-CD1 3.96Å; R275-I279 VanDerWaalsContact O-CG1 3.31Å; R275-I279 WeakPolarHBondContact O-CG1 3.24Å; R275-I279 PolarHBondContact O-N 3.41Å
276	Q	92.8	Very high	92.9	Very high	32 Å²	32	35.2 Å²	35.2	15%	0.15	18%	0.18	C	C	.	.	H	α-helix	trans	-62.5	-40.6	175.1	-177.5	67.4	-6.3	0	0	111.8	D196 I199 T272 T273 R278 I279 C280	D196-Q276 HydrophobicContact CB-CG 4.13Å; D196-Q276 WeakPolarHBondContact OD1-CG 2.94Å; I199-Q276 HydrophobicContact CB-CG 4.3Å; I199-Q276 HydrophobicContact CD1-CB 4.21Å; I199-Q276 HydrophobicContact CD1-CG 4.04Å; I199-Q276 HydrophobicContact CG2-CG 4.02Å; T272-Q276 WeakPolarHBondContact O-CB 3.29Å; T272-Q276 PolarHBondContact O-N 2.98Å; T273-Q276 PolarHBondContact O-N 2.98Å; Q276-R278 PolarHBondContact O-N 3.27Å; Q276-I279 PolarHBondContact O-N 3Å; Q276-C280 PolarHBondContact NE2-SG 2.94Å; Q276-C280 WeakPolarHBondContact O-CB 3.41Å; Q276-C280 PolarHBondContact O-N 2.8Å; Q276-C280 PolarHBondContact O-SG 2.87Å
277	A	92.4	Very high	92.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57	-48	174.8	0	0	0	0	0	112.3	I199 T273 M274 R275 C280 G281 L282 T287	I199-A277 HydrophobicContact CG2-CB 4.23Å; T273-A277 PolarHBondContact O-N 3.22Å; M274-A277 PolarHBondContact O-N 2.77Å; R275-A277 VanDerWaalsContact C-N 3.35Å; R275-A277 PolarHBondContact O-N 3.05Å; A277-C280 PolarHBondContact O-N 3.34Å; A277-G281 PolarHBondContact O-N 3.38Å; A277-L282 HydrophobicContact CB-CB 4.14Å; A277-L282 HydrophobicContact CB-CD2 3.9Å; A277-L282 VanDerWaalsContact O-CB 3.31Å; A277-L282 WeakPolarHBondContact O-CB 3.31Å; A277-L282 PolarHBondContact O-N 2.73Å; A277-T287 HydrophobicContact CB-CG2 4.34Å
278	R	89.6	Confident	92.4	Very high	110 Å²	110	38.5 Å²	38.5	42%	0.415	20%	0.197	S	C	.	.	H	α-helix	trans	-63.3	-44.6	175.5	-67.7	175.9	-170.6	142	-2.2	112.4	M274 R275 Q276 C280 G281 M338	M274-R278 WeakPolarHBondContact O-CG 2.88Å; M274-R278 PolarHBondContact O-N 3.09Å; M274-R278 VanDerWaalsContact O-N 3.11Å; R275-R278 PolarHBondContact O-N 3.5Å; Q276-R278 PolarHBondContact O-N 3.27Å; R278-C280 VanDerWaalsContact C-N 3.27Å; R278-C280 PolarHBondContact O-N 3.05Å; R278-G281 PolarHBondContact O-N 3.05Å; R278-G281 VanDerWaalsContact O-N 3.1Å; R278-M338 VanDerWaalsContact NH1-CE 3.28Å; R278-M338 PolarHBondContact NH1-SD 2.93Å; R278-M338 PolarHBondContact NH2-O 3.04Å; R278-M338 PolarHBondContact NH2-SD 2.9Å; R278-M338 VanDerWaalsContact NH2-SD 3.38Å
279	I	88.4	Confident	92.2	Very high	92 Å²	92	34.2 Å²	34.2	47%	0.472	18%	0.178	S	C	.	.	H	α-helix	trans	-60.2	-37.9	177.4	-72.1	167.4	0	0	0	111.4	R152 R275 Q276 G281	R152-I279 HydrophobicContact CG-CG2 4.45Å; R152-I279 VanDerWaalsContact CG-O 3.25Å; R152-I279 WeakPolarHBondContact CG-O 3.46Å; R275-I279 HydrophobicContact CG-CD1 3.96Å; R275-I279 VanDerWaalsContact O-CG1 3.31Å; R275-I279 WeakPolarHBondContact O-CG1 3.24Å; R275-I279 PolarHBondContact O-N 3.41Å; Q276-I279 PolarHBondContact O-N 3Å; I279-G281 PolarHBondContact O-N 3.15Å
280	C	90.5	Very high	92.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-6.5	178.7	-65.2	0	0	0	0	114.1	L153 I199 A203 Q276 A277 R278	L153-C280 WeakPolarHBondContact CD2-O 3.49Å; I199-C280 HydrophobicContact CG2-CB 4.1Å; A203-C280 HydrophobicContact CB-CB 4.14Å; A203-C280 WeakPolarHBondContact CB-O 3.39Å; Q276-C280 PolarHBondContact NE2-SG 2.94Å; Q276-C280 WeakPolarHBondContact O-CB 3.41Å; Q276-C280 PolarHBondContact O-N 2.8Å; Q276-C280 PolarHBondContact O-SG 2.87Å; A277-C280 PolarHBondContact O-N 3.34Å; R278-C280 VanDerWaalsContact C-N 3.27Å; R278-C280 PolarHBondContact O-N 3.05Å
281	G	88.4	Confident	92.1	Very high	9 Å²	9	33.5 Å²	33.5	9%	0.093	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	30.4	-172.8	0	0	0	0	0	113.4	A277 R278 I279 N283 Y442	A277-G281 PolarHBondContact O-N 3.38Å; R278-G281 PolarHBondContact O-N 3.05Å; R278-G281 VanDerWaalsContact O-N 3.1Å; I279-G281 PolarHBondContact O-N 3.15Å; G281-N283 PolarHBondContact O-N 2.97Å; G281-Y442 WeakPolarHBondContact O-CD2 3.43Å
282	L	91.3	Very high	92.1	Very high	5 Å²	5	32.2 Å²	32.2	3%	0.026	17%	0.168	C	C	.	.			trans	-65.6	130.1	174.9	-173.2	65.8	0	0	0	109.6	L202 A203 A277 L286 T287	L202-L282 HydrophobicContact CB-CD1 4.32Å; L202-L282 HydrophobicContact CD2-CD1 3.82Å; L202-L282 HydrophobicContact CD2-CD2 4.12Å; L202-L282 HydrophobicContact CG-CD1 3.8Å; A203-L282 HydrophobicContact CB-CB 4.2Å; A203-L282 HydrophobicContact CB-CD1 4.04Å; A277-L282 HydrophobicContact CB-CB 4.14Å; A277-L282 HydrophobicContact CB-CD2 3.9Å; A277-L282 VanDerWaalsContact O-CB 3.31Å; A277-L282 WeakPolarHBondContact O-CB 3.31Å; A277-L282 PolarHBondContact O-N 2.73Å; L282-L286 HydrophobicContact CD1-CB 3.89Å; L282-L286 HydrophobicContact CD1-CD1 3.82Å; L282-L286 HydrophobicContact CD2-CB 4.21Å; L282-L286 HydrophobicContact CG-CB 3.94Å; L282-T287 PolarHBondContact O-OG1 3.19Å
283	N	89.7	Confident	92	Very high	25 Å²	25	31.7 Å²	31.7	13%	0.134	16%	0.163	C	C	.	.			trans	-53.9	144.9	178.9	174.8	-72.5	0	0	0	112	G281 A285 L286 T287 P438 D440	G281-N283 PolarHBondContact O-N 2.97Å; N283-A285 PolarHBondContact O-N 3.29Å; N283-A285 WeakPolarHBondContact OD1-CB 3.25Å; N283-A285 PolarHBondContact OD1-N 3.46Å; N283-L286 PolarHBondContact O-N 3.34Å; N283-L286 VanDerWaalsContact O-N 3.16Å; N283-T287 PolarHBondContact O-N 3.39Å; N283-T287 PolarHBondContact O-OG1 3.43Å; N283-P438 HydrophobicContact CB-CB 4.19Å; N283-P438 HydrophobicContact CB-CG 3.82Å; N283-P438 VanDerWaalsContact CG-CG 3.41Å; N283-P438 WeakPolarHBondContact ND2-CB 3.35Å; N283-P438 WeakPolarHBondContact OD1-CB 3.43Å; N283-P438 WeakPolarHBondContact OD1-CG 3.49Å; N283-D440 PolarHBondContact ND2-O 3.3Å
284	A	88.1	Confident	92.1	Very high	63 Å²	63	31.7 Å²	31.7	52%	0.521	16%	0.163	S	C	.	.	H	α-helix	trans	-56.2	-42	-177.2	0	0	0	0	0	113.7	L286 T287 I288	A284-L286 PolarHBondContact O-N 3.26Å; A284-T287 CarbonylContact O-C 3.56Å; A284-T287 WeakPolarHBondContact O-CB 3.28Å; A284-T287 PolarHBondContact O-N 2.7Å; A284-I288 VanDerWaalsContact O-CG1 3.29Å; A284-I288 WeakPolarHBondContact O-CG1 3.44Å; A284-I288 PolarHBondContact O-N 3.2Å
285	A	89.6	Confident	92.2	Very high	29 Å²	29	31.6 Å²	31.6	24%	0.24	16%	0.162	C	C	.	.	H	α-helix	trans	-69.8	-30.5	179.3	0	0	0	0	0	113.1	N283 Q289 P438	N283-A285 PolarHBondContact O-N 3.29Å; N283-A285 WeakPolarHBondContact OD1-CB 3.25Å; N283-A285 PolarHBondContact OD1-N 3.46Å; A285-Q289 WeakPolarHBondContact O-CB 3.47Å; A285-Q289 VanDerWaalsContact O-CG 3.31Å; A285-Q289 WeakPolarHBondContact O-CG 3.42Å; A285-Q289 PolarHBondContact O-N 2.9Å; A285-Q289 VanDerWaalsContact O-N 3.07Å; A285-Q289 PolarHBondContact O-NE2 2.9Å; A285-P438 HydrophobicContact CB-CG 4.31Å
286	L	92.6	Very high	92.4	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-72.8	-35.6	169.4	-74.9	170.7	0	0	0	111.6	L202 L282 N283 A284 Q289 L290 F435 P438	L202-L286 HydrophobicContact CG-CD1 4.5Å; L282-L286 HydrophobicContact CD1-CB 3.89Å; L282-L286 HydrophobicContact CD1-CD1 3.82Å; L282-L286 HydrophobicContact CD2-CB 4.21Å; L282-L286 HydrophobicContact CG-CB 3.94Å; N283-L286 PolarHBondContact O-N 3.34Å; N283-L286 VanDerWaalsContact O-N 3.16Å; A284-L286 PolarHBondContact O-N 3.26Å; L286-Q289 PolarHBondContact O-N 3.42Å; L286-L290 WeakPolarHBondContact O-CB 3.42Å; L286-L290 PolarHBondContact O-N 2.86Å; L286-F435 HydrophobicContact CD2-CE2 3.59Å; L286-F435 HydrophobicContact CD2-CZ 3.63Å; L286-P438 HydrophobicContact CD1-CG 3.89Å; L286-P438 HydrophobicContact CG-CG 3.65Å
287	T	92.3	Very high	92.5	Very high	12 Å²	12	25.1 Å²	25.1	7%	0.074	14%	0.138	C	C	.	.	H	α-helix	trans	-66.8	-40.2	176.3	-59	0	0	0	0	111.7	M274 A277 L282 N283 A284 L290 C291	M274-T287 HydrophobicContact CE-CG2 3.52Å; M274-T287 HydrophobicContact SD-CG2 3.92Å; A277-T287 HydrophobicContact CB-CG2 4.34Å; L282-T287 PolarHBondContact O-OG1 3.19Å; N283-T287 PolarHBondContact O-N 3.39Å; N283-T287 PolarHBondContact O-OG1 3.43Å; A284-T287 CarbonylContact O-C 3.56Å; A284-T287 WeakPolarHBondContact O-CB 3.28Å; A284-T287 PolarHBondContact O-N 2.7Å; T287-L290 PolarHBondContact O-N 2.99Å; T287-C291 WeakPolarHBondContact O-CB 3.35Å; T287-C291 PolarHBondContact O-N 2.91Å
288	I	91.3	Very high	92.7	Very high	91 Å²	91	25.4 Å²	25.4	47%	0.467	14%	0.139	S	C	.	.	H	α-helix	trans	-65.8	-46.2	172.8	-68.7	162.3	0	0	0	110.7	A284 L290 C291 G292 V340	A284-I288 VanDerWaalsContact O-CG1 3.29Å; A284-I288 WeakPolarHBondContact O-CG1 3.44Å; A284-I288 PolarHBondContact O-N 3.2Å; I288-L290 VanDerWaalsContact C-N 3.35Å; I288-L290 PolarHBondContact O-N 3.38Å; I288-C291 PolarHBondContact O-N 2.93Å; I288-G292 PolarHBondContact O-N 3.49Å; I288-V340 HydrophobicContact CG1-CG1 4.32Å
289	Q	93.7	Very high	93	Very high	31 Å²	31	20.3 Å²	20.3	15%	0.145	12%	0.12	C	C	.	.	H	α-helix	trans	-58.9	-44.1	175.3	-79.9	171.5	93.2	0	0	112	F234 A285 L286 G292 H293 L436	F234-Q289 HydrophobicContact CE2-CB 4.19Å; F234-Q289 HydrophobicContact CZ-CB 4.02Å; A285-Q289 WeakPolarHBondContact O-CB 3.47Å; A285-Q289 VanDerWaalsContact O-CG 3.31Å; A285-Q289 WeakPolarHBondContact O-CG 3.42Å; A285-Q289 PolarHBondContact O-N 2.9Å; A285-Q289 VanDerWaalsContact O-N 3.07Å; A285-Q289 PolarHBondContact O-NE2 2.9Å; L286-Q289 PolarHBondContact O-N 3.42Å; Q289-G292 PolarHBondContact O-N 3.19Å; Q289-H293 PolarHBondContact O-N 3.35Å; Q289-H293 PolarHBondContact O-ND1 3.02Å; Q289-L436 PolarHBondContact NE2-O 3.28Å
290	L	94.6	Very high	93.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.3	-44.9	176.5	-177.8	60.6	0	0	0	111.4	F234 L237 V238 L241 T273 L286 T287 I288 H293 L294	F234-L290 HydrophobicContact CE2-CB 4.08Å; F234-L290 HydrophobicContact CE2-CD1 4.41Å; L237-L290 HydrophobicContact CD2-CD1 3.83Å; L237-L290 HydrophobicContact CD2-CD2 3.95Å; L237-L290 HydrophobicContact CG-CD1 4.09Å; V238-L290 HydrophobicContact CG2-CD1 4.48Å; L241-L290 HydrophobicContact CD1-CD1 3.86Å; T273-L290 HydrophobicContact CG2-CD2 4.16Å; L286-L290 WeakPolarHBondContact O-CB 3.42Å; L286-L290 PolarHBondContact O-N 2.86Å; T287-L290 PolarHBondContact O-N 2.99Å; I288-L290 VanDerWaalsContact C-N 3.35Å; I288-L290 PolarHBondContact O-N 3.38Å; L290-H293 PolarHBondContact O-N 3.48Å; L290-L294 HydrophobicContact CD1-CD1 4.46Å; L290-L294 HydrophobicContact CG-CD1 4.16Å; L290-L294 WeakPolarHBondContact O-CG 3.01Å; L290-L294 PolarHBondContact O-N 2.93Å; L290-L294 VanDerWaalsContact O-N 3.07Å
291	C	94.8	Very high	93.5	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.007	10%	0.104	C	C	.	.	H	α-helix	trans	-61.7	-44.8	176.6	-163.6	0	0	0	0	112.1	M274 T287 I288 H293 L294 L295	M274-C291 HydrophobicContact CE-CB 3.7Å; M274-C291 HydrophobicContact SD-CB 3.84Å; T287-C291 WeakPolarHBondContact O-CB 3.35Å; T287-C291 PolarHBondContact O-N 2.91Å; I288-C291 PolarHBondContact O-N 2.93Å; C291-H293 VanDerWaalsContact C-N 3.35Å; C291-H293 PolarHBondContact O-N 2.91Å; C291-L294 PolarHBondContact O-N 2.93Å; C291-L294 VanDerWaalsContact O-N 3.15Å; C291-L295 WeakPolarHBondContact O-CB 3.24Å; C291-L295 WeakPolarHBondContact O-CD1 3.39Å; C291-L295 VanDerWaalsContact O-CG 3.31Å; C291-L295 WeakPolarHBondContact O-CG 3.15Å; C291-L295 PolarHBondContact O-N 2.9Å; C291-L295 VanDerWaalsContact SG-CD1 3.56Å
292	G	95.3	Very high	93.8	Very high	4 Å²	4	16.9 Å²	16.9	4%	0.041	10%	0.1	C	C	.	.	H	α-helix	trans	-59.6	-40.9	176.5	0	0	0	0	0	113.2	I288 Q289 H296	I288-G292 PolarHBondContact O-N 3.49Å; Q289-G292 PolarHBondContact O-N 3.19Å; G292-H296 VanDerWaalsContact O-CB 3.25Å; G292-H296 WeakPolarHBondContact O-CB 3.47Å; G292-H296 PolarHBondContact O-N 3.49Å
293	H	95.6	Very high	94	Very high	27 Å²	27	16.7 Å²	16.7	13%	0.125	10%	0.099	C	C	.	.	H	α-helix	trans	-64.2	-42.2	173.5	-75.2	73.7	0	0	0	112.2	F234 V238 Q289 L290 C291 H296 M297 L431	F234-H293 AromaticContact CE1-CE1 3.6Å; F234-H293 AromaticContact CE1-ND1 3.83Å; F234-H293 AromaticContact CE1-NE2 3.84Å; F234-H293 AromaticContact CZ-CE1 3.81Å; F234-H293 AromaticContact CZ-ND1 3.63Å; V238-H293 HydrophobicContact CG1-CB 4.31Å; V238-H293 HydrophobicContact CG2-CB 4.02Å; Q289-H293 PolarHBondContact O-N 3.35Å; Q289-H293 PolarHBondContact O-ND1 3.02Å; L290-H293 PolarHBondContact O-N 3.48Å; C291-H293 VanDerWaalsContact C-N 3.35Å; C291-H293 PolarHBondContact O-N 2.91Å; H293-H296 PolarHBondContact O-N 3.02Å; H293-M297 WeakPolarHBondContact O-CE 3.15Å; H293-M297 WeakPolarHBondContact O-CG 3.21Å; H293-M297 PolarHBondContact O-N 3.15Å; H293-L431 HydrophobicContact CB-CD2 4.48Å
294	L	95.8	Very high	94.2	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.7	-45.9	177.9	-68.9	162.9	0	0	0	111.8	L241 I245 L270 T273 L290 C291 M297 V298	L241-L294 HydrophobicContact CB-CD2 3.81Å; L241-L294 HydrophobicContact CD1-CD1 4.47Å; L241-L294 HydrophobicContact CD1-CD2 3.98Å; L241-L294 HydrophobicContact CG-CD2 4.34Å; I245-L294 HydrophobicContact CD1-CB 3.92Å; I245-L294 HydrophobicContact CD1-CD2 3.68Å; I245-L294 HydrophobicContact CD1-CG 4.44Å; I245-L294 WeakPolarHBondContact CD1-O 3.29Å; L270-L294 HydrophobicContact CD2-CB 3.81Å; L270-L294 HydrophobicContact CD2-CD1 4.13Å; T273-L294 HydrophobicContact CG2-CD1 4.19Å; L290-L294 HydrophobicContact CD1-CD1 4.46Å; L290-L294 HydrophobicContact CG-CD1 4.16Å; L290-L294 WeakPolarHBondContact O-CG 3.01Å; L290-L294 PolarHBondContact O-N 2.93Å; L290-L294 VanDerWaalsContact O-N 3.07Å; C291-L294 PolarHBondContact O-N 2.93Å; C291-L294 VanDerWaalsContact O-N 3.15Å; L294-M297 HydrophobicContact CD2-CE 3.82Å; L294-M297 HydrophobicContact CG-CE 4.39Å; L294-M297 PolarHBondContact O-N 3.25Å; L294-V298 PolarHBondContact O-N 2.95Å; L294-V298 VanDerWaalsContact O-N 3.09Å
295	L	96.6	Very high	94.4	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-67.4	-36.7	178.1	-67.2	161.6	0	0	0	111.8	L270 C291 V298 N299 I331 A343 A344 H347 L348	L270-L295 HydrophobicContact CD1-CD2 4.42Å; C291-L295 WeakPolarHBondContact O-CB 3.24Å; C291-L295 WeakPolarHBondContact O-CD1 3.39Å; C291-L295 VanDerWaalsContact O-CG 3.31Å; C291-L295 WeakPolarHBondContact O-CG 3.15Å; C291-L295 PolarHBondContact O-N 2.9Å; C291-L295 VanDerWaalsContact SG-CD1 3.56Å; L295-V298 PolarHBondContact O-N 3.36Å; L295-N299 PolarHBondContact O-N 3.03Å; L295-I331 HydrophobicContact CD2-CG2 4.08Å; L295-A343 HydrophobicContact CD1-CB 3.89Å; L295-A344 HydrophobicContact CD1-CB 4.14Å; L295-A344 HydrophobicContact CD2-CB 4.42Å; L295-H347 HydrophobicContact CB-CB 3.84Å; L295-L348 HydrophobicContact CB-CD2 4.33Å; L295-L348 HydrophobicContact CD2-CD1 3.91Å; L295-L348 HydrophobicContact CD2-CD2 4.17Å; L295-L348 HydrophobicContact CD2-CG 4.08Å; L295-L348 WeakPolarHBondContact O-CD2 3.31Å
296	H	96.5	Very high	94.6	Very high	15 Å²	15	13.3 Å²	13.3	7%	0.069	7%	0.069	C	C	.	.	H	α-helix	trans	-62.8	-42.7	171.6	-176.5	80.4	0	0	0	112.1	G292 H293 V298 N299 A300 S428 L431	G292-H296 VanDerWaalsContact O-CB 3.25Å; G292-H296 WeakPolarHBondContact O-CB 3.47Å; G292-H296 PolarHBondContact O-N 3.49Å; H293-H296 PolarHBondContact O-N 3.02Å; H296-V298 VanDerWaalsContact C-N 3.3Å; H296-V298 PolarHBondContact O-N 3.01Å; H296-N299 PolarHBondContact O-N 2.59Å; H296-A300 WeakPolarHBondContact O-CB 3.48Å; H296-A300 PolarHBondContact O-N 3.35Å; H296-S428 PolarHBondContact NE2-O 2.94Å; H296-L431 HydrophobicContact CB-CB 4.23Å; H296-L431 HydrophobicContact CB-CD1 4.37Å; H296-L431 HydrophobicContact CB-CD2 3.94Å; H296-L431 HydrophobicContact CB-CG 4.41Å
297	M	95.7	Very high	94.5	Very high	14 Å²	14	13.3 Å²	13.3	7%	0.069	7%	0.069	C	C	.	.	H	α-helix	trans	-64.7	-33.3	176.6	-72	-176.7	-67.9	0	0	112.7	V238 Q242 I245 H293 L294 F301	V238-M297 HydrophobicContact CG1-CE 4.07Å; V238-M297 HydrophobicContact CG1-SD 4.17Å; Q242-M297 HydrophobicContact CB-SD 3.48Å; Q242-M297 WeakPolarHBondContact CB-SD 3.39Å; Q242-M297 HydrophobicContact CG-SD 3.58Å; Q242-M297 VanDerWaalsContact CG-SD 3.58Å; I245-M297 HydrophobicContact CG2-CB 3.88Å; I245-M297 HydrophobicContact CG2-CE 4.17Å; I245-M297 HydrophobicContact CG2-SD 4.23Å; H293-M297 WeakPolarHBondContact O-CE 3.15Å; H293-M297 WeakPolarHBondContact O-CG 3.21Å; H293-M297 PolarHBondContact O-N 3.15Å; L294-M297 HydrophobicContact CD2-CE 3.82Å; L294-M297 HydrophobicContact CG-CE 4.39Å; L294-M297 PolarHBondContact O-N 3.25Å; M297-F301 VanDerWaalsContact O-CB 3.28Å; M297-F301 WeakPolarHBondContact O-CB 3.45Å; M297-F301 PolarHBondContact O-N 2.74Å; M297-F301 VanDerWaalsContact O-N 3.08Å
298	V	96.6	Very high	94.2	Very high	5 Å²	5	13.8 Å²	13.8	3%	0.03	7%	0.073	C	C	.	.	H	α-helix	trans	-66.7	-48	170.4	175.2	0	0	0	0	110.9	I245 L252 V266 L294 L295 H296 F301 V302 L348	I245-V298 HydrophobicContact CD1-CG2 3.68Å; I245-V298 HydrophobicContact CG1-CG2 3.78Å; L252-V298 HydrophobicContact CD1-CG1 3.81Å; V266-V298 HydrophobicContact CG1-CG2 3.93Å; L294-V298 PolarHBondContact O-N 2.95Å; L294-V298 VanDerWaalsContact O-N 3.09Å; L295-V298 PolarHBondContact O-N 3.36Å; H296-V298 VanDerWaalsContact C-N 3.3Å; H296-V298 PolarHBondContact O-N 3.01Å; V298-F301 PolarHBondContact O-N 2.7Å; V298-V302 HydrophobicContact CG1-CG2 4.26Å; V298-V302 WeakPolarHBondContact O-CB 3.39Å; V298-V302 WeakPolarHBondContact O-CG2 3.39Å; V298-V302 PolarHBondContact O-N 2.76Å; V298-L348 HydrophobicContact CB-CD2 4.15Å; V298-L348 HydrophobicContact CG1-CD2 4.04Å
299	N	96	Very high	93.3	Very high	3 Å²	3	14.1 Å²	14.1	2%	0.016	8%	0.079	C	C	.	.	H	α-helix	trans	-60.2	-51.8	177.7	175.8	87	0	0	0	111.7	L295 H296 F301 V302 F303 H347 L348 R350 S351	L295-N299 PolarHBondContact O-N 3.03Å; H296-N299 PolarHBondContact O-N 2.59Å; N299-F301 VanDerWaalsContact C-N 3.35Å; N299-F301 PolarHBondContact O-N 3.13Å; N299-V302 PolarHBondContact O-N 2.68Å; N299-F303 WeakPolarHBondContact O-CA 3.2Å; N299-F303 WeakPolarHBondContact O-CB 3.46Å; N299-F303 PolarHBondContact O-N 3.43Å; N299-H347 WeakPolarHBondContact CB-O 3.36Å; N299-H347 PolarHBondContact OD1-O 3.4Å; N299-L348 HydrophobicContact CB-CD2 4.34Å; N299-R350 WeakPolarHBondContact OD1-CB 3.34Å; N299-R350 PolarHBondContact OD1-N 3.17Å; N299-S351 PolarHBondContact O-OG 2.8Å; N299-S351 PolarHBondContact OD1-N 2.84Å; N299-S351 PolarHBondContact OD1-OG 3.49Å
300	A	94.7	Very high	91.7	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-59.2	-44.3	179.5	0	0	0	0	0	111.5	H296 N304 E427	H296-A300 WeakPolarHBondContact O-CB 3.48Å; H296-A300 PolarHBondContact O-N 3.35Å; A300-N304 WeakPolarHBondContact O-CB 3.36Å; A300-N304 PolarHBondContact O-N 3.27Å; A300-N304 PolarHBondContact O-ND2 2.76Å; A300-E427 HydrophobicContact CB-CB 4.27Å
301	F	93.9	Very high	90.1	Very high	28 Å²	28	25.8 Å²	25.8	12%	0.123	14%	0.142	C	C	.	.	H	α-helix	trans	-64.5	-51.6	176.8	175.1	-96.8	0	0	0	112.8	R246 A249 R250 L253 M297 V298 N299 S305	R246-F301 HydrophobicContact CG-CD2 3.78Å; R246-F301 HydrophobicContact CG-CE2 4.16Å; R246-F301 HydrophobicContact CG-CG 4.42Å; A249-F301 HydrophobicContact CB-CD1 3.49Å; A249-F301 VanDerWaalsContact CB-CD1 3.49Å; A249-F301 HydrophobicContact CB-CE1 4.12Å; A249-F301 HydrophobicContact CB-CG 4.28Å; A249-F301 WeakPolarHBondContact O-CE1 3.48Å; R250-F301 HydrophobicContact CB-CZ 4.49Å; R250-F301 HydrophobicContact CG-CE1 4.03Å; R250-F301 HydrophobicContact CG-CE2 4.43Å; R250-F301 HydrophobicContact CG-CZ 3.59Å; L253-F301 HydrophobicContact CD1-CE1 3.79Å; L253-F301 HydrophobicContact CD1-CZ 4.13Å; M297-F301 VanDerWaalsContact O-CB 3.28Å; M297-F301 WeakPolarHBondContact O-CB 3.45Å; M297-F301 PolarHBondContact O-N 2.74Å; M297-F301 VanDerWaalsContact O-N 3.08Å; V298-F301 PolarHBondContact O-N 2.7Å; N299-F301 VanDerWaalsContact C-N 3.35Å; N299-F301 PolarHBondContact O-N 3.13Å; F301-S305 WeakPolarHBondContact CZ-OG 3.45Å; F301-S305 WeakPolarHBondContact O-CB 3.06Å; F301-S305 PolarHBondContact O-N 2.83Å; F301-S305 PolarHBondContact O-OG 3.11Å
302	V	94.9	Very high	88.5	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.012	17%	0.174	C	C	.	.	H	α-helix	trans	-64.4	-46.5	-178	170.7	0	0	0	0	110.2	L252 L253 V298 N299 S305 L306 L324	L252-V302 HydrophobicContact CB-CG2 4.3Å; L252-V302 HydrophobicContact CD1-CG2 3.72Å; L253-V302 HydrophobicContact CD2-CG1 4.21Å; V298-V302 HydrophobicContact CG1-CG2 4.26Å; V298-V302 WeakPolarHBondContact O-CB 3.39Å; V298-V302 WeakPolarHBondContact O-CG2 3.39Å; V298-V302 PolarHBondContact O-N 2.76Å; N299-V302 PolarHBondContact O-N 2.68Å; V302-S305 PolarHBondContact O-N 2.89Å; V302-L306 WeakPolarHBondContact O-CG 3.02Å; V302-L306 PolarHBondContact O-N 3.28Å; V302-L324 HydrophobicContact CG1-CD2 3.97Å
303	F	95.4	Very high	86.7	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.8	-48.8	-179.4	-169.1	-91	0	0	0	112.2	N299 S305 L306 V307 R350 A354 L375 Q379 I383 E427	N299-F303 WeakPolarHBondContact O-CA 3.2Å; N299-F303 WeakPolarHBondContact O-CB 3.46Å; N299-F303 PolarHBondContact O-N 3.43Å; F303-S305 PolarHBondContact O-N 3.12Å; F303-L306 WeakPolarHBondContact O-CA 3.33Å; F303-L306 WeakPolarHBondContact O-CB 3.43Å; F303-L306 PolarHBondContact O-N 2.91Å; F303-V307 HydrophobicContact CD1-CG2 4.08Å; F303-V307 HydrophobicContact CE1-CG1 4.04Å; F303-V307 HydrophobicContact CE1-CG2 3.88Å; F303-V307 HydrophobicContact CZ-CG1 4.16Å; F303-V307 PolarHBondContact O-N 2.89Å; F303-R350 HydrophobicContact CD2-CB 4.04Å; F303-R350 HydrophobicContact CD2-CG 4.13Å; F303-R350 HydrophobicContact CE2-CB 4.25Å; F303-R350 HydrophobicContact CE2-CG 3.84Å; F303-R350 HydrophobicContact CZ-CG 4.26Å; F303-A354 HydrophobicContact CD2-CB 4.13Å; F303-A354 HydrophobicContact CE2-CB 3.98Å; F303-L375 HydrophobicContact CE2-CD2 3.69Å; F303-L375 HydrophobicContact CZ-CD2 4.14Å; F303-Q379 HydrophobicContact CE1-CG 3.86Å; F303-Q379 HydrophobicContact CZ-CB 4.01Å; F303-Q379 VanDerWaalsContact CZ-CD 3.44Å; F303-Q379 HydrophobicContact CZ-CG 3.66Å; F303-I383 HydrophobicContact CE2-CD1 4.41Å; F303-E427 HydrophobicContact CB-CG 4.49Å; F303-E427 HydrophobicContact CD1-CB 4.47Å; F303-E427 HydrophobicContact CD1-CG 3.78Å; F303-E427 HydrophobicContact CE1-CG 4.39Å; F303-E427 HydrophobicContact CG-CG 4.27Å
304	N	94.3	Very high	85.4	Confident	25 Å²	25	33.6 Å²	33.6	13%	0.134	20%	0.202	C	C	.	.	H	α-helix	trans	-65	-29.1	179.5	-67	-4.5	0	0	0	111.7	A300 L306 V307 S308 E426 E427	A300-N304 WeakPolarHBondContact O-CB 3.36Å; A300-N304 PolarHBondContact O-N 3.27Å; A300-N304 PolarHBondContact O-ND2 2.76Å; N304-L306 VanDerWaalsContact C-N 3.25Å; N304-L306 PolarHBondContact O-N 3.21Å; N304-V307 PolarHBondContact O-N 3.38Å; N304-S308 WeakPolarHBondContact O-CA 3.5Å; N304-S308 WeakPolarHBondContact O-CB 3.34Å; N304-S308 PolarHBondContact O-N 2.89Å; N304-E426 HydrophobicContact CB-CG 4.43Å; N304-E426 WeakPolarHBondContact OD1-CA 3.41Å; N304-E427 PolarHBondContact ND2-O 3.43Å; N304-E427 WeakPolarHBondContact OD1-CB 3.36Å; N304-E427 PolarHBondContact OD1-N 3.5Å
305	S	92.8	Very high	84.9	Confident	17 Å²	17	39.5 Å²	39.5	12%	0.119	23%	0.229	C	C	.	.	H	α-helix	trans	-68.5	-21.1	172.7	-58.3	0	0	0	0	114	F301 V302 F303	F301-S305 WeakPolarHBondContact CZ-OG 3.45Å; F301-S305 WeakPolarHBondContact O-CB 3.06Å; F301-S305 PolarHBondContact O-N 2.83Å; F301-S305 PolarHBondContact O-OG 3.11Å; V302-S305 PolarHBondContact O-N 2.89Å; F303-S305 PolarHBondContact O-N 3.12Å
306	L	92.6	Very high	84.7	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-90	-15.7	174.4	-62.4	171.2	0	0	0	113.5	L253 V302 F303 N304 L316 L320 L324 A354 L358	L253-L306 HydrophobicContact CD2-CD2 4.08Å; L253-L306 HydrophobicContact CD2-CG 4.38Å; V302-L306 WeakPolarHBondContact O-CG 3.02Å; V302-L306 PolarHBondContact O-N 3.28Å; F303-L306 WeakPolarHBondContact O-CA 3.33Å; F303-L306 WeakPolarHBondContact O-CB 3.43Å; F303-L306 PolarHBondContact O-N 2.91Å; N304-L306 VanDerWaalsContact C-N 3.25Å; N304-L306 PolarHBondContact O-N 3.21Å; L306-L316 HydrophobicContact CB-CD2 4.25Å; L306-L316 HydrophobicContact CD2-CD2 3.65Å; L306-L320 HydrophobicContact CD2-CD2 3.69Å; L306-L320 HydrophobicContact CD2-CG 4.48Å; L306-L324 HydrophobicContact CD1-CD1 3.96Å; L306-L324 HydrophobicContact CD2-CD1 4.13Å; L306-A354 HydrophobicContact CD1-CB 3.98Å; L306-L358 HydrophobicContact CD2-CD1 4.27Å
307	V	91.8	Very high	84.5	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-123.5	9.8	-178.7	-54.7	0	0	0	0	114.3	F303 N304 V309 I383 L425 E426	F303-V307 HydrophobicContact CD1-CG2 4.08Å; F303-V307 HydrophobicContact CE1-CG1 4.04Å; F303-V307 HydrophobicContact CE1-CG2 3.88Å; F303-V307 HydrophobicContact CZ-CG1 4.16Å; F303-V307 PolarHBondContact O-N 2.89Å; N304-V307 PolarHBondContact O-N 3.38Å; V307-V309 PolarHBondContact O-N 3.3Å; V307-I383 HydrophobicContact CG1-CD1 3.99Å; V307-I383 HydrophobicContact CG1-CG1 3.82Å; V307-L425 HydrophobicContact CB-CD1 3.9Å; V307-L425 HydrophobicContact CB-CG 3.96Å; V307-L425 HydrophobicContact CG1-CD1 4.36Å; V307-L425 HydrophobicContact CG2-CD1 4.37Å; V307-L425 HydrophobicContact CG2-CG 4.08Å; V307-L425 WeakPolarHBondContact O-CD2 3.3Å; V307-E426 HydrophobicContact CG2-CG 4.23Å
308	S	84.9	Confident	84.3	Confident	21 Å²	21	39.5 Å²	39.5	15%	0.147	23%	0.23	C	C	.	.			trans	-76.2	107.7	179.9	159.2	0	0	0	0	110.8	N304 N310 L311	N304-S308 WeakPolarHBondContact O-CA 3.5Å; N304-S308 WeakPolarHBondContact O-CB 3.34Å; N304-S308 PolarHBondContact O-N 2.89Å; S308-N310 VanDerWaalsContact C-N 3.25Å; S308-N310 PolarHBondContact O-N 3.27Å; S308-L311 WeakPolarHBondContact CB-O 3.48Å; S308-L311 PolarHBondContact OG-N 3.1Å; S308-L311 VanDerWaalsContact OG-N 3.1Å; S308-L311 PolarHBondContact OG-O 2.85Å
309	V	73.2	Confident	84.1	Confident	99 Å²	99	45 Å²	45	60%	0.6	25%	0.25	S	S	*	.	S	Bend	trans	-66.3	-28.1	176.5	-165.3	0	0	0	0	112.2	V307 L425	V307-V309 PolarHBondContact O-N 3.3Å; V309-L425 HydrophobicContact CG2-CD2 3.75Å
310	N	60.5	Low	84	Confident	139 Å²	139	44.9 Å²	44.9	74%	0.743	25%	0.25	S	C	*	.	S	Bend	trans	-89.6	-26.4	-170.7	-59.2	-67.3	0	0	0	113.5	S308	S308-N310 VanDerWaalsContact C-N 3.25Å; S308-N310 PolarHBondContact O-N 3.27Å
311	L	59.6	Low	84.1	Confident	137 Å²	137	44.9 Å²	44.9	72%	0.717	25%	0.25	S	C	*	.			trans	-148.6	85.5	-178.5	-75.7	172.4	0	0	0	107.9	S308 A313	S308-L311 WeakPolarHBondContact CB-O 3.48Å; S308-L311 PolarHBondContact OG-N 3.1Å; S308-L311 VanDerWaalsContact OG-N 3.1Å; S308-L311 PolarHBondContact OG-O 2.85Å; L311-A313 PolarHBondContact O-N 2.96Å; L311-A313 VanDerWaalsContact O-N 3.11Å
312	P	62.5	Low	84.1	Confident	106 Å²	106	48.4 Å²	48.4	69%	0.688	27%	0.265	S	S	*	.			trans	-68.2	106	171.4	27.2	-32.7	0	0	0	108.7	A314	P312-A314 VanDerWaalsContact C-N 3.33Å
313	A	58	Low	84.1	Confident	66 Å²	66	49.3 Å²	49.3	55%	0.545	27%	0.271	S	S	.	.			trans	-78.8	-17.6	-171.7	0	0	0	0	0	113.7	L311	L311-A313 PolarHBondContact O-N 2.96Å; L311-A313 VanDerWaalsContact O-N 3.11Å
314	A	67.8	Low	84.2	Confident	24 Å²	24	49.3 Å²	49.3	20%	0.198	27%	0.271	C	S	.	.	S	Bend	trans	-152.6	152.5	177.3	0	0	0	0	0	110.1	P312 L320	P312-A314 VanDerWaalsContact C-N 3.33Å; A314-L320 HydrophobicContact CB-CD1 4.44Å; A314-L320 HydrophobicContact CB-CD2 3.7Å
315	Q	85.3	Confident	84.3	Confident	124 Å²	124	51.1 Å²	51.1	58%	0.579	28%	0.279	S	S	*	.			trans	-70	132.3	171	-66.5	179.9	-87.5	0	0	109.8	N317 L320 E388	Q315-N317 VanDerWaalsContact C-N 3.32Å; Q315-N317 PolarHBondContact O-N 3.29Å; Q315-L320 VanDerWaalsContact O-CD2 3.29Å; Q315-L320 WeakPolarHBondContact O-CD2 3.3Å; Q315-E388 WeakPolarHBondContact CB-OE2 3.45Å; Q315-E388 VanDerWaalsContact CG-OE2 3.3Å; Q315-E388 WeakPolarHBondContact CG-OE2 3.2Å; Q315-E388 PolarHBondContact NE2-OE2 3.46Å
316	L	91.3	Very high	84.5	Confident	15 Å²	15	57.7 Å²	57.7	8%	0.079	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-83.3	73.4	-174.8	-62.5	-176.7	0	0	0	111	L306 L320 L358 G386 F387 E388	L306-L316 HydrophobicContact CB-CD2 4.25Å; L306-L316 HydrophobicContact CD2-CD2 3.65Å; L316-L320 HydrophobicContact CD2-CD2 4.3Å; L316-L358 HydrophobicContact CB-CD2 3.93Å; L316-L358 HydrophobicContact CD2-CD1 4.38Å; L316-G386 WeakPolarHBondContact CB-O 3.34Å; L316-F387 WeakPolarHBondContact O-CA 3.43Å; L316-F387 WeakPolarHBondContact O-CD2 3.22Å; L316-E388 PolarHBondContact O-N 3.23Å
317	N	92.1	Very high	84.7	Confident	10 Å²	10	57.4 Å²	57.4	5%	0.053	30%	0.301	C	S	.	.			trans	-109.9	168.7	178.3	66.8	9.6	0	0	0	113.4	Q315 R319 L320 G321 E388 D390	Q315-N317 VanDerWaalsContact C-N 3.32Å; Q315-N317 PolarHBondContact O-N 3.29Å; N317-R319 PolarHBondContact O-N 3.49Å; N317-L320 PolarHBondContact O-N 3.11Å; N317-L320 WeakPolarHBondContact OD1-CB 3.41Å; N317-L320 PolarHBondContact OD1-N 3.41Å; N317-G321 PolarHBondContact O-N 3.19Å; N317-G321 VanDerWaalsContact O-N 3.15Å; N317-E388 WeakPolarHBondContact CA-O 3.4Å; N317-E388 WeakPolarHBondContact CB-O 3.32Å; N317-D390 PolarHBondContact ND2-OD1 2.95Å
318	T	93	Very high	85	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.018	30%	0.303	C	S	.	.	H	α-helix	trans	-65.7	-27.7	179.6	-78	0	0	0	0	112.2	G321 K322 L358 K362 F387 E393	T318-G321 PolarHBondContact O-N 3.21Å; T318-K322 HydrophobicContact CG2-CD 3.9Å; T318-K322 HydrophobicContact CG2-CG 4.45Å; T318-K322 WeakPolarHBondContact O-CG 3.44Å; T318-K322 PolarHBondContact O-N 3.09Å; T318-L358 PolarHBondContact OG1-O 2.87Å; T318-K362 PolarHBondContact OG1-NZ 3.28Å; T318-F387 WeakPolarHBondContact OG1-CZ 3.4Å; T318-E393 VanDerWaalsContact CB-OE1 3.22Å; T318-E393 WeakPolarHBondContact CB-OE1 3.47Å; T318-E393 WeakPolarHBondContact CB-OE2 3.22Å; T318-E393 WeakPolarHBondContact CG2-OE1 3.31Å; T318-E393 PolarHBondContact OG1-OE1 3.04Å; T318-E393 PolarHBondContact OG1-OE2 3.29Å
319	R	92.4	Very high	85.5	Confident	121 Å²	121	60.2 Å²	60.2	46%	0.457	31%	0.312	S	S	.	.	H	α-helix	trans	-60.3	-50.4	171.3	177.9	177	174.8	157.3	-1.4	111.7	I255 N317 G321 K322 C323	I255-R319 PolarHBondContact O-NE 3.18Å; I255-R319 PolarHBondContact O-NH2 3.23Å; N317-R319 PolarHBondContact O-N 3.49Å; R319-G321 VanDerWaalsContact C-N 3.33Å; R319-G321 PolarHBondContact O-N 2.98Å; R319-K322 PolarHBondContact O-N 3.21Å; R319-C323 PolarHBondContact O-N 2.8Å
320	L	94.2	Very high	86.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-58.3	-45	175.7	176.5	62.4	0	0	0	111.4	L253 I255 L306 A314 Q315 L316 N317 K322 C323 L324	L253-L320 WeakPolarHBondContact O-CD1 3.48Å; I255-L320 HydrophobicContact CG2-CB 3.92Å; I255-L320 HydrophobicContact CG2-CD1 3.87Å; I255-L320 HydrophobicContact CG2-CG 4.49Å; L306-L320 HydrophobicContact CD2-CD2 3.69Å; L306-L320 HydrophobicContact CD2-CG 4.48Å; A314-L320 HydrophobicContact CB-CD1 4.44Å; A314-L320 HydrophobicContact CB-CD2 3.7Å; Q315-L320 VanDerWaalsContact O-CD2 3.29Å; Q315-L320 WeakPolarHBondContact O-CD2 3.3Å; L316-L320 HydrophobicContact CD2-CD2 4.3Å; N317-L320 PolarHBondContact O-N 3.11Å; N317-L320 WeakPolarHBondContact OD1-CB 3.41Å; N317-L320 PolarHBondContact OD1-N 3.41Å; L320-K322 PolarHBondContact O-N 3.32Å; L320-C323 PolarHBondContact O-N 2.98Å; L320-L324 HydrophobicContact CD1-CD1 3.92Å; L320-L324 HydrophobicContact CD1-CG 4.08Å; L320-L324 HydrophobicContact CG-CD1 3.97Å; L320-L324 WeakPolarHBondContact O-CB 3.48Å; L320-L324 WeakPolarHBondContact O-CG 3.2Å; L320-L324 PolarHBondContact O-N 3.32Å
321	G	95	Very high	88.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-54.5	-49.9	175.4	0	0	0	0	0	112.8	N317 T318 R319 L324 Q325	N317-G321 PolarHBondContact O-N 3.19Å; N317-G321 VanDerWaalsContact O-N 3.15Å; T318-G321 PolarHBondContact O-N 3.21Å; R319-G321 VanDerWaalsContact C-N 3.33Å; R319-G321 PolarHBondContact O-N 2.98Å; G321-L324 PolarHBondContact O-N 3.49Å; G321-Q325 WeakPolarHBondContact O-CG 3.38Å; G321-Q325 PolarHBondContact O-N 2.73Å
322	K	94.5	Very high	90.2	Very high	103 Å²	103	46.2 Å²	46.2	45%	0.448	24%	0.236	S	C	.	.	H	α-helix	trans	-64.8	-43.6	179	-72.6	165.8	-179.2	163.7	0	112.6	T318 R319 L320 Q325 Y326 A359	T318-K322 HydrophobicContact CG2-CD 3.9Å; T318-K322 HydrophobicContact CG2-CG 4.45Å; T318-K322 WeakPolarHBondContact O-CG 3.44Å; T318-K322 PolarHBondContact O-N 3.09Å; R319-K322 PolarHBondContact O-N 3.21Å; L320-K322 PolarHBondContact O-N 3.32Å; K322-Q325 WeakPolarHBondContact O-CB 3.45Å; K322-Q325 PolarHBondContact O-N 3.45Å; K322-Y326 WeakPolarHBondContact O-CD2 3.39Å; K322-Y326 PolarHBondContact O-N 2.92Å; K322-A359 HydrophobicContact CG-CB 3.98Å
323	C	95.8	Very high	91.7	Very high	20 Å²	20	47.5 Å²	47.5	14%	0.135	23%	0.227	C	C	.	.	H	α-helix	trans	-58.5	-48.2	174	-76.2	0	0	0	0	111.2	R319 L320 Q325 Y326 R327	R319-C323 PolarHBondContact O-N 2.8Å; L320-C323 PolarHBondContact O-N 2.98Å; C323-Q325 VanDerWaalsContact C-N 3.34Å; C323-Q325 PolarHBondContact O-N 3.44Å; C323-Y326 PolarHBondContact O-N 2.98Å; C323-R327 WeakPolarHBondContact O-CB 3.5Å; C323-R327 WeakPolarHBondContact O-CD 3.32Å; C323-R327 WeakPolarHBondContact O-CG 3.48Å; C323-R327 PolarHBondContact O-N 3.14Å
324	L	96.9	Very high	93.5	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-36.6	177.8	-74.1	172.3	0	0	0	112.8	L252 L253 V302 L306 L320 G321 R327 I328 A355	L252-L324 HydrophobicContact CB-CD2 4.41Å; L252-L324 VanDerWaalsContact O-CD2 3.29Å; L252-L324 WeakPolarHBondContact O-CD2 3.43Å; L253-L324 HydrophobicContact CD2-CD1 4.37Å; L253-L324 HydrophobicContact CD2-CD2 4.35Å; V302-L324 HydrophobicContact CG1-CD2 3.97Å; L306-L324 HydrophobicContact CD1-CD1 3.96Å; L306-L324 HydrophobicContact CD2-CD1 4.13Å; L320-L324 HydrophobicContact CD1-CD1 3.92Å; L320-L324 HydrophobicContact CD1-CG 4.08Å; L320-L324 HydrophobicContact CG-CD1 3.97Å; L320-L324 WeakPolarHBondContact O-CB 3.48Å; L320-L324 WeakPolarHBondContact O-CG 3.2Å; L320-L324 PolarHBondContact O-N 3.32Å; G321-L324 PolarHBondContact O-N 3.49Å; L324-R327 PolarHBondContact O-N 3Å; L324-I328 HydrophobicContact CB-CD1 4.36Å; L324-I328 VanDerWaalsContact O-CB 3.27Å; L324-I328 WeakPolarHBondContact O-CB 3.4Å; L324-I328 WeakPolarHBondContact O-CD1 3.27Å; L324-I328 WeakPolarHBondContact O-CG1 3.48Å; L324-I328 PolarHBondContact O-N 3.29Å; L324-A355 HydrophobicContact CB-CB 3.59Å
325	Q	95.9	Very high	94.8	Very high	62 Å²	62	44.1 Å²	44.1	29%	0.29	20%	0.196	S	C	.	.	H	α-helix	trans	-56.4	-53.7	173	-75.7	177.7	-42.7	0	0	111.7	G321 K322 C323 R327 E329 A355 N356 A359	G321-Q325 WeakPolarHBondContact O-CG 3.38Å; G321-Q325 PolarHBondContact O-N 2.73Å; K322-Q325 WeakPolarHBondContact O-CB 3.45Å; K322-Q325 PolarHBondContact O-N 3.45Å; C323-Q325 VanDerWaalsContact C-N 3.34Å; C323-Q325 PolarHBondContact O-N 3.44Å; Q325-R327 PolarHBondContact O-N 2.89Å; Q325-E329 VanDerWaalsContact O-CB 3.24Å; Q325-E329 WeakPolarHBondContact O-CB 3.29Å; Q325-E329 PolarHBondContact O-N 2.9Å; Q325-A355 HydrophobicContact CG-CB 4.07Å; Q325-N356 PolarHBondContact NE2-OD1 3.42Å; Q325-A359 HydrophobicContact CG-CB 4.43Å; Q325-A359 VanDerWaalsContact OE1-CB 3.25Å
326	Y	96.3	Very high	95.2	Very high	155 Å²	155	43.4 Å²	43.4	61%	0.608	19%	0.192	S	C	*	.	H	α-helix	trans	-65.7	-38.5	-179.8	-67.1	-61.5	0	0	0	112.8	K322 C323 S330	K322-Y326 WeakPolarHBondContact O-CD2 3.39Å; K322-Y326 PolarHBondContact O-N 2.92Å; C323-Y326 PolarHBondContact O-N 2.98Å; Y326-S330 WeakPolarHBondContact O-CB 3.47Å; Y326-S330 PolarHBondContact O-N 3.45Å
327	R	97.7	Very high	95.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-70.5	-42.3	-178.5	-67.4	165.9	-171.3	-163.1	-6.2	112.5	A251 L252 D254 L257 D259 A262 T263 C323 L324 Q325 S330 I331	A251-R327 PolarHBondContact O-NH1 3.04Å; L252-R327 VanDerWaalsContact C-NH1 3.34Å; L252-R327 HydrophobicContact CD2-CB 4.1Å; L252-R327 WeakPolarHBondContact O-CD 3.42Å; L252-R327 PolarHBondContact O-NH1 2.72Å; D254-R327 VanDerWaalsContact O-CZ 3.28Å; D254-R327 PolarHBondContact O-NH1 2.89Å; D254-R327 PolarHBondContact O-NH2 3.3Å; L257-R327 PolarHBondContact O-NH2 2.89Å; D259-R327 HydrophobicContact CB-CG 3.99Å; D259-R327 IonicContact OD1-CZ 3.9Å; D259-R327 IonicContact OD1-NE 3.61Å; D259-R327 PolarHBondContact OD1-NE 3.14Å; D259-R327 IonicContact OD1-NH2 2.72Å; D259-R327 PolarHBondContact OD1-NH2 3.27Å; A262-R327 HydrophobicContact CB-CG 4.42Å; A262-R327 VanDerWaalsContact CB-CZ 3.45Å; T263-R327 HydrophobicContact CG2-CB 3.6Å; T263-R327 HydrophobicContact CG2-CG 3.87Å; T263-R327 WeakPolarHBondContact CG2-O 3.36Å; C323-R327 WeakPolarHBondContact O-CB 3.5Å; C323-R327 WeakPolarHBondContact O-CD 3.32Å; C323-R327 WeakPolarHBondContact O-CG 3.48Å; C323-R327 PolarHBondContact O-N 3.14Å; L324-R327 PolarHBondContact O-N 3Å; Q325-R327 PolarHBondContact O-N 2.89Å; R327-S330 WeakPolarHBondContact O-CB 3.43Å; R327-S330 PolarHBondContact O-N 3.03Å; R327-I331 WeakPolarHBondContact O-CG1 3.32Å; R327-I331 PolarHBondContact O-N 2.95Å; R327-I331 VanDerWaalsContact O-N 3.16Å
328	I	97.6	Very high	95	Very high	10 Å²	10	52.4 Å²	52.4	5%	0.051	23%	0.226	C	C	.	.	H	α-helix	trans	-68.4	-39.5	176.2	-66.5	168.1	0	0	0	110.6	L324 S330 I331 H332 L348 R352 A355	L324-I328 HydrophobicContact CB-CD1 4.36Å; L324-I328 VanDerWaalsContact O-CB 3.27Å; L324-I328 WeakPolarHBondContact O-CB 3.4Å; L324-I328 WeakPolarHBondContact O-CD1 3.27Å; L324-I328 WeakPolarHBondContact O-CG1 3.48Å; L324-I328 PolarHBondContact O-N 3.29Å; I328-S330 VanDerWaalsContact C-N 3.34Å; I328-S330 PolarHBondContact O-N 3.48Å; I328-I331 PolarHBondContact O-N 3.07Å; I328-H332 PolarHBondContact O-N 3.22Å; I328-L348 HydrophobicContact CG2-CB 4.09Å; I328-L348 HydrophobicContact CG2-CD1 4.2Å; I328-R352 HydrophobicContact CG2-CB 4.17Å; I328-A355 HydrophobicContact CD1-CB 4.44Å
329	E	96.2	Very high	94.8	Very high	70 Å²	70	54.9 Å²	54.9	33%	0.327	25%	0.252	S	S	.	.	H	α-helix	trans	-62.5	-37.8	173	175.6	65.9	179.2	0	0	112.3	Q325 H332 R333	Q325-E329 VanDerWaalsContact O-CB 3.24Å; Q325-E329 WeakPolarHBondContact O-CB 3.29Å; Q325-E329 PolarHBondContact O-N 2.9Å; E329-H332 PolarHBondContact O-N 3.4Å; E329-R333 WeakPolarHBondContact O-CG 3.13Å; E329-R333 PolarHBondContact O-N 2.97Å; E329-R333 IonicContact OE1-CZ 3.89Å; E329-R333 IonicContact OE1-NE 3.33Å; E329-R333 PolarHBondContact OE1-NE 3.11Å; E329-R333 IonicContact OE1-NH2 3.34Å; E329-R333 PolarHBondContact OE1-NH2 3.49Å
330	S	97	Very high	94.6	Very high	41 Å²	41	49.7 Å²	49.7	29%	0.287	23%	0.234	S	C	.	.	H	α-helix	trans	-60.7	-45.3	173.7	-174.1	0	0	0	0	111.9	Y326 R327 I328 R333 F334	Y326-S330 WeakPolarHBondContact O-CB 3.47Å; Y326-S330 PolarHBondContact O-N 3.45Å; R327-S330 WeakPolarHBondContact O-CB 3.43Å; R327-S330 PolarHBondContact O-N 3.03Å; I328-S330 VanDerWaalsContact C-N 3.34Å; I328-S330 PolarHBondContact O-N 3.48Å; S330-R333 PolarHBondContact O-N 3.33Å; S330-F334 PolarHBondContact O-N 3.02Å
331	I	97.6	Very high	94.5	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.5	-41.1	174.6	-63	164.7	0	0	0	110.6	L252 T263 V266 I267 L270 L295 R327 I328 F334 C335 L348	L252-I331 HydrophobicContact CD1-CD1 4.1Å; L252-I331 HydrophobicContact CD2-CD1 3.88Å; T263-I331 HydrophobicContact CG2-CG1 4.4Å; V266-I331 HydrophobicContact CG1-CD1 3.98Å; V266-I331 HydrophobicContact CG1-CG1 4.45Å; I267-I331 HydrophobicContact CD1-CG1 4.47Å; I267-I331 HydrophobicContact CG1-CG1 4.19Å; L270-I331 HydrophobicContact CD1-CG2 4.06Å; L295-I331 HydrophobicContact CD2-CG2 4.08Å; R327-I331 WeakPolarHBondContact O-CG1 3.32Å; R327-I331 PolarHBondContact O-N 2.95Å; R327-I331 VanDerWaalsContact O-N 3.16Å; I328-I331 PolarHBondContact O-N 3.07Å; I331-F334 WeakPolarHBondContact O-CB 3.24Å; I331-F334 PolarHBondContact O-N 3.3Å; I331-C335 PolarHBondContact O-N 3.42Å; I331-C335 PolarHBondContact O-SG 2.91Å; I331-C335 VanDerWaalsContact O-SG 3.41Å; I331-L348 HydrophobicContact CB-CD1 4.3Å; I331-L348 HydrophobicContact CG2-CD1 3.79Å
332	H	96.1	Very high	94.2	Very high	39 Å²	39	58.5 Å²	58.5	18%	0.181	28%	0.276	C	S	.	.	H	α-helix	trans	-60	-49	176.9	-173.6	-89.3	0	0	0	112.3	I328 E329 F334 C335 E336	I328-H332 PolarHBondContact O-N 3.22Å; E329-H332 PolarHBondContact O-N 3.4Å; H332-F334 PolarHBondContact O-N 3.31Å; H332-C335 WeakPolarHBondContact O-CA 3.12Å; H332-C335 WeakPolarHBondContact O-CB 3.41Å; H332-C335 PolarHBondContact O-N 2.9Å; H332-E336 PolarHBondContact O-N 3.36Å
333	R	95.6	Very high	94	Very high	133 Å²	133	54.1 Å²	54.1	50%	0.502	26%	0.259	S	S	.	.	H	α-helix	trans	-67.1	-21	175.8	-67.4	-178.6	-166.3	170.7	7.9	113.7	E329 S330 R337	E329-R333 WeakPolarHBondContact O-CG 3.13Å; E329-R333 PolarHBondContact O-N 2.97Å; E329-R333 IonicContact OE1-CZ 3.89Å; E329-R333 IonicContact OE1-NE 3.33Å; E329-R333 PolarHBondContact OE1-NE 3.11Å; E329-R333 IonicContact OE1-NH2 3.34Å; E329-R333 PolarHBondContact OE1-NH2 3.49Å; S330-R333 PolarHBondContact O-N 3.33Å; R333-R337 WeakPolarHBondContact O-CG 3.36Å; R333-R337 PolarHBondContact O-N 3.49Å; R333-R337 PolarHBondContact O-NE 3.46Å
334	F	95.7	Very high	93.9	Very high	19 Å²	19	53.2 Å²	53.2	8%	0.083	25%	0.253	C	S	.	.	H	α-helix	trans	-70.6	-46.4	166.8	175.5	-95	0	0	0	111.1	I267 L270 D271 S330 I331 H332 E336 R337 M338	I267-F334 HydrophobicContact CD1-CB 4.41Å; I267-F334 HydrophobicContact CG1-CB 4.33Å; I267-F334 HydrophobicContact CG1-CG 4.41Å; I267-F334 HydrophobicContact CG2-CB 4.44Å; I267-F334 HydrophobicContact CG2-CD1 4.45Å; I267-F334 HydrophobicContact CG2-CD2 3.61Å; I267-F334 HydrophobicContact CG2-CE2 3.99Å; I267-F334 HydrophobicContact CG2-CG 3.87Å; L270-F334 HydrophobicContact CB-CD1 4.24Å; L270-F334 HydrophobicContact CB-CE1 3.66Å; L270-F334 HydrophobicContact CD1-CD1 4.38Å; D271-F334 HydrophobicContact CB-CE2 4.01Å; D271-F334 HydrophobicContact CB-CZ 3.6Å; S330-F334 PolarHBondContact O-N 3.02Å; I331-F334 WeakPolarHBondContact O-CB 3.24Å; I331-F334 PolarHBondContact O-N 3.3Å; H332-F334 PolarHBondContact O-N 3.31Å; F334-E336 PolarHBondContact O-N 3.04Å; F334-R337 PolarHBondContact O-N 2.93Å; F334-M338 HydrophobicContact CD1-CG 4.47Å; F334-M338 HydrophobicContact CE1-CE 4.33Å; F334-M338 HydrophobicContact CE1-CG 3.9Å; F334-M338 HydrophobicContact CE2-CG 4.17Å; F334-M338 HydrophobicContact CZ-CE 3.85Å; F334-M338 HydrophobicContact CZ-CG 3.73Å; F334-M338 HydrophobicContact CZ-SD 4.1Å; F334-M338 VanDerWaalsContact O-CG 3.24Å; F334-M338 WeakPolarHBondContact O-CG 3.18Å; F334-M338 PolarHBondContact O-N 3.41Å
335	C	95.3	Very high	93.6	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.007	27%	0.273	C	S	.	.	H	α-helix	trans	-62.9	-38.4	176.7	-68.7	0	0	0	0	113.4	I331 H332 M338 G339 V340 A344	I331-C335 PolarHBondContact O-N 3.42Å; I331-C335 PolarHBondContact O-SG 2.91Å; I331-C335 VanDerWaalsContact O-SG 3.41Å; H332-C335 WeakPolarHBondContact O-CA 3.12Å; H332-C335 WeakPolarHBondContact O-CB 3.41Å; H332-C335 PolarHBondContact O-N 2.9Å; C335-M338 CarbonylContact O-C 3.53Å; C335-M338 WeakPolarHBondContact O-CA 3.44Å; C335-M338 WeakPolarHBondContact O-CB 3.44Å; C335-M338 PolarHBondContact O-N 3.36Å; C335-G339 PolarHBondContact O-N 3.48Å; C335-G339 VanDerWaalsContact O-N 3.14Å; C335-V340 HydrophobicContact CB-CG2 3.93Å; C335-V340 WeakPolarHBondContact O-CG2 3.34Å; C335-V340 PolarHBondContact O-N 2.81Å; C335-A344 HydrophobicContact CB-CB 3.61Å
336	E	93.1	Very high	93.5	Very high	108 Å²	108	58.1 Å²	58.1	51%	0.505	28%	0.283	S	S	.	.	H	α-helix	trans	-59.5	-48.1	173.7	-175.6	-175.4	-171.8	0	0	112.3	H332 F334 M338 G339 E341	H332-E336 PolarHBondContact O-N 3.36Å; F334-E336 PolarHBondContact O-N 3.04Å; E336-M338 PolarHBondContact O-N 2.93Å; E336-G339 PolarHBondContact O-N 3.43Å; E336-G339 VanDerWaalsContact O-N 3.11Å; E336-E341 HydrophobicContact CB-CB 4.11Å; E336-E341 HydrophobicContact CG-CB 4.48Å
337	R	92.5	Very high	93.4	Very high	189 Å²	189	52.2 Å²	52.2	71%	0.713	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-9.6	173.5	-71.6	178.2	-68.2	166.8	1.2	113.8	R333 F334	R333-R337 WeakPolarHBondContact O-CG 3.36Å; R333-R337 PolarHBondContact O-N 3.49Å; R333-R337 PolarHBondContact O-NE 3.46Å; F334-R337 PolarHBondContact O-N 2.93Å
338	M	86.6	Confident	93.3	Very high	26 Å²	26	52.3 Å²	52.3	13%	0.128	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-2.3	179.8	-67.4	-75.2	-87.2	0	0	113.2	M274 R278 F334 C335 E336 V340	M274-M338 HydrophobicContact CB-CE 3.48Å; M274-M338 VanDerWaalsContact CB-CE 3.48Å; M274-M338 HydrophobicContact CG-CE 4.29Å; R278-M338 VanDerWaalsContact NH1-CE 3.28Å; R278-M338 PolarHBondContact NH1-SD 2.93Å; R278-M338 PolarHBondContact NH2-O 3.04Å; R278-M338 PolarHBondContact NH2-SD 2.9Å; R278-M338 VanDerWaalsContact NH2-SD 3.38Å; F334-M338 HydrophobicContact CD1-CG 4.47Å; F334-M338 HydrophobicContact CE1-CE 4.33Å; F334-M338 HydrophobicContact CE1-CG 3.9Å; F334-M338 HydrophobicContact CE2-CG 4.17Å; F334-M338 HydrophobicContact CZ-CE 3.85Å; F334-M338 HydrophobicContact CZ-CG 3.73Å; F334-M338 HydrophobicContact CZ-SD 4.1Å; F334-M338 VanDerWaalsContact O-CG 3.24Å; F334-M338 WeakPolarHBondContact O-CG 3.18Å; F334-M338 PolarHBondContact O-N 3.41Å; C335-M338 CarbonylContact O-C 3.53Å; C335-M338 WeakPolarHBondContact O-CA 3.44Å; C335-M338 WeakPolarHBondContact O-CB 3.44Å; C335-M338 PolarHBondContact O-N 3.36Å; E336-M338 PolarHBondContact O-N 2.93Å; M338-V340 HydrophobicContact CB-CG2 3.95Å
339	G	87.9	Confident	93.1	Very high	54 Å²	54	52.3 Å²	52.3	56%	0.557	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	33.9	-178	0	0	0	0	0	114	C335 E336 E341	C335-G339 PolarHBondContact O-N 3.48Å; C335-G339 VanDerWaalsContact O-N 3.14Å; E336-G339 PolarHBondContact O-N 3.43Å; E336-G339 VanDerWaalsContact O-N 3.11Å; G339-E341 WeakPolarHBondContact CA-OE2 3.47Å
340	V	88.6	Confident	93	Very high	13 Å²	13	50.3 Å²	50.3	8%	0.079	25%	0.251	C	S	.	.			trans	-136.7	24.1	-178.8	-67.3	0	0	0	0	112.6	M274 I288 C335 M338 M342 A343 A344	M274-V340 HydrophobicContact CE-CG1 3.91Å; M274-V340 HydrophobicContact CE-CG2 4.27Å; I288-V340 HydrophobicContact CG1-CG1 4.32Å; C335-V340 HydrophobicContact CB-CG2 3.93Å; C335-V340 WeakPolarHBondContact O-CG2 3.34Å; C335-V340 PolarHBondContact O-N 2.81Å; M338-V340 HydrophobicContact CB-CG2 3.95Å; V340-M342 VanDerWaalsContact C-N 3.31Å; V340-M342 PolarHBondContact O-N 2.85Å; V340-A343 WeakPolarHBondContact O-CB 3.46Å; V340-A343 PolarHBondContact O-N 2.84Å; V340-A343 VanDerWaalsContact O-N 3.09Å; V340-A344 PolarHBondContact O-N 3.48Å
341	E	92.4	Very high	92.9	Very high	65 Å²	65	48.5 Å²	48.5	30%	0.304	24%	0.238	S	C	.	.	H	α-helix	trans	-52.9	-42.3	177	59	-68.3	163.3	0	0	113.1	E336 G339 A343 A344 E345	E336-E341 HydrophobicContact CB-CB 4.11Å; E336-E341 HydrophobicContact CG-CB 4.48Å; G339-E341 WeakPolarHBondContact CA-OE2 3.47Å; E341-A343 PolarHBondContact O-N 3.05Å; E341-A344 CarbonylContact O-C 3.58Å; E341-A344 WeakPolarHBondContact O-CA 3.37Å; E341-A344 WeakPolarHBondContact O-CB 3.4Å; E341-A344 PolarHBondContact O-N 2.92Å; E341-E345 PolarHBondContact O-N 3.19Å
342	M	89.4	Confident	92.8	Very high	120 Å²	120	51.2 Å²	51.2	59%	0.591	25%	0.249	S	C	*	.	H	α-helix	trans	-61	-30.5	178.8	-63	-73.2	92.4	0	0	113	V340 E345 C346	V340-M342 VanDerWaalsContact C-N 3.31Å; V340-M342 PolarHBondContact O-N 2.85Å; M342-E345 WeakPolarHBondContact CE-OE2 3.15Å; M342-C346 VanDerWaalsContact O-CB 3.25Å; M342-C346 WeakPolarHBondContact O-CB 3.47Å; M342-C346 PolarHBondContact O-N 2.8Å
343	A	90.1	Very high	92.8	Very high	11 Å²	11	49.4 Å²	49.4	9%	0.091	24%	0.24	C	C	.	.	H	α-helix	trans	-72.6	-41	173	0	0	0	0	0	111	L295 V340 E341 C346 H347	L295-A343 HydrophobicContact CD1-CB 3.89Å; V340-A343 WeakPolarHBondContact O-CB 3.46Å; V340-A343 PolarHBondContact O-N 2.84Å; V340-A343 VanDerWaalsContact O-N 3.09Å; E341-A343 PolarHBondContact O-N 3.05Å; A343-C346 PolarHBondContact O-N 3.43Å; A343-H347 WeakPolarHBondContact O-CB 3.35Å; A343-H347 PolarHBondContact O-CD2 2.98Å; A343-H347 PolarHBondContact O-N 3.02Å
344	A	93.3	Very high	92.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.1	-43.5	177.6	0	0	0	0	0	112.2	L295 C335 V340 E341 C346 L348	L295-A344 HydrophobicContact CD1-CB 4.14Å; L295-A344 HydrophobicContact CD2-CB 4.42Å; C335-A344 HydrophobicContact CB-CB 3.61Å; V340-A344 PolarHBondContact O-N 3.48Å; E341-A344 CarbonylContact O-C 3.58Å; E341-A344 WeakPolarHBondContact O-CA 3.37Å; E341-A344 WeakPolarHBondContact O-CB 3.4Å; E341-A344 PolarHBondContact O-N 2.92Å; A344-C346 PolarHBondContact O-N 2.97Å; A344-L348 HydrophobicContact CB-CD1 4.37Å; A344-L348 WeakPolarHBondContact O-CB 3.42Å; A344-L348 PolarHBondContact O-N 3.41Å
345	E	91.4	Very high	92.8	Very high	94 Å²	94	42.2 Å²	42.2	44%	0.439	21%	0.212	S	C	.	.	H	α-helix	trans	-59	-46.5	175.2	-173.9	177.6	-164.4	0	0	111	E341 M342 D349 R352	E341-E345 PolarHBondContact O-N 3.19Å; M342-E345 WeakPolarHBondContact CE-OE2 3.15Å; E345-D349 WeakPolarHBondContact O-CB 3.38Å; E345-R352 PolarHBondContact O-NH2 3.07Å
346	C	92.1	Very high	92.9	Very high	73 Å²	73	44.2 Å²	44.2	49%	0.493	22%	0.223	S	C	.	.	H	α-helix	trans	-69.2	-48.5	-178.1	-179.6	0	0	0	0	113.4	M342 A343 A344 K374	M342-C346 VanDerWaalsContact O-CB 3.25Å; M342-C346 WeakPolarHBondContact O-CB 3.47Å; M342-C346 PolarHBondContact O-N 2.8Å; A343-C346 PolarHBondContact O-N 3.43Å; A344-C346 PolarHBondContact O-N 2.97Å; C346-K374 PolarHBondContact O-NZ 3.44Å
347	H	95.1	Very high	92.9	Very high	30 Å²	30	39 Å²	39	14%	0.139	20%	0.199	C	C	.	.	H	α-helix	trans	-86.3	-35.2	-169.9	-70.1	-70.7	0	0	0	114.1	L295 N299 A343 D349	L295-H347 HydrophobicContact CB-CB 3.84Å; N299-H347 WeakPolarHBondContact CB-O 3.36Å; N299-H347 PolarHBondContact OD1-O 3.4Å; A343-H347 WeakPolarHBondContact O-CB 3.35Å; A343-H347 PolarHBondContact O-CD2 2.98Å; A343-H347 PolarHBondContact O-N 3.02Å; H347-D349 PolarHBondContact O-N 2.79Å
348	L	95.9	Very high	93	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.016	17%	0.165	C	C	.	.	S	Bend	trans	-83.2	0.8	178.4	-57	179.1	0	0	0	113.5	L295 V298 N299 I328 I331 A344 R350 S351 R352	L295-L348 HydrophobicContact CB-CD2 4.33Å; L295-L348 HydrophobicContact CD2-CD1 3.91Å; L295-L348 HydrophobicContact CD2-CD2 4.17Å; L295-L348 HydrophobicContact CD2-CG 4.08Å; L295-L348 WeakPolarHBondContact O-CD2 3.31Å; V298-L348 HydrophobicContact CB-CD2 4.15Å; V298-L348 HydrophobicContact CG1-CD2 4.04Å; N299-L348 HydrophobicContact CB-CD2 4.34Å; I328-L348 HydrophobicContact CG2-CB 4.09Å; I328-L348 HydrophobicContact CG2-CD1 4.2Å; I331-L348 HydrophobicContact CB-CD1 4.3Å; I331-L348 HydrophobicContact CG2-CD1 3.79Å; A344-L348 HydrophobicContact CB-CD1 4.37Å; A344-L348 WeakPolarHBondContact O-CB 3.42Å; A344-L348 PolarHBondContact O-N 3.41Å; L348-R350 VanDerWaalsContact C-N 3.32Å; L348-R350 PolarHBondContact O-N 3.3Å; L348-S351 PolarHBondContact O-N 3.39Å; L348-R352 VanDerWaalsContact O-CB 3.29Å; L348-R352 WeakPolarHBondContact O-CB 3.34Å; L348-R352 PolarHBondContact O-N 2.93Å
349	D	93.3	Very high	93.4	Very high	10 Å²	10	29.6 Å²	29.6	5%	0.053	17%	0.165	C	C	.	.	H	α-helix	trans	-57.7	-38.1	-171.1	-163.3	13.8	0	0	0	113.9	E345 H347 R352 Q353 Y373 K374	E345-D349 WeakPolarHBondContact O-CB 3.38Å; H347-D349 PolarHBondContact O-N 2.79Å; D349-R352 PolarHBondContact O-N 3.4Å; D349-R352 IonicContact OD1-CZ 3.86Å; D349-R352 VanDerWaalsContact OD1-CZ 3.24Å; D349-R352 IonicContact OD1-NH1 2.81Å; D349-R352 PolarHBondContact OD1-NH1 3.39Å; D349-R352 IonicContact OD1-NH2 3.73Å; D349-R352 PolarHBondContact OD1-NH2 2.87Å; D349-Q353 VanDerWaalsContact CG-NE2 3.31Å; D349-Q353 WeakPolarHBondContact O-CB 3.32Å; D349-Q353 VanDerWaalsContact O-CG 3.25Å; D349-Q353 WeakPolarHBondContact O-CG 3.45Å; D349-Q353 PolarHBondContact O-N 2.59Å; D349-Q353 PolarHBondContact OD1-NE2 2.85Å; D349-Q353 PolarHBondContact OD2-NE2 3.1Å; D349-Y373 PolarHBondContact OD1-OH 2.9Å; D349-K374 HydrophobicContact CB-CD 4.15Å; D349-K374 VanDerWaalsContact CB-NZ 3.35Å; D349-K374 WeakPolarHBondContact OD2-CD 3.31Å; D349-K374 WeakPolarHBondContact OD2-CE 3.48Å; D349-K374 IonicContact OD2-NZ 2.6Å; D349-K374 PolarHBondContact OD2-NZ 3.08Å
350	R	93.7	Very high	93.6	Very high	28 Å²	28	28.3 Å²	28.3	11%	0.106	15%	0.146	C	C	.	.	H	α-helix	trans	-76.7	-43.9	-174.3	-133.9	167.9	-161.4	166.2	5.5	111.8	N299 F303 L348 R352 Q353 A354 K374 L375 E427	N299-R350 WeakPolarHBondContact OD1-CB 3.34Å; N299-R350 PolarHBondContact OD1-N 3.17Å; F303-R350 HydrophobicContact CD2-CB 4.04Å; F303-R350 HydrophobicContact CD2-CG 4.13Å; F303-R350 HydrophobicContact CE2-CB 4.25Å; F303-R350 HydrophobicContact CE2-CG 3.84Å; F303-R350 HydrophobicContact CZ-CG 4.26Å; L348-R350 VanDerWaalsContact C-N 3.32Å; L348-R350 PolarHBondContact O-N 3.3Å; R350-R352 VanDerWaalsContact C-N 3.3Å; R350-R352 PolarHBondContact O-N 3.46Å; R350-Q353 PolarHBondContact O-N 2.98Å; R350-A354 WeakPolarHBondContact O-CB 3.5Å; R350-A354 PolarHBondContact O-N 3.38Å; R350-K374 PolarHBondContact NE-O 3.31Å; R350-K374 PolarHBondContact NH2-O 3.46Å; R350-K374 VanDerWaalsContact NH2-O 3.09Å; R350-L375 HydrophobicContact CG-CD2 3.56Å; R350-E427 WeakPolarHBondContact CD-OE1 3.41Å; R350-E427 IonicContact CZ-OE1 3.47Å; R350-E427 IonicContact NE-OE1 3.54Å; R350-E427 IonicContact NH1-OE1 2.66Å; R350-E427 PolarHBondContact NH1-OE1 3.43Å; R350-E427 IonicContact NH1-OE2 3.51Å; R350-E427 PolarHBondContact NH1-OE2 2.99Å; R350-E427 VanDerWaalsContact NH1-OE2 3.1Å
351	S	95.6	Very high	93.7	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.014	17%	0.171	C	C	.	.	H	α-helix	trans	-60.5	-38.3	168	-57.6	0	0	0	0	112.1	N299 L348 A354 A355	N299-S351 PolarHBondContact O-OG 2.8Å; N299-S351 PolarHBondContact OD1-N 2.84Å; N299-S351 PolarHBondContact OD1-OG 3.49Å; L348-S351 PolarHBondContact O-N 3.39Å; S351-A354 PolarHBondContact O-N 2.68Å; S351-A355 VanDerWaalsContact O-CB 3.31Å; S351-A355 WeakPolarHBondContact O-CB 3.14Å; S351-A355 PolarHBondContact O-N 3.07Å
352	R	95.9	Very high	93.7	Very high	58 Å²	58	30.8 Å²	30.8	22%	0.219	16%	0.157	C	C	.	.	H	α-helix	trans	-63.6	-41.5	175.2	179.9	163.7	44.8	55.2	-4.2	112	I328 E345 L348 D349 R350 N356	I328-R352 HydrophobicContact CG2-CB 4.17Å; E345-R352 PolarHBondContact O-NH2 3.07Å; L348-R352 VanDerWaalsContact O-CB 3.29Å; L348-R352 WeakPolarHBondContact O-CB 3.34Å; L348-R352 PolarHBondContact O-N 2.93Å; D349-R352 PolarHBondContact O-N 3.4Å; D349-R352 IonicContact OD1-CZ 3.86Å; D349-R352 VanDerWaalsContact OD1-CZ 3.24Å; D349-R352 IonicContact OD1-NH1 2.81Å; D349-R352 PolarHBondContact OD1-NH1 3.39Å; D349-R352 IonicContact OD1-NH2 3.73Å; D349-R352 PolarHBondContact OD1-NH2 2.87Å; R350-R352 VanDerWaalsContact C-N 3.3Å; R350-R352 PolarHBondContact O-N 3.46Å; R352-N356 WeakPolarHBondContact O-CB 3.05Å; R352-N356 PolarHBondContact O-N 3.38Å; R352-N356 PolarHBondContact O-ND2 3.36Å
353	Q	95.8	Very high	93.7	Very high	1 Å²	1	29 Å²	29	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-70.1	-39.2	175.7	-71.5	-177.9	40.6	0	0	112.5	D349 R350 N356 L357 T371 C372 Y373 K374 L375	D349-Q353 VanDerWaalsContact CG-NE2 3.31Å; D349-Q353 WeakPolarHBondContact O-CB 3.32Å; D349-Q353 VanDerWaalsContact O-CG 3.25Å; D349-Q353 WeakPolarHBondContact O-CG 3.45Å; D349-Q353 PolarHBondContact O-N 2.59Å; D349-Q353 PolarHBondContact OD1-NE2 2.85Å; D349-Q353 PolarHBondContact OD2-NE2 3.1Å; R350-Q353 PolarHBondContact O-N 2.98Å; Q353-N356 PolarHBondContact O-N 3.38Å; Q353-L357 WeakPolarHBondContact O-CB 3.43Å; Q353-L357 PolarHBondContact O-N 2.89Å; Q353-T371 VanDerWaalsContact CB-O 3.28Å; Q353-T371 WeakPolarHBondContact CB-O 3.39Å; Q353-T371 WeakPolarHBondContact CG-O 3.46Å; Q353-T371 PolarHBondContact OE1-O 3.25Å; Q353-C372 VanDerWaalsContact OE1-C 3.31Å; Q353-Y373 HydrophobicContact CG-CE1 4.47Å; Q353-Y373 VanDerWaalsContact NE2-CE2 3.31Å; Q353-Y373 PolarHBondContact NE2-OH 3.07Å; Q353-Y373 VanDerWaalsContact OE1-N 3.15Å; Q353-K374 VanDerWaalsContact NE2-CB 3.31Å; Q353-L375 HydrophobicContact CB-CD1 4.16Å; Q353-L375 HydrophobicContact CB-CD2 4.02Å; Q353-L375 HydrophobicContact CB-CG 3.96Å
354	A	95.8	Very high	93.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.2	-45.5	172.9	0	0	0	0	0	112	F303 L306 R350 S351 N356 L357 L358 I383	F303-A354 HydrophobicContact CD2-CB 4.13Å; F303-A354 HydrophobicContact CE2-CB 3.98Å; L306-A354 HydrophobicContact CD1-CB 3.98Å; R350-A354 WeakPolarHBondContact O-CB 3.5Å; R350-A354 PolarHBondContact O-N 3.38Å; S351-A354 PolarHBondContact O-N 2.68Å; A354-N356 VanDerWaalsContact C-N 3.33Å; A354-N356 PolarHBondContact O-N 2.97Å; A354-L357 PolarHBondContact O-N 2.86Å; A354-L358 WeakPolarHBondContact O-CG 3.45Å; A354-L358 PolarHBondContact O-N 2.97Å; A354-I383 HydrophobicContact CB-CD1 3.92Å
355	A	95.9	Very high	93.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.3	-41.3	175.3	0	0	0	0	0	112.2	L324 Q325 I328 S351 A359	L324-A355 HydrophobicContact CB-CB 3.59Å; Q325-A355 HydrophobicContact CG-CB 4.07Å; I328-A355 HydrophobicContact CD1-CB 4.44Å; S351-A355 VanDerWaalsContact O-CB 3.31Å; S351-A355 WeakPolarHBondContact O-CB 3.14Å; S351-A355 PolarHBondContact O-N 3.07Å; A355-A359 VanDerWaalsContact O-CB 3.24Å; A355-A359 WeakPolarHBondContact O-CB 3.37Å; A355-A359 PolarHBondContact O-N 3.37Å
356	N	95.6	Very high	93.3	Very high	43 Å²	43	33.5 Å²	33.5	23%	0.23	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-43	173.5	-71.7	-17.1	0	0	0	112.5	Q325 R352 Q353 A354 A359 T360 T371	Q325-N356 PolarHBondContact NE2-OD1 3.42Å; R352-N356 WeakPolarHBondContact O-CB 3.05Å; R352-N356 PolarHBondContact O-N 3.38Å; R352-N356 PolarHBondContact O-ND2 3.36Å; Q353-N356 PolarHBondContact O-N 3.38Å; A354-N356 VanDerWaalsContact C-N 3.33Å; A354-N356 PolarHBondContact O-N 2.97Å; N356-A359 PolarHBondContact O-N 2.87Å; N356-T360 VanDerWaalsContact O-CB 3.32Å; N356-T360 WeakPolarHBondContact O-CB 3.44Å; N356-T360 PolarHBondContact O-N 3.06Å; N356-T360 PolarHBondContact O-OG1 3.43Å; N356-T371 HydrophobicContact CB-CG2 3.79Å
357	L	95	Very high	93.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.4	-41.2	179.3	-171	67.5	0	0	0	111.4	Q353 A354 L368 C372 L375 I383 L384	Q353-L357 WeakPolarHBondContact O-CB 3.43Å; Q353-L357 PolarHBondContact O-N 2.89Å; A354-L357 PolarHBondContact O-N 2.86Å; L357-L368 HydrophobicContact CD1-CB 4.33Å; L357-L368 HydrophobicContact CD1-CD2 3.76Å; L357-C372 HydrophobicContact CD1-CB 4.42Å; L357-L375 HydrophobicContact CB-CD1 4.49Å; L357-L375 HydrophobicContact CD2-CD1 3.87Å; L357-I383 HydrophobicContact CD2-CB 4.27Å; L357-I383 HydrophobicContact CD2-CG2 3.97Å; L357-I383 HydrophobicContact CG-CG2 4.48Å; L357-L384 HydrophobicContact CD1-CD1 4.48Å; L357-L384 HydrophobicContact CD1-CD2 4.07Å; L357-L384 HydrophobicContact CD2-CD2 4.18Å; L357-L384 HydrophobicContact CD2-CG 4.1Å; L357-L384 HydrophobicContact CG-CD2 3.87Å; L357-L384 HydrophobicContact CG-CG 4.34Å
358	L	94.2	Very high	93	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-64.4	-43.9	172.3	-71.7	173.7	0	0	0	112.2	L306 L316 T318 A354 T360 K362 I383 F387	L306-L358 HydrophobicContact CD2-CD1 4.27Å; L316-L358 HydrophobicContact CB-CD2 3.93Å; L316-L358 HydrophobicContact CD2-CD1 4.38Å; T318-L358 PolarHBondContact OG1-O 2.87Å; A354-L358 WeakPolarHBondContact O-CG 3.45Å; A354-L358 PolarHBondContact O-N 2.97Å; L358-T360 PolarHBondContact O-N 3.41Å; L358-K362 PolarHBondContact O-NZ 2.96Å; L358-I383 HydrophobicContact CD2-CG2 3.76Å; L358-I383 HydrophobicContact CG-CG2 4.01Å; L358-F387 HydrophobicContact CD2-CD2 3.98Å
359	A	93.6	Very high	92.6	Very high	16 Å²	16	30.2 Å²	30.2	13%	0.132	17%	0.173	C	C	.	.	H	α-helix	trans	-77.9	-15.6	-175.9	0	0	0	0	0	115.1	K322 Q325 A355 N356	K322-A359 HydrophobicContact CG-CB 3.98Å; Q325-A359 HydrophobicContact CG-CB 4.43Å; Q325-A359 VanDerWaalsContact OE1-CB 3.25Å; A355-A359 VanDerWaalsContact O-CB 3.24Å; A355-A359 WeakPolarHBondContact O-CB 3.37Å; A355-A359 PolarHBondContact O-N 3.37Å; N356-A359 PolarHBondContact O-N 2.87Å
360	T	93.3	Very high	92.3	Very high	26 Å²	26	33.7 Å²	33.7	16%	0.16	20%	0.198	C	C	.	.	S	Bend	trans	-81.5	145.7	-177.5	-62.8	0	0	0	0	111.5	N356 L358 K362 A367 L368	N356-T360 VanDerWaalsContact O-CB 3.32Å; N356-T360 WeakPolarHBondContact O-CB 3.44Å; N356-T360 PolarHBondContact O-N 3.06Å; N356-T360 PolarHBondContact O-OG1 3.43Å; L358-T360 PolarHBondContact O-N 3.41Å; T360-K362 PolarHBondContact O-N 3.09Å; T360-K362 PolarHBondContact O-NZ 3.34Å; T360-A367 HydrophobicContact CG2-CB 3.68Å; T360-L368 HydrophobicContact CG2-CD2 3.71Å; T360-L368 HydrophobicContact CG2-CG 3.94Å
361	Q	90.3	Very high	91.9	Very high	129 Å²	129	33.2 Å²	33.2	60%	0.603	20%	0.198	S	C	*	.			trans	-63.2	128.7	178	-63	-175.6	-4.4	0	0	110.8	N363 D364	Q361-N363 WeakPolarHBondContact CB-OD1 3.31Å; Q361-N363 PolarHBondContact O-N 2.79Å; Q361-N363 VanDerWaalsContact O-N 3.11Å; Q361-D364 PolarHBondContact O-N 3.21Å; Q361-D364 VanDerWaalsContact O-N 3.17Å
362	K	92.6	Very high	91.4	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.009	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-6.5	-168.1	-56.6	-55.9	176.7	-61.3	0	115.1	T318 L358 T360 L368 L384 F387 C396 V400	T318-K362 PolarHBondContact OG1-NZ 3.28Å; L358-K362 PolarHBondContact O-NZ 2.96Å; T360-K362 PolarHBondContact O-N 3.09Å; T360-K362 PolarHBondContact O-NZ 3.34Å; K362-L368 HydrophobicContact CD-CD2 4.45Å; K362-L384 HydrophobicContact CD-CD2 4.29Å; K362-F387 HydrophobicContact CD-CD1 4.26Å; K362-F387 HydrophobicContact CD-CE1 4.24Å; K362-F387 HydrophobicContact CD-CG 4.47Å; K362-F387 HydrophobicContact CD-CZ 4.45Å; K362-F387 VanDerWaalsContact CE-CZ 3.48Å; K362-F387 HydrophobicContact CG-CD1 3.98Å; K362-F387 HydrophobicContact CG-CE1 3.71Å; K362-F387 HydrophobicContact CG-CZ 4.21Å; K362-C396 HydrophobicContact CB-CB 4.1Å; K362-C396 HydrophobicContact CD-CB 4.41Å; K362-C396 HydrophobicContact CG-CB 4.17Å; K362-V400 WeakPolarHBondContact O-CG1 3.27Å
363	N	88.4	Confident	90.9	Very high	81 Å²	81	35.9 Å²	35.9	43%	0.433	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-19.4	173.7	60.7	-17	0	0	0	114.1	Q361 V365 I394	Q361-N363 WeakPolarHBondContact CB-OD1 3.31Å; Q361-N363 PolarHBondContact O-N 2.79Å; Q361-N363 VanDerWaalsContact O-N 3.11Å; N363-V365 PolarHBondContact O-N 3.43Å; N363-V365 VanDerWaalsContact O-N 3.1Å; N363-I394 WeakPolarHBondContact ND2-CD1 3.44Å
364	D	89.8	Confident	90.6	Very high	73 Å²	73	39 Å²	39	39%	0.39	22%	0.223	S	C	.	.			trans	-86.2	83.6	-179.9	-169.9	-14.8	0	0	0	111.5	Q361 A366 A367 L368	Q361-D364 PolarHBondContact O-N 3.21Å; Q361-D364 VanDerWaalsContact O-N 3.17Å; D364-A366 PolarHBondContact O-N 3.4Å; D364-A366 VanDerWaalsContact O-N 3.15Å; D364-A366 WeakPolarHBondContact OD1-CA 3.25Å; D364-A366 WeakPolarHBondContact OD1-CB 3.38Å; D364-A366 PolarHBondContact OD1-N 2.92Å; D364-A367 HydrophobicContact CB-CB 3.91Å; D364-A367 VanDerWaalsContact CG-CB 3.41Å; D364-A367 PolarHBondContact O-N 3.45Å; D364-A367 PolarHBondContact OD1-N 3.08Å; D364-A367 WeakPolarHBondContact OD2-CB 3.43Å; D364-L368 WeakPolarHBondContact O-CB 3.38Å; D364-L368 VanDerWaalsContact O-CG 3.23Å; D364-L368 WeakPolarHBondContact O-CG 3.33Å; D364-L368 PolarHBondContact O-N 2.78Å
365	V	89.3	Confident	90.5	Very high	48 Å²	48	39 Å²	39	29%	0.291	22%	0.223	S	C	.	.	H	α-helix	trans	-54.7	-30.1	176.5	-175	0	0	0	0	112.4	N363 G369 V400 R403 I404	N363-V365 PolarHBondContact O-N 3.43Å; N363-V365 VanDerWaalsContact O-N 3.1Å; V365-G369 PolarHBondContact O-N 2.94Å; V365-V400 HydrophobicContact CG2-CG1 4.4Å; V365-V400 HydrophobicContact CG2-CG2 4.23Å; V365-R403 HydrophobicContact CG1-CB 4.08Å; V365-I404 HydrophobicContact CB-CD1 4.5Å; V365-I404 HydrophobicContact CG1-CD1 3.75Å; V365-I404 WeakPolarHBondContact O-CD1 3.47Å
366	A	88.6	Confident	90.5	Very high	79 Å²	79	39.1 Å²	39.1	65%	0.653	22%	0.223	S	C	*	.	H	α-helix	trans	-78.6	-42.7	-179.4	0	0	0	0	0	111.6	D364 S370	D364-A366 PolarHBondContact O-N 3.4Å; D364-A366 VanDerWaalsContact O-N 3.15Å; D364-A366 WeakPolarHBondContact OD1-CA 3.25Å; D364-A366 WeakPolarHBondContact OD1-CB 3.38Å; D364-A366 PolarHBondContact OD1-N 2.92Å; A366-S370 PolarHBondContact O-N 3.41Å; A366-S370 VanDerWaalsContact O-N 3.12Å
367	A	89.7	Confident	90.5	Very high	27 Å²	27	37.7 Å²	37.7	22%	0.223	22%	0.217	C	C	.	.	H	α-helix	trans	-62.7	-53.1	171.8	0	0	0	0	0	110.8	T360 D364 G369 S370 T371	T360-A367 HydrophobicContact CG2-CB 3.68Å; D364-A367 HydrophobicContact CB-CB 3.91Å; D364-A367 VanDerWaalsContact CG-CB 3.41Å; D364-A367 PolarHBondContact O-N 3.45Å; D364-A367 PolarHBondContact OD1-N 3.08Å; D364-A367 WeakPolarHBondContact OD2-CB 3.43Å; A367-G369 VanDerWaalsContact C-N 3.33Å; A367-G369 PolarHBondContact O-N 2.7Å; A367-S370 WeakPolarHBondContact O-CA 3.29Å; A367-S370 WeakPolarHBondContact O-CB 3.42Å; A367-S370 PolarHBondContact O-N 2.77Å; A367-S370 PolarHBondContact O-OG 3.33Å; A367-T371 WeakPolarHBondContact O-CG2 3.32Å; A367-T371 PolarHBondContact O-N 2.81Å
368	L	90.4	Very high	90.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-52.6	-50.7	178.2	-67.4	166.3	0	0	0	111.2	L357 T360 K362 D364 S370 T371 V400 I404	L357-L368 HydrophobicContact CD1-CB 4.33Å; L357-L368 HydrophobicContact CD1-CD2 3.76Å; T360-L368 HydrophobicContact CG2-CD2 3.71Å; T360-L368 HydrophobicContact CG2-CG 3.94Å; K362-L368 HydrophobicContact CD-CD2 4.45Å; D364-L368 WeakPolarHBondContact O-CB 3.38Å; D364-L368 VanDerWaalsContact O-CG 3.23Å; D364-L368 WeakPolarHBondContact O-CG 3.33Å; D364-L368 PolarHBondContact O-N 2.78Å; L368-S370 PolarHBondContact O-N 2.8Å; L368-T371 PolarHBondContact O-N 3.17Å; L368-T371 PolarHBondContact O-OG1 3.33Å; L368-V400 HydrophobicContact CD1-CG1 3.6Å; L368-I404 HydrophobicContact CB-CD1 3.77Å; L368-I404 HydrophobicContact CB-CG1 4.07Å; L368-I404 HydrophobicContact CD1-CG1 4.48Å
369	G	87.3	Confident	90.5	Very high	11 Å²	11	41.6 Å²	41.6	11%	0.113	24%	0.237	C	C	.	.	H	α-helix	trans	-64.4	-22	178.7	0	0	0	0	0	114.9	V365 A367 L407	V365-G369 PolarHBondContact O-N 2.94Å; A367-G369 VanDerWaalsContact C-N 3.33Å; A367-G369 PolarHBondContact O-N 2.7Å; G369-L407 VanDerWaalsContact CA-CD2 3.47Å; G369-L407 WeakPolarHBondContact O-CD2 3.4Å
370	S	88.2	Confident	90.6	Very high	83 Å²	83	40.9 Å²	40.9	58%	0.58	23%	0.231	S	C	*	.	H	α-helix	trans	-79.6	-23.3	172.1	78	0	0	0	0	113.4	A366 A367 L368	A366-S370 PolarHBondContact O-N 3.41Å; A366-S370 VanDerWaalsContact O-N 3.12Å; A367-S370 WeakPolarHBondContact O-CA 3.29Å; A367-S370 WeakPolarHBondContact O-CB 3.42Å; A367-S370 PolarHBondContact O-N 2.77Å; A367-S370 PolarHBondContact O-OG 3.33Å; L368-S370 PolarHBondContact O-N 2.8Å
371	T	85.9	Confident	90.7	Very high	17 Å²	17	42.1 Å²	42.1	10%	0.104	24%	0.239	C	C	.	.	H	α-helix	trans	-84.8	-21.3	-175.6	62.4	0	0	0	0	114.6	Q353 N356 A367 L368	Q353-T371 VanDerWaalsContact CB-O 3.28Å; Q353-T371 WeakPolarHBondContact CB-O 3.39Å; Q353-T371 WeakPolarHBondContact CG-O 3.46Å; Q353-T371 PolarHBondContact OE1-O 3.25Å; N356-T371 HydrophobicContact CB-CG2 3.79Å; A367-T371 WeakPolarHBondContact O-CG2 3.32Å; A367-T371 PolarHBondContact O-N 2.81Å; L368-T371 PolarHBondContact O-N 3.17Å; L368-T371 PolarHBondContact O-OG1 3.33Å
372	C	83.7	Confident	90.8	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.007	22%	0.221	C	C	.	.			trans	-110.4	22	-163.1	69.2	0	0	0	0	115.6	Q353 L357 K374 L375 V380 I404	Q353-C372 VanDerWaalsContact OE1-C 3.31Å; L357-C372 HydrophobicContact CD1-CB 4.42Å; C372-K374 PolarHBondContact O-N 3.23Å; C372-L375 HydrophobicContact CB-CB 4.19Å; C372-L375 HydrophobicContact CB-CD1 3.95Å; C372-L375 HydrophobicContact CB-CG 4.22Å; C372-L375 PolarHBondContact O-N 2.74Å; C372-V380 HydrophobicContact CB-CG2 4.08Å; C372-I404 VanDerWaalsContact SG-CG2 3.52Å
373	Y	86.6	Confident	90.9	Very high	115 Å²	115	38.4 Å²	38.4	45%	0.451	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-13.4	-169.2	65.7	-97	0	0	0	116.3	D349 Q353	D349-Y373 PolarHBondContact OD1-OH 2.9Å; Q353-Y373 HydrophobicContact CG-CE1 4.47Å; Q353-Y373 VanDerWaalsContact NE2-CE2 3.31Å; Q353-Y373 PolarHBondContact NE2-OH 3.07Å; Q353-Y373 VanDerWaalsContact OE1-N 3.15Å
374	K	88.6	Confident	91.1	Very high	67 Å²	67	34.7 Å²	34.7	29%	0.291	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118	-4.5	177.4	-163.6	173.2	177	174.8	0	112.7	C346 D349 R350 Q353 C372	C346-K374 PolarHBondContact O-NZ 3.44Å; D349-K374 HydrophobicContact CB-CD 4.15Å; D349-K374 VanDerWaalsContact CB-NZ 3.35Å; D349-K374 WeakPolarHBondContact OD2-CD 3.31Å; D349-K374 WeakPolarHBondContact OD2-CE 3.48Å; D349-K374 IonicContact OD2-NZ 2.6Å; D349-K374 PolarHBondContact OD2-NZ 3.08Å; R350-K374 PolarHBondContact NE-O 3.31Å; R350-K374 PolarHBondContact NH2-O 3.46Å; R350-K374 VanDerWaalsContact NH2-O 3.09Å; Q353-K374 VanDerWaalsContact NE2-CB 3.31Å; C372-K374 PolarHBondContact O-N 3.23Å
375	L	94.4	Very high	91.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.21	C	C	.	.	S	Bend	trans	-82.8	126.2	172.2	-54.7	-173.8	0	0	0	108.4	F303 R350 Q353 L357 C372 Q379 V380 A412	F303-L375 HydrophobicContact CE2-CD2 3.69Å; F303-L375 HydrophobicContact CZ-CD2 4.14Å; R350-L375 HydrophobicContact CG-CD2 3.56Å; Q353-L375 HydrophobicContact CB-CD1 4.16Å; Q353-L375 HydrophobicContact CB-CD2 4.02Å; Q353-L375 HydrophobicContact CB-CG 3.96Å; L357-L375 HydrophobicContact CB-CD1 4.49Å; L357-L375 HydrophobicContact CD2-CD1 3.87Å; C372-L375 HydrophobicContact CB-CB 4.19Å; C372-L375 HydrophobicContact CB-CD1 3.95Å; C372-L375 HydrophobicContact CB-CG 4.22Å; C372-L375 PolarHBondContact O-N 2.74Å; L375-Q379 HydrophobicContact CB-CB 4.46Å; L375-V380 HydrophobicContact CB-CG2 3.67Å; L375-A412 WeakPolarHBondContact O-CB 3.14Å
376	N	95	Very high	91.2	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.011	21%	0.213	C	C	.	.			trans	-77.9	168.4	177.6	69.4	46.6	0	0	0	112	L378 Q379 V380 D413 V423 T424	N376-L378 VanDerWaalsContact C-N 3.32Å; N376-L378 PolarHBondContact O-N 2.87Å; N376-L378 WeakPolarHBondContact OD1-CB 3.43Å; N376-L378 PolarHBondContact OD1-N 2.9Å; N376-Q379 VanDerWaalsContact CG-CD 3.5Å; N376-Q379 PolarHBondContact ND2-NE2 3.17Å; N376-Q379 PolarHBondContact ND2-OE1 3.16Å; N376-Q379 WeakPolarHBondContact O-CB 3.29Å; N376-Q379 PolarHBondContact O-N 3.41Å; N376-Q379 VanDerWaalsContact O-N 3.11Å; N376-Q379 VanDerWaalsContact OD1-CG 3.3Å; N376-Q379 WeakPolarHBondContact OD1-CG 3.48Å; N376-Q379 PolarHBondContact OD1-N 2.87Å; N376-V380 WeakPolarHBondContact O-CG2 3.38Å; N376-V380 PolarHBondContact O-N 2.99Å; N376-D413 VanDerWaalsContact CA-OD1 3.24Å; N376-D413 WeakPolarHBondContact CA-OD1 3.27Å; N376-D413 VanDerWaalsContact CB-OD1 3.28Å; N376-D413 WeakPolarHBondContact CB-OD1 3.48Å; N376-V423 HydrophobicContact CB-CG1 3.85Å; N376-T424 PolarHBondContact ND2-O 3.34Å
377	S	95.2	Very high	91.4	Very high	14 Å²	14	31.5 Å²	31.5	10%	0.098	19%	0.185	C	C	.	.	H	α-helix	trans	-51.3	-47.7	-178.1	58.2	0	0	0	0	112.7	Q379 V380 V381 D413	S377-Q379 PolarHBondContact O-N 2.75Å; S377-V380 PolarHBondContact O-N 2.81Å; S377-V381 WeakPolarHBondContact O-CB 3.41Å; S377-V381 VanDerWaalsContact O-CG2 3.26Å; S377-V381 WeakPolarHBondContact O-CG2 3.4Å; S377-V381 PolarHBondContact O-N 3.31Å; S377-D413 VanDerWaalsContact CB-OD2 3.28Å; S377-D413 WeakPolarHBondContact CB-OD2 3.35Å; S377-D413 PolarHBondContact N-OD1 2.78Å; S377-D413 PolarHBondContact OG-OD2 2.68Å
378	L	95	Very high	91.5	Very high	83 Å²	83	34.7 Å²	34.7	44%	0.435	20%	0.195	S	C	.	.	H	α-helix	trans	-61.6	-43.4	178.9	-54.2	-178.4	0	0	0	111.9	N376 H382 V423 L425	N376-L378 VanDerWaalsContact C-N 3.32Å; N376-L378 PolarHBondContact O-N 2.87Å; N376-L378 WeakPolarHBondContact OD1-CB 3.43Å; N376-L378 PolarHBondContact OD1-N 2.9Å; L378-H382 VanDerWaalsContact O-CB 3.29Å; L378-H382 WeakPolarHBondContact O-CB 3.26Å; L378-H382 PolarHBondContact O-N 2.78Å; L378-V423 HydrophobicContact CD1-CG1 3.92Å; L378-V423 HydrophobicContact CG-CG1 3.97Å; L378-L425 HydrophobicContact CB-CD1 4.34Å
379	Q	95.1	Very high	91.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.4	-45.8	178.1	-70.6	167.7	-12	0	0	111.8	F303 L375 N376 S377 I383 T424 L425	F303-Q379 HydrophobicContact CE1-CG 3.86Å; F303-Q379 HydrophobicContact CZ-CB 4.01Å; F303-Q379 VanDerWaalsContact CZ-CD 3.44Å; F303-Q379 HydrophobicContact CZ-CG 3.66Å; L375-Q379 HydrophobicContact CB-CB 4.46Å; N376-Q379 VanDerWaalsContact CG-CD 3.5Å; N376-Q379 PolarHBondContact ND2-NE2 3.17Å; N376-Q379 PolarHBondContact ND2-OE1 3.16Å; N376-Q379 WeakPolarHBondContact O-CB 3.29Å; N376-Q379 PolarHBondContact O-N 3.41Å; N376-Q379 VanDerWaalsContact O-N 3.11Å; N376-Q379 VanDerWaalsContact OD1-CG 3.3Å; N376-Q379 WeakPolarHBondContact OD1-CG 3.48Å; N376-Q379 PolarHBondContact OD1-N 2.87Å; S377-Q379 PolarHBondContact O-N 2.75Å; Q379-I383 WeakPolarHBondContact O-CB 3.4Å; Q379-I383 WeakPolarHBondContact O-CD1 3.42Å; Q379-I383 VanDerWaalsContact O-CG1 3.24Å; Q379-I383 WeakPolarHBondContact O-CG1 3.24Å; Q379-I383 PolarHBondContact O-N 3.38Å; Q379-T424 PolarHBondContact NE2-O 3.39Å; Q379-L425 HydrophobicContact CG-CD1 4.36Å; Q379-L425 WeakPolarHBondContact CG-O 3.39Å; Q379-L425 PolarHBondContact NE2-O 2.75Å
380	V	95.1	Very high	91.4	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-48.5	176.8	165.3	0	0	0	0	111.2	C372 L375 N376 S377 L384 I404 A408	C372-V380 HydrophobicContact CB-CG2 4.08Å; L375-V380 HydrophobicContact CB-CG2 3.67Å; N376-V380 WeakPolarHBondContact O-CG2 3.38Å; N376-V380 PolarHBondContact O-N 2.99Å; S377-V380 PolarHBondContact O-N 2.81Å; V380-L384 HydrophobicContact CG1-CD1 3.93Å; V380-L384 WeakPolarHBondContact O-CB 3.47Å; V380-L384 WeakPolarHBondContact O-CG 3.38Å; V380-L384 PolarHBondContact O-N 3.26Å; V380-L384 VanDerWaalsContact O-N 3.11Å; V380-I404 HydrophobicContact CG1-CB 3.94Å; V380-I404 HydrophobicContact CG1-CG2 3.6Å; V380-A408 HydrophobicContact CG2-CB 4.02Å
381	V	94.5	Very high	91	Very high	53 Å²	53	44.7 Å²	44.7	32%	0.321	24%	0.243	S	C	.	.	H	α-helix	trans	-59.7	-52.1	178.7	170.1	0	0	0	0	109.8	S377 I383 L384 S385 V401 C405	S377-V381 WeakPolarHBondContact O-CB 3.41Å; S377-V381 VanDerWaalsContact O-CG2 3.26Å; S377-V381 WeakPolarHBondContact O-CG2 3.4Å; S377-V381 PolarHBondContact O-N 3.31Å; V381-I383 PolarHBondContact O-N 3.2Å; V381-L384 PolarHBondContact O-N 3.33Å; V381-S385 VanDerWaalsContact O-CB 3.31Å; V381-S385 WeakPolarHBondContact O-CB 3.32Å; V381-S385 PolarHBondContact O-N 3.22Å; V381-S385 PolarHBondContact O-OG 3.03Å; V381-V401 HydrophobicContact CB-CG1 4.44Å; V381-V401 HydrophobicContact CG1-CG1 4.44Å; V381-V401 HydrophobicContact CG2-CG1 4.21Å; V381-C405 HydrophobicContact CG2-CB 3.77Å; V381-C405 VanDerWaalsContact CG2-SG 3.57Å
382	H	93.8	Very high	90.7	Very high	51 Å²	51	48.1 Å²	48.1	24%	0.236	28%	0.282	C	S	.	.	H	α-helix	trans	-61.3	-43.8	-176.3	-169.8	88.7	0	0	0	113.1	L378 L384 G386 L425	L378-H382 VanDerWaalsContact O-CB 3.29Å; L378-H382 WeakPolarHBondContact O-CB 3.26Å; L378-H382 PolarHBondContact O-N 2.78Å; H382-L384 PolarHBondContact O-N 3.22Å; H382-G386 PolarHBondContact O-N 3.42Å; H382-L425 HydrophobicContact CB-CD1 3.73Å
383	I	93.9	Very high	90.9	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-67.3	-36.3	180	-66.8	167.4	0	0	0	111.6	F303 V307 A354 L357 L358 Q379 V381	F303-I383 HydrophobicContact CE2-CD1 4.41Å; V307-I383 HydrophobicContact CG1-CD1 3.99Å; V307-I383 HydrophobicContact CG1-CG1 3.82Å; A354-I383 HydrophobicContact CB-CD1 3.92Å; L357-I383 HydrophobicContact CD2-CB 4.27Å; L357-I383 HydrophobicContact CD2-CG2 3.97Å; L357-I383 HydrophobicContact CG-CG2 4.48Å; L358-I383 HydrophobicContact CD2-CG2 3.76Å; L358-I383 HydrophobicContact CG-CG2 4.01Å; Q379-I383 WeakPolarHBondContact O-CB 3.4Å; Q379-I383 WeakPolarHBondContact O-CD1 3.42Å; Q379-I383 VanDerWaalsContact O-CG1 3.24Å; Q379-I383 WeakPolarHBondContact O-CG1 3.24Å; Q379-I383 PolarHBondContact O-N 3.38Å; V381-I383 PolarHBondContact O-N 3.2Å
384	L	93.1	Very high	90.9	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-84	-36.4	-179.5	-66.2	176.9	0	0	0	113.2	L357 K362 V380 V381 H382 G386 F387 V401 I404	L357-L384 HydrophobicContact CD1-CD1 4.48Å; L357-L384 HydrophobicContact CD1-CD2 4.07Å; L357-L384 HydrophobicContact CD2-CD2 4.18Å; L357-L384 HydrophobicContact CD2-CG 4.1Å; L357-L384 HydrophobicContact CG-CD2 3.87Å; L357-L384 HydrophobicContact CG-CG 4.34Å; K362-L384 HydrophobicContact CD-CD2 4.29Å; V380-L384 HydrophobicContact CG1-CD1 3.93Å; V380-L384 WeakPolarHBondContact O-CB 3.47Å; V380-L384 WeakPolarHBondContact O-CG 3.38Å; V380-L384 PolarHBondContact O-N 3.26Å; V380-L384 VanDerWaalsContact O-N 3.11Å; V381-L384 PolarHBondContact O-N 3.33Å; H382-L384 PolarHBondContact O-N 3.22Å; L384-G386 VanDerWaalsContact C-N 3.35Å; L384-F387 VanDerWaalsContact O-CB 3.28Å; L384-F387 WeakPolarHBondContact O-CB 3.23Å; L384-F387 PolarHBondContact O-N 2.73Å; L384-V401 HydrophobicContact CB-CG1 4.17Å; L384-V401 HydrophobicContact CB-CG2 3.88Å; L384-I404 HydrophobicContact CD1-CB 4.19Å; L384-I404 HydrophobicContact CD1-CG1 4.32Å
385	S	91.9	Very high	90.9	Very high	82 Å²	82	49.1 Å²	49.1	57%	0.573	30%	0.3	S	S	*	.	H	α-helix	trans	-75	-25.8	176.6	70.1	0	0	0	0	112.8	V381 F387	V381-S385 VanDerWaalsContact O-CB 3.31Å; V381-S385 WeakPolarHBondContact O-CB 3.32Å; V381-S385 PolarHBondContact O-N 3.22Å; V381-S385 PolarHBondContact O-OG 3.03Å; S385-F387 VanDerWaalsContact C-N 3.32Å
386	G	89.6	Confident	90.6	Very high	33 Å²	33	50.3 Å²	50.3	34%	0.34	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	3.6	172	0	0	0	0	0	114.1	L316 H382 L384 E388	L316-G386 WeakPolarHBondContact CB-O 3.34Å; H382-G386 PolarHBondContact O-N 3.42Å; L384-G386 VanDerWaalsContact C-N 3.35Å; G386-E388 PolarHBondContact O-N 2.97Å
387	F	92.7	Very high	90.5	Very high	17 Å²	17	54.8 Å²	54.8	8%	0.075	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-72.5	119.2	-175.4	179.7	-100.4	0	0	0	112	L316 T318 L358 K362 L384 S385 P389 C396	L316-F387 WeakPolarHBondContact O-CA 3.43Å; L316-F387 WeakPolarHBondContact O-CD2 3.22Å; T318-F387 WeakPolarHBondContact OG1-CZ 3.4Å; L358-F387 HydrophobicContact CD2-CD2 3.98Å; K362-F387 HydrophobicContact CD-CD1 4.26Å; K362-F387 HydrophobicContact CD-CE1 4.24Å; K362-F387 HydrophobicContact CD-CG 4.47Å; K362-F387 HydrophobicContact CD-CZ 4.45Å; K362-F387 VanDerWaalsContact CE-CZ 3.48Å; K362-F387 HydrophobicContact CG-CD1 3.98Å; K362-F387 HydrophobicContact CG-CE1 3.71Å; K362-F387 HydrophobicContact CG-CZ 4.21Å; L384-F387 VanDerWaalsContact O-CB 3.28Å; L384-F387 WeakPolarHBondContact O-CB 3.23Å; L384-F387 PolarHBondContact O-N 2.73Å; S385-F387 VanDerWaalsContact C-N 3.32Å; F387-P389 HydrophobicContact CE1-CB 3.94Å; F387-P389 WeakPolarHBondContact O-CD 3.4Å; F387-C396 HydrophobicContact CD1-CB 4.47Å
388	E	91	Very high	90.3	Very high	94 Å²	94	60.8 Å²	60.8	44%	0.439	36%	0.363	S	S	.	.			trans	-99.7	110.4	175.6	-65.3	-174.1	149.4	0	0	109.1	Q315 L316 N317 G386	Q315-E388 WeakPolarHBondContact CB-OE2 3.45Å; Q315-E388 VanDerWaalsContact CG-OE2 3.3Å; Q315-E388 WeakPolarHBondContact CG-OE2 3.2Å; Q315-E388 PolarHBondContact NE2-OE2 3.46Å; L316-E388 PolarHBondContact O-N 3.23Å; N317-E388 WeakPolarHBondContact CA-O 3.4Å; N317-E388 WeakPolarHBondContact CB-O 3.32Å; G386-E388 PolarHBondContact O-N 2.97Å
389	P	89.8	Confident	90.3	Very high	56 Å²	56	61.6 Å²	61.6	36%	0.364	37%	0.367	S	S	.	.			trans	-70.5	136.9	178.1	27.5	-32.9	0	0	0	111.4	F387 E393 P395	F387-P389 HydrophobicContact CE1-CB 3.94Å; F387-P389 WeakPolarHBondContact O-CD 3.4Å; P389-E393 HydrophobicContact CB-CB 3.99Å; P389-E393 HydrophobicContact CB-CG 4.32Å; P389-P395 HydrophobicContact CG-CB 4.34Å; P389-P395 HydrophobicContact CG-CG 4.25Å
390	D	86.1	Confident	90.2	Very high	67 Å²	67	61.7 Å²	61.7	36%	0.358	37%	0.368	S	S	.	.			trans	-69.5	162.6	169.3	-67.4	-46	0	0	0	110.6	N317 G392 E393	N317-D390 PolarHBondContact ND2-OD1 2.95Å; D390-G392 PolarHBondContact O-N 2.76Å; D390-E393 VanDerWaalsContact O-CB 3.31Å; D390-E393 WeakPolarHBondContact O-CB 3.49Å; D390-E393 PolarHBondContact O-N 3.39Å
391	D	79.8	Confident	90.1	Very high	182 Å²	182	62.3 Å²	62.3	97%	0.973	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	114	-177.1	-89.8	-36.1	0	0	0	113.2
392	G	79.8	Confident	90.1	Very high	89 Å²	89	63.5 Å²	63.5	92%	0.918	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.9	3.5	-179.5	0	0	0	0	0	115.5	D390	D390-G392 PolarHBondContact O-N 2.76Å
393	E	88.3	Confident	90.2	Very high	52 Å²	52	65.5 Å²	65.5	24%	0.243	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-78.6	155.5	169.7	-174.4	159.7	-143.8	0	0	112.4	T318 P389 D390 P395	T318-E393 VanDerWaalsContact CB-OE1 3.22Å; T318-E393 WeakPolarHBondContact CB-OE1 3.47Å; T318-E393 WeakPolarHBondContact CB-OE2 3.22Å; T318-E393 WeakPolarHBondContact CG2-OE1 3.31Å; T318-E393 PolarHBondContact OG1-OE1 3.04Å; T318-E393 PolarHBondContact OG1-OE2 3.29Å; P389-E393 HydrophobicContact CB-CB 3.99Å; P389-E393 HydrophobicContact CB-CG 4.32Å; D390-E393 VanDerWaalsContact O-CB 3.31Å; D390-E393 WeakPolarHBondContact O-CB 3.49Å; D390-E393 PolarHBondContact O-N 3.39Å; E393-P395 WeakPolarHBondContact O-CD 3.46Å
394	I	86.6	Confident	90.2	Very high	77 Å²	77	65.6 Å²	65.6	40%	0.395	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-77.1	121	177	-53.3	176.4	0	0	0	108.8	N363	N363-I394 WeakPolarHBondContact ND2-CD1 3.44Å
395	P	87.3	Confident	90.3	Very high	75 Å²	75	66.1 Å²	66.1	49%	0.487	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-59.4	162.7	172.8	-22.2	33.9	0	0	0	112.5	P389 E393	P389-P395 HydrophobicContact CG-CB 4.34Å; P389-P395 HydrophobicContact CG-CG 4.25Å; E393-P395 WeakPolarHBondContact O-CD 3.46Å
396	C	89.6	Confident	90.5	Very high	25 Å²	25	68.1 Å²	68.1	17%	0.169	38%	0.381	C	S	.	.			trans	-87.7	111.5	171.2	-155.9	0	0	0	0	110	K362 F387	K362-C396 HydrophobicContact CB-CB 4.1Å; K362-C396 HydrophobicContact CD-CB 4.41Å; K362-C396 HydrophobicContact CG-CB 4.17Å; F387-C396 HydrophobicContact CD1-CB 4.47Å
397	D	91.8	Very high	90.6	Very high	96 Å²	96	69 Å²	69	51%	0.513	38%	0.377	S	S	.	.			trans	-65	137.7	172.4	-59.7	-49.7	0	0	0	110.2	D399 V400 V401	D397-D399 HydrophobicContact CB-CB 4.37Å; D397-D399 PolarHBondContact O-N 2.67Å; D397-V400 HydrophobicContact CB-CG2 4.24Å; D397-V400 WeakPolarHBondContact O-CA 3.49Å; D397-V400 WeakPolarHBondContact O-CB 3.07Å; D397-V400 PolarHBondContact O-N 2.61Å; D397-V401 PolarHBondContact O-N 3.18Å; D397-V401 VanDerWaalsContact O-N 3.15Å
398	D	92.6	Very high	90.8	Very high	140 Å²	140	68.2 Å²	68.2	75%	0.749	38%	0.375	S	S	*	.	H	α-helix	trans	-48.4	-38.4	171.1	-67	-41.5	0	0	0	111.7	V400 V401 D402	D398-V400 PolarHBondContact O-N 2.8Å; D398-V401 WeakPolarHBondContact O-CB 3.28Å; D398-V401 PolarHBondContact O-N 3.02Å; D398-V401 VanDerWaalsContact O-N 3.07Å; D398-D402 WeakPolarHBondContact O-CB 3.4Å; D398-D402 PolarHBondContact O-N 2.93Å
399	D	93.3	Very high	91	Very high	99 Å²	99	68.4 Å²	68.4	53%	0.529	38%	0.375	S	S	.	.	H	α-helix	trans	-62.7	-27.6	179.5	-158.1	48.9	0	0	0	112.6	D397 R403	D397-D399 HydrophobicContact CB-CB 4.37Å; D397-D399 PolarHBondContact O-N 2.67Å; D399-R403 VanDerWaalsContact C-CZ 3.48Å; D399-R403 WeakPolarHBondContact O-CG 3.49Å; D399-R403 PolarHBondContact O-NE 3.37Å; D399-R403 VanDerWaalsContact O-NE 3.14Å; D399-R403 PolarHBondContact O-NH1 3.33Å; D399-R403 VanDerWaalsContact O-NH1 3.15Å; D399-R403 PolarHBondContact O-NH2 2.81Å; D399-R403 IonicContact OD1-NH1 2.67Å; D399-R403 IonicContact OD2-CZ 2.88Å; D399-R403 IonicContact OD2-NH1 3.67Å; D399-R403 PolarHBondContact OD2-NH1 3.39Å; D399-R403 IonicContact OD2-NH2 2.61Å; D399-R403 PolarHBondContact OD2-NH2 3.43Å
400	V	92.8	Very high	91.1	Very high	3 Å²	3	72.3 Å²	72.3	2%	0.018	39%	0.386	C	S	.	.	H	α-helix	trans	-77.8	-47.8	168.3	174.9	0	0	0	0	110.7	K362 V365 L368 D397 D398 D402 R403 I404	K362-V400 WeakPolarHBondContact O-CG1 3.27Å; V365-V400 HydrophobicContact CG2-CG1 4.4Å; V365-V400 HydrophobicContact CG2-CG2 4.23Å; L368-V400 HydrophobicContact CD1-CG1 3.6Å; D397-V400 HydrophobicContact CB-CG2 4.24Å; D397-V400 WeakPolarHBondContact O-CA 3.49Å; D397-V400 WeakPolarHBondContact O-CB 3.07Å; D397-V400 PolarHBondContact O-N 2.61Å; D398-V400 PolarHBondContact O-N 2.8Å; V400-D402 PolarHBondContact O-N 3.22Å; V400-R403 WeakPolarHBondContact O-CB 3.42Å; V400-R403 PolarHBondContact O-N 3.48Å; V400-I404 HydrophobicContact CG1-CG1 4.17Å; V400-I404 WeakPolarHBondContact O-CG1 3.21Å; V400-I404 PolarHBondContact O-N 3Å
401	V	94.6	Very high	91.3	Very high	12 Å²	12	72.8 Å²	72.8	7%	0.073	39%	0.386	C	S	.	.	H	α-helix	trans	-52.4	-46.6	178.9	-172.5	0	0	0	0	110.3	V381 L384 D397 D398 R403 I404 C405	V381-V401 HydrophobicContact CB-CG1 4.44Å; V381-V401 HydrophobicContact CG1-CG1 4.44Å; V381-V401 HydrophobicContact CG2-CG1 4.21Å; L384-V401 HydrophobicContact CB-CG1 4.17Å; L384-V401 HydrophobicContact CB-CG2 3.88Å; D397-V401 PolarHBondContact O-N 3.18Å; D397-V401 VanDerWaalsContact O-N 3.15Å; D398-V401 WeakPolarHBondContact O-CB 3.28Å; D398-V401 PolarHBondContact O-N 3.02Å; D398-V401 VanDerWaalsContact O-N 3.07Å; V401-R403 VanDerWaalsContact C-N 3.34Å; V401-R403 PolarHBondContact O-N 3Å; V401-I404 PolarHBondContact O-N 3.45Å; V401-C405 WeakPolarHBondContact O-CB 3.39Å; V401-C405 PolarHBondContact O-N 2.9Å
402	D	94.9	Very high	91.9	Very high	78 Å²	78	64.3 Å²	64.3	42%	0.417	34%	0.342	S	S	.	.	H	α-helix	trans	-65.4	-34.5	-179.8	-137.9	64.3	0	0	0	112.4	D398 V400 R406	D398-D402 WeakPolarHBondContact O-CB 3.4Å; D398-D402 PolarHBondContact O-N 2.93Å; V400-D402 PolarHBondContact O-N 3.22Å; D402-R406 WeakPolarHBondContact O-CB 3.33Å; D402-R406 WeakPolarHBondContact O-CG 3.48Å; D402-R406 PolarHBondContact O-N 3.27Å; D402-R406 VanDerWaalsContact O-N 3.09Å; D402-R406 IonicContact OD2-CZ 2.8Å; D402-R406 IonicContact OD2-NE 3.84Å; D402-R406 PolarHBondContact OD2-NE 3.19Å; D402-R406 IonicContact OD2-NH2 3.26Å; D402-R406 PolarHBondContact OD2-NH2 3.07Å
403	R	94.4	Very high	92.6	Very high	94 Å²	94	60.9 Å²	60.9	36%	0.355	30%	0.302	S	S	.	.	H	α-helix	trans	-68.5	-42.1	174.5	-78.3	-176.5	-72	-95.6	5.5	112.9	V365 D399 V400 V401 L407	V365-R403 HydrophobicContact CG1-CB 4.08Å; D399-R403 VanDerWaalsContact C-CZ 3.48Å; D399-R403 WeakPolarHBondContact O-CG 3.49Å; D399-R403 PolarHBondContact O-NE 3.37Å; D399-R403 VanDerWaalsContact O-NE 3.14Å; D399-R403 PolarHBondContact O-NH1 3.33Å; D399-R403 VanDerWaalsContact O-NH1 3.15Å; D399-R403 PolarHBondContact O-NH2 2.81Å; D399-R403 IonicContact OD1-NH1 2.67Å; D399-R403 IonicContact OD2-CZ 2.88Å; D399-R403 IonicContact OD2-NH1 3.67Å; D399-R403 PolarHBondContact OD2-NH1 3.39Å; D399-R403 IonicContact OD2-NH2 2.61Å; D399-R403 PolarHBondContact OD2-NH2 3.43Å; V400-R403 WeakPolarHBondContact O-CB 3.42Å; V400-R403 PolarHBondContact O-N 3.48Å; V401-R403 VanDerWaalsContact C-N 3.34Å; V401-R403 PolarHBondContact O-N 3Å; R403-L407 PolarHBondContact O-N 3.14Å
404	I	95	Very high	92.7	Very high	2 Å²	2	63 Å²	63	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-76.5	-36.6	179.8	-49.3	-54.6	0	0	0	110.7	V365 L368 C372 V380 L384 V400 V401 L407 A408	V365-I404 HydrophobicContact CB-CD1 4.5Å; V365-I404 HydrophobicContact CG1-CD1 3.75Å; V365-I404 WeakPolarHBondContact O-CD1 3.47Å; L368-I404 HydrophobicContact CB-CD1 3.77Å; L368-I404 HydrophobicContact CB-CG1 4.07Å; L368-I404 HydrophobicContact CD1-CG1 4.48Å; C372-I404 VanDerWaalsContact SG-CG2 3.52Å; V380-I404 HydrophobicContact CG1-CB 3.94Å; V380-I404 HydrophobicContact CG1-CG2 3.6Å; L384-I404 HydrophobicContact CD1-CB 4.19Å; L384-I404 HydrophobicContact CD1-CG1 4.32Å; V400-I404 HydrophobicContact CG1-CG1 4.17Å; V400-I404 WeakPolarHBondContact O-CG1 3.21Å; V400-I404 PolarHBondContact O-N 3Å; V401-I404 PolarHBondContact O-N 3.45Å; I404-L407 WeakPolarHBondContact O-CA 3.33Å; I404-L407 WeakPolarHBondContact O-CB 3.33Å; I404-L407 PolarHBondContact O-N 3.31Å; I404-A408 PolarHBondContact O-N 3.16Å
405	C	95.3	Very high	92.9	Very high	16 Å²	16	62.6 Å²	62.6	11%	0.108	31%	0.309	C	S	.	.	H	α-helix	trans	-55.2	-53.5	171.2	-178.5	0	0	0	0	111.2	V381 V401 L407 A408 E409	V381-C405 HydrophobicContact CG2-CB 3.77Å; V381-C405 VanDerWaalsContact CG2-SG 3.57Å; V401-C405 WeakPolarHBondContact O-CB 3.39Å; V401-C405 PolarHBondContact O-N 2.9Å; C405-L407 PolarHBondContact O-N 3.08Å; C405-A408 PolarHBondContact O-N 2.99Å; C405-E409 WeakPolarHBondContact O-CG 3.28Å; C405-E409 PolarHBondContact O-N 2.89Å
406	R	94.6	Very high	93	Very high	124 Å²	124	59.7 Å²	59.7	47%	0.468	29%	0.29	S	S	.	.	H	α-helix	trans	-64	-5.2	176	-67.3	-178.9	-134.3	163.3	-1.9	114.8	D402 E409 K410	D402-R406 WeakPolarHBondContact O-CB 3.33Å; D402-R406 WeakPolarHBondContact O-CG 3.48Å; D402-R406 PolarHBondContact O-N 3.27Å; D402-R406 VanDerWaalsContact O-N 3.09Å; D402-R406 IonicContact OD2-CZ 2.8Å; D402-R406 IonicContact OD2-NE 3.84Å; D402-R406 PolarHBondContact OD2-NE 3.19Å; D402-R406 IonicContact OD2-NH2 3.26Å; D402-R406 PolarHBondContact OD2-NH2 3.07Å; R406-E409 WeakPolarHBondContact CA-OE2 3.44Å; R406-K410 VanDerWaalsContact O-CD 3.27Å; R406-K410 WeakPolarHBondContact O-CD 3.23Å; R406-K410 VanDerWaalsContact O-CE 3.28Å; R406-K410 WeakPolarHBondContact O-CE 3.28Å; R406-K410 WeakPolarHBondContact O-CG 3.46Å; R406-K410 PolarHBondContact O-NZ 3.28Å
407	L	93.7	Very high	93	Very high	50 Å²	50	63.8 Å²	63.8	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-94.1	-46.2	169.5	-173.6	67.5	0	0	0	110.6	G369 R403 I404 C405 E409 K410 Q411	G369-L407 VanDerWaalsContact CA-CD2 3.47Å; G369-L407 WeakPolarHBondContact O-CD2 3.4Å; R403-L407 PolarHBondContact O-N 3.14Å; I404-L407 WeakPolarHBondContact O-CA 3.33Å; I404-L407 WeakPolarHBondContact O-CB 3.33Å; I404-L407 PolarHBondContact O-N 3.31Å; C405-L407 PolarHBondContact O-N 3.08Å; L407-E409 PolarHBondContact O-N 2.86Å; L407-K410 PolarHBondContact O-N 2.89Å; L407-K410 VanDerWaalsContact O-N 3.12Å; L407-Q411 PolarHBondContact O-N 3.32Å; L407-Q411 VanDerWaalsContact O-N 3.15Å
408	A	95.2	Very high	93	Very high	2 Å²	2	61.9 Å²	61.9	2%	0.017	30%	0.298	C	S	.	.	H	α-helix	trans	-58.8	-44.5	174.8	0	0	0	0	0	112.2	V380 I404 C405 K410 Q411 A412 D413	V380-A408 HydrophobicContact CG2-CB 4.02Å; I404-A408 PolarHBondContact O-N 3.16Å; C405-A408 PolarHBondContact O-N 2.99Å; A408-K410 PolarHBondContact O-N 2.67Å; A408-K410 VanDerWaalsContact O-N 3.15Å; A408-Q411 CarbonylContact O-C 3.6Å; A408-Q411 PolarHBondContact O-N 3.24Å; A408-A412 PolarHBondContact O-N 3.38Å; A408-D413 PolarHBondContact O-N 3.09Å; A408-D413 VanDerWaalsContact O-N 3.08Å
409	E	94.9	Very high	92.7	Very high	97 Å²	97	56.9 Å²	56.9	45%	0.453	27%	0.271	S	S	.	.	I	π-helix	trans	-49.8	-40.2	172.3	-73.6	-177.2	142.8	0	0	113	C405 R406 L407	C405-E409 WeakPolarHBondContact O-CG 3.28Å; C405-E409 PolarHBondContact O-N 2.89Å; R406-E409 WeakPolarHBondContact CA-OE2 3.44Å; L407-E409 PolarHBondContact O-N 2.86Å
410	K	92.1	Very high	92.3	Very high	138 Å²	138	55.3 Å²	55.3	60%	0.6	28%	0.278	S	S	*	.	I	π-helix	trans	-85.1	-17	-175.8	-66.5	174.8	-170.4	132.1	0	113.3	R406 L407 A408	R406-K410 VanDerWaalsContact O-CD 3.27Å; R406-K410 WeakPolarHBondContact O-CD 3.23Å; R406-K410 VanDerWaalsContact O-CE 3.28Å; R406-K410 WeakPolarHBondContact O-CE 3.28Å; R406-K410 WeakPolarHBondContact O-CG 3.46Å; R406-K410 PolarHBondContact O-NZ 3.28Å; L407-K410 PolarHBondContact O-N 2.89Å; L407-K410 VanDerWaalsContact O-N 3.12Å; A408-K410 PolarHBondContact O-N 2.67Å; A408-K410 VanDerWaalsContact O-N 3.15Å
411	Q	90.3	Very high	92.1	Very high	77 Å²	77	60.5 Å²	60.5	36%	0.36	30%	0.302	S	S	.	.	I	π-helix	trans	-117	-80.4	-174.3	-63.7	-175.2	1.9	0	0	110.8	L407 A408 L415	L407-Q411 PolarHBondContact O-N 3.32Å; L407-Q411 VanDerWaalsContact O-N 3.15Å; A408-Q411 CarbonylContact O-C 3.6Å; A408-Q411 PolarHBondContact O-N 3.24Å; Q411-L415 WeakPolarHBondContact O-CB 3.41Å; Q411-L415 VanDerWaalsContact O-CG 3.27Å; Q411-L415 WeakPolarHBondContact O-CG 3.16Å; Q411-L415 PolarHBondContact O-N 3.06Å
412	A	92.1	Very high	91.8	Very high	4 Å²	4	70.2 Å²	70.2	3%	0.033	34%	0.338	C	S	.	.	I	π-helix	trans	-65.1	-45.3	-173.3	0	0	0	0	0	113.2	L375 A408 L415 T416	L375-A412 WeakPolarHBondContact O-CB 3.14Å; A408-A412 PolarHBondContact O-N 3.38Å; A412-L415 PolarHBondContact O-N 2.7Å; A412-T416 WeakPolarHBondContact O-CB 3.31Å; A412-T416 PolarHBondContact O-N 3.11Å; A412-T416 PolarHBondContact O-OG1 2.75Å
413	D	94.9	Very high	91.7	Very high	17 Å²	17	68.3 Å²	68.3	9%	0.091	33%	0.329	C	S	.	.	I	π-helix	trans	-65.1	-45.7	179.6	-67.4	36.3	0	0	0	110.5	N376 S377 A408 L415 T416 L417 V423	N376-D413 VanDerWaalsContact CA-OD1 3.24Å; N376-D413 WeakPolarHBondContact CA-OD1 3.27Å; N376-D413 VanDerWaalsContact CB-OD1 3.28Å; N376-D413 WeakPolarHBondContact CB-OD1 3.48Å; S377-D413 VanDerWaalsContact CB-OD2 3.28Å; S377-D413 WeakPolarHBondContact CB-OD2 3.35Å; S377-D413 PolarHBondContact N-OD1 2.78Å; S377-D413 PolarHBondContact OG-OD2 2.68Å; A408-D413 PolarHBondContact O-N 3.09Å; A408-D413 VanDerWaalsContact O-N 3.08Å; D413-L415 VanDerWaalsContact C-N 3.33Å; D413-L415 PolarHBondContact O-N 2.92Å; D413-T416 WeakPolarHBondContact O-CB 3.28Å; D413-T416 PolarHBondContact O-N 2.91Å; D413-L417 WeakPolarHBondContact O-CB 3.39Å; D413-L417 VanDerWaalsContact O-CG 3.29Å; D413-L417 WeakPolarHBondContact O-CG 3.49Å; D413-L417 PolarHBondContact O-N 3.17Å; D413-V423 HydrophobicContact CB-CG2 4.05Å
414	K	92	Very high	91.6	Very high	97 Å²	97	67 Å²	67	42%	0.422	33%	0.331	S	S	.	.	H	α-helix	trans	-58.5	-43.2	176.5	-176.5	175.6	174.3	-65	0	111.7	E418	K414-E418 WeakPolarHBondContact CE-OE1 3.39Å; K414-E418 IonicContact NZ-OE1 3.95Å; K414-E418 PolarHBondContact NZ-OE1 3.16Å; K414-E418 IonicContact NZ-OE2 2.7Å; K414-E418 VanDerWaalsContact O-CB 3.31Å; K414-E418 WeakPolarHBondContact O-CB 3.45Å; K414-E418 VanDerWaalsContact O-CG 3.3Å; K414-E418 WeakPolarHBondContact O-CG 3.23Å; K414-E418 PolarHBondContact O-N 2.81Å
415	L	89.2	Confident	91.5	Very high	69 Å²	69	68.8 Å²	68.8	36%	0.361	34%	0.341	S	S	.	.	H	α-helix	trans	-66.7	-40.6	175.1	-72.4	168.7	0	0	0	112.3	Q411 A412 D413 L417 E418 D419	Q411-L415 WeakPolarHBondContact O-CB 3.41Å; Q411-L415 VanDerWaalsContact O-CG 3.27Å; Q411-L415 WeakPolarHBondContact O-CG 3.16Å; Q411-L415 PolarHBondContact O-N 3.06Å; A412-L415 PolarHBondContact O-N 2.7Å; D413-L415 VanDerWaalsContact C-N 3.33Å; D413-L415 PolarHBondContact O-N 2.92Å; L415-L417 VanDerWaalsContact C-N 3.34Å; L415-L417 PolarHBondContact O-N 2.98Å; L415-E418 PolarHBondContact O-N 2.88Å; L415-D419 PolarHBondContact O-N 3.48Å
416	T	89	Confident	91.4	Very high	13 Å²	13	72.1 Å²	72.1	8%	0.08	36%	0.355	C	S	.	.	H	α-helix	trans	-61.6	-42.9	176.6	-55.3	0	0	0	0	111.1	A412 D413 D419 G420 Q421 V423	A412-T416 WeakPolarHBondContact O-CB 3.31Å; A412-T416 PolarHBondContact O-N 3.11Å; A412-T416 PolarHBondContact O-OG1 2.75Å; D413-T416 WeakPolarHBondContact O-CB 3.28Å; D413-T416 PolarHBondContact O-N 2.91Å; T416-D419 WeakPolarHBondContact O-CB 3.35Å; T416-D419 PolarHBondContact O-N 3.5Å; T416-G420 PolarHBondContact O-N 3.07Å; T416-Q421 HydrophobicContact CG2-CB 3.72Å; T416-Q421 PolarHBondContact O-N 3.15Å; T416-V423 HydrophobicContact CG2-CG2 4.32Å
417	L	91.2	Very high	91.3	Very high	111 Å²	111	67.9 Å²	67.9	58%	0.581	34%	0.34	S	S	*	.	H	α-helix	trans	-72.2	-35.8	176.1	-67.3	169.4	0	0	0	112.6	D413 L415 D419 G420 V423	D413-L417 WeakPolarHBondContact O-CB 3.39Å; D413-L417 VanDerWaalsContact O-CG 3.29Å; D413-L417 WeakPolarHBondContact O-CG 3.49Å; D413-L417 PolarHBondContact O-N 3.17Å; L415-L417 VanDerWaalsContact C-N 3.34Å; L415-L417 PolarHBondContact O-N 2.98Å; L417-D419 VanDerWaalsContact C-N 3.28Å; L417-D419 PolarHBondContact O-N 3.43Å; L417-G420 PolarHBondContact O-N 3.22Å; L417-G420 VanDerWaalsContact O-N 3.1Å; L417-V423 HydrophobicContact CG-CG2 4.38Å
418	E	91.3	Very high	91.1	Very high	57 Å²	57	68.6 Å²	68.6	27%	0.266	35%	0.349	S	S	.	.	H	α-helix	trans	-66.4	-29	173.5	-82.1	175.7	179.1	0	0	112.7	K414 L415 G420 R1067	K414-E418 WeakPolarHBondContact CE-OE1 3.39Å; K414-E418 IonicContact NZ-OE1 3.95Å; K414-E418 PolarHBondContact NZ-OE1 3.16Å; K414-E418 IonicContact NZ-OE2 2.7Å; K414-E418 VanDerWaalsContact O-CB 3.31Å; K414-E418 WeakPolarHBondContact O-CB 3.45Å; K414-E418 VanDerWaalsContact O-CG 3.3Å; K414-E418 WeakPolarHBondContact O-CG 3.23Å; K414-E418 PolarHBondContact O-N 2.81Å; L415-E418 PolarHBondContact O-N 2.88Å; E418-G420 VanDerWaalsContact C-N 3.3Å; E418-R1067 PolarHBondContact O-NH1 2.76Å
419	D	85.1	Confident	90.7	Very high	34 Å²	34	71.7 Å²	71.7	18%	0.182	37%	0.365	C	S	.	.	H	α-helix	trans	-66	-32.9	169.2	-97.2	-19.5	0	0	0	112.8	L415 T416 L417 Q421 R1064 R1067	L415-D419 PolarHBondContact O-N 3.48Å; T416-D419 WeakPolarHBondContact O-CB 3.35Å; T416-D419 PolarHBondContact O-N 3.5Å; L417-D419 VanDerWaalsContact C-N 3.28Å; L417-D419 PolarHBondContact O-N 3.43Å; D419-Q421 HydrophobicContact CB-CG 4.29Å; D419-R1064 VanDerWaalsContact CG-NE 3.33Å; D419-R1064 WeakPolarHBondContact OD1-CG 3.45Å; D419-R1064 IonicContact OD1-NE 3.43Å; D419-R1064 PolarHBondContact OD1-NE 3.36Å; D419-R1064 IonicContact OD2-CZ 3.17Å; D419-R1064 IonicContact OD2-NE 3.49Å; D419-R1064 PolarHBondContact OD2-NE 2.75Å; D419-R1064 IonicContact OD2-NH2 3.59Å; D419-R1064 PolarHBondContact OD2-NH2 3.34Å; D419-R1067 PolarHBondContact O-NH1 3.17Å; D419-R1067 PolarHBondContact O-NH2 3.24Å; D419-R1067 IonicContact OD1-NH2 2.65Å; D419-R1067 PolarHBondContact OD1-NH2 3.39Å
420	G	86.6	Confident	90.3	Very high	67 Å²	67	74 Å²	74	69%	0.691	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.3	7.7	-166.9	0	0	0	0	0	113.6	T416 L417 E418	T416-G420 PolarHBondContact O-N 3.07Å; L417-G420 PolarHBondContact O-N 3.22Å; L417-G420 VanDerWaalsContact O-N 3.1Å; E418-G420 VanDerWaalsContact C-N 3.3Å
421	Q	87.4	Confident	90.2	Very high	111 Å²	111	69 Å²	69	52%	0.519	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-81.8	159.5	173.2	-68.6	-175.6	-17.1	0	0	110.8	T416 D419	T416-Q421 HydrophobicContact CG2-CB 3.72Å; T416-Q421 PolarHBondContact O-N 3.15Å; D419-Q421 HydrophobicContact CB-CG 4.29Å
422	R	89.4	Confident	89.8	Confident	216 Å²	216	71.3 Å²	71.3	82%	0.815	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-89.7	145.5	170.6	-65.6	-175.3	-177.4	-84.2	-0.8	109.2	T424	R422-T424 HydrophobicContact CB-CG2 4.46Å; R422-T424 PolarHBondContact O-N 2.78Å
423	V	92.2	Very high	89.4	Confident	38 Å²	38	74.6 Å²	74.6	23%	0.23	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-69.4	116.3	167.7	-179.1	0	0	0	0	107.9	N376 L378 D413 T416 L417	N376-V423 HydrophobicContact CB-CG1 3.85Å; L378-V423 HydrophobicContact CD1-CG1 3.92Å; L378-V423 HydrophobicContact CG-CG1 3.97Å; D413-V423 HydrophobicContact CB-CG2 4.05Å; T416-V423 HydrophobicContact CG2-CG2 4.32Å; L417-V423 HydrophobicContact CG-CG2 4.38Å
424	T	93.3	Very high	88.9	Confident	67 Å²	67	78.7 Å²	78.7	41%	0.411	42%	0.415	S	S	.	.			trans	-125.5	150.4	179.2	55.7	0	0	0	0	110.2	N376 Q379 R422 E426	N376-T424 PolarHBondContact ND2-O 3.34Å; Q379-T424 PolarHBondContact NE2-O 3.39Å; R422-T424 HydrophobicContact CB-CG2 4.46Å; R422-T424 PolarHBondContact O-N 2.78Å; T424-E426 PolarHBondContact OG1-O 2.83Å
425	L	92.8	Very high	88.8	Confident	39 Å²	39	76 Å²	76	20%	0.204	40%	0.403	C	S	.	.	S	Bend	trans	-67.4	-58.3	174.1	-176.9	59.5	0	0	0	110.1	V307 V309 L378 Q379 H382	V307-L425 HydrophobicContact CB-CD1 3.9Å; V307-L425 HydrophobicContact CB-CG 3.96Å; V307-L425 HydrophobicContact CG1-CD1 4.36Å; V307-L425 HydrophobicContact CG2-CD1 4.37Å; V307-L425 HydrophobicContact CG2-CG 4.08Å; V307-L425 WeakPolarHBondContact O-CD2 3.3Å; V309-L425 HydrophobicContact CG2-CD2 3.75Å; L378-L425 HydrophobicContact CB-CD1 4.34Å; Q379-L425 HydrophobicContact CG-CD1 4.36Å; Q379-L425 WeakPolarHBondContact CG-O 3.39Å; Q379-L425 PolarHBondContact NE2-O 2.75Å; H382-L425 HydrophobicContact CB-CD1 3.73Å
426	E	92.6	Very high	88.7	Confident	87 Å²	87	77.9 Å²	77.9	41%	0.407	41%	0.413	S	S	.	.	S	Bend	trans	-77.9	152.3	178.1	-68.4	171.6	-162.5	0	0	112.9	N304 V307 T424	N304-E426 HydrophobicContact CB-CG 4.43Å; N304-E426 WeakPolarHBondContact OD1-CA 3.41Å; V307-E426 HydrophobicContact CG2-CG 4.23Å; T424-E426 PolarHBondContact OG1-O 2.83Å
427	E	91.4	Very high	88.5	Confident	35 Å²	35	79.6 Å²	79.6	16%	0.164	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-75.7	153.5	166	-81.7	-75.8	-152.7	0	0	112.4	A300 F303 N304 R350 D429	A300-E427 HydrophobicContact CB-CB 4.27Å; F303-E427 HydrophobicContact CB-CG 4.49Å; F303-E427 HydrophobicContact CD1-CB 4.47Å; F303-E427 HydrophobicContact CD1-CG 3.78Å; F303-E427 HydrophobicContact CE1-CG 4.39Å; F303-E427 HydrophobicContact CG-CG 4.27Å; N304-E427 PolarHBondContact ND2-O 3.43Å; N304-E427 WeakPolarHBondContact OD1-CB 3.36Å; N304-E427 PolarHBondContact OD1-N 3.5Å; R350-E427 WeakPolarHBondContact CD-OE1 3.41Å; R350-E427 IonicContact CZ-OE1 3.47Å; R350-E427 IonicContact NE-OE1 3.54Å; R350-E427 IonicContact NH1-OE1 2.66Å; R350-E427 PolarHBondContact NH1-OE1 3.43Å; R350-E427 IonicContact NH1-OE2 3.51Å; R350-E427 PolarHBondContact NH1-OE2 2.99Å; R350-E427 VanDerWaalsContact NH1-OE2 3.1Å; E427-D429 PolarHBondContact O-N 2.99Å
428	S	90.8	Very high	88	Confident	64 Å²	64	75.3 Å²	75.3	45%	0.448	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-70.7	126.3	172.4	-63	0	0	0	0	111.4	H296 E430	H296-S428 PolarHBondContact NE2-O 2.94Å; S428-E430 PolarHBondContact O-N 3.46Å
429	D	87	Confident	87.2	Confident	67 Å²	67	81 Å²	81	36%	0.358	43%	0.427	S	S	.	.	S	Bend	trans	-62	-26.3	174.5	-124	8.3	0	0	0	112.5	R246 E427	R246-D429 IonicContact CZ-OD1 2.77Å; R246-D429 IonicContact CZ-OD2 2.88Å; R246-D429 IonicContact NH1-OD2 3.7Å; R246-D429 IonicContact NH2-OD1 2.72Å; R246-D429 PolarHBondContact NH2-OD1 2.88Å; R246-D429 IonicContact NH2-OD2 3.73Å; R246-D429 PolarHBondContact NH2-OD2 3.33Å; E427-D429 PolarHBondContact O-N 2.99Å
430	E	86.6	Confident	86.6	Confident	147 Å²	147	84.5 Å²	84.5	69%	0.687	45%	0.445	S	S	*	.	S	Bend	trans	-101.3	132.7	176	-64.2	-172.8	172.1	0	0	112	S428 N432	S428-E430 PolarHBondContact O-N 3.46Å; E430-N432 PolarHBondContact O-N 3.21Å; E430-N432 PolarHBondContact O-ND2 3.49Å; E430-N432 VanDerWaalsContact O-ND2 3.17Å
431	L	89.8	Confident	85.6	Confident	31 Å²	31	82.3 Å²	82.3	16%	0.162	42%	0.423	C	S	.	.			trans	-81	103.2	174.9	178.9	54.6	0	0	0	110.3	H293 H296 L433	H293-L431 HydrophobicContact CB-CD2 4.48Å; H296-L431 HydrophobicContact CB-CB 4.23Å; H296-L431 HydrophobicContact CB-CD1 4.37Å; H296-L431 HydrophobicContact CB-CD2 3.94Å; H296-L431 HydrophobicContact CB-CG 4.41Å; L431-L433 HydrophobicContact CD1-CD1 4.13Å; L431-L433 HydrophobicContact CD1-CG 3.94Å; L431-L433 HydrophobicContact CD2-CD1 3.82Å; L431-L433 HydrophobicContact CD2-CG 4.34Å; L431-L433 HydrophobicContact CG-CB 4.43Å; L431-L433 HydrophobicContact CG-CD1 3.97Å; L431-L433 HydrophobicContact CG-CG 3.92Å; L431-L433 PolarHBondContact O-N 3.15Å
432	N	82.1	Confident	84.6	Confident	126 Å²	126	82 Å²	82	67%	0.674	42%	0.418	S	S	*	.			trans	-78.1	58.9	-177.2	-76.5	-84.7	0	0	0	113.1	E430	E430-N432 PolarHBondContact O-N 3.21Å; E430-N432 PolarHBondContact O-ND2 3.49Å; E430-N432 VanDerWaalsContact O-ND2 3.17Å
433	L	82.1	Confident	83.2	Confident	74 Å²	74	72.5 Å²	72.5	39%	0.387	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-100.9	139.8	169.6	-70.5	177.8	0	0	0	110.9	L431 F435	L431-L433 HydrophobicContact CD1-CD1 4.13Å; L431-L433 HydrophobicContact CD1-CG 3.94Å; L431-L433 HydrophobicContact CD2-CD1 3.82Å; L431-L433 HydrophobicContact CD2-CG 4.34Å; L431-L433 HydrophobicContact CG-CB 4.43Å; L431-L433 HydrophobicContact CG-CD1 3.97Å; L431-L433 HydrophobicContact CG-CG 3.92Å; L431-L433 PolarHBondContact O-N 3.15Å; L433-F435 PolarHBondContact O-N 3.13Å
434	P	85.4	Confident	81.3	Confident	103 Å²	103	72.2 Å²	72.2	67%	0.669	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-60.2	129.8	167.3	-20.3	32.6	0	0	0	110.4	L436	P434-L436 PolarHBondContact O-N 3.38Å
435	F	88.6	Confident	79.3	Confident	39 Å²	39	75.3 Å²	75.3	17%	0.171	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-67.5	126.1	175.4	179.7	-113.1	0	0	0	110.6	I230 E231 F234 L286 L433 I437	I230-F435 HydrophobicContact CG2-CE1 3.99Å; I230-F435 HydrophobicContact CG2-CZ 3.92Å; E231-F435 HydrophobicContact CB-CD1 3.53Å; E231-F435 HydrophobicContact CB-CE1 3.73Å; E231-F435 HydrophobicContact CB-CG 4.27Å; E231-F435 HydrophobicContact CG-CB 3.96Å; E231-F435 HydrophobicContact CG-CD1 3.56Å; E231-F435 HydrophobicContact CG-CE1 4.2Å; E231-F435 HydrophobicContact CG-CG 3.81Å; F234-F435 HydrophobicContact CB-CD2 4.42Å; F234-F435 HydrophobicContact CB-CE2 3.71Å; F234-F435 HydrophobicContact CB-CZ 4.01Å; F234-F435 AromaticContact CD1-CD2 3.85Å; F234-F435 HydrophobicContact CD1-CD2 3.85Å; F234-F435 AromaticContact CD1-CE2 3.81Å; F234-F435 HydrophobicContact CD1-CE2 3.81Å; F234-F435 AromaticContact CD2-CE2 3.81Å; F234-F435 HydrophobicContact CD2-CE2 3.81Å; F234-F435 HydrophobicContact CE1-CD2 4.28Å; F234-F435 HydrophobicContact CE1-CE2 4.41Å; F234-F435 HydrophobicContact CE2-CE2 4.4Å; F234-F435 HydrophobicContact CG-CD2 4.03Å; F234-F435 AromaticContact CG-CE2 3.48Å; F234-F435 HydrophobicContact CG-CE2 3.48Å; F234-F435 VanDerWaalsContact CG-CE2 3.48Å; F234-F435 HydrophobicContact CG-CZ 4.27Å; L286-F435 HydrophobicContact CD2-CE2 3.59Å; L286-F435 HydrophobicContact CD2-CZ 3.63Å; L433-F435 PolarHBondContact O-N 3.13Å; F435-I437 HydrophobicContact CD1-CG1 4.07Å; F435-I437 HydrophobicContact CE1-CD1 4.22Å; F435-I437 HydrophobicContact CE1-CG1 3.53Å; F435-I437 HydrophobicContact CZ-CG1 4.33Å
436	L	87.9	Confident	77.4	Confident	110 Å²	110	80.1 Å²	80.1	58%	0.576	41%	0.412	S	S	*	.			trans	-109.6	115.4	-179	-61.1	-178.7	0	0	0	110.3	Q289 P434	Q289-L436 PolarHBondContact NE2-O 3.28Å; P434-L436 PolarHBondContact O-N 3.38Å
437	I	85.2	Confident	75.5	Confident	48 Å²	48	81.2 Å²	81.2	25%	0.246	42%	0.416	C	S	.	.			trans	-78.3	127.7	169.7	-64.2	175.7	0	0	0	108.2	F435 Q439	F435-I437 HydrophobicContact CD1-CG1 4.07Å; F435-I437 HydrophobicContact CE1-CD1 4.22Å; F435-I437 HydrophobicContact CE1-CG1 3.53Å; F435-I437 HydrophobicContact CZ-CG1 4.33Å; I437-Q439 PolarHBondContact O-N 3.12Å
438	P	80.9	Confident	73.8	Confident	21 Å²	21	91.5 Å²	91.5	14%	0.136	45%	0.453	C	S	.	.			trans	-60.1	135.6	175.6	-20.6	31.3	0	0	0	111.2	N283 A285 L286 D440	N283-P438 HydrophobicContact CB-CB 4.19Å; N283-P438 HydrophobicContact CB-CG 3.82Å; N283-P438 VanDerWaalsContact CG-CG 3.41Å; N283-P438 WeakPolarHBondContact ND2-CB 3.35Å; N283-P438 WeakPolarHBondContact OD1-CB 3.43Å; N283-P438 WeakPolarHBondContact OD1-CG 3.49Å; A285-P438 HydrophobicContact CB-CG 4.31Å; L286-P438 HydrophobicContact CD1-CG 3.89Å; L286-P438 HydrophobicContact CG-CG 3.65Å; P438-D440 VanDerWaalsContact C-N 3.28Å
439	Q	73.1	Confident	72.7	Confident	176 Å²	176	93 Å²	93	82%	0.822	46%	0.46	S	S	*	.	S	Bend	trans	-80.3	-17.2	171.9	-62.6	-174.5	27.2	0	0	111.6	H210 I437	H210-Q439 PolarHBondContact CE1-O 3.23Å; H210-Q439 PolarHBondContact ND1-O 3.23Å; I437-Q439 PolarHBondContact O-N 3.12Å
440	D	73.6	Confident	72.1	Confident	108 Å²	108	91.3 Å²	91.3	58%	0.578	45%	0.452	S	S	*	.	S	Bend	trans	-101.1	134.3	179.3	-54.8	-54.4	0	0	0	112.1	N283 P438	N283-D440 PolarHBondContact ND2-O 3.3Å; P438-D440 VanDerWaalsContact C-N 3.28Å
441	G	66.1	Low	71.8	Confident	22 Å²	22	85.7 Å²	85.7	23%	0.227	43%	0.428	C	S	.	.			trans	-91	167.9	174.1	0	0	0	0	0	111.5	E207 H210 F443	E207-G441 VanDerWaalsContact OE2-CA 3.23Å; E207-G441 WeakPolarHBondContact OE2-CA 3.2Å; H210-G441 VanDerWaalsContact CD2-CA 3.42Å; H210-G441 WeakPolarHBondContact CD2-CA 3.32Å; H210-G441 PolarHBondContact CE1-N 3.12Å; H210-G441 PolarHBondContact ND1-N 3.37Å; H210-G441 PolarHBondContact NE2-N 3.15Å; H210-G441 VanDerWaalsContact NE2-N 3.17Å; G441-F443 PolarHBondContact O-N 3.11Å
442	Y	64.8	Low	71.4	Confident	104 Å²	104	89.8 Å²	89.8	41%	0.408	45%	0.45	S	S	.	.	S	Bend	trans	-76.4	-24.8	-170.5	-164.6	-97.3	0	0	0	113.8	L153 E207 G281	L153-Y442 HydrophobicContact CD1-CD1 3.96Å; L153-Y442 HydrophobicContact CD1-CG 4.04Å; E207-Y442 PolarHBondContact OE2-N 3.48Å; G281-Y442 WeakPolarHBondContact O-CD2 3.43Å
443	F	61.1	Low	71.5	Confident	16 Å²	16	84.1 Å²	84.1	7%	0.07	42%	0.421	C	S	.	.	S	Bend	trans	-135.1	-46.6	-148.3	-173.4	-109.9	0	0	0	116.7	F151 Y157 G441 E445 Q446 F447 P451	F151-F443 HydrophobicContact CD1-CZ 4.21Å; F151-F443 AromaticContact CD2-CE2 3.84Å; F151-F443 HydrophobicContact CD2-CE2 3.84Å; F151-F443 HydrophobicContact CD2-CZ 4.22Å; F151-F443 AromaticContact CE1-CE1 3.93Å; F151-F443 HydrophobicContact CE1-CE1 3.93Å; F151-F443 AromaticContact CE1-CE2 4Å; F151-F443 HydrophobicContact CE1-CE2 4Å; F151-F443 AromaticContact CE1-CZ 3.54Å; F151-F443 HydrophobicContact CE1-CZ 3.54Å; F151-F443 AromaticContact CE2-CD2 3.49Å; F151-F443 HydrophobicContact CE2-CD2 3.49Å; F151-F443 VanDerWaalsContact CE2-CD2 3.49Å; F151-F443 HydrophobicContact CE2-CE1 4.41Å; F151-F443 AromaticContact CE2-CE2 3.09Å; F151-F443 HydrophobicContact CE2-CE2 3.09Å; F151-F443 HydrophobicContact CE2-CG 4.27Å; F151-F443 AromaticContact CE2-CZ 3.57Å; F151-F443 HydrophobicContact CE2-CZ 3.57Å; F151-F443 AromaticContact CZ-CD1 3.95Å; F151-F443 HydrophobicContact CZ-CD1 3.95Å; F151-F443 AromaticContact CZ-CD2 3.51Å; F151-F443 HydrophobicContact CZ-CD2 3.51Å; F151-F443 AromaticContact CZ-CE1 3.63Å; F151-F443 HydrophobicContact CZ-CE1 3.63Å; F151-F443 AromaticContact CZ-CE2 3.16Å; F151-F443 HydrophobicContact CZ-CE2 3.16Å; F151-F443 AromaticContact CZ-CG 3.85Å; F151-F443 HydrophobicContact CZ-CG 3.85Å; F151-F443 AromaticContact CZ-CZ 3.16Å; F151-F443 HydrophobicContact CZ-CZ 3.16Å; Y157-F443 HydrophobicContact CD1-CE1 4.44Å; Y157-F443 AromaticContact CE1-CD1 3.74Å; Y157-F443 HydrophobicContact CE1-CD1 3.74Å; Y157-F443 HydrophobicContact CE1-CE1 4.01Å; Y157-F443 HydrophobicContact CE2-CB 4.46Å; Y157-F443 AromaticContact CE2-CD1 3.88Å; Y157-F443 HydrophobicContact CE2-CD1 3.88Å; Y157-F443 HydrophobicContact CE2-CE1 4.28Å; Y157-F443 HydrophobicContact CE2-CG 4.42Å; Y157-F443 AromaticContact CZ-CD1 3.38Å; Y157-F443 AromaticContact CZ-CE1 3.97Å; Y157-F443 WeakPolarHBondContact OH-CB 3.33Å; Y157-F443 WeakPolarHBondContact OH-CD1 3.44Å; G441-F443 PolarHBondContact O-N 3.11Å; F443-E445 PolarHBondContact O-N 3.5Å; F443-Q446 PolarHBondContact O-N 2.96Å; F443-F447 HydrophobicContact CD2-CD2 4.23Å; F443-P451 HydrophobicContact CE1-CG 4.1Å; F443-P451 HydrophobicContact CE2-CB 4.15Å; F443-P451 HydrophobicContact CE2-CG 3.62Å; F443-P451 HydrophobicContact CZ-CB 3.88Å; F443-P451 VanDerWaalsContact CZ-CD 3.41Å; F443-P451 HydrophobicContact CZ-CG 3.29Å
444	V	52.8	Low	71.6	Confident	32 Å²	32	80.7 Å²	80.7	19%	0.194	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-29.4	-163.6	-164.5	0	0	0	0	114.8	L117 L119 Y157 L211	L117-V444 HydrophobicContact CD1-CB 3.94Å; L117-V444 HydrophobicContact CD1-CG1 3.73Å; L117-V444 HydrophobicContact CD1-CG2 4.25Å; L117-V444 HydrophobicContact CD2-CG1 4.32Å; L117-V444 HydrophobicContact CD2-CG2 4.39Å; L117-V444 HydrophobicContact CG-CG1 3.92Å; L119-V444 HydrophobicContact CD2-CG1 3.72Å; L119-V444 HydrophobicContact CD2-CG2 4.26Å; Y157-V444 HydrophobicContact CE1-CG2 4.02Å; Y157-V444 WeakPolarHBondContact OH-CG2 3.27Å; L211-V444 HydrophobicContact CD2-CG2 3.69Å
445	E	50	Low	71.6	Confident	132 Å²	132	78.9 Å²	78.9	62%	0.617	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-16.1	179.1	-64	-159.4	170.7	0	0	113.7	R214 F443	R214-E445 IonicContact CZ-OE1 3.3Å; R214-E445 IonicContact NH1-OE1 3.34Å; R214-E445 PolarHBondContact NH1-OE1 2.84Å; R214-E445 IonicContact NH2-OE1 2.67Å; R214-E445 PolarHBondContact NH2-OE1 3.39Å; F443-E445 PolarHBondContact O-N 3.5Å
446	Q	53.3	Low	71.5	Confident	140 Å²	140	81.3 Å²	81.3	65%	0.654	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-26.8	-174.7	-61.2	-171.9	11.1	0	0	113.2	F443	F443-Q446 PolarHBondContact O-N 2.96Å
447	F	53.4	Low	71.5	Confident	110 Å²	110	76.4 Å²	76.4	48%	0.482	37%	0.369	S	S	.	.			trans	-120.1	117.6	-175.2	-63.9	-81.8	0	0	0	112.3	F443 T449 P451	F443-F447 HydrophobicContact CD2-CD2 4.23Å; F447-T449 PolarHBondContact O-N 3.37Å; F447-P451 HydrophobicContact CB-CG 4.29Å; F447-P451 HydrophobicContact CG-CG 4.29Å
448	R	55.8	Low	71.6	Confident	251 Å²	251	74.1 Å²	74.1	95%	0.947	36%	0.357	S	S	*	.	S	Bend	trans	-75.1	2.9	174.7	-67.8	-177.3	178	-102.5	0.4	114.1
449	T	66.1	Low	71.9	Confident	97 Å²	97	76.4 Å²	76.4	60%	0.595	37%	0.366	S	S	*	.	S	Bend	trans	-141.1	151.8	-170.8	50.1	0	0	0	0	109.9	F447 P451	F447-T449 PolarHBondContact O-N 3.37Å; T449-P451 WeakPolarHBondContact O-CD 3.36Å
450	V	75.5	Confident	72.5	Confident	30 Å²	30	71 Å²	71	18%	0.182	34%	0.341	C	S	.	.			trans	-62.5	123.1	170.6	-177	0	0	0	0	109.6	P120 L121 W455 L472	P120-V450 HydrophobicContact CG-CG2 3.97Å; L121-V450 HydrophobicContact CD1-CG1 3.8Å; L121-V450 HydrophobicContact CD1-CG2 3.95Å; L121-V450 HydrophobicContact CD2-CG1 4.36Å; L121-V450 HydrophobicContact CD2-CG2 3.91Å; L121-V450 HydrophobicContact CG-CG1 4.31Å; L121-V450 HydrophobicContact CG-CG2 3.63Å; V450-W455 HydrophobicContact CG1-CB 4.18Å; V450-L472 HydrophobicContact CG2-CD2 3.85Å
451	P	81	Confident	73.2	Confident	29 Å²	29	66.1 Å²	66.1	19%	0.188	32%	0.315	C	S	.	.			trans	-79.1	141.6	176	-25.6	42.7	0	0	0	112.6	F443 F447 T449 G453 L454 W455	F443-P451 HydrophobicContact CE1-CG 4.1Å; F443-P451 HydrophobicContact CE2-CB 4.15Å; F443-P451 HydrophobicContact CE2-CG 3.62Å; F443-P451 HydrophobicContact CZ-CB 3.88Å; F443-P451 VanDerWaalsContact CZ-CD 3.41Å; F443-P451 HydrophobicContact CZ-CG 3.29Å; F447-P451 HydrophobicContact CB-CG 4.29Å; F447-P451 HydrophobicContact CG-CG 4.29Å; T449-P451 WeakPolarHBondContact O-CD 3.36Å; P451-G453 VanDerWaalsContact C-N 3.29Å; P451-G453 PolarHBondContact O-N 3.33Å; P451-G453 VanDerWaalsContact O-N 3.13Å; P451-L454 WeakPolarHBondContact O-CB 3.33Å; P451-L454 PolarHBondContact O-N 3.43Å; P451-W455 PolarHBondContact O-N 2.99Å
452	D	80.3	Confident	74.3	Confident	117 Å²	117	68.2 Å²	68.2	63%	0.626	32%	0.319	S	S	*	.	H	α-helix	trans	-59.5	-33.7	-163.9	-58.2	-62	0	0	0	114.2	L454 W455 Q456	D452-L454 VanDerWaalsContact C-N 3.32Å; D452-L454 PolarHBondContact O-N 3.37Å; D452-W455 PolarHBondContact O-N 3.24Å; D452-Q456 WeakPolarHBondContact O-CB 3.48Å; D452-Q456 WeakPolarHBondContact O-CG 3.28Å; D452-Q456 PolarHBondContact O-N 2.83Å
453	G	83.6	Confident	75.3	Confident	7 Å²	7	70.5 Å²	70.5	7%	0.072	33%	0.333	C	S	.	.	H	α-helix	trans	-64.5	-32.3	178.2	0	0	0	0	0	114.2	S149 T150 P451 Y457	S149-G453 PolarHBondContact OG-O 2.97Å; T150-G453 WeakPolarHBondContact OG1-CA 3.46Å; P451-G453 VanDerWaalsContact C-N 3.29Å; P451-G453 PolarHBondContact O-N 3.33Å; P451-G453 VanDerWaalsContact O-N 3.13Å; G453-Y457 WeakPolarHBondContact O-CB 3.39Å; G453-Y457 PolarHBondContact O-N 2.89Å; G453-Y457 VanDerWaalsContact O-N 3.16Å
454	L	85.8	Confident	76.5	Confident	3 Å²	3	75 Å²	75	2%	0.016	35%	0.349	C	S	.	.	H	α-helix	trans	-71.4	-44.1	172.3	177.4	58.7	0	0	0	110.4	L121 F151 Y157 P451 D452 Y457 L458	L121-L454 HydrophobicContact CD1-CD2 4.07Å; F151-L454 HydrophobicContact CD1-CB 3.8Å; F151-L454 HydrophobicContact CD1-CD1 4.42Å; F151-L454 HydrophobicContact CE1-CB 4.29Å; Y157-L454 HydrophobicContact CD1-CD2 3.94Å; Y157-L454 HydrophobicContact CG-CD1 4.42Å; Y157-L454 HydrophobicContact CG-CD2 3.96Å; P451-L454 WeakPolarHBondContact O-CB 3.33Å; P451-L454 PolarHBondContact O-N 3.43Å; D452-L454 VanDerWaalsContact C-N 3.32Å; D452-L454 PolarHBondContact O-N 3.37Å; L454-Y457 PolarHBondContact O-N 3.33Å; L454-L458 HydrophobicContact CD1-CD1 4.11Å; L454-L458 HydrophobicContact CD1-CG 4.21Å; L454-L458 HydrophobicContact CG-CD1 4.1Å; L454-L458 VanDerWaalsContact O-CG 3.32Å; L454-L458 WeakPolarHBondContact O-CG 3.45Å; L454-L458 PolarHBondContact O-N 3.24Å
455	W	85	Confident	78.1	Confident	65 Å²	65	82.8 Å²	82.8	25%	0.246	38%	0.375	C	S	.	.	H	α-helix	trans	-62	-46.1	178.6	-179.7	-99.4	0	0	0	111.8	L121 V450 P451 D452 Y457 L458 Q459 V470 L472	L121-W455 HydrophobicContact CD2-CE3 3.78Å; L121-W455 HydrophobicContact CD2-CZ3 3.67Å; V450-W455 HydrophobicContact CG1-CB 4.18Å; P451-W455 PolarHBondContact O-N 2.99Å; D452-W455 PolarHBondContact O-N 3.24Å; W455-Y457 PolarHBondContact O-N 2.81Å; W455-L458 PolarHBondContact O-N 3.47Å; W455-Q459 VanDerWaalsContact NE1-NE2 3.11Å; W455-Q459 WeakPolarHBondContact O-CG 3.31Å; W455-Q459 PolarHBondContact O-N 3.39Å; W455-V470 HydrophobicContact CE3-CG1 3.99Å; W455-V470 HydrophobicContact CH2-CB 4.5Å; W455-V470 HydrophobicContact CH2-CG1 4.06Å; W455-V470 HydrophobicContact CZ3-CB 4.42Å; W455-V470 HydrophobicContact CZ3-CG1 3.52Å; W455-L472 HydrophobicContact CH2-CG 4.3Å; W455-L472 HydrophobicContact CZ3-CD2 4.26Å; W455-L472 HydrophobicContact CZ3-CG 4.02Å
456	Q	86.6	Confident	79.7	Confident	89 Å²	89	77.3 Å²	77.3	42%	0.416	35%	0.35	S	S	.	.	H	α-helix	trans	-59.6	-44.9	175.6	-72.3	167.2	10.2	0	0	111.9	D452 Q459 Q460	D452-Q456 WeakPolarHBondContact O-CB 3.48Å; D452-Q456 WeakPolarHBondContact O-CG 3.28Å; D452-Q456 PolarHBondContact O-N 2.83Å; Q456-Q459 WeakPolarHBondContact O-CB 3.46Å; Q456-Q459 PolarHBondContact O-N 2.96Å; Q456-Q460 WeakPolarHBondContact O-CG 3.14Å; Q456-Q460 PolarHBondContact O-N 2.59Å
457	Y	87.7	Confident	81.3	Confident	7 Å²	7	70.7 Å²	70.7	3%	0.027	32%	0.319	C	S	.	.	H	α-helix	trans	-61.5	-46.2	176.3	179.2	-102	0	0	0	112.1	M148 S154 S158 G453 L454 W455 Q459 Q460 L461	M148-Y457 HydrophobicContact CG-CD2 4.07Å; M148-Y457 HydrophobicContact CG-CE2 3.9Å; M148-Y457 WeakPolarHBondContact O-CD2 3.46Å; S154-Y457 VanDerWaalsContact CB-CD1 3.49Å; S158-Y457 VanDerWaalsContact OG-CE1 3.31Å; S158-Y457 WeakPolarHBondContact OG-CE1 3.31Å; G453-Y457 WeakPolarHBondContact O-CB 3.39Å; G453-Y457 PolarHBondContact O-N 2.89Å; G453-Y457 VanDerWaalsContact O-N 3.16Å; L454-Y457 PolarHBondContact O-N 3.33Å; W455-Y457 PolarHBondContact O-N 2.81Å; Y457-Q459 VanDerWaalsContact C-N 3.31Å; Y457-Q459 PolarHBondContact O-N 2.7Å; Y457-Q460 WeakPolarHBondContact O-CB 3.34Å; Y457-Q460 PolarHBondContact O-N 3.3Å; Y457-Q460 VanDerWaalsContact O-N 3.13Å; 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 2.69Å
458	L	88	Confident	82.4	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.2	-37	176.3	-68.4	173.5	0	0	0	111.9	L121 I123 S158 L161 L454 W455 L461 Q462 V470	L121-L458 HydrophobicContact CD1-CD1 3.98Å; I123-L458 HydrophobicContact CG2-CD1 4.46Å; I123-L458 HydrophobicContact CG2-CD2 4.31Å; S158-L458 WeakPolarHBondContact OG-CD2 3.44Å; L161-L458 HydrophobicContact CD1-CD1 3.96Å; L454-L458 HydrophobicContact CD1-CD1 4.11Å; L454-L458 HydrophobicContact CD1-CG 4.21Å; L454-L458 HydrophobicContact CG-CD1 4.1Å; L454-L458 VanDerWaalsContact O-CG 3.32Å; L454-L458 WeakPolarHBondContact O-CG 3.45Å; L454-L458 PolarHBondContact O-N 3.24Å; W455-L458 PolarHBondContact O-N 3.47Å; L458-L461 HydrophobicContact CD2-CD1 4.49Å; L458-L461 PolarHBondContact O-N 3.1Å; L458-Q462 PolarHBondContact O-N 3.24Å; L458-V470 HydrophobicContact CB-CG1 3.99Å; L458-V470 HydrophobicContact CB-CG2 3.91Å; L458-V470 HydrophobicContact CD1-CG1 4.09Å
459	Q	86.6	Confident	83.4	Confident	70 Å²	70	60 Å²	60	33%	0.327	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-40.5	171.3	-75.3	-174.3	-40.3	0	0	112.4	W455 Q456 Y457 L461 Q462 H463	W455-Q459 VanDerWaalsContact NE1-NE2 3.11Å; W455-Q459 WeakPolarHBondContact O-CG 3.31Å; W455-Q459 PolarHBondContact O-N 3.39Å; Q456-Q459 WeakPolarHBondContact O-CB 3.46Å; Q456-Q459 PolarHBondContact O-N 2.96Å; Y457-Q459 VanDerWaalsContact C-N 3.31Å; Y457-Q459 PolarHBondContact O-N 2.7Å; Q459-L461 PolarHBondContact O-N 3.04Å; Q459-Q462 WeakPolarHBondContact O-CB 3.44Å; Q459-Q462 PolarHBondContact O-N 3.46Å; Q459-Q462 VanDerWaalsContact O-N 3.16Å; Q459-H463 PolarHBondContact O-CD2 2.89Å; Q459-H463 PolarHBondContact O-N 3.47Å
460	Q	86.3	Confident	83.9	Confident	63 Å²	63	56 Å²	56	29%	0.294	26%	0.261	S	S	.	.	H	α-helix	trans	-61.7	-42.5	175.3	-70	178.4	21.9	0	0	111.8	M148 Q456 Y457 Q462 H463 R464	M148-Q460 PolarHBondContact O-NE2 2.66Å; M148-Q460 PolarHBondContact O-OE1 3.34Å; Q456-Q460 WeakPolarHBondContact O-CG 3.14Å; Q456-Q460 PolarHBondContact O-N 2.59Å; Y457-Q460 WeakPolarHBondContact O-CB 3.34Å; Y457-Q460 PolarHBondContact O-N 3.3Å; Y457-Q460 VanDerWaalsContact O-N 3.13Å; Q460-Q462 VanDerWaalsContact C-N 3.31Å; Q460-Q462 PolarHBondContact O-N 3.08Å; Q460-H463 PolarHBondContact O-N 3.45Å; Q460-R464 WeakPolarHBondContact O-CG 3.48Å; Q460-R464 PolarHBondContact O-N 3.32Å
461	L	87.9	Confident	83.9	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-38.7	173.2	-63.8	179.3	0	0	0	111.8	F133 E136 V137 Y457 L458 Q459 R464 R465 L466	F133-L461 HydrophobicContact CD2-CD1 4.33Å; F133-L461 HydrophobicContact CE2-CD1 3.78Å; E136-L461 HydrophobicContact CG-CD2 4.25Å; V137-L461 HydrophobicContact CG2-CD1 3.75Å; V137-L461 HydrophobicContact CG2-CD2 4.4Å; 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 2.69Å; L458-L461 HydrophobicContact CD2-CD1 4.49Å; L458-L461 PolarHBondContact O-N 3.1Å; Q459-L461 PolarHBondContact O-N 3.04Å; L461-R464 CarbonylContact O-C 3.57Å; L461-R464 PolarHBondContact O-N 3.12Å; L461-R465 PolarHBondContact O-N 3.15Å; L461-L466 HydrophobicContact CB-CB 4.47Å; L461-L466 HydrophobicContact CD2-CD1 3.91Å; L461-L466 PolarHBondContact O-N 2.88Å
462	Q	88.4	Confident	83.6	Confident	66 Å²	66	60.2 Å²	60.2	31%	0.308	28%	0.283	S	S	.	.	H	α-helix	trans	-67.5	-41.7	176	-161.2	-172.3	-94.6	0	0	112.1	L458 Q459 Q460 R464 R465 C467 V470	L458-Q462 PolarHBondContact O-N 3.24Å; Q459-Q462 WeakPolarHBondContact O-CB 3.44Å; Q459-Q462 PolarHBondContact O-N 3.46Å; Q459-Q462 VanDerWaalsContact O-N 3.16Å; Q460-Q462 VanDerWaalsContact C-N 3.31Å; Q460-Q462 PolarHBondContact O-N 3.08Å; Q462-R464 VanDerWaalsContact C-N 3.28Å; Q462-R464 PolarHBondContact O-N 3.3Å; Q462-R465 WeakPolarHBondContact O-CA 3.5Å; Q462-R465 PolarHBondContact O-N 2.92Å; Q462-C467 VanDerWaalsContact CA-SG 3.58Å; Q462-C467 PolarHBondContact N-SG 2.89Å; Q462-C467 VanDerWaalsContact N-SG 3.44Å; Q462-V470 HydrophobicContact CB-CG2 4.38Å
463	H	86.3	Confident	82.7	Confident	153 Å²	153	56.5 Å²	56.5	71%	0.708	27%	0.265	S	S	*	.	H	α-helix	trans	-62.6	-35.2	174.1	-77.6	-64	0	0	0	112.2	Q459 Q460 R465	Q459-H463 PolarHBondContact O-CD2 2.89Å; Q459-H463 PolarHBondContact O-N 3.47Å; Q460-H463 PolarHBondContact O-N 3.45Å; H463-R465 PolarHBondContact O-N 3.49Å
464	R	86.2	Confident	81	Confident	110 Å²	110	61.6 Å²	61.6	42%	0.415	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	3.9	171.3	-67.1	-179.1	62.5	-173.8	-9.6	113.8	E136 Q460 L461 Q462 L466	E136-R464 VanDerWaalsContact CD-CZ 3.47Å; E136-R464 IonicContact OE1-CZ 3.52Å; E136-R464 IonicContact OE1-NH1 2.71Å; E136-R464 PolarHBondContact OE1-NH1 3.29Å; E136-R464 IonicContact OE1-NH2 2.8Å; E136-R464 IonicContact OE2-CZ 3.46Å; E136-R464 IonicContact OE2-NH1 3.45Å; E136-R464 PolarHBondContact OE2-NH1 3.09Å; E136-R464 IonicContact OE2-NH2 3.51Å; E136-R464 PolarHBondContact OE2-NH2 2.97Å; Q460-R464 WeakPolarHBondContact O-CG 3.48Å; Q460-R464 PolarHBondContact O-N 3.32Å; L461-R464 CarbonylContact O-C 3.57Å; L461-R464 PolarHBondContact O-N 3.12Å; Q462-R464 VanDerWaalsContact C-N 3.28Å; Q462-R464 PolarHBondContact O-N 3.3Å; R464-L466 HydrophobicContact CB-CD1 4.29Å; R464-L466 HydrophobicContact CB-CG 4.2Å; R464-L466 PolarHBondContact O-N 3.41Å
465	R	86.4	Confident	78.8	Confident	196 Å²	196	65.5 Å²	65.5	74%	0.74	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	15.2	-179.8	-52.5	-177	178.4	-163.9	-2	115	N129 L461 Q462 H463 C467	N129-R465 PolarHBondContact ND2-O 3.16Å; L461-R465 PolarHBondContact O-N 3.15Å; Q462-R465 WeakPolarHBondContact O-CA 3.5Å; Q462-R465 PolarHBondContact O-N 2.92Å; H463-R465 PolarHBondContact O-N 3.49Å; R465-C467 VanDerWaalsContact C-N 3.3Å
466	L	84.6	Confident	76.5	Confident	17 Å²	17	67.1 Å²	67.1	9%	0.089	35%	0.348	C	S	.	.	S	Bend	trans	-74.6	-23.6	179	-61.7	176.4	0	0	0	111.9	D132 F133 E136 L461 R464	D132-L466 HydrophobicContact CB-CD2 3.85Å; F133-L466 HydrophobicContact CB-CB 4.21Å; F133-L466 HydrophobicContact CD2-CB 4.18Å; E136-L466 HydrophobicContact CB-CD1 3.68Å; E136-L466 HydrophobicContact CG-CD1 3.81Å; L461-L466 HydrophobicContact CB-CB 4.47Å; L461-L466 HydrophobicContact CD2-CD1 3.91Å; L461-L466 PolarHBondContact O-N 2.88Å; R464-L466 HydrophobicContact CB-CD1 4.29Å; R464-L466 HydrophobicContact CB-CG 4.2Å; R464-L466 PolarHBondContact O-N 3.41Å
467	C	85.3	Confident	73.9	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.007	37%	0.367	C	S	.	.	S	Bend	trans	-128.6	157	161.9	59.6	0	0	0	0	110.2	Q124 I125 Q462 R465	Q124-C467 CarbonylContact O-C 3.47Å; Q124-C467 WeakPolarHBondContact O-CA 3.47Å; Q124-C467 WeakPolarHBondContact O-CB 3.45Å; I125-C467 HydrophobicContact CG1-CB 4.12Å; Q462-C467 VanDerWaalsContact CA-SG 3.58Å; Q462-C467 PolarHBondContact N-SG 2.89Å; Q462-C467 VanDerWaalsContact N-SG 3.44Å; R465-C467 VanDerWaalsContact C-N 3.3Å
468	H	77.8	Confident	71.3	Confident	78 Å²	78	72.3 Å²	72.3	36%	0.361	40%	0.397	S	S	.	.	S	Bend	trans	-98.1	-32.5	-171.5	-69.3	61.1	0	0	0	112.7	Q124 G126 Y128	Q124-H468 PolarHBondContact O-N 3.46Å; G126-H468 VanDerWaalsContact CA-CE1 3.48Å; G126-H468 WeakPolarHBondContact CA-CE1 3.47Å; G126-H468 PolarHBondContact N-CE1 3.31Å; G126-H468 PolarHBondContact N-ND1 2.7Å; Y128-H468 AromaticContact CZ-NE2 3.67Å; Y128-H468 PolarHBondContact OH-NE2 3.49Å
469	T	75.4	Confident	68.8	Low	57 Å²	57	77.2 Å²	77.2	35%	0.35	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	128.1	-179.9	-62.5	0	0	0	0	109.3	I123 Q124	I123-T469 CarbonylContact C-O 3.57Å; I123-T469 VanDerWaalsContact CA-O 3.31Å; I123-T469 WeakPolarHBondContact CA-O 3.48Å; Q124-T469 PolarHBondContact N-O 3.19Å
470	V	78.2	Confident	66.2	Low	13 Å²	13	82 Å²	82	8%	0.079	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	114.3	163.8	-174.5	0	0	0	0	106.6	L121 I123 W455 L458 Q462	L121-V470 HydrophobicContact CD2-CG1 4.36Å; I123-V470 HydrophobicContact CG2-CG1 4.23Å; I123-V470 HydrophobicContact CG2-CG2 4.18Å; W455-V470 HydrophobicContact CE3-CG1 3.99Å; W455-V470 HydrophobicContact CH2-CB 4.5Å; W455-V470 HydrophobicContact CH2-CG1 4.06Å; W455-V470 HydrophobicContact CZ3-CB 4.42Å; W455-V470 HydrophobicContact CZ3-CG1 3.52Å; L458-V470 HydrophobicContact CB-CG1 3.99Å; L458-V470 HydrophobicContact CB-CG2 3.91Å; L458-V470 HydrophobicContact CD1-CG1 4.09Å; Q462-V470 HydrophobicContact CB-CG2 4.38Å
471	S	75.6	Confident	63.6	Low	43 Å²	43	85.1 Å²	85.1	30%	0.301	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137.7	-176.6	64	0	0	0	0	111.8	L121 S122 T473	L121-S471 WeakPolarHBondContact CA-O 3.5Å; S122-S471 PolarHBondContact N-O 3.26Å; S122-S471 PolarHBondContact O-N 3.17Å; S122-S471 PolarHBondContact OG-OG 3.45Å; S471-T473 PolarHBondContact O-N 3.28Å
472	L	73	Confident	60.8	Low	105 Å²	105	94.2 Å²	94.2	55%	0.55	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	118.1	167.8	-72.2	166.2	0	0	0	108.4	P120 L121 V450 W455	P120-L472 CarbonylContact O-C 3.59Å; P120-L472 VanDerWaalsContact O-CA 3.29Å; P120-L472 WeakPolarHBondContact O-CA 3.22Å; L121-L472 HydrophobicContact CD2-CD2 3.99Å; V450-L472 HydrophobicContact CG2-CD2 3.85Å; W455-L472 HydrophobicContact CH2-CG 4.3Å; W455-L472 HydrophobicContact CZ3-CD2 4.26Å; W455-L472 HydrophobicContact CZ3-CG 4.02Å
473	T	62	Low	58	Low	39 Å²	39	96.8 Å²	96.8	24%	0.239	55%	0.554	C	S	.	*	P	Polyproline II helix	trans	-72.4	121.8	175.8	-43.6	0	0	0	0	108.1	P120 L121 S471 A475	P120-T473 PolarHBondContact O-N 3.15Å; L121-T473 PolarHBondContact N-OG1 2.71Å; S471-T473 PolarHBondContact O-N 3.28Å; T473-A475 PolarHBondContact O-N 2.94Å
474	P	48.1	Very low	55.3	Low	115 Å²	115	97.1 Å²	97.1	75%	0.747	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-62	131.7	174.5	26.5	-33.2	0	0	0	108.9
475	A	40.5	Very low	52.5	Low	84 Å²	84	100.1 Å²	100.1	69%	0.694	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-56.8	140.2	176.4	0	0	0	0	0	109.9	T473	T473-A475 PolarHBondContact O-N 2.94Å
476	P	35.7	Very low	49.8	Very low	99 Å²	99	95 Å²	95	64%	0.643	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-57.4	133.6	175	25.1	-33.5	0	0	0	108.9	A478	P476-A478 PolarHBondContact O-N 3.09Å; P476-A478 VanDerWaalsContact O-N 3.12Å
477	P	32.1	Very low	47.1	Very low	124 Å²	124	102.4 Å²	102.4	81%	0.805	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-60.9	122	180	24.9	-33.1	0	0	0	108.7	A479	P477-A479 PolarHBondContact O-N 3.15Å
478	A	33.4	Very low	44.3	Very low	81 Å²	81	110.4 Å²	110.4	67%	0.669	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-53.5	130.8	178.4	0	0	0	0	0	109.6	P476 M480	P476-A478 PolarHBondContact O-N 3.09Å; P476-A478 VanDerWaalsContact O-N 3.12Å; A478-M480 PolarHBondContact O-N 3.28Å
479	A	35.6	Very low	41.8	Very low	103 Å²	103	114.4 Å²	114.4	85%	0.851	67%	0.67	S	S	*	*			trans	-70.6	75.3	-177.5	0	0	0	0	0	110.8	P477 T481	P477-A479 PolarHBondContact O-N 3.15Å; A479-T481 PolarHBondContact O-N 3.01Å; A479-T481 VanDerWaalsContact O-N 3.08Å
480	M	31.7	Very low	39.4	Very low	171 Å²	171	114.9 Å²	114.9	84%	0.842	69%	0.687	S	S	*	*			trans	-67.2	109.9	176.2	-90.5	-169.2	-85.6	0	0	109.8	A478 H482	A478-M480 PolarHBondContact O-N 3.28Å; M480-H482 PolarHBondContact O-N 3.41Å
481	T	31.5	Very low	36.8	Very low	129 Å²	129	118.7 Å²	118.7	79%	0.791	72%	0.719	S	S	*	*			trans	-41.8	129.9	169.3	47.6	0	0	0	0	111.9	A479 S483	A479-T481 PolarHBondContact O-N 3.01Å; A479-T481 VanDerWaalsContact O-N 3.08Å; T481-S483 PolarHBondContact O-N 2.67Å; T481-S483 VanDerWaalsContact O-N 3.14Å
482	H	28.9	Very low	34.3	Very low	195 Å²	195	121.9 Å²	121.9	90%	0.903	74%	0.742	S	S	*	*			trans	-52.5	119	175	-72.4	-95.5	0	0	0	111.4	M480	M480-H482 PolarHBondContact O-N 3.41Å
483	S	28.8	Very low	32	Very low	120 Å²	120	124.5 Å²	124.5	84%	0.839	76%	0.757	S	S	*	*			trans	-124.3	108.9	162.3	-168.7	0	0	0	0	108.4	T481	T481-S483 PolarHBondContact O-N 2.67Å; T481-S483 VanDerWaalsContact O-N 3.14Å
484	M	30.8	Very low	30.1	Very low	159 Å²	159	126.8 Å²	126.8	78%	0.783	78%	0.779	S	S	*	*			trans	-82	130.9	177.9	-73.5	-96.6	-73.7	0	0	109.8
485	H	27.8	Very low	30	Very low	174 Å²	174	130.5 Å²	130.5	81%	0.806	79%	0.786	S	S	*	*				-179.1	132.1	122	-100	78.4	0	0	0	112.7
486	A	29.3	Very low	29.3	Very low	87 Å²	87	137.2 Å²	137.2	72%	0.719	80%	0.795	S	S	*	*			trans	44.5	144.6	131.2	0	0	0	0	0	121.1
487	M	26.6	Very low	28.9	Very low	174 Å²	174	139.9 Å²	139.9	86%	0.857	80%	0.799	S	S	*	*			cis	-129.8	150.4	19.7	-71.9	-177.8	-68.5	0	0	110.2
488	H	27.1	Very low	28.6	Very low	169 Å²	169	140.7 Å²	140.7	78%	0.782	79%	0.792	S	S	*	*			cis	77.4	104.3	47.5	-168.7	85.2	0	0	0	115.1
489	I	25.3	Very low	28.4	Very low	161 Å²	161	144.3 Å²	144.3	83%	0.826	80%	0.795	S	S	*	*			trans	176.8	145.2	136.7	-94.5	160.6	0	0	0	110.3
490	G	25.8	Very low	27.9	Very low	68 Å²	68	146 Å²	146	70%	0.701	79%	0.785	S	S	*	*			trans	96.4	85	178	0	0	0	0	0	113.7
491	A	22.6	Very low	27.7	Very low	92 Å²	92	144.5 Å²	144.5	76%	0.76	78%	0.776	S	S	*	*			cis	92.8	145.5	26.2	0	0	0	0	0	114.9
492	S	23.6	Very low	27.4	Very low	110 Å²	110	144.5 Å²	144.5	77%	0.769	77%	0.767	S	S	*	*			trans	75.1	135	-163.3	73.7	0	0	0	0	115.5
493	D	24.1	Very low	27.3	Very low	161 Å²	161	142 Å²	142	86%	0.861	76%	0.756	S	S	*	*			cis	-152	162.5	-14.1	-118.9	-35.6	0	0	0	114.6
494	A	23.5	Very low	27	Very low	87 Å²	87	143.7 Å²	143.7	72%	0.719	75%	0.75	S	S	*	*			trans	-91.9	170.8	172.3	0	0	0	0	0	112
495	H	44.7	Very low	26.8	Very low	193 Å²	193	144.6 Å²	144.6	89%	0.894	75%	0.752	S	S	*	*	S	Bend	trans	-69.6	159.8	175.7	-77.9	30.5	0	0	0	113
496	Y	26.2	Very low	26.4	Very low	224 Å²	224	143.6 Å²	143.6	88%	0.878	75%	0.753	S	S	*	*	S	Bend	trans	-36.2	124.6	-173.8	-84	-100.2	0	0	0	117.1
497	H	27.7	Very low	27.1	Very low	155 Å²	155	144.7 Å²	144.7	72%	0.718	75%	0.753	S	S	*	*			trans	50.8	111.5	147.2	-87.5	-96.6	0	0	0	121.6
498	Q	25.6	Very low	27	Very low	142 Å²	142	144.2 Å²	144.2	66%	0.664	75%	0.752	S	S	*	*				94	102.9	112.4	-165.1	170	-32.6	0	0	122
499	H	29.7	Very low	26.8	Very low	156 Å²	156	142.4 Å²	142.4	72%	0.722	75%	0.753	S	S	*	*			trans	71.8	153.6	145.3	-62.5	-9.7	0	0	0	118.7
500	Q	23.7	Very low	26.7	Very low	139 Å²	139	145.9 Å²	145.9	65%	0.65	76%	0.755	S	S	*	*			cis	-159.5	152.2	-0.2	-128.9	178	3.3	0	0	112.3
501	H	28.9	Very low	26.6	Very low	140 Å²	140	148 Å²	148	65%	0.648	76%	0.759	S	S	*	*			trans	66.7	155.6	150	-66.9	-21.8	0	0	0	120.5
502	Q	25.1	Very low	26.6	Very low	128 Å²	128	149.6 Å²	149.6	60%	0.598	76%	0.759	S	S	*	*			cis	-167.1	155.8	-11.3	-114.7	178	47.3	0	0	113.6
503	Q	25.6	Very low	26.8	Very low	144 Å²	144	148.7 Å²	148.7	67%	0.673	75%	0.753	S	S	*	*			trans	64.6	163.2	151.4	-65.1	-174.3	42.8	0	0	120.4
504	Q	24.3	Very low	26.9	Very low	154 Å²	154	149 Å²	149	72%	0.72	75%	0.749	S	S	*	*			cis	-168.2	174.9	-28.6	-104.7	-175.2	17.5	0	0	111
505	Q	24.7	Very low	27	Very low	178 Å²	178	150.1 Å²	150.1	83%	0.832	75%	0.747	S	S	*	*			trans	110.7	155.4	149.4	-55.9	-160.7	-1.8	0	0	121.9
506	N	21.1	Very low	26.1	Very low	154 Å²	154	146.6 Å²	146.6	82%	0.824	74%	0.74	S	S	*	*			trans	-161.1	174.8	-171.7	-118.5	-11.9	0	0	0	106.3
507	P	43.9	Very low	26.1	Very low	110 Å²	110	143.4 Å²	143.4	71%	0.714	74%	0.737	S	S	*	*			cis	-134.2	-170.7	-27.2	41.8	-24.6	0	0	0	113
508	I	23.5	Very low	26	Very low	163 Å²	163	142.6 Å²	142.6	84%	0.836	74%	0.743	S	S	*	*			trans	-161.3	161.7	156.8	-129.8	171	0	0	0	114.1
509	V	24.2	Very low	25.9	Very low	132 Å²	132	141.1 Å²	141.1	80%	0.8	75%	0.749	S	S	*	*			trans	-149	142.6	-176	-175.5	0	0	0	0	113.6
510	R	23.3	Very low	25.8	Very low	234 Å²	234	141.5 Å²	141.5	88%	0.883	75%	0.754	S	S	*	*			trans	179.1	156.7	164.5	-100.1	157.3	-168.4	147.6	5.3	109.3
511	S	22	Very low	26.2	Very low	111 Å²	111	140.5 Å²	140.5	78%	0.776	76%	0.76	S	S	*	*			cis	-159.7	-169.6	-15.4	-158.6	0	0	0	0	110.4
512	V	24.1	Very low	25.9	Very low	127 Å²	127	139.8 Å²	139.8	77%	0.77	77%	0.765	S	S	*	*			trans	-120.3	154.7	-160.5	-86.1	0	0	0	0	118.1
513	S	27.7	Very low	26.1	Very low	91 Å²	91	140.6 Å²	140.6	64%	0.636	78%	0.779	S	S	*	*			trans	85.1	126.2	136.6	-78.9	0	0	0	0	125.9
514	Q	25.6	Very low	26.1	Very low	166 Å²	166	141.6 Å²	141.6	78%	0.776	78%	0.784	S	S	*	*				96.1	140	120	-75.6	175.1	64.7	0	0	126.7
515	T	26.1	Very low	26	Very low	111 Å²	111	144.6 Å²	144.6	68%	0.681	80%	0.795	S	S	*	*			trans	81.8	101.2	137.2	45	0	0	0	0	127.3
516	T	25.6	Very low	26	Very low	120 Å²	120	139.9 Å²	139.9	74%	0.736	79%	0.794	S	S	*	*				59.3	130.4	115.8	58.4	0	0	0	0	127.8
517	L	26.1	Very low	26.3	Very low	156 Å²	156	140.2 Å²	140.2	82%	0.817	80%	0.795	S	S	*	*				95.3	156.3	127.9	-81.4	170.4	0	0	0	124.4
518	T	25.1	Very low	25.6	Very low	139 Å²	139	140.1 Å²	140.1	85%	0.853	80%	0.798	S	S	*	*			trans	77.2	158.1	-176	78.9	0	0	0	0	115.3
519	S	22.9	Very low	25.8	Very low	111 Å²	111	143 Å²	143	78%	0.776	81%	0.805	S	S	*	*			cis	-148.2	173.1	0.1	62.5	0	0	0	0	111.2
520	I	27.8	Very low	26.1	Very low	163 Å²	163	140.6 Å²	140.6	84%	0.836	81%	0.806	S	S	*	*			trans	-146.8	139.3	-175.5	-49.1	179	0	0	0	113.1
521	P	32	Very low	26.5	Very low	118 Å²	118	134.5 Å²	134.5	77%	0.766	80%	0.8	S	S	*	*			trans	-113.6	-156.9	173.1	39.9	-28.5	0	0	0	114.6
522	T	24.3	Very low	27.4	Very low	126 Å²	126	133.9 Å²	133.9	77%	0.773	80%	0.801	S	S	*	*			trans	-155	139.9	-174.1	-59.4	0	0	0	0	115.4
523	T	27.8	Very low	28	Very low	144 Å²	144	133.6 Å²	133.6	88%	0.883	80%	0.799	S	S	*	*			trans	-151.5	151.2	148.9	38.7	0	0	0	0	110.3
524	Q	26	Very low	28.7	Very low	166 Å²	166	133.8 Å²	133.8	78%	0.776	80%	0.801	S	S	*	*			trans	-107.8	148.1	-178.1	-60	174.1	0.9	0	0	112.2
525	F	21.7	Very low	30.2	Very low	217 Å²	217	130.1 Å²	130.1	95%	0.952	79%	0.786	S	S	*	*				167.7	133.3	129.8	-103.5	-73.4	0	0	0	111.3
526	G	24.7	Very low	32.1	Very low	78 Å²	78	128.7 Å²	128.7	80%	0.804	78%	0.777	S	S	*	*			trans	103.3	78.2	160.7	0	0	0	0	0	117.6
527	D	27.5	Very low	34.9	Very low	161 Å²	161	127.2 Å²	127.2	86%	0.861	76%	0.764	S	S	*	*			trans	-78.6	136.2	164.9	-73	-59.8	0	0	0	112
528	S	29.1	Very low	37.8	Very low	109 Å²	109	121.5 Å²	121.5	76%	0.762	74%	0.737	S	S	*	*			trans	150.6	88.3	132.7	-69.7	0	0	0	0	113.7
529	F	28.8	Very low	40.9	Very low	224 Å²	224	122.3 Å²	122.3	98%	0.982	73%	0.729	S	S	*	*	S	Bend	trans	-156.4	132.4	136.1	-100.6	-68.3	0	0	0	108.7
530	G	29.4	Very low	44.2	Very low	80 Å²	80	117.1 Å²	117.1	83%	0.825	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-70	129.4	-163.7	0	0	0	0	0	114.5
531	S	32.5	Very low	47.1	Very low	107 Å²	107	111.5 Å²	111.5	75%	0.748	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-60.7	148.2	176.1	-173.9	0	0	0	0	112.7
532	A	39.8	Very low	49.8	Very low	98 Å²	98	106 Å²	106	81%	0.81	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-59	141.2	156.8	0	0	0	0	0	109.8
533	V	37.7	Very low	52.7	Low	121 Å²	121	107.6 Å²	107.6	73%	0.733	62%	0.622	S	S	*	*			trans	-124.6	133.1	176.5	-176.9	0	0	0	0	108.3
534	S	42.9	Very low	55.2	Low	95 Å²	95	102.6 Å²	102.6	66%	0.664	59%	0.588	S	S	*	*			trans	-67	161.2	-172.5	-169.8	0	0	0	0	113.9	T536	S534-T536 PolarHBondContact O-N 3.32Å
535	D	56	Low	57.3	Low	88 Å²	88	98.6 Å²	98.6	47%	0.471	57%	0.572	S	S	.	*			trans	-72.3	62.4	176.4	-87.7	46.1	0	0	0	112.3	I537 R627	D535-I537 PolarHBondContact O-N 3.38Å; D535-R627 VanDerWaalsContact CG-NH2 3.28Å; D535-R627 IonicContact OD1-CZ 2.92Å; D535-R627 VanDerWaalsContact OD1-CZ 3.27Å; D535-R627 IonicContact OD1-NH1 2.65Å; D535-R627 PolarHBondContact OD1-NH1 3.47Å; D535-R627 IonicContact OD1-NH2 3.61Å; D535-R627 PolarHBondContact OD1-NH2 2.95Å; D535-R627 IonicContact OD2-CZ 3.12Å; D535-R627 IonicContact OD2-NH1 3.82Å; D535-R627 PolarHBondContact OD2-NH1 3.22Å; D535-R627 IonicContact OD2-NH2 2.67Å; D535-R627 PolarHBondContact OD2-NH2 3.38Å
536	T	66.1	Low	59.2	Low	81 Å²	81	91.7 Å²	91.7	50%	0.497	56%	0.562	S	S	.	*			trans	-75.2	89.9	-178.9	50.3	0	0	0	0	112.1	S534 S538	S534-T536 PolarHBondContact O-N 3.32Å; T536-S538 PolarHBondContact O-N 3.32Å; T536-S538 PolarHBondContact O-OG 2.74Å
537	I	83.8	Confident	61.1	Low	90 Å²	90	89.4 Å²	89.4	46%	0.462	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	118.5	164.6	-59.4	175.8	0	0	0	108.3	D535 L590 D619 V620	D535-I537 PolarHBondContact O-N 3.38Å; I537-L590 HydrophobicContact CD1-CD1 3.78Å; I537-L590 HydrophobicContact CG1-CD1 3.96Å; I537-L590 HydrophobicContact CG2-CD1 3.99Å; I537-D619 HydrophobicContact CG2-CB 4.05Å; I537-V620 WeakPolarHBondContact CA-O 3.43Å
538	S	87.2	Confident	63.6	Low	36 Å²	36	82 Å²	82	25%	0.252	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127.8	-177.7	-60.4	0	0	0	0	110.1	T536 V620	T536-S538 PolarHBondContact O-N 3.32Å; T536-S538 PolarHBondContact O-OG 2.74Å; S538-V620 PolarHBondContact N-O 3.2Å; S538-V620 PolarHBondContact O-N 3.32Å
539	K	90.5	Very high	66.3	Low	155 Å²	155	77 Å²	77	67%	0.674	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	120.8	170.7	-70.8	-176.1	-177.7	-65.6	0	109.8	F618 D619	K539-F618 WeakPolarHBondContact CA-O 3.35Å; K539-D619 WeakPolarHBondContact CG-OD1 3.36Å; K539-D619 IonicContact NZ-OD1 2.89Å; K539-D619 PolarHBondContact NZ-OD1 3.24Å; K539-D619 IonicContact NZ-OD2 3.2Å
540	V	92.3	Very high	69	Low	3 Å²	3	66.9 Å²	66.9	2%	0.018	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	116.7	-179.7	-176.7	0	0	0	0	109.5	L542 R582 L583 F618 V620	V540-L542 HydrophobicContact CG1-CD2 4.03Å; V540-L542 HydrophobicContact CG1-CG 4.14Å; V540-R582 HydrophobicContact CG1-CB 4.25Å; V540-R582 HydrophobicContact CG2-CB 4.16Å; V540-L583 HydrophobicContact CB-CD2 4.1Å; V540-L583 HydrophobicContact CG1-CD1 4.5Å; V540-L583 HydrophobicContact CG1-CD2 4.05Å; V540-L583 HydrophobicContact CG1-CG 4.1Å; V540-L583 HydrophobicContact CG2-CD2 3.89Å; V540-F618 PolarHBondContact N-O 3.28Å; V540-F618 PolarHBondContact O-N 2.77Å; V540-V620 HydrophobicContact CB-CG2 4.46Å; V540-V620 HydrophobicContact CG2-CG2 4.27Å
541	T	89.9	Confident	71.9	Confident	44 Å²	44	63.6 Å²	63.6	27%	0.27	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.6	174.5	-52.7	0	0	0	0	109.3	R582 E615 V616 H617	T541-R582 PolarHBondContact O-NH2 3.5Å; T541-R582 VanDerWaalsContact O-NH2 3.07Å; T541-E615 HydrophobicContact CG2-CG 3.43Å; T541-E615 VanDerWaalsContact CG2-CG 3.43Å; T541-E615 WeakPolarHBondContact CG2-OE1 3.21Å; T541-V616 WeakPolarHBondContact CA-O 3.36Å; T541-H617 WeakPolarHBondContact CG2-NE2 3.48Å; T541-H617 PolarHBondContact OG1-CD2 3.47Å
542	L	88.6	Confident	74.5	Confident	4 Å²	4	59 Å²	59	2%	0.021	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	137.6	176.2	-62	-176.6	0	0	0	110.6	V540 I549 A577 D580 L583 E615 V616 F618	V540-L542 HydrophobicContact CG1-CD2 4.03Å; V540-L542 HydrophobicContact CG1-CG 4.14Å; L542-I549 HydrophobicContact CB-CG2 4.41Å; L542-I549 HydrophobicContact CD1-CG2 3.6Å; L542-A577 HydrophobicContact CD1-CB 3.82Å; L542-D580 HydrophobicContact CD2-CB 3.35Å; L542-L583 HydrophobicContact CD1-CD1 3.73Å; L542-E615 WeakPolarHBondContact O-CA 3.31Å; L542-V616 PolarHBondContact N-O 3.2Å; L542-V616 PolarHBondContact O-N 3.29Å; L542-F618 HydrophobicContact CD1-CE2 4.27Å
543	R	84	Confident	77	Confident	159 Å²	159	54.6 Å²	54.6	60%	0.6	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	130.5	172.1	-62.5	-177.8	69.8	-167.3	3.8	109.4	P576 N614 E615	R543-P576 VanDerWaalsContact O-CB 3.25Å; R543-P576 WeakPolarHBondContact O-CB 3.33Å; R543-N614 CarbonylContact C-O 3.56Å; R543-N614 WeakPolarHBondContact CA-O 3.24Å; R543-E615 HydrophobicContact CG-CB 4.36Å; R543-E615 HydrophobicContact CG-CG 4.03Å; R543-E615 WeakPolarHBondContact CG-OE1 3.29Å
544	K	80.2	Confident	79.5	Confident	39 Å²	39	49.3 Å²	49.3	17%	0.17	29%	0.286	C	S	.	.			trans	-67.1	149.9	177.4	-66.7	-174.9	-178	177.5	0	109.8	I549 M609 T610 S612 G613 N614 V616	K544-I549 HydrophobicContact CD-CG1 4.46Å; K544-I549 HydrophobicContact CG-CG1 3.94Å; K544-M609 VanDerWaalsContact CE-O 3.31Å; K544-M609 WeakPolarHBondContact CE-O 3.46Å; K544-M609 PolarHBondContact NZ-O 3.1Å; K544-T610 PolarHBondContact NZ-O 3.35Å; K544-S612 PolarHBondContact NZ-O 3.42Å; K544-G613 VanDerWaalsContact CD-O 3.29Å; K544-G613 WeakPolarHBondContact CD-O 3.44Å; K544-G613 VanDerWaalsContact CE-O 3.24Å; K544-G613 WeakPolarHBondContact CE-O 3.42Å; K544-N614 PolarHBondContact N-O 3.32Å; K544-N614 PolarHBondContact O-OD1 3.11Å; K544-V616 HydrophobicContact CD-CG2 4.37Å; K544-V616 VanDerWaalsContact CE-CG2 3.5Å; K544-V616 HydrophobicContact CG-CG2 4.1Å
545	N	70.8	Confident	81.8	Confident	81 Å²	81	45.7 Å²	45.7	43%	0.433	26%	0.262	S	S	.	.	B	Isolated β-bridge	trans	-114.3	-177	161.4	73.9	6.9	0	0	0	110	G547 G548 P576	N545-G547 PolarHBondContact O-N 3.46Å; N545-G547 WeakPolarHBondContact OD1-CA 3.44Å; N545-G547 PolarHBondContact OD1-N 3.16Å; N545-G548 PolarHBondContact N-O 3.13Å; N545-G548 PolarHBondContact O-N 2.91Å; N545-G548 PolarHBondContact OD1-N 3.13Å; N545-G548 PolarHBondContact OD1-O 3.16Å; N545-P576 HydrophobicContact CB-CG 4.01Å
546	G	62.1	Low	83.2	Confident	73 Å²	73	42 Å²	42	75%	0.753	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	0.6	176.9	0	0	0	0	0	115.6	P787	G546-P787 WeakPolarHBondContact O-CD 3.36Å; G546-P787 WeakPolarHBondContact O-CG 3.15Å
547	G	64.6	Low	84.2	Confident	30 Å²	30	42.6 Å²	42.6	31%	0.309	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	13.5	173.3	0	0	0	0	0	114.1	N545 I785	N545-G547 PolarHBondContact O-N 3.46Å; N545-G547 WeakPolarHBondContact OD1-CA 3.44Å; N545-G547 PolarHBondContact OD1-N 3.16Å; G547-I785 VanDerWaalsContact O-O 3.06Å
548	G	78.8	Confident	83.8	Confident	5 Å²	5	38.6 Å²	38.6	5%	0.052	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	97.2	-149.7	175.9	0	0	0	0	0	114.8	N545	N545-G548 PolarHBondContact N-O 3.13Å; N545-G548 PolarHBondContact O-N 2.91Å; N545-G548 PolarHBondContact OD1-N 3.13Å; N545-G548 PolarHBondContact OD1-O 3.16Å
549	I	85.6	Confident	82.6	Confident	4 Å²	4	43 Å²	43	2%	0.021	25%	0.247	C	C	.	.			trans	-95.1	-34.9	177.7	-54.3	173.4	0	0	0	111.1	L542 K544 L551 A577 M609 V616 F618	L542-I549 HydrophobicContact CB-CG2 4.41Å; L542-I549 HydrophobicContact CD1-CG2 3.6Å; K544-I549 HydrophobicContact CD-CG1 4.46Å; K544-I549 HydrophobicContact CG-CG1 3.94Å; I549-L551 HydrophobicContact CG2-CD1 4.01Å; I549-L551 HydrophobicContact CG2-CG 4.12Å; I549-A577 VanDerWaalsContact O-CB 3.32Å; I549-A577 WeakPolarHBondContact O-CB 3.17Å; I549-A577 PolarHBondContact O-N 3.43Å; I549-A577 VanDerWaalsContact O-N 3.09Å; I549-M609 HydrophobicContact CD1-CB 4.14Å; I549-V616 HydrophobicContact CD1-CB 4.35Å; I549-V616 HydrophobicContact CD1-CG1 4.21Å; I549-V616 HydrophobicContact CD1-CG2 3.95Å; I549-V616 HydrophobicContact CG1-CG2 4.45Å; I549-F618 HydrophobicContact CD1-CZ 4.15Å
550	G	86.8	Confident	80.8	Confident	11 Å²	11	39.3 Å²	39.3	11%	0.113	25%	0.252	C	S	.	.			trans	89.1	20.9	-179.5	0	0	0	0	0	116.3	V572 T575	G550-V572 WeakPolarHBondContact O-CB 3.06Å; G550-V572 WeakPolarHBondContact O-CG2 3.38Å; G550-V572 PolarHBondContact O-N 2.83Å; G550-T575 WeakPolarHBondContact CA-OG1 3.39Å
551	L	89.1	Confident	79.6	Confident	12 Å²	12	41.3 Å²	41.3	6%	0.063	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	134.4	173.5	-64.6	172.3	0	0	0	110.9	I549 I553 V568 V571 A577 L583 L589 F618	I549-L551 HydrophobicContact CG2-CD1 4.01Å; I549-L551 HydrophobicContact CG2-CG 4.12Å; L551-I553 HydrophobicContact CB-CG2 4.32Å; L551-V568 HydrophobicContact CD2-CG1 4.08Å; L551-V568 HydrophobicContact CD2-CG2 4.48Å; L551-V571 HydrophobicContact CD2-CG1 4.39Å; L551-V571 HydrophobicContact CD2-CG2 3.97Å; L551-A577 HydrophobicContact CD2-CB 3.67Å; L551-A577 HydrophobicContact CG-CB 3.91Å; L551-L583 HydrophobicContact CD1-CD1 3.65Å; L551-L583 HydrophobicContact CD2-CB 4.4Å; L551-L583 HydrophobicContact CD2-CD1 3.82Å; L551-L583 HydrophobicContact CG-CD1 4.28Å; L551-L589 HydrophobicContact CD1-CD1 4.45Å; L551-F618 HydrophobicContact CD1-CE2 4.41Å; L551-F618 HydrophobicContact CD1-CZ 4.3Å
552	S	88.8	Confident	78.5	Confident	10 Å²	10	49.8 Å²	49.8	7%	0.07	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	117.3	159.8	-175.2	0	0	0	0	108.2	K569 K570 P782	S552-K569 PolarHBondContact O-N 3.49Å; S552-K570 WeakPolarHBondContact CB-O 3.2Å; S552-K570 PolarHBondContact N-O 3.09Å; S552-K570 PolarHBondContact O-N 2.88Å; S552-P782 WeakPolarHBondContact OG-CB 3.47Å
553	I	92.3	Very high	77.9	Confident	6 Å²	6	55.3 Å²	55.3	3%	0.031	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	158.5	-179.1	61.2	167.1	0	0	0	111.4	L551 I566 Y567 L589 Q602 A605 A606 M609	L551-I553 HydrophobicContact CB-CG2 4.32Å; I553-I566 HydrophobicContact CB-CG2 3.93Å; I553-I566 HydrophobicContact CD1-CG2 3.92Å; I553-I566 HydrophobicContact CG1-CG2 4.48Å; I553-I566 HydrophobicContact CG2-CG2 4.17Å; I553-Y567 CarbonylContact C-O 3.59Å; I553-Y567 WeakPolarHBondContact CA-O 3.46Å; I553-L589 HydrophobicContact CG2-CD1 3.98Å; I553-Q602 HydrophobicContact CD1-CG 4.49Å; I553-Q602 HydrophobicContact CG1-CG 4.35Å; I553-A605 HydrophobicContact CD1-CB 3.83Å; I553-A606 HydrophobicContact CD1-CB 4.44Å; I553-M609 HydrophobicContact CD1-CE 3.89Å; I553-M609 HydrophobicContact CD1-SD 4.07Å; I553-M609 HydrophobicContact CG2-CE 4.41Å; I553-M609 HydrophobicContact CG2-SD 4.4Å
554	V	89.1	Confident	77.8	Confident	9 Å²	9	51.1 Å²	51.1	6%	0.055	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	147.3	168.7	-70	0	0	0	0	111	Y567 K569 W633 L634	V554-Y567 PolarHBondContact N-O 2.9Å; V554-Y567 PolarHBondContact O-N 2.72Å; V554-K569 HydrophobicContact CG1-CB 4.15Å; V554-K569 HydrophobicContact CG1-CD 3.69Å; V554-K569 HydrophobicContact CG2-CB 4.11Å; V554-W633 HydrophobicContact CB-CH2 3.96Å; V554-W633 HydrophobicContact CB-CZ3 4.15Å; V554-W633 HydrophobicContact CG1-CH2 4.41Å; V554-W633 HydrophobicContact CG2-CH2 3.85Å; V554-W633 HydrophobicContact CG2-CZ3 3.51Å; V554-L634 HydrophobicContact CG2-CD2 3.55Å
555	A	90.9	Very high	78.3	Confident	20 Å²	20	49.3 Å²	49.3	17%	0.165	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	132.7	168.3	0	0	0	0	0	110.1	M564 G565 I566 Q602	A555-M564 HydrophobicContact CB-CE 3.75Å; A555-G565 WeakPolarHBondContact CA-O 3.22Å; A555-I566 HydrophobicContact CB-CD1 3.84Å; A555-Q602 HydrophobicContact CB-CB 3.96Å
556	A	85.3	Confident	79.4	Confident	9 Å²	9	45.5 Å²	45.5	7%	0.074	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	156.6	177.7	0	0	0	0	0	112	G565 Y567 L630 W633	A556-G565 PolarHBondContact N-O 3.19Å; A556-G565 PolarHBondContact O-N 3.48Å; A556-Y567 HydrophobicContact CB-CD2 4.04Å; A556-Y567 HydrophobicContact CB-CE2 4.2Å; A556-Y567 WeakPolarHBondContact O-CE2 3.31Å; A556-L630 HydrophobicContact CB-CD1 3.85Å; A556-L630 HydrophobicContact CB-CD2 4.2Å; A556-W633 HydrophobicContact CB-CE3 4.3Å; A556-W633 HydrophobicContact CB-CH2 4.16Å; A556-W633 HydrophobicContact CB-CZ3 3.66Å
557	Q	87.5	Confident	80.9	Confident	95 Å²	95	42 Å²	42	44%	0.444	24%	0.239	S	C	.	.			trans	-107.4	127.8	173.3	-171.2	172.3	5.8	0	0	109.7	D561 M564	Q557-D561 HydrophobicContact CG-CB 4.31Å; Q557-D561 WeakPolarHBondContact CG-O 3.42Å; Q557-D561 PolarHBondContact NE2-O 2.99Å; Q557-M564 HydrophobicContact CB-SD 3.75Å
558	G	74.8	Confident	82.3	Confident	6 Å²	6	40.6 Å²	40.6	6%	0.062	23%	0.225	C	C	.	.			trans	-73.4	159.1	176.1	0	0	0	0	0	113.4	G560 D561 N628	G558-G560 PolarHBondContact O-N 2.96Å; G558-D561 VanDerWaalsContact CA-OD2 3.3Å; G558-D561 WeakPolarHBondContact CA-OD2 3.39Å; G558-D561 PolarHBondContact N-OD2 3.08Å; G558-D561 PolarHBondContact O-N 3Å; G558-D561 VanDerWaalsContact O-N 3.09Å; G558-N628 CarbonylContact C-O 3.59Å; G558-N628 VanDerWaalsContact CA-O 3.27Å; G558-N628 WeakPolarHBondContact CA-O 3.3Å
559	V	61.9	Low	82.8	Confident	129 Å²	129	43.6 Å²	43.6	78%	0.782	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	103.8	171.7	-177.7	0	0	0	0	108.8	N628	V559-N628 PolarHBondContact N-O 3.43Å
560	G	54.6	Low	83	Confident	76 Å²	76	46.6 Å²	46.6	78%	0.784	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	99.9	-9	-175.8	0	0	0	0	0	115.2	G558	G558-G560 PolarHBondContact O-N 2.96Å
561	D	67.2	Low	83.2	Confident	46 Å²	46	47.3 Å²	47.3	25%	0.246	25%	0.251	C	S	.	.			trans	-73.4	133.6	170.1	-75.9	-35.2	0	0	0	109.9	Q557 G558 Q563 Y567 N628	Q557-D561 HydrophobicContact CG-CB 4.31Å; Q557-D561 WeakPolarHBondContact CG-O 3.42Å; Q557-D561 PolarHBondContact NE2-O 2.99Å; G558-D561 VanDerWaalsContact CA-OD2 3.3Å; G558-D561 WeakPolarHBondContact CA-OD2 3.39Å; G558-D561 PolarHBondContact N-OD2 3.08Å; G558-D561 PolarHBondContact O-N 3Å; G558-D561 VanDerWaalsContact O-N 3.09Å; D561-Q563 VanDerWaalsContact C-N 3.34Å; D561-Y567 PolarHBondContact OD2-OH 3.42Å; D561-N628 PolarHBondContact OD1-ND2 3.38Å; D561-N628 PolarHBondContact OD2-ND2 3.04Å
562	R	64.9	Low	83.1	Confident	221 Å²	221	49.2 Å²	49.2	83%	0.834	26%	0.263	S	S	*	.	S	Bend	trans	-83.4	-5.4	174.8	-69.7	-173.3	175.4	-169.8	-3.3	114.4
563	Q	76.3	Confident	82.9	Confident	120 Å²	120	56 Å²	56	56%	0.561	29%	0.294	S	S	*	.	S	Bend	trans	-141.9	151.6	-173.5	-70.1	179.2	-30.3	0	0	110.9	D561 I598	D561-Q563 VanDerWaalsContact C-N 3.34Å; Q563-I598 HydrophobicContact CB-CG2 4.01Å; Q563-I598 VanDerWaalsContact OE1-CG2 3.31Å
564	M	81.5	Confident	82.3	Confident	72 Å²	72	58.4 Å²	58.4	36%	0.355	32%	0.32	S	S	.	.			trans	-62.9	141.4	172	-67.6	-69.3	-76.5	0	0	110.7	A555 Q557 G599	A555-M564 HydrophobicContact CB-CE 3.75Å; Q557-M564 HydrophobicContact CB-SD 3.75Å; M564-G599 PolarHBondContact O-N 3.17Å
565	G	90.6	Very high	82.2	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.01	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	153.2	172.7	0	0	0	0	0	111.7	A555 A556 Y567	A555-G565 WeakPolarHBondContact CA-O 3.22Å; A556-G565 PolarHBondContact N-O 3.19Å; A556-G565 PolarHBondContact O-N 3.48Å; G565-Y567 VanDerWaalsContact O-CD2 3.25Å; G565-Y567 WeakPolarHBondContact O-CD2 3.46Å; G565-Y567 WeakPolarHBondContact O-CE2 3.38Å
566	I	95	Very high	82	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.2	175.6	-56.6	-60.5	0	0	0	109.4	I553 A555 Q588 L589 L597 A605 M609	I553-I566 HydrophobicContact CB-CG2 3.93Å; I553-I566 HydrophobicContact CD1-CG2 3.92Å; I553-I566 HydrophobicContact CG1-CG2 4.48Å; I553-I566 HydrophobicContact CG2-CG2 4.17Å; A555-I566 HydrophobicContact CB-CD1 3.84Å; I566-Q588 CarbonylContact O-C 3.45Å; I566-Q588 WeakPolarHBondContact O-CA 3.4Å; I566-L589 HydrophobicContact CG2-CB 4.5Å; I566-L589 HydrophobicContact CG2-CD1 4.32Å; I566-L589 PolarHBondContact O-N 3.46Å; I566-L597 HydrophobicContact CB-CB 4.38Å; I566-L597 HydrophobicContact CG1-CB 4.06Å; I566-L597 WeakPolarHBondContact CG1-O 3.22Å; I566-A605 HydrophobicContact CD1-CB 3.56Å; I566-A605 HydrophobicContact CG1-CB 3.64Å; I566-A605 HydrophobicContact CG2-CB 4.19Å; I566-M609 HydrophobicContact CG2-CE 4.19Å
567	Y	94.3	Very high	82.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	144.7	-177.7	-64	-95.5	0	0	0	111.5	I553 V554 A556 D561 G565 K569 D587 Q588 A624 A625 N628 L630 L634	I553-Y567 CarbonylContact C-O 3.59Å; I553-Y567 WeakPolarHBondContact CA-O 3.46Å; V554-Y567 PolarHBondContact N-O 2.9Å; V554-Y567 PolarHBondContact O-N 2.72Å; A556-Y567 HydrophobicContact CB-CD2 4.04Å; A556-Y567 HydrophobicContact CB-CE2 4.2Å; A556-Y567 WeakPolarHBondContact O-CE2 3.31Å; D561-Y567 PolarHBondContact OD2-OH 3.42Å; G565-Y567 VanDerWaalsContact O-CD2 3.25Å; G565-Y567 WeakPolarHBondContact O-CD2 3.46Å; G565-Y567 WeakPolarHBondContact O-CE2 3.38Å; Y567-K569 PolarHBondContact O-N 2.86Å; Y567-D587 CarbonylContact C-O 3.43Å; Y567-D587 VanDerWaalsContact CA-O 3.32Å; Y567-D587 WeakPolarHBondContact CA-O 3.32Å; Y567-Q588 HydrophobicContact CD1-CB 3.81Å; Y567-Q588 HydrophobicContact CD1-CG 4.29Å; Y567-Q588 HydrophobicContact CE1-CB 3.69Å; Y567-Q588 HydrophobicContact CE1-CG 3.98Å; Y567-A624 HydrophobicContact CE1-CB 3.98Å; Y567-A625 HydrophobicContact CD1-CB 4.16Å; Y567-A625 HydrophobicContact CE1-CB 4.45Å; Y567-N628 PolarHBondContact OH-ND2 3.36Å; Y567-L630 HydrophobicContact CD2-CD1 4.12Å; Y567-L630 HydrophobicContact CE1-CD1 4.02Å; Y567-L630 HydrophobicContact CE2-CD1 3.58Å; Y567-L634 HydrophobicContact CD1-CD1 4.42Å; Y567-L634 HydrophobicContact CG-CD1 4.33Å
568	V	94	Very high	82.1	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	113.4	172.9	-179.8	0	0	0	0	109	L551 V571 E584 T585 G586 D587 L589	L551-V568 HydrophobicContact CD2-CG1 4.08Å; L551-V568 HydrophobicContact CD2-CG2 4.48Å; V568-V571 HydrophobicContact CG1-CG2 3.86Å; V568-E584 WeakPolarHBondContact CB-O 3.04Å; V568-T585 WeakPolarHBondContact O-CA 3.42Å; V568-G586 PolarHBondContact O-N 3.41Å; V568-D587 HydrophobicContact CG2-CB 4.24Å; V568-D587 PolarHBondContact N-O 2.96Å; V568-L589 HydrophobicContact CG2-CD1 4.27Å; V568-L589 HydrophobicContact CG2-CD2 3.97Å; V568-L589 HydrophobicContact CG2-CG 4.07Å
569	K	89.5	Confident	82.7	Confident	68 Å²	68	62.5 Å²	62.5	30%	0.296	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-44.6	176.1	-179	162	-178.4	161.7	0	112.4	S552 V554 Y567 T585 L634	S552-K569 PolarHBondContact O-N 3.49Å; V554-K569 HydrophobicContact CG1-CB 4.15Å; V554-K569 HydrophobicContact CG1-CD 3.69Å; V554-K569 HydrophobicContact CG2-CB 4.11Å; Y567-K569 PolarHBondContact O-N 2.86Å; K569-T585 WeakPolarHBondContact O-CG2 3.42Å; K569-T585 PolarHBondContact O-OG1 3.33Å; K569-L634 HydrophobicContact CB-CD2 3.82Å; K569-L634 HydrophobicContact CG-CD2 4.19Å
570	K	89.4	Confident	83.9	Confident	68 Å²	68	58.8 Å²	58.8	30%	0.296	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	137.2	173.7	179.3	159.4	-177.4	164.3	0	110.5	S552 E573 T585	S552-K570 WeakPolarHBondContact CB-O 3.2Å; S552-K570 PolarHBondContact N-O 3.09Å; S552-K570 PolarHBondContact O-N 2.88Å; K570-E573 IonicContact NZ-OE1 3.54Å; K570-T585 WeakPolarHBondContact CA-OG1 3.49Å
571	V	90.3	Very high	85.4	Confident	25 Å²	25	57.4 Å²	57.4	15%	0.152	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	131.3	162.1	-170.7	0	0	0	0	107.7	L551 V568 A577 A578 L583	L551-V571 HydrophobicContact CD2-CG1 4.39Å; L551-V571 HydrophobicContact CD2-CG2 3.97Å; V568-V571 HydrophobicContact CG1-CG2 3.86Å; V571-A577 HydrophobicContact CG1-CB 3.74Å; V571-A578 HydrophobicContact CG1-CB 3.97Å; V571-L583 HydrophobicContact CG2-CB 4.44Å; V571-L583 WeakPolarHBondContact CG2-O 3.31Å
572	V	87.8	Confident	86.4	Confident	52 Å²	52	60.5 Å²	60.5	32%	0.315	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-89	123.9	-175.5	-178	0	0	0	0	109.5	G550 T575 A578	G550-V572 WeakPolarHBondContact O-CB 3.06Å; G550-V572 WeakPolarHBondContact O-CG2 3.38Å; G550-V572 PolarHBondContact O-N 2.83Å; V572-T575 HydrophobicContact CB-CG2 3.77Å; V572-T575 HydrophobicContact CG1-CG2 3.77Å; V572-T575 WeakPolarHBondContact O-CB 3.25Å; V572-T575 WeakPolarHBondContact O-CG2 3.32Å; V572-T575 PolarHBondContact O-N 3.37Å; V572-T575 PolarHBondContact O-OG1 3.05Å; V572-A578 WeakPolarHBondContact O-CB 3.47Å
573	E	84.1	Confident	87.7	Confident	153 Å²	153	50.3 Å²	50.3	72%	0.715	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	145	179.5	-68.5	152.9	-125.5	0	0	111.9	K570 T575	K570-E573 IonicContact NZ-OE1 3.54Å; E573-T575 VanDerWaalsContact C-N 3.29Å; E573-T575 PolarHBondContact O-N 3.48Å
574	G	79.1	Confident	88.4	Confident	56 Å²	56	48.5 Å²	48.5	58%	0.577	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	12.2	-177.9	0	0	0	0	0	115.8
575	T	87.1	Confident	88.8	Confident	20 Å²	20	48.3 Å²	48.3	12%	0.123	27%	0.268	C	S	.	.	S	Bend	trans	-109.8	166.4	178.7	70.6	0	0	0	0	112.4	G550 V572 E573 A577 A578 H579	G550-T575 WeakPolarHBondContact CA-OG1 3.39Å; V572-T575 HydrophobicContact CB-CG2 3.77Å; V572-T575 HydrophobicContact CG1-CG2 3.77Å; V572-T575 WeakPolarHBondContact O-CB 3.25Å; V572-T575 WeakPolarHBondContact O-CG2 3.32Å; V572-T575 PolarHBondContact O-N 3.37Å; V572-T575 PolarHBondContact O-OG1 3.05Å; E573-T575 VanDerWaalsContact C-N 3.29Å; E573-T575 PolarHBondContact O-N 3.48Å; T575-A577 VanDerWaalsContact C-N 3.27Å; T575-A577 PolarHBondContact O-N 3.32Å; T575-A578 PolarHBondContact O-N 3.3Å; T575-H579 PolarHBondContact O-CD2 3.44Å; T575-H579 PolarHBondContact O-N 2.99Å
576	P	86.2	Confident	88.7	Confident	20 Å²	20	48.5 Å²	48.5	13%	0.13	27%	0.27	C	S	.	.	H	α-helix	trans	-55.3	-38.4	179.9	-27.5	36.8	0	0	0	113.9	R543 N545 H579 D580	R543-P576 VanDerWaalsContact O-CB 3.25Å; R543-P576 WeakPolarHBondContact O-CB 3.33Å; N545-P576 HydrophobicContact CB-CG 4.01Å; P576-H579 PolarHBondContact O-N 2.86Å; P576-D580 VanDerWaalsContact O-CB 3.28Å; P576-D580 WeakPolarHBondContact O-CB 3.37Å; P576-D580 PolarHBondContact O-N 3.32Å
577	A	89.1	Confident	88.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.9	-36.2	175.9	0	0	0	0	0	113.3	L542 I549 L551 V571 T575 G581	L542-A577 HydrophobicContact CD1-CB 3.82Å; I549-A577 VanDerWaalsContact O-CB 3.32Å; I549-A577 WeakPolarHBondContact O-CB 3.17Å; I549-A577 PolarHBondContact O-N 3.43Å; I549-A577 VanDerWaalsContact O-N 3.09Å; L551-A577 HydrophobicContact CD2-CB 3.67Å; L551-A577 HydrophobicContact CG-CB 3.91Å; V571-A577 HydrophobicContact CG1-CB 3.74Å; T575-A577 VanDerWaalsContact C-N 3.27Å; T575-A577 PolarHBondContact O-N 3.32Å; A577-G581 PolarHBondContact O-N 3.49Å
578	A	87.6	Confident	88.6	Confident	36 Å²	36	48.8 Å²	48.8	30%	0.298	27%	0.271	S	S	.	.	H	α-helix	trans	-74.5	-35.9	175.5	0	0	0	0	0	112.7	V571 V572 T575 G581	V571-A578 HydrophobicContact CG1-CB 3.97Å; V572-A578 WeakPolarHBondContact O-CB 3.47Å; T575-A578 PolarHBondContact O-N 3.3Å; A578-G581 PolarHBondContact O-N 3.17Å
579	H	85.8	Confident	88.6	Confident	149 Å²	149	48.8 Å²	48.8	69%	0.69	27%	0.271	S	S	*	.	H	α-helix	trans	-72.9	-32.2	177.4	-72.1	-58.1	0	0	0	113.3	T575 P576	T575-H579 PolarHBondContact O-CD2 3.44Å; T575-H579 PolarHBondContact O-N 2.99Å; P576-H579 PolarHBondContact O-N 2.86Å
580	D	87.1	Confident	88.8	Confident	51 Å²	51	46.7 Å²	46.7	27%	0.273	26%	0.263	S	S	.	.	H	α-helix	trans	-71.4	-34.3	171.6	-177.5	-92	0	0	0	112	L542 P576 R582	L542-D580 HydrophobicContact CD2-CB 3.35Å; P576-D580 VanDerWaalsContact O-CB 3.28Å; P576-D580 WeakPolarHBondContact O-CB 3.37Å; P576-D580 PolarHBondContact O-N 3.32Å; D580-R582 VanDerWaalsContact CG-NE 3.35Å; D580-R582 PolarHBondContact O-N 3.35Å; D580-R582 VanDerWaalsContact OD1-CB 3.22Å; D580-R582 WeakPolarHBondContact OD1-CB 3.29Å; D580-R582 WeakPolarHBondContact OD1-CG 3.14Å; D580-R582 IonicContact OD1-CZ 2.69Å; D580-R582 PolarHBondContact OD1-N 2.96Å; D580-R582 IonicContact OD1-NE 3.46Å; D580-R582 PolarHBondContact OD1-NE 3.35Å; D580-R582 IonicContact OD1-NH2 3.15Å; D580-R582 PolarHBondContact OD1-NH2 3.46Å; D580-R582 IonicContact OD2-CZ 2.61Å; D580-R582 IonicContact OD2-NE 2.89Å; D580-R582 PolarHBondContact OD2-NE 3.34Å; D580-R582 VanDerWaalsContact OD2-NE 3.15Å; D580-R582 IonicContact OD2-NH2 3.98Å; D580-R582 PolarHBondContact OD2-NH2 2.89Å
581	G	86	Confident	89	Confident	48 Å²	48	43.9 Å²	43.9	50%	0.495	25%	0.252	S	S	.	.			trans	69.6	-9.5	172.6	0	0	0	0	0	115.7	A577 A578 L583	A577-G581 PolarHBondContact O-N 3.49Å; A578-G581 PolarHBondContact O-N 3.17Å; G581-L583 VanDerWaalsContact C-N 3.26Å; G581-L583 PolarHBondContact O-N 2.72Å
582	R	89.2	Confident	89.2	Confident	111 Å²	111	42.7 Å²	42.7	42%	0.419	25%	0.245	S	C	.	.			trans	-80.7	4	-177.9	-57.5	177	-69.5	170.9	-7.3	114.2	V540 T541 D580 K622	V540-R582 HydrophobicContact CG1-CB 4.25Å; V540-R582 HydrophobicContact CG2-CB 4.16Å; T541-R582 PolarHBondContact O-NH2 3.5Å; T541-R582 VanDerWaalsContact O-NH2 3.07Å; D580-R582 VanDerWaalsContact CG-NE 3.35Å; D580-R582 PolarHBondContact O-N 3.35Å; D580-R582 VanDerWaalsContact OD1-CB 3.22Å; D580-R582 WeakPolarHBondContact OD1-CB 3.29Å; D580-R582 WeakPolarHBondContact OD1-CG 3.14Å; D580-R582 IonicContact OD1-CZ 2.69Å; D580-R582 PolarHBondContact OD1-N 2.96Å; D580-R582 IonicContact OD1-NE 3.46Å; D580-R582 PolarHBondContact OD1-NE 3.35Å; D580-R582 IonicContact OD1-NH2 3.15Å; D580-R582 PolarHBondContact OD1-NH2 3.46Å; D580-R582 IonicContact OD2-CZ 2.61Å; D580-R582 IonicContact OD2-NE 2.89Å; D580-R582 PolarHBondContact OD2-NE 3.34Å; D580-R582 VanDerWaalsContact OD2-NE 3.15Å; D580-R582 IonicContact OD2-NH2 3.98Å; D580-R582 PolarHBondContact OD2-NH2 2.89Å; R582-K622 PolarHBondContact O-NZ 3.01Å
583	L	91.3	Very high	89.3	Confident	7 Å²	7	42.8 Å²	42.8	4%	0.037	24%	0.244	C	C	.	.			trans	-116.4	135	173.2	-60.9	-178	0	0	0	110.1	V540 L542 L551 V571 G581 V620	V540-L583 HydrophobicContact CB-CD2 4.1Å; V540-L583 HydrophobicContact CG1-CD1 4.5Å; V540-L583 HydrophobicContact CG1-CD2 4.05Å; V540-L583 HydrophobicContact CG1-CG 4.1Å; V540-L583 HydrophobicContact CG2-CD2 3.89Å; L542-L583 HydrophobicContact CD1-CD1 3.73Å; L551-L583 HydrophobicContact CD1-CD1 3.65Å; L551-L583 HydrophobicContact CD2-CB 4.4Å; L551-L583 HydrophobicContact CD2-CD1 3.82Å; L551-L583 HydrophobicContact CG-CD1 4.28Å; V571-L583 HydrophobicContact CG2-CB 4.44Å; V571-L583 WeakPolarHBondContact CG2-O 3.31Å; G581-L583 VanDerWaalsContact C-N 3.26Å; G581-L583 PolarHBondContact O-N 2.72Å; L583-V620 HydrophobicContact CD2-CB 4.46Å; L583-V620 HydrophobicContact CD2-CG1 4.08Å; L583-V620 HydrophobicContact CD2-CG2 3.85Å
584	E	91.1	Very high	89.4	Confident	81 Å²	81	38.8 Å²	38.8	38%	0.379	24%	0.244	S	C	.	.			trans	-121.6	154.8	-179.2	-62.7	-177.2	159.6	0	0	110.4	V568 G586 D587 R623	V568-E584 WeakPolarHBondContact CB-O 3.04Å; E584-G586 PolarHBondContact O-N 3.5Å; E584-D587 PolarHBondContact N-OD2 3Å; E584-D587 WeakPolarHBondContact O-CB 3.46Å; E584-D587 PolarHBondContact O-N 3.43Å; E584-R623 IonicContact OE1-NH2 3.32Å; E584-R623 IonicContact OE2-CZ 3.82Å; E584-R623 IonicContact OE2-NE 3.57Å; E584-R623 PolarHBondContact OE2-NE 2.87Å; E584-R623 IonicContact OE2-NH2 3.81Å; E584-R623 PolarHBondContact OE2-NH2 3.42Å
585	T	90.1	Very high	89.8	Confident	68 Å²	68	41.7 Å²	41.7	42%	0.417	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	130.3	166.9	-75.4	0	0	0	0	109.7	V568 K569 K570 L634	V568-T585 WeakPolarHBondContact O-CA 3.42Å; K569-T585 WeakPolarHBondContact O-CG2 3.42Å; K569-T585 PolarHBondContact O-OG1 3.33Å; K570-T585 WeakPolarHBondContact CA-OG1 3.49Å; T585-L634 HydrophobicContact CG2-CB 4.39Å
586	G	88	Confident	90	Very high	6 Å²	6	44 Å²	44	6%	0.062	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	-2.6	-176.6	0	0	0	0	0	115.1	V568 E584 R623 A624 A625	V568-G586 PolarHBondContact O-N 3.41Å; E584-G586 PolarHBondContact O-N 3.5Å; G586-R623 CarbonylContact O-C 3.56Å; G586-A624 PolarHBondContact O-N 3.02Å; G586-A624 VanDerWaalsContact O-N 3.16Å; G586-A625 VanDerWaalsContact O-CB 3.25Å; G586-A625 WeakPolarHBondContact O-CB 3.48Å; G586-A625 PolarHBondContact O-N 3.09Å
587	D	94.2	Very high	90.2	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.253	C	S	.	.			trans	-68.6	146.4	165.4	-75.4	-24.1	0	0	0	111.6	Y567 V568 E584 V620 K622 R623	Y567-D587 CarbonylContact C-O 3.43Å; Y567-D587 VanDerWaalsContact CA-O 3.32Å; Y567-D587 WeakPolarHBondContact CA-O 3.32Å; V568-D587 HydrophobicContact CG2-CB 4.24Å; V568-D587 PolarHBondContact N-O 2.96Å; E584-D587 PolarHBondContact N-OD2 3Å; E584-D587 WeakPolarHBondContact O-CB 3.46Å; E584-D587 PolarHBondContact O-N 3.43Å; D587-V620 HydrophobicContact CB-CG1 3.76Å; D587-K622 VanDerWaalsContact OD1-CA 3.3Å; D587-K622 WeakPolarHBondContact OD1-CA 3.46Å; D587-K622 IonicContact OD1-NZ 3.87Å; D587-K622 IonicContact OD2-NZ 3.49Å; D587-K622 PolarHBondContact OD2-NZ 2.91Å; D587-R623 PolarHBondContact OD1-N 3.22Å
588	Q	93.9	Very high	90.3	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.028	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.1	171	-177.8	-174.4	29.3	0	0	109.8	I566 Y567 L590 V620 R621 A624	I566-Q588 CarbonylContact O-C 3.45Å; I566-Q588 WeakPolarHBondContact O-CA 3.4Å; Y567-Q588 HydrophobicContact CD1-CB 3.81Å; Y567-Q588 HydrophobicContact CD1-CG 4.29Å; Y567-Q588 HydrophobicContact CE1-CB 3.69Å; Y567-Q588 HydrophobicContact CE1-CG 3.98Å; Q588-L590 HydrophobicContact CG-CD2 3.95Å; Q588-V620 CarbonylContact O-C 3.58Å; Q588-V620 WeakPolarHBondContact O-CA 3.41Å; Q588-R621 HydrophobicContact CB-CB 4.35Å; Q588-R621 PolarHBondContact N-O 2.94Å; Q588-R621 VanDerWaalsContact N-O 3.08Å; Q588-R621 PolarHBondContact O-N 2.85Å; Q588-A624 HydrophobicContact CB-CB 3.39Å
589	L	94.8	Very high	90.1	Very high	0 Å²	0	46 Å²	46	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	115.6	172.8	-52	179	0	0	0	107.6	L551 I553 I566 V568 L597 M609 F618 V620	L551-L589 HydrophobicContact CD1-CD1 4.45Å; I553-L589 HydrophobicContact CG2-CD1 3.98Å; I566-L589 HydrophobicContact CG2-CB 4.5Å; I566-L589 HydrophobicContact CG2-CD1 4.32Å; I566-L589 PolarHBondContact O-N 3.46Å; V568-L589 HydrophobicContact CG2-CD1 4.27Å; V568-L589 HydrophobicContact CG2-CD2 3.97Å; V568-L589 HydrophobicContact CG2-CG 4.07Å; L589-L597 HydrophobicContact CB-CD1 3.51Å; L589-L597 WeakPolarHBondContact O-CB 3.46Å; L589-M609 HydrophobicContact CD1-CE 3.64Å; L589-M609 HydrophobicContact CD1-SD 4.41Å; L589-F618 HydrophobicContact CD1-CD1 4.2Å; L589-F618 HydrophobicContact CD1-CE1 4.07Å; L589-F618 HydrophobicContact CD2-CB 4.47Å; L589-F618 HydrophobicContact CD2-CD1 4.21Å; L589-F618 HydrophobicContact CD2-CG 4.41Å; L589-V620 HydrophobicContact CD2-CG1 4.27Å; L589-V620 HydrophobicContact CD2-CG2 3.77Å
590	L	93.5	Very high	90.1	Very high	23 Å²	23	41.1 Å²	41.1	12%	0.12	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-34.4	-177.8	-52.4	179.7	0	0	0	111.9	I537 Q588 L597 I598 D619 R621	I537-L590 HydrophobicContact CD1-CD1 3.78Å; I537-L590 HydrophobicContact CG1-CD1 3.96Å; I537-L590 HydrophobicContact CG2-CD1 3.99Å; Q588-L590 HydrophobicContact CG-CD2 3.95Å; L590-L597 PolarHBondContact O-N 3.36Å; L590-I598 HydrophobicContact CD2-CD1 3.96Å; L590-D619 HydrophobicContact CB-CB 4.23Å; L590-D619 WeakPolarHBondContact CB-O 3.28Å; L590-D619 PolarHBondContact N-O 3.02Å; L590-R621 HydrophobicContact CD1-CB 4.16Å; L590-R621 HydrophobicContact CD2-CB 4.03Å; L590-R621 HydrophobicContact CG-CB 4.22Å
591	S	93.4	Very high	90.1	Very high	9 Å²	9	40.7 Å²	40.7	6%	0.063	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	160.5	178.7	82.8	0	0	0	0	111.7	H595 F618 D619	S591-H595 CarbonylContact C-O 3.59Å; S591-H595 WeakPolarHBondContact CA-O 3.44Å; S591-H595 WeakPolarHBondContact CB-O 3.3Å; S591-F618 WeakPolarHBondContact O-CA 3.43Å; S591-F618 WeakPolarHBondContact O-CD1 3.24Å; S591-D619 PolarHBondContact N-O 3.23Å; S591-D619 WeakPolarHBondContact OG-CB 3.41Å; S591-D619 VanDerWaalsContact OG-CG 3.31Å; S591-D619 PolarHBondContact OG-N 2.64Å; S591-D619 PolarHBondContact OG-OD2 3.4Å
592	V	93.9	Very high	90.3	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	121.7	163	64.8	0	0	0	0	110.1	G594 H595 L597 L608 M609 V616 H617 F618	V592-G594 PolarHBondContact O-N 3.05Å; V592-H595 PolarHBondContact N-O 3.01Å; V592-H595 WeakPolarHBondContact O-CB 3.49Å; V592-H595 PolarHBondContact O-N 3.49Å; V592-L597 HydrophobicContact CB-CD1 4.14Å; V592-L597 HydrophobicContact CB-CD2 4.38Å; V592-L597 HydrophobicContact CB-CG 4.39Å; V592-L597 HydrophobicContact CG1-CD1 4.37Å; V592-L597 HydrophobicContact CG1-CD2 3.71Å; V592-L597 HydrophobicContact CG1-CG 4.16Å; V592-L608 HydrophobicContact CG1-CB 3.72Å; V592-L608 HydrophobicContact CG1-CD1 4.37Å; V592-M609 HydrophobicContact CG2-CG 4.07Å; V592-V616 HydrophobicContact CG2-CG1 3.4Å; V592-V616 VanDerWaalsContact CG2-CG1 3.4Å; V592-H617 CarbonylContact C-O 3.59Å; V592-H617 WeakPolarHBondContact CA-O 3.16Å; V592-F618 HydrophobicContact CB-CD1 4.09Å; V592-F618 HydrophobicContact CB-CE1 3.97Å; V592-F618 HydrophobicContact CG2-CD1 4.09Å; V592-F618 HydrophobicContact CG2-CE1 3.66Å; V592-F618 HydrophobicContact CG2-CZ 4.22Å
593	N	89.9	Confident	90.2	Very high	54 Å²	54	39.5 Å²	39.5	29%	0.289	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.5	35	-175.5	-73.9	-36.4	0	0	0	113.6	S612 H617	N593-S612 VanDerWaalsContact ND2-CB 3.27Å; N593-S612 WeakPolarHBondContact ND2-CB 3.48Å; N593-S612 PolarHBondContact ND2-OG 3.01Å; N593-H617 PolarHBondContact N-O 3.18Å; N593-H617 PolarHBondContact OD1-N 3.01Å; N593-H617 PolarHBondContact OD1-ND1 2.98Å
594	G	85.5	Confident	89.9	Confident	69 Å²	69	42 Å²	42	71%	0.711	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	-12.5	-178.3	0	0	0	0	0	115.6	V592	V592-G594 PolarHBondContact O-N 3.05Å
595	H	88.2	Confident	89.8	Confident	116 Å²	116	38.1 Å²	38.1	54%	0.537	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	131.1	172	-63.3	-78.5	0	0	0	110.6	S591 V592 L608	S591-H595 CarbonylContact C-O 3.59Å; S591-H595 WeakPolarHBondContact CA-O 3.44Å; S591-H595 WeakPolarHBondContact CB-O 3.3Å; V592-H595 PolarHBondContact N-O 3.01Å; V592-H595 WeakPolarHBondContact O-CB 3.49Å; V592-H595 PolarHBondContact O-N 3.49Å; H595-L608 HydrophobicContact CB-CD1 4.41Å
596	S	91	Very high	89.7	Confident	69 Å²	69	35.3 Å²	35.3	48%	0.483	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	138.4	175.3	-177.6	0	0	0	0	111.5	I598	S596-I598 PolarHBondContact OG-N 2.78Å; S596-I598 VanDerWaalsContact OG-N 3.12Å
597	L	91	Very high	89.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.24	C	C	.	.			trans	-104.2	4.5	169.5	-65.4	176.5	0	0	0	112.2	I566 L589 L590 V592 I600 A605 L608 M609	I566-L597 HydrophobicContact CB-CB 4.38Å; I566-L597 HydrophobicContact CG1-CB 4.06Å; I566-L597 WeakPolarHBondContact CG1-O 3.22Å; L589-L597 HydrophobicContact CB-CD1 3.51Å; L589-L597 WeakPolarHBondContact O-CB 3.46Å; L590-L597 PolarHBondContact O-N 3.36Å; V592-L597 HydrophobicContact CB-CD1 4.14Å; V592-L597 HydrophobicContact CB-CD2 4.38Å; V592-L597 HydrophobicContact CB-CG 4.39Å; V592-L597 HydrophobicContact CG1-CD1 4.37Å; V592-L597 HydrophobicContact CG1-CD2 3.71Å; V592-L597 HydrophobicContact CG1-CG 4.16Å; L597-I600 HydrophobicContact CD2-CD1 3.68Å; L597-A605 HydrophobicContact CD2-CB 3.97Å; L597-L608 HydrophobicContact CD2-CD1 4.28Å; L597-M609 HydrophobicContact CD1-CE 3.74Å; L597-M609 HydrophobicContact CD2-CE 4.27Å
598	I	90.2	Very high	89.3	Confident	52 Å²	52	43.9 Å²	43.9	27%	0.267	25%	0.252	S	S	.	.	S	Bend	trans	-84.2	130.9	176.2	-49.6	-56.4	0	0	0	109.5	Q563 L590 S596	Q563-I598 HydrophobicContact CB-CG2 4.01Å; Q563-I598 VanDerWaalsContact OE1-CG2 3.31Å; L590-I598 HydrophobicContact CD2-CD1 3.96Å; S596-I598 PolarHBondContact OG-N 2.78Å; S596-I598 VanDerWaalsContact OG-N 3.12Å
599	G	83.1	Confident	89	Confident	45 Å²	45	43.7 Å²	43.7	46%	0.464	25%	0.251	S	S	.	.	S	Bend	trans	84.3	-2.1	176.9	0	0	0	0	0	116	M564	M564-G599 PolarHBondContact O-N 3.17Å
600	I	86	Confident	88.4	Confident	47 Å²	47	47.1 Å²	47.1	24%	0.241	27%	0.272	C	S	.	.			trans	-99.3	164.3	-176.2	73.1	171	0	0	0	113.3	L597 D604 A605 L608	L597-I600 HydrophobicContact CD2-CD1 3.68Å; I600-D604 HydrophobicContact CB-CB 4.28Å; I600-D604 HydrophobicContact CD1-CB 4.08Å; I600-D604 HydrophobicContact CG1-CB 4.47Å; I600-A605 HydrophobicContact CD1-CB 4.07Å; I600-A605 HydrophobicContact CG1-CB 4.44Å; I600-L608 HydrophobicContact CD1-CD1 3.79Å
601	S	87.5	Confident	87.8	Confident	42 Å²	42	53.3 Å²	53.3	29%	0.294	30%	0.3	S	S	.	.			trans	-70.7	162	177.1	74.9	0	0	0	0	113.1	E603 D604 A605	S601-E603 PolarHBondContact O-N 3.11Å; S601-E603 PolarHBondContact OG-N 2.97Å; S601-D604 PolarHBondContact O-N 3.02Å; S601-D604 WeakPolarHBondContact OG-CB 3.39Å; S601-D604 PolarHBondContact OG-N 2.82Å; S601-D604 PolarHBondContact OG-OD2 3.28Å; S601-A605 WeakPolarHBondContact O-CB 3.42Å; S601-A605 PolarHBondContact O-N 3.33Å
602	Q	89.9	Confident	87.1	Confident	28 Å²	28	53.9 Å²	53.9	13%	0.131	30%	0.304	C	S	.	.	H	α-helix	trans	-62.7	-36.8	173.1	-174.5	-174.7	-62.8	0	0	110.6	I553 A555 A605 A606 T783	I553-Q602 HydrophobicContact CD1-CG 4.49Å; I553-Q602 HydrophobicContact CG1-CG 4.35Å; A555-Q602 HydrophobicContact CB-CB 3.96Å; Q602-A605 PolarHBondContact O-N 3.34Å; Q602-A606 VanDerWaalsContact O-CB 3.31Å; Q602-A606 WeakPolarHBondContact O-CB 3.38Å; Q602-A606 PolarHBondContact O-N 2.89Å; Q602-T783 PolarHBondContact NE2-OG1 3.22Å; Q602-T783 VanDerWaalsContact NE2-OG1 3.12Å
603	E	87.3	Confident	86.3	Confident	107 Å²	107	56 Å²	56	50%	0.5	33%	0.327	S	S	.	.	H	α-helix	trans	-66	-43.1	179.1	-68	60.7	-138.9	0	0	110.8	S601 A606 R607	S601-E603 PolarHBondContact O-N 3.11Å; S601-E603 PolarHBondContact OG-N 2.97Å; E603-A606 PolarHBondContact O-N 2.57Å; E603-R607 WeakPolarHBondContact O-CB 3.25Å; E603-R607 VanDerWaalsContact O-CG 3.3Å; E603-R607 WeakPolarHBondContact O-CG 3.44Å; E603-R607 PolarHBondContact O-N 3.45Å
604	D	86.2	Confident	85.9	Confident	58 Å²	58	58.4 Å²	58.4	31%	0.31	34%	0.34	S	S	.	.	H	α-helix	trans	-67.9	-43	175.3	-70.9	-51.2	0	0	0	112.3	I600 S601 A606 R607 L608	I600-D604 HydrophobicContact CB-CB 4.28Å; I600-D604 HydrophobicContact CD1-CB 4.08Å; I600-D604 HydrophobicContact CG1-CB 4.47Å; S601-D604 PolarHBondContact O-N 3.02Å; S601-D604 WeakPolarHBondContact OG-CB 3.39Å; S601-D604 PolarHBondContact OG-N 2.82Å; S601-D604 PolarHBondContact OG-OD2 3.28Å; D604-A606 VanDerWaalsContact C-N 3.31Å; D604-A606 PolarHBondContact O-N 2.96Å; D604-R607 PolarHBondContact O-N 3.35Å; D604-R607 IonicContact OD1-CZ 2.78Å; D604-R607 IonicContact OD1-NE 2.98Å; D604-R607 PolarHBondContact OD1-NE 3.34Å; D604-R607 IonicContact OD1-NH2 2.69Å; D604-R607 PolarHBondContact OD1-NH2 3.26Å; D604-R607 IonicContact OD2-NH2 3.18Å; D604-L608 WeakPolarHBondContact O-CG 3.5Å; D604-L608 PolarHBondContact O-N 3.27Å
605	A	88.8	Confident	85.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-58.7	-44.4	173.3	0	0	0	0	0	111.4	I553 I566 L597 I600 S601 Q602 L608 M609	I553-A605 HydrophobicContact CD1-CB 3.83Å; I566-A605 HydrophobicContact CD1-CB 3.56Å; I566-A605 HydrophobicContact CG1-CB 3.64Å; I566-A605 HydrophobicContact CG2-CB 4.19Å; L597-A605 HydrophobicContact CD2-CB 3.97Å; I600-A605 HydrophobicContact CD1-CB 4.07Å; I600-A605 HydrophobicContact CG1-CB 4.44Å; S601-A605 WeakPolarHBondContact O-CB 3.42Å; S601-A605 PolarHBondContact O-N 3.33Å; Q602-A605 PolarHBondContact O-N 3.34Å; A605-L608 PolarHBondContact O-N 3.44Å; A605-M609 HydrophobicContact CB-CE 4.15Å; A605-M609 WeakPolarHBondContact O-CB 3.25Å; A605-M609 VanDerWaalsContact O-CG 3.24Å; A605-M609 WeakPolarHBondContact O-CG 3.41Å; A605-M609 PolarHBondContact O-N 3.03Å
606	A	87.2	Confident	86	Confident	9 Å²	9	53.9 Å²	53.9	7%	0.074	30%	0.3	C	S	.	.	H	α-helix	trans	-65.5	-38.5	174.7	0	0	0	0	0	112.4	I553 Q602 E603 D604 T610 T783	I553-A606 HydrophobicContact CD1-CB 4.44Å; Q602-A606 VanDerWaalsContact O-CB 3.31Å; Q602-A606 WeakPolarHBondContact O-CB 3.38Å; Q602-A606 PolarHBondContact O-N 2.89Å; E603-A606 PolarHBondContact O-N 2.57Å; D604-A606 VanDerWaalsContact C-N 3.31Å; D604-A606 PolarHBondContact O-N 2.96Å; A606-T610 VanDerWaalsContact O-CB 3.24Å; A606-T610 WeakPolarHBondContact O-CB 3.42Å; A606-T610 PolarHBondContact O-N 3.33Å; A606-T610 PolarHBondContact O-OG1 3.03Å; A606-T783 HydrophobicContact CB-CG2 4.25Å
607	R	86	Confident	86	Confident	140 Å²	140	54.8 Å²	54.8	53%	0.528	30%	0.297	S	S	.	.	H	α-helix	trans	-61.3	-50.6	173.8	-79	-168.3	-77.9	-137.3	6.9	111.1	E603 D604 M609 T610 Q611	E603-R607 WeakPolarHBondContact O-CB 3.25Å; E603-R607 VanDerWaalsContact O-CG 3.3Å; E603-R607 WeakPolarHBondContact O-CG 3.44Å; E603-R607 PolarHBondContact O-N 3.45Å; D604-R607 PolarHBondContact O-N 3.35Å; D604-R607 IonicContact OD1-CZ 2.78Å; D604-R607 IonicContact OD1-NE 2.98Å; D604-R607 PolarHBondContact OD1-NE 3.34Å; D604-R607 IonicContact OD1-NH2 2.69Å; D604-R607 PolarHBondContact OD1-NH2 3.26Å; D604-R607 IonicContact OD2-NH2 3.18Å; R607-M609 PolarHBondContact O-N 3.38Å; R607-T610 PolarHBondContact O-N 3.37Å; R607-T610 VanDerWaalsContact O-N 3.16Å; R607-Q611 WeakPolarHBondContact O-CB 3.32Å; R607-Q611 VanDerWaalsContact O-CG 3.32Å; R607-Q611 WeakPolarHBondContact O-CG 3.36Å; R607-Q611 PolarHBondContact O-N 3.3Å
608	L	87.7	Confident	86.2	Confident	46 Å²	46	55 Å²	55	24%	0.241	30%	0.297	C	S	.	.	H	α-helix	trans	-61.6	-43.8	178.7	-69	170.7	0	0	0	112.2	V592 H595 L597 I600 D604 A605 T610 S612	V592-L608 HydrophobicContact CG1-CB 3.72Å; V592-L608 HydrophobicContact CG1-CD1 4.37Å; H595-L608 HydrophobicContact CB-CD1 4.41Å; L597-L608 HydrophobicContact CD2-CD1 4.28Å; I600-L608 HydrophobicContact CD1-CD1 3.79Å; D604-L608 WeakPolarHBondContact O-CG 3.5Å; D604-L608 PolarHBondContact O-N 3.27Å; A605-L608 PolarHBondContact O-N 3.44Å; L608-T610 VanDerWaalsContact C-N 3.31Å; L608-T610 PolarHBondContact O-N 3.33Å; L608-S612 WeakPolarHBondContact O-CB 3.32Å; L608-S612 PolarHBondContact O-N 2.94Å; L608-S612 PolarHBondContact O-OG 3.46Å
609	M	87.3	Confident	86.4	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.015	30%	0.295	C	S	.	.	H	α-helix	trans	-65	-34.2	174.9	-70.1	175.7	-150.4	0	0	112.4	K544 I549 I553 I566 L589 V592 L597 A605 R607 F618 I785	K544-M609 VanDerWaalsContact CE-O 3.31Å; K544-M609 WeakPolarHBondContact CE-O 3.46Å; K544-M609 PolarHBondContact NZ-O 3.1Å; I549-M609 HydrophobicContact CD1-CB 4.14Å; I553-M609 HydrophobicContact CD1-CE 3.89Å; I553-M609 HydrophobicContact CD1-SD 4.07Å; I553-M609 HydrophobicContact CG2-CE 4.41Å; I553-M609 HydrophobicContact CG2-SD 4.4Å; I566-M609 HydrophobicContact CG2-CE 4.19Å; L589-M609 HydrophobicContact CD1-CE 3.64Å; L589-M609 HydrophobicContact CD1-SD 4.41Å; V592-M609 HydrophobicContact CG2-CG 4.07Å; L597-M609 HydrophobicContact CD1-CE 3.74Å; L597-M609 HydrophobicContact CD2-CE 4.27Å; A605-M609 HydrophobicContact CB-CE 4.15Å; A605-M609 WeakPolarHBondContact O-CB 3.25Å; A605-M609 VanDerWaalsContact O-CG 3.24Å; A605-M609 WeakPolarHBondContact O-CG 3.41Å; A605-M609 PolarHBondContact O-N 3.03Å; R607-M609 PolarHBondContact O-N 3.38Å; M609-F618 HydrophobicContact CE-CE1 4.02Å; M609-F618 HydrophobicContact CG-CE1 3.94Å; M609-F618 HydrophobicContact CG-CZ 4.16Å; M609-F618 HydrophobicContact SD-CE1 3.97Å; M609-F618 HydrophobicContact SD-CZ 4.22Å; M609-I785 HydrophobicContact CB-CD1 4.21Å
610	T	82.9	Confident	86.9	Confident	72 Å²	72	52.2 Å²	52.2	44%	0.442	27%	0.273	S	S	.	.	H	α-helix	trans	-74.4	-46	177.9	-57.8	0	0	0	0	111.8	K544 A606 R607 L608 S612 I785	K544-T610 PolarHBondContact NZ-O 3.35Å; A606-T610 VanDerWaalsContact O-CB 3.24Å; A606-T610 WeakPolarHBondContact O-CB 3.42Å; A606-T610 PolarHBondContact O-N 3.33Å; A606-T610 PolarHBondContact O-OG1 3.03Å; R607-T610 PolarHBondContact O-N 3.37Å; R607-T610 VanDerWaalsContact O-N 3.16Å; L608-T610 VanDerWaalsContact C-N 3.31Å; L608-T610 PolarHBondContact O-N 3.33Å; T610-S612 VanDerWaalsContact C-N 3.32Å; T610-S612 PolarHBondContact O-N 2.9Å; T610-I785 HydrophobicContact CG2-CG2 4.35Å
611	Q	79.9	Confident	87.2	Confident	152 Å²	152	53.1 Å²	53.1	71%	0.71	27%	0.273	S	S	*	.	H	α-helix	trans	-71	-22.6	179.5	-70.5	176	-1.4	0	0	113.9	R607	R607-Q611 WeakPolarHBondContact O-CB 3.32Å; R607-Q611 VanDerWaalsContact O-CG 3.32Å; R607-Q611 WeakPolarHBondContact O-CG 3.36Å; R607-Q611 PolarHBondContact O-N 3.3Å
612	S	78.8	Confident	87.4	Confident	21 Å²	21	53.6 Å²	53.6	15%	0.147	27%	0.27	C	S	.	.	S	Bend	trans	-52	153.1	170.8	-73	0	0	0	0	112.2	K544 N593 L608 T610	K544-S612 PolarHBondContact NZ-O 3.42Å; N593-S612 VanDerWaalsContact ND2-CB 3.27Å; N593-S612 WeakPolarHBondContact ND2-CB 3.48Å; N593-S612 PolarHBondContact ND2-OG 3.01Å; L608-S612 WeakPolarHBondContact O-CB 3.32Å; L608-S612 PolarHBondContact O-N 2.94Å; L608-S612 PolarHBondContact O-OG 3.46Å; T610-S612 VanDerWaalsContact C-N 3.32Å; T610-S612 PolarHBondContact O-N 2.9Å
613	G	78.1	Confident	87.1	Confident	47 Å²	47	59.8 Å²	59.8	49%	0.485	29%	0.292	S	S	.	.			trans	-66.3	-165.3	-178.5	0	0	0	0	0	114.9	K544 E615	K544-G613 VanDerWaalsContact CD-O 3.29Å; K544-G613 WeakPolarHBondContact CD-O 3.44Å; K544-G613 VanDerWaalsContact CE-O 3.24Å; K544-G613 WeakPolarHBondContact CE-O 3.42Å; G613-E615 PolarHBondContact O-N 3.48Å; G613-E615 VanDerWaalsContact O-N 3.08Å
614	N	81.5	Confident	86.9	Confident	104 Å²	104	54.7 Å²	54.7	56%	0.556	27%	0.268	S	S	*	.	S	Bend	trans	-65.4	-7.5	175.6	-164.4	38.8	0	0	0	113.4	R543 K544	R543-N614 CarbonylContact C-O 3.56Å; R543-N614 WeakPolarHBondContact CA-O 3.24Å; K544-N614 PolarHBondContact N-O 3.32Å; K544-N614 PolarHBondContact O-OD1 3.11Å
615	E	85.9	Confident	86.8	Confident	89 Å²	89	51.9 Å²	51.9	42%	0.416	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	139.6	178.8	-171.1	154.7	-134.7	0	0	109.1	T541 L542 R543 G613	T541-E615 HydrophobicContact CG2-CG 3.43Å; T541-E615 VanDerWaalsContact CG2-CG 3.43Å; T541-E615 WeakPolarHBondContact CG2-OE1 3.21Å; L542-E615 WeakPolarHBondContact O-CA 3.31Å; R543-E615 HydrophobicContact CG-CB 4.36Å; R543-E615 HydrophobicContact CG-CG 4.03Å; R543-E615 WeakPolarHBondContact CG-OE1 3.29Å; G613-E615 PolarHBondContact O-N 3.48Å; G613-E615 VanDerWaalsContact O-N 3.08Å
616	V	89.9	Confident	86.3	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	116.5	-167.9	-168.4	0	0	0	0	109.3	T541 L542 K544 I549 V592 F618	T541-V616 WeakPolarHBondContact CA-O 3.36Å; L542-V616 PolarHBondContact N-O 3.2Å; L542-V616 PolarHBondContact O-N 3.29Å; K544-V616 HydrophobicContact CD-CG2 4.37Å; K544-V616 VanDerWaalsContact CE-CG2 3.5Å; K544-V616 HydrophobicContact CG-CG2 4.1Å; I549-V616 HydrophobicContact CD1-CB 4.35Å; I549-V616 HydrophobicContact CD1-CG1 4.21Å; I549-V616 HydrophobicContact CD1-CG2 3.95Å; I549-V616 HydrophobicContact CG1-CG2 4.45Å; V592-V616 HydrophobicContact CG2-CG1 3.4Å; V592-V616 VanDerWaalsContact CG2-CG1 3.4Å; V616-F618 HydrophobicContact CB-CE2 4.12Å; V616-F618 HydrophobicContact CB-CZ 4.44Å; V616-F618 HydrophobicContact CG1-CD2 4.29Å; V616-F618 HydrophobicContact CG1-CE1 4.12Å; V616-F618 HydrophobicContact CG1-CE2 3.58Å; V616-F618 HydrophobicContact CG1-CZ 3.49Å; V616-F618 VanDerWaalsContact CG1-CZ 3.49Å
617	H	91.8	Very high	85.7	Confident	89 Å²	89	64.4 Å²	64.4	41%	0.412	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	130	-179.6	-56.6	75.5	0	0	0	109.4	T541 V592 N593	T541-H617 WeakPolarHBondContact CG2-NE2 3.48Å; T541-H617 PolarHBondContact OG1-CD2 3.47Å; V592-H617 CarbonylContact C-O 3.59Å; V592-H617 WeakPolarHBondContact CA-O 3.16Å; N593-H617 PolarHBondContact N-O 3.18Å; N593-H617 PolarHBondContact OD1-N 3.01Å; N593-H617 PolarHBondContact OD1-ND1 2.98Å
618	F	94.4	Very high	85.4	Confident	3 Å²	3	58.7 Å²	58.7	1%	0.013	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	133.1	174.7	-61.2	-82.7	0	0	0	110.6	K539 V540 L542 I549 L551 L589 S591 V592 M609 V616 V620	K539-F618 WeakPolarHBondContact CA-O 3.35Å; V540-F618 PolarHBondContact N-O 3.28Å; V540-F618 PolarHBondContact O-N 2.77Å; L542-F618 HydrophobicContact CD1-CE2 4.27Å; I549-F618 HydrophobicContact CD1-CZ 4.15Å; L551-F618 HydrophobicContact CD1-CE2 4.41Å; L551-F618 HydrophobicContact CD1-CZ 4.3Å; L589-F618 HydrophobicContact CD1-CD1 4.2Å; L589-F618 HydrophobicContact CD1-CE1 4.07Å; L589-F618 HydrophobicContact CD2-CB 4.47Å; L589-F618 HydrophobicContact CD2-CD1 4.21Å; L589-F618 HydrophobicContact CD2-CG 4.41Å; S591-F618 WeakPolarHBondContact O-CA 3.43Å; S591-F618 WeakPolarHBondContact O-CD1 3.24Å; V592-F618 HydrophobicContact CB-CD1 4.09Å; V592-F618 HydrophobicContact CB-CE1 3.97Å; V592-F618 HydrophobicContact CG2-CD1 4.09Å; V592-F618 HydrophobicContact CG2-CE1 3.66Å; V592-F618 HydrophobicContact CG2-CZ 4.22Å; M609-F618 HydrophobicContact CE-CE1 4.02Å; M609-F618 HydrophobicContact CG-CE1 3.94Å; M609-F618 HydrophobicContact CG-CZ 4.16Å; M609-F618 HydrophobicContact SD-CE1 3.97Å; M609-F618 HydrophobicContact SD-CZ 4.22Å; V616-F618 HydrophobicContact CB-CE2 4.12Å; V616-F618 HydrophobicContact CB-CZ 4.44Å; V616-F618 HydrophobicContact CG1-CD2 4.29Å; V616-F618 HydrophobicContact CG1-CE1 4.12Å; V616-F618 HydrophobicContact CG1-CE2 3.58Å; V616-F618 HydrophobicContact CG1-CZ 3.49Å; V616-F618 VanDerWaalsContact CG1-CZ 3.49Å; F618-V620 HydrophobicContact CB-CG2 3.56Å
619	D	94.2	Very high	84.9	Confident	40 Å²	40	59 Å²	59	21%	0.214	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.2	156.4	-66.9	-63.4	0	0	0	108.4	I537 K539 L590 S591	I537-D619 HydrophobicContact CG2-CB 4.05Å; K539-D619 WeakPolarHBondContact CG-OD1 3.36Å; K539-D619 IonicContact NZ-OD1 2.89Å; K539-D619 PolarHBondContact NZ-OD1 3.24Å; K539-D619 IonicContact NZ-OD2 3.2Å; L590-D619 HydrophobicContact CB-CB 4.23Å; L590-D619 WeakPolarHBondContact CB-O 3.28Å; L590-D619 PolarHBondContact N-O 3.02Å; S591-D619 PolarHBondContact N-O 3.23Å; S591-D619 WeakPolarHBondContact OG-CB 3.41Å; S591-D619 VanDerWaalsContact OG-CG 3.31Å; S591-D619 PolarHBondContact OG-N 2.64Å; S591-D619 PolarHBondContact OG-OD2 3.4Å
620	V	93.7	Very high	84.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	125.8	-168.4	-175.2	0	0	0	0	111.4	I537 S538 V540 L583 D587 Q588 L589 F618	I537-V620 WeakPolarHBondContact CA-O 3.43Å; S538-V620 PolarHBondContact N-O 3.2Å; S538-V620 PolarHBondContact O-N 3.32Å; V540-V620 HydrophobicContact CB-CG2 4.46Å; V540-V620 HydrophobicContact CG2-CG2 4.27Å; L583-V620 HydrophobicContact CD2-CB 4.46Å; L583-V620 HydrophobicContact CD2-CG1 4.08Å; L583-V620 HydrophobicContact CD2-CG2 3.85Å; D587-V620 HydrophobicContact CB-CG1 3.76Å; Q588-V620 CarbonylContact O-C 3.58Å; Q588-V620 WeakPolarHBondContact O-CA 3.41Å; L589-V620 HydrophobicContact CD2-CG1 4.27Å; L589-V620 HydrophobicContact CD2-CG2 3.77Å; F618-V620 HydrophobicContact CB-CG2 3.56Å
621	R	92.3	Very high	84.1	Confident	65 Å²	65	58.1 Å²	58.1	25%	0.245	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	113.3	170.8	-175.6	-179.3	-74.6	132.9	-6.2	109.4	Q588 L590 A624	Q588-R621 HydrophobicContact CB-CB 4.35Å; Q588-R621 PolarHBondContact N-O 2.94Å; Q588-R621 VanDerWaalsContact N-O 3.08Å; Q588-R621 PolarHBondContact O-N 2.85Å; L590-R621 HydrophobicContact CD1-CB 4.16Å; L590-R621 HydrophobicContact CD2-CB 4.03Å; L590-R621 HydrophobicContact CG-CB 4.22Å; R621-A624 HydrophobicContact CB-CB 4.19Å; R621-A624 HydrophobicContact CG-CB 3.95Å
622	K	90.9	Very high	83.6	Confident	52 Å²	52	58.4 Å²	58.4	23%	0.226	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	131.1	-176.7	-77.7	-75.7	145.2	-164.6	0	112.4	R582 D587 A624	R582-K622 PolarHBondContact O-NZ 3.01Å; D587-K622 VanDerWaalsContact OD1-CA 3.3Å; D587-K622 WeakPolarHBondContact OD1-CA 3.46Å; D587-K622 IonicContact OD1-NZ 3.87Å; D587-K622 IonicContact OD2-NZ 3.49Å; D587-K622 PolarHBondContact OD2-NZ 2.91Å; K622-A624 PolarHBondContact O-N 2.98Å
623	R	83.8	Confident	83	Confident	158 Å²	158	63.5 Å²	63.5	60%	0.596	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	26.9	174.3	-57.8	178.6	-178.7	159.4	1.6	114.5	E584 G586 D587 A625 H626	E584-R623 IonicContact OE1-NH2 3.32Å; E584-R623 IonicContact OE2-CZ 3.82Å; E584-R623 IonicContact OE2-NE 3.57Å; E584-R623 PolarHBondContact OE2-NE 2.87Å; E584-R623 IonicContact OE2-NH2 3.81Å; E584-R623 PolarHBondContact OE2-NH2 3.42Å; G586-R623 CarbonylContact O-C 3.56Å; D587-R623 PolarHBondContact OD1-N 3.22Å; R623-A625 PolarHBondContact O-N 2.77Å; R623-H626 WeakPolarHBondContact O-CB 3.24Å; R623-H626 PolarHBondContact O-N 2.98Å
624	A	83.8	Confident	82.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-54.6	-36.8	-176	0	0	0	0	0	112.9	Y567 G586 Q588 R621 K622 H626 R627 N628	Y567-A624 HydrophobicContact CE1-CB 3.98Å; G586-A624 PolarHBondContact O-N 3.02Å; G586-A624 VanDerWaalsContact O-N 3.16Å; Q588-A624 HydrophobicContact CB-CB 3.39Å; R621-A624 HydrophobicContact CB-CB 4.19Å; R621-A624 HydrophobicContact CG-CB 3.95Å; K622-A624 PolarHBondContact O-N 2.98Å; A624-H626 PolarHBondContact O-N 3.09Å; A624-R627 PolarHBondContact O-N 3Å; A624-R627 VanDerWaalsContact O-N 3.11Å; A624-N628 WeakPolarHBondContact O-CB 3.43Å; A624-N628 PolarHBondContact O-N 2.98Å; A624-N628 PolarHBondContact O-OD1 3.43Å
625	A	83.8	Confident	81.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57.2	-32.9	177	0	0	0	0	0	113.9	Y567 G586 R623 G629 L630 S631 L634	Y567-A625 HydrophobicContact CD1-CB 4.16Å; Y567-A625 HydrophobicContact CE1-CB 4.45Å; G586-A625 VanDerWaalsContact O-CB 3.25Å; G586-A625 WeakPolarHBondContact O-CB 3.48Å; G586-A625 PolarHBondContact O-N 3.09Å; R623-A625 PolarHBondContact O-N 2.77Å; A625-G629 PolarHBondContact O-N 3.05Å; A625-L630 HydrophobicContact CB-CB 4.09Å; A625-L630 CarbonylContact O-C 3.57Å; A625-L630 WeakPolarHBondContact O-CA 3.32Å; A625-L630 PolarHBondContact O-N 3.17Å; A625-S631 PolarHBondContact O-N 3.04Å; A625-L634 HydrophobicContact CB-CD1 3.37Å
626	H	79.3	Confident	78.6	Confident	142 Å²	142	59.4 Å²	59.4	66%	0.657	31%	0.306	S	S	*	.	H	α-helix	trans	-71.4	-38.8	178.3	-169.8	-75.5	0	0	0	111.6	R623 A624 S631	R623-H626 WeakPolarHBondContact O-CB 3.24Å; R623-H626 PolarHBondContact O-N 2.98Å; A624-H626 PolarHBondContact O-N 3.09Å; H626-S631 WeakPolarHBondContact CA-OG 3.49Å; H626-S631 WeakPolarHBondContact CB-OG 3.43Å; H626-S631 PolarHBondContact N-OG 2.89Å
627	R	73.7	Confident	75.8	Confident	129 Å²	129	66.3 Å²	66.3	49%	0.487	34%	0.338	S	S	.	.	H	α-helix	trans	-70.9	-37.3	177.5	-67	167.3	54.9	155.9	-2.2	111.8	D535 A624 G629	D535-R627 VanDerWaalsContact CG-NH2 3.28Å; D535-R627 IonicContact OD1-CZ 2.92Å; D535-R627 VanDerWaalsContact OD1-CZ 3.27Å; D535-R627 IonicContact OD1-NH1 2.65Å; D535-R627 PolarHBondContact OD1-NH1 3.47Å; D535-R627 IonicContact OD1-NH2 3.61Å; D535-R627 PolarHBondContact OD1-NH2 2.95Å; D535-R627 IonicContact OD2-CZ 3.12Å; D535-R627 IonicContact OD2-NH1 3.82Å; D535-R627 PolarHBondContact OD2-NH1 3.22Å; D535-R627 IonicContact OD2-NH2 2.67Å; D535-R627 PolarHBondContact OD2-NH2 3.38Å; A624-R627 PolarHBondContact O-N 3Å; A624-R627 VanDerWaalsContact O-N 3.11Å; R627-G629 VanDerWaalsContact C-N 3.32Å; R627-G629 PolarHBondContact O-N 2.99Å
628	N	79.4	Confident	72.7	Confident	20 Å²	20	67.6 Å²	67.6	11%	0.107	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	11	-171.3	-64.1	29.7	0	0	0	112.3	G558 V559 D561 Y567 A624 L630	G558-N628 CarbonylContact C-O 3.59Å; G558-N628 VanDerWaalsContact CA-O 3.27Å; G558-N628 WeakPolarHBondContact CA-O 3.3Å; V559-N628 PolarHBondContact N-O 3.43Å; D561-N628 PolarHBondContact OD1-ND2 3.38Å; D561-N628 PolarHBondContact OD2-ND2 3.04Å; Y567-N628 PolarHBondContact OH-ND2 3.36Å; A624-N628 WeakPolarHBondContact O-CB 3.43Å; A624-N628 PolarHBondContact O-N 2.98Å; A624-N628 PolarHBondContact O-OD1 3.43Å; N628-L630 VanDerWaalsContact C-N 3.34Å; N628-L630 PolarHBondContact O-N 2.66Å
629	G	77.3	Confident	69.5	Low	52 Å²	52	73.7 Å²	73.7	54%	0.536	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	10.1	175.5	0	0	0	0	0	115.8	A625 R627	A625-G629 PolarHBondContact O-N 3.05Å; R627-G629 VanDerWaalsContact C-N 3.32Å; R627-G629 PolarHBondContact O-N 2.99Å
630	L	79.3	Confident	66.3	Low	20 Å²	20	78 Å²	78	11%	0.105	42%	0.42	C	S	.	.			trans	-99.2	-6.6	-172.4	-64.7	170.9	0	0	0	114.4	A556 Y567 A625 N628 N632 W633 L634	A556-L630 HydrophobicContact CB-CD1 3.85Å; A556-L630 HydrophobicContact CB-CD2 4.2Å; Y567-L630 HydrophobicContact CD2-CD1 4.12Å; Y567-L630 HydrophobicContact CE1-CD1 4.02Å; Y567-L630 HydrophobicContact CE2-CD1 3.58Å; A625-L630 HydrophobicContact CB-CB 4.09Å; A625-L630 CarbonylContact O-C 3.57Å; A625-L630 WeakPolarHBondContact O-CA 3.32Å; A625-L630 PolarHBondContact O-N 3.17Å; N628-L630 VanDerWaalsContact C-N 3.34Å; N628-L630 PolarHBondContact O-N 2.66Å; L630-N632 VanDerWaalsContact C-N 3.33Å; L630-N632 PolarHBondContact O-N 3.39Å; L630-W633 WeakPolarHBondContact O-CB 3.44Å; L630-W633 PolarHBondContact O-N 3.05Å; L630-L634 HydrophobicContact CB-CD1 4.03Å; L630-L634 PolarHBondContact O-N 3.41Å; L630-L634 VanDerWaalsContact O-N 3.08Å
631	S	74.6	Confident	63.2	Low	38 Å²	38	84.9 Å²	84.9	27%	0.266	46%	0.463	S	S	.	.	H	α-helix	trans	-53.1	-44.3	-177.1	-93.3	0	0	0	0	113.9	A625 H626 W633 L634 G635	A625-S631 PolarHBondContact O-N 3.04Å; H626-S631 WeakPolarHBondContact CA-OG 3.49Å; H626-S631 WeakPolarHBondContact CB-OG 3.43Å; H626-S631 PolarHBondContact N-OG 2.89Å; S631-W633 PolarHBondContact O-N 3.29Å; S631-L634 PolarHBondContact O-N 3.3Å; S631-G635 WeakPolarHBondContact O-CA 3.4Å; S631-G635 PolarHBondContact O-N 2.82Å
632	N	68.4	Low	60.1	Low	157 Å²	157	86.5 Å²	86.5	84%	0.84	48%	0.484	S	S	*	.	H	α-helix	trans	-70.3	-20.2	-179.4	-63.3	11	0	0	0	112.9	L630	L630-N632 VanDerWaalsContact C-N 3.33Å; L630-N632 PolarHBondContact O-N 3.39Å
633	W	66.9	Low	57.1	Low	129 Å²	129	90.8 Å²	90.8	49%	0.489	51%	0.509	S	S	.	.	H	α-helix	trans	-87.2	-31	178.4	-177.4	77.8	0	0	0	112.5	V554 A556 L630 S631	V554-W633 HydrophobicContact CB-CH2 3.96Å; V554-W633 HydrophobicContact CB-CZ3 4.15Å; V554-W633 HydrophobicContact CG1-CH2 4.41Å; V554-W633 HydrophobicContact CG2-CH2 3.85Å; V554-W633 HydrophobicContact CG2-CZ3 3.51Å; A556-W633 HydrophobicContact CB-CE3 4.3Å; A556-W633 HydrophobicContact CB-CH2 4.16Å; A556-W633 HydrophobicContact CB-CZ3 3.66Å; L630-W633 WeakPolarHBondContact O-CB 3.44Å; L630-W633 PolarHBondContact O-N 3.05Å; S631-W633 PolarHBondContact O-N 3.29Å
634	L	68.6	Low	54.3	Low	7 Å²	7	93 Å²	93	4%	0.037	52%	0.524	C	S	.	.	H	α-helix	trans	-83.9	-33.3	173.2	-74.3	149.2	0	0	0	112.2	V554 Y567 K569 T585 A625 L630 S631 S636	V554-L634 HydrophobicContact CG2-CD2 3.55Å; Y567-L634 HydrophobicContact CD1-CD1 4.42Å; Y567-L634 HydrophobicContact CG-CD1 4.33Å; K569-L634 HydrophobicContact CB-CD2 3.82Å; K569-L634 HydrophobicContact CG-CD2 4.19Å; T585-L634 HydrophobicContact CG2-CB 4.39Å; A625-L634 HydrophobicContact CB-CD1 3.37Å; L630-L634 HydrophobicContact CB-CD1 4.03Å; L630-L634 PolarHBondContact O-N 3.41Å; L630-L634 VanDerWaalsContact O-N 3.08Å; S631-L634 PolarHBondContact O-N 3.3Å; L634-S636 PolarHBondContact O-N 2.7Å
635	G	51.1	Low	51.7	Low	53 Å²	53	100.3 Å²	100.3	55%	0.546	56%	0.561	S	S	.	*			trans	-85.4	80.5	-178	0	0	0	0	0	113.9	S631	S631-G635 WeakPolarHBondContact O-CA 3.4Å; S631-G635 PolarHBondContact O-N 2.82Å
636	S	33.1	Very low	48.9	Very low	93 Å²	93	104.5 Å²	104.5	65%	0.65	60%	0.596	S	S	*	*			trans	-133.2	94.3	161.9	31.8	0	0	0	0	111	L634	L634-S636 PolarHBondContact O-N 2.7Å
637	Q	30.7	Very low	46.4	Very low	145 Å²	145	103.7 Å²	103.7	68%	0.678	60%	0.603	S	S	*	*			trans	-129.1	144.1	162.9	-69.2	-157.8	113.3	0	0	110.3
638	T	27.2	Very low	44.2	Very low	116 Å²	116	103 Å²	103	71%	0.712	62%	0.618	S	S	*	*			trans	-64.1	150.1	168.5	46	0	0	0	0	111.4	T640	T638-T640 PolarHBondContact O-N 2.64Å; T638-T640 VanDerWaalsContact O-N 3.16Å
639	P	26.9	Very low	42.2	Very low	131 Å²	131	107.9 Å²	107.9	85%	0.851	65%	0.651	S	S	*	*			trans	-71.3	107.8	174.3	29.4	-33.8	0	0	0	111.1
640	T	26.7	Very low	39.9	Very low	131 Å²	131	110.6 Å²	110.6	80%	0.804	66%	0.662	S	S	*	*			trans	-87	124.7	164.4	17.2	0	0	0	0	110.2	T638	T638-T640 PolarHBondContact O-N 2.64Å; T638-T640 VanDerWaalsContact O-N 3.16Å
641	T	30.2	Very low	37.5	Very low	144 Å²	144	116.2 Å²	116.2	88%	0.883	70%	0.697	S	S	*	*			trans	-75.9	137.7	178.9	39.6	0	0	0	0	112.3
642	S	26	Very low	35.2	Very low	100 Å²	100	120.4 Å²	120.4	70%	0.699	72%	0.721	S	S	*	*			trans	-157.8	141.2	167.2	67.4	0	0	0	0	107.9
643	N	27.8	Very low	34	Very low	141 Å²	141	118.2 Å²	118.2	75%	0.754	72%	0.715	S	S	*	*			cis	-137.3	151.7	-3.6	-76.8	-61.5	0	0	0	109.8
644	F	25.8	Very low	33.1	Very low	205 Å²	205	117.8 Å²	117.8	90%	0.899	73%	0.729	S	S	*	*			trans	-136.5	100.8	149.6	-101.3	-77	0	0	0	110.9
645	I	28.8	Very low	31.8	Very low	153 Å²	153	122.4 Å²	122.4	79%	0.785	76%	0.76	S	S	*	*			trans	11.1	119.7	156	-56.6	167.8	0	0	0	117
646	A	24.5	Very low	30.6	Very low	89 Å²	89	124.1 Å²	124.1	74%	0.736	76%	0.763	S	S	*	*			trans	-89.3	153.7	163.4	0	0	0	0	0	112
647	P	27.2	Very low	30.3	Very low	125 Å²	125	130.3 Å²	130.3	81%	0.812	77%	0.774	S	S	*	*			trans	-126	133.8	145.5	35.3	-25.2	0	0	0	112.9
648	S	26.7	Very low	30.2	Very low	113 Å²	113	128.2 Å²	128.2	79%	0.79	78%	0.775	S	S	*	*			trans	-94.3	154.3	160.7	-49.5	0	0	0	0	107.8
649	P	37.7	Very low	30.4	Very low	123 Å²	123	132 Å²	132	80%	0.799	78%	0.784	S	S	*	*				-147.6	177.9	54.3	40	-18.7	0	0	0	118.2
650	S	29.8	Very low	30.7	Very low	110 Å²	110	132.6 Å²	132.6	77%	0.769	79%	0.785	S	S	*	*			trans	-27.7	147.7	172.1	-41.9	0	0	0	0	120.3
651	T	28	Very low	30.8	Very low	138 Å²	138	129.6 Å²	129.6	85%	0.847	78%	0.78	S	S	*	*				-168.7	153.9	126	-79.1	0	0	0	0	113.2
652	V	27.7	Very low	30.7	Very low	126 Å²	126	134.8 Å²	134.8	76%	0.764	78%	0.783	S	S	*	*			trans	-42.8	150.3	-179	-175.8	0	0	0	0	117.6
653	P	42.5	Very low	30.8	Very low	111 Å²	111	136.3 Å²	136.3	72%	0.721	79%	0.789	S	S	*	*			trans	-73.8	-175.1	172.9	35.6	-42.1	0	0	0	113.4
654	P	48.5	Very low	31.7	Very low	119 Å²	119	135.7 Å²	135.7	77%	0.773	79%	0.792	S	S	*	*			cis	-132	-137.1	15.4	38.7	-13.6	0	0	0	111.2
655	P	41.8	Very low	31.8	Very low	105 Å²	105	131 Å²	131	68%	0.682	79%	0.785	S	S	*	*			cis	-138.9	-171.9	-15.8	30	-4.9	0	0	0	117.2
656	S	24.7	Very low	32	Very low	88 Å²	88	134.6 Å²	134.6	62%	0.615	79%	0.79	S	S	*	*			trans	85.8	127.4	142.5	23.1	0	0	0	0	124
657	Y	27.9	Very low	32.2	Very low	224 Å²	224	137.8 Å²	137.8	88%	0.878	80%	0.795	S	S	*	*			trans	53.6	148.6	145.6	-57.7	-59.9	0	0	0	121.1
658	S	28.7	Very low	32.4	Very low	100 Å²	100	135.3 Å²	135.3	70%	0.699	79%	0.792	S	S	*	*			cis	-171.6	143.7	-19.1	50.5	0	0	0	0	110
659	H	31.5	Very low	32.5	Very low	197 Å²	197	138.8 Å²	138.8	91%	0.912	80%	0.796	S	S	*	*			trans	-87.6	140	164.6	-90	-77.8	0	0	0	111.8
660	V	31.5	Very low	33.1	Very low	143 Å²	143	138.1 Å²	138.1	87%	0.867	79%	0.792	S	S	*	*			trans	-77.7	140	166.4	180	0	0	0	0	109
661	G	29.7	Very low	34.6	Very low	67 Å²	67	138 Å²	138	69%	0.691	79%	0.789	S	S	*	*			trans	-134.7	179.7	177.3	0	0	0	0	0	113.4
662	R	28.1	Very low	35.6	Very low	254 Å²	254	137.4 Å²	137.4	96%	0.958	79%	0.787	S	S	*	*			trans	-140.9	147.9	161.4	-103.3	-172.1	177.2	-152.1	-1.4	111.1
663	T	27.9	Very low	35.6	Very low	132 Å²	132	136.6 Å²	136.6	81%	0.81	79%	0.787	S	S	*	*			trans	-102.1	177.4	-173	45.2	0	0	0	0	109.6
664	P	45.8	Very low	35.1	Very low	127 Å²	127	142.3 Å²	142.3	83%	0.825	80%	0.796	S	S	*	*			cis	-129.6	-164.7	22.3	43.9	-25.8	0	0	0	116.6
665	S	29.3	Very low	34.3	Very low	108 Å²	108	143.5 Å²	143.5	76%	0.755	80%	0.795	S	S	*	*			trans	-152.4	175.2	-164.6	52.4	0	0	0	0	109.6
666	Y	32.4	Very low	33.7	Very low	227 Å²	227	146.2 Å²	146.2	89%	0.89	80%	0.798	S	S	*	*			trans	-143.2	159.8	172.3	-121.2	-84	0	0	0	111.6
667	D	29.8	Very low	33.9	Very low	156 Å²	156	152.2 Å²	152.2	83%	0.834	81%	0.808	S	S	*	*			trans	-62.7	165.2	176	-70.4	-69.6	0	0	0	114.3
668	G	30.4	Very low	34	Very low	74 Å²	74	148.6 Å²	148.6	76%	0.763	80%	0.804	S	S	*	*			cis	179.1	-153.6	4.5	0	0	0	0	0	114.9
669	Q	28.6	Very low	33.9	Very low	186 Å²	186	147.4 Å²	147.4	87%	0.869	81%	0.807	S	S	*	*			trans	-118.3	-172.7	-170.4	-118.4	-172.2	6.6	0	0	110.4
670	P	51	Low	33.7	Very low	109 Å²	109	142.1 Å²	142.1	71%	0.708	81%	0.806	S	S	*	*			cis	-129.6	-107.1	-10.5	22.9	5.3	0	0	0	115.6
671	P	60.5	Low	33.6	Very low	108 Å²	108	140 Å²	140	70%	0.701	80%	0.804	S	S	*	*				-134	177.9	-128.6	43.7	-23.6	0	0	0	117.3
672	P	49	Very low	33.6	Very low	124 Å²	124	143 Å²	143	81%	0.805	81%	0.813	S	S	*	*			trans	-135.7	-178.9	142.2	39	-27	0	0	0	114.3
673	S	28.7	Very low	33.6	Very low	109 Å²	109	134.3 Å²	134.3	76%	0.762	80%	0.803	S	S	*	*			trans	-155.9	151.3	165.6	-66.9	0	0	0	0	108.8
674	Y	30.4	Very low	33.6	Very low	232 Å²	232	133.1 Å²	133.1	91%	0.91	81%	0.807	S	S	*	*			trans	169.2	161.9	135.7	-104.6	-79.1	0	0	0	113.1
675	N	31.8	Very low	32.7	Very low	143 Å²	143	131.1 Å²	131.1	77%	0.765	81%	0.809	S	S	*	*			trans	-106.4	154.1	-178.6	-88.8	-46.3	0	0	0	112.6
676	H	30.7	Very low	32.5	Very low	162 Å²	162	129 Å²	129	75%	0.75	81%	0.805	S	S	*	*			trans	-172.7	132.1	130.3	-95	-38.5	0	0	0	111.4
677	R	27.5	Very low	32.2	Very low	215 Å²	215	123.7 Å²	123.7	81%	0.811	80%	0.801	S	S	*	*				59.5	140.3	92.2	-86.5	-171.2	168.9	172.7	-4.3	114.4
678	N	30.4	Very low	32.1	Very low	148 Å²	148	122.1 Å²	122.1	79%	0.791	80%	0.802	S	S	*	*			cis	-134.5	175.6	11.7	-93.8	-26.2	0	0	0	109.9
679	G	26.6	Very low	31.9	Very low	75 Å²	75	121.9 Å²	121.9	77%	0.773	80%	0.8	S	S	*	*			cis	-174.2	175.7	1.9	0	0	0	0	0	109.6
680	G	27.5	Very low	31.9	Very low	86 Å²	86	124.3 Å²	124.3	89%	0.887	80%	0.801	S	S	*	*			trans	-132.3	149	-167.6	0	0	0	0	0	116.7
681	A	29	Very low	30.8	Very low	99 Å²	99	126.4 Å²	126.4	82%	0.818	81%	0.806	S	S	*	*			trans	-163.8	151.5	164.9	0	0	0	0	0	106.7
682	S	30	Very low	29.2	Very low	128 Å²	128	126.3 Å²	126.3	90%	0.895	81%	0.808	S	S	*	*			cis	-156.9	179.3	-10.5	45.2	0	0	0	0	107.6
683	G	28	Very low	28.1	Very low	72 Å²	72	124.5 Å²	124.5	74%	0.742	80%	0.804	S	S	*	*			trans	-151.6	170	178.9	0	0	0	0	0	114.6
684	A	27.8	Very low	28	Very low	108 Å²	108	129.1 Å²	129.1	89%	0.893	81%	0.81	S	S	*	*			trans	69	142.1	175.6	0	0	0	0	0	118.1
685	G	26.6	Very low	28	Very low	84 Å²	84	124 Å²	124	87%	0.866	80%	0.803	S	S	*	*			trans	86	145.9	172.3	0	0	0	0	0	115.5
686	G	25.8	Very low	27.9	Very low	65 Å²	65	121.7 Å²	121.7	67%	0.67	80%	0.803	S	S	*	*			cis	159.4	119	-12.1	0	0	0	0	0	115.2
687	S	25.3	Very low	28.5	Very low	115 Å²	115	118.7 Å²	118.7	80%	0.804	80%	0.799	S	S	*	*			trans	68.8	147.9	162.9	80.4	0	0	0	0	119.8
688	S	27.8	Very low	28.4	Very low	122 Å²	122	116 Å²	116	85%	0.853	80%	0.8	S	S	*	*			trans	60.2	131.9	149	-53.4	0	0	0	0	120.8
689	G	27.8	Very low	28.3	Very low	70 Å²	70	113.1 Å²	113.1	72%	0.722	79%	0.791	S	S	*	*			cis	144.7	152.3	-16.5	0	0	0	0	0	116.1
690	R	27.4	Very low	28.4	Very low	237 Å²	237	116.6 Å²	116.6	89%	0.894	79%	0.792	S	S	*	*			trans	74.6	155.4	161.7	-62.7	-176.6	168.8	-178.8	-3.7	119.7
691	N	28.2	Very low	28.4	Very low	153 Å²	153	116.9 Å²	116.9	82%	0.818	78%	0.78	S	S	*	*			trans	70.5	142.4	168.5	-51.1	-22	0	0	0	115.4
692	S	27.3	Very low	28.4	Very low	105 Å²	105	117.6 Å²	117.6	73%	0.734	78%	0.779	S	S	*	*			cis	-164.3	123.3	-13.3	41.9	0	0	0	0	106.8
693	A	26.5	Very low	28.5	Very low	87 Å²	87	116.5 Å²	116.5	72%	0.719	77%	0.772	S	S	*	*				74.6	144.3	85.3	0	0	0	0	0	115.7
694	F	25	Very low	28.4	Very low	205 Å²	205	120.4 Å²	120.4	90%	0.899	78%	0.775	S	S	*	*			trans	79	162.1	167.8	-85.3	-82.9	0	0	0	121.5
695	V	30.3	Very low	28.5	Very low	126 Å²	126	119.6 Å²	119.6	76%	0.764	77%	0.769	S	S	*	*			trans	78.3	87.6	169	-161	0	0	0	0	117.9
696	A	31.2	Very low	28.5	Very low	93 Å²	93	120.9 Å²	120.9	77%	0.769	77%	0.765	S	S	*	*			trans	-77.9	156.7	131	0	0	0	0	0	107.8
697	P	41.7	Very low	28.6	Very low	100 Å²	100	123.1 Å²	123.1	65%	0.649	77%	0.77	S	S	*	*				-161.8	-170.1	77.7	43	-21.3	0	0	0	116.6
698	L	26.4	Very low	28.9	Very low	159 Å²	159	123.2 Å²	123.2	83%	0.832	77%	0.77	S	S	*	*			trans	66	159.2	158.2	-57.8	175.8	0	0	0	117.3
699	S	28.7	Very low	29.1	Very low	86 Å²	86	125.7 Å²	125.7	60%	0.601	77%	0.768	S	S	*	*			cis	-166.3	170.5	-26.5	-103.9	0	0	0	0	111.3
700	N	28.2	Very low	29.1	Very low	148 Å²	148	130.5 Å²	130.5	79%	0.791	77%	0.774	S	S	*	*			trans	74.7	151.7	159.5	-69.6	-7.8	0	0	0	118.5
701	S	27.8	Very low	29.2	Very low	92 Å²	92	127.4 Å²	127.4	64%	0.643	77%	0.77	S	S	*	*			cis	161.4	141.6	-33.6	-97.2	0	0	0	0	108
702	S	29.4	Very low	29.3	Very low	114 Å²	114	127.9 Å²	127.9	80%	0.797	77%	0.767	S	S	*	*			trans	67	159.7	157	80.1	0	0	0	0	116.1
703	S	31.8	Very low	29.4	Very low	106 Å²	106	129 Å²	129	74%	0.741	76%	0.76	S	S	*	*			cis	-140.2	149.6	5.6	-73.9	0	0	0	0	113.7
704	N	26.3	Very low	29.5	Very low	154 Å²	154	134.8 Å²	134.8	82%	0.824	77%	0.765	S	S	*	*			trans	-37.4	151	153.6	-44.4	-34	0	0	0	116.6
705	A	28.1	Very low	29.7	Very low	91 Å²	91	128.7 Å²	128.7	75%	0.752	75%	0.752	S	S	*	*				168	136.4	123.6	0	0	0	0	0	108.8
706	S	26.8	Very low	29.5	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	75%	0.752	S	S	*	*			cis	72.3	139	37.8	-52.4	0	0	0	0	113.9
707	S	28.2	Very low	29.6	Very low	112 Å²	112	132.8 Å²	132.8	78%	0.783	75%	0.746	S	S	*	*			cis	-178.9	137.1	-17.2	48.8	0	0	0	0	110.4
708	S	31.3	Very low	29.1	Very low	116 Å²	116	134 Å²	134	81%	0.811	75%	0.748	S	S	*	*			trans	-159	130.8	159.2	39.8	0	0	0	0	108.8
709	H	32.3	Very low	29.3	Very low	175 Å²	175	134.3 Å²	134.3	81%	0.81	75%	0.747	S	S	*	*				72	124.8	52.1	-151.1	69.4	0	0	0	110.5
710	M	29.1	Very low	29.3	Very low	171 Å²	171	138.1 Å²	138.1	84%	0.842	76%	0.757	S	S	*	*			cis	-122.8	171.6	38.1	-68.5	-168	-66.4	0	0	117
711	Q	28.6	Very low	29.4	Very low	172 Å²	172	138.6 Å²	138.6	80%	0.804	75%	0.754	S	S	*	*			trans	-125.4	137.8	161.7	170.9	-177.8	21.1	0	0	107.2
712	Q	31.2	Very low	29.5	Very low	163 Å²	163	141.5 Å²	141.5	76%	0.762	76%	0.762	S	S	*	*			trans	179.3	144.8	147.8	-104.6	170.7	20.3	0	0	116.9
713	H	29	Very low	29.4	Very low	127 Å²	127	139.8 Å²	139.8	59%	0.588	76%	0.763	S	S	*	*			trans	66.8	120.9	143.4	-67.7	-45.1	0	0	0	125.3
714	Y	28.1	Very low	29.4	Very low	210 Å²	210	142.3 Å²	142.3	82%	0.824	77%	0.768	S	S	*	*			trans	58.3	149.8	132.5	-63.8	-49.2	0	0	0	121.1
715	A	28.6	Very low	29.8	Very low	77 Å²	77	142.7 Å²	142.7	64%	0.636	77%	0.769	S	S	*	*			cis	-168.8	160.8	-12.8	0	0	0	0	0	112.6
716	H	27.8	Very low	30.1	Very low	161 Å²	161	143.7 Å²	143.7	75%	0.745	77%	0.771	S	S	*	*			trans	67.3	144.4	147.8	-92.8	-116.1	0	0	0	124.7
717	H	32	Very low	30.4	Very low	143 Å²	143	142.8 Å²	142.8	66%	0.662	77%	0.77	S	S	*	*			trans	77.9	111.7	148.9	-76.5	-52.5	0	0	0	125.3
718	N	30.6	Very low	30.9	Very low	126 Å²	126	142 Å²	142	67%	0.674	77%	0.77	S	S	*	*				57.7	129.2	118.9	-75.2	15.4	0	0	0	124.7
719	M	30.6	Very low	31.8	Very low	165 Å²	165	142.9 Å²	142.9	81%	0.813	77%	0.773	S	S	*	*			trans	64.2	108.7	131.5	-69.4	-174.2	164.6	0	0	121.8
720	M	28.8	Very low	31.8	Very low	167 Å²	167	137.9 Å²	137.9	82%	0.823	77%	0.769	S	S	*	*				48.9	132.5	111.1	-71.1	-67	-172.2	0	0	122.2
721	H	31.8	Very low	31.9	Very low	157 Å²	157	134.7 Å²	134.7	73%	0.727	77%	0.769	S	S	*	*			trans	93	125.5	141.4	-94.5	-60.1	0	0	0	122.8
722	N	29.7	Very low	32.9	Very low	153 Å²	153	132.9 Å²	132.9	82%	0.818	77%	0.773	S	S	*	*			trans	77.8	133.5	143.5	-71.8	-2.8	0	0	0	121.9
723	G	27.8	Very low	33.1	Very low	78 Å²	78	130.2 Å²	130.2	80%	0.804	78%	0.778	S	S	*	*			trans	179.3	85.4	170.9	0	0	0	0	0	110.7
724	N	30.8	Very low	33.1	Very low	159 Å²	159	127.9 Å²	127.9	85%	0.85	79%	0.789	S	S	*	*			trans	-71.7	154.9	174.6	-89.7	-11.6	0	0	0	111.7
725	L	34.5	Very low	33.6	Very low	163 Å²	163	125.4 Å²	125.4	85%	0.853	79%	0.79	S	S	*	*				178.9	123.1	121.9	-93.9	157.2	0	0	0	113.8
726	S	34.1	Very low	34.3	Very low	112 Å²	112	127.2 Å²	127.2	78%	0.783	80%	0.795	S	S	*	*			trans	11.5	150.3	136.4	-48.7	0	0	0	0	121.2
727	A	34.2	Very low	34.4	Very low	91 Å²	91	128 Å²	128	75%	0.752	80%	0.797	S	S	*	*			cis	-155.6	143	6.9	0	0	0	0	0	109
728	A	37.3	Very low	34.3	Very low	96 Å²	96	129.2 Å²	129.2	79%	0.793	80%	0.802	S	S	*	*				71.2	151	68.1	0	0	0	0	0	115.2
729	P	51.4	Low	34.2	Very low	135 Å²	135	132.5 Å²	132.5	88%	0.877	81%	0.807	S	S	*	*			cis	-116.1	-163.8	-8.8	43.1	-29.5	0	0	0	112.4
730	G	31.9	Very low	34	Very low	69 Å²	69	134.6 Å²	134.6	71%	0.711	81%	0.805	S	S	*	*			cis	146.7	105	-20.1	0	0	0	0	0	117.4
731	A	32	Very low	34.2	Very low	104 Å²	104	131.9 Å²	131.9	86%	0.86	80%	0.803	S	S	*	*			trans	67.5	170.9	162.2	0	0	0	0	0	119.1
732	P	49.6	Very low	34	Very low	134 Å²	134	130.4 Å²	130.4	87%	0.87	81%	0.81	S	S	*	*			cis	-127	-156.2	-5	42.7	-24.9	0	0	0	114.9
733	A	34.1	Very low	34	Very low	107 Å²	107	128.9 Å²	128.9	88%	0.884	81%	0.812	S	S	*	*			trans	-89.1	165.3	-162.7	0	0	0	0	0	118.2
734	G	30.3	Very low	34.2	Very low	79 Å²	79	129.3 Å²	129.3	81%	0.814	81%	0.808	S	S	*	*			trans	166	125.7	162.2	0	0	0	0	0	116
735	D	38.3	Very low	34.2	Very low	158 Å²	158	126.5 Å²	126.5	85%	0.845	80%	0.8	S	S	*	*			trans	-86.3	144.9	168.6	-119.7	-45.1	0	0	0	110.1
736	P	42.4	Very low	34.1	Very low	114 Å²	114	125.9 Å²	125.9	74%	0.74	80%	0.798	S	S	*	*				-160.7	152.7	92.8	40.3	-20	0	0	0	119.8
737	K	31.2	Very low	33.9	Very low	179 Å²	179	127.6 Å²	127.6	78%	0.778	80%	0.797	S	S	*	*			trans	41	114.3	136	-64.7	-176	178.4	-179	0	122.8
738	H	29.3	Very low	33.8	Very low	167 Å²	167	131 Å²	131	77%	0.773	80%	0.798	S	S	*	*				75.9	136.2	128.7	-68	-53.4	0	0	0	124.6
739	Y	28	Very low	33.5	Very low	196 Å²	196	135.3 Å²	135.3	77%	0.769	80%	0.801	S	S	*	*			trans	91.7	100.2	141.3	-107.3	-103.4	0	0	0	122.9
740	R	27.8	Very low	32.3	Very low	209 Å²	209	135.8 Å²	135.8	79%	0.789	80%	0.796	S	S	*	*			trans	42	125	137.4	-82.5	-169.9	173.4	-173.8	-0.7	122.9
741	S	31.2	Very low	32.9	Very low	109 Å²	109	137.1 Å²	137.1	76%	0.762	79%	0.792	S	S	*	*				79.5	129.5	126	68	0	0	0	0	122.1
742	S	27.8	Very low	32.6	Very low	126 Å²	126	139.3 Å²	139.3	88%	0.881	79%	0.789	S	S	*	*			trans	-135.1	132.8	158.4	-56.4	0	0	0	0	109.6
743	S	30.6	Very low	31.6	Very low	122 Å²	122	136.6 Å²	136.6	85%	0.853	78%	0.778	S	S	*	*			trans	-84.4	173.4	168.2	-30.5	0	0	0	0	109.8
744	A	31.5	Very low	31.1	Very low	87 Å²	87	136.9 Å²	136.9	72%	0.719	77%	0.774	S	S	*	*			cis	-153.9	-162.9	1.3	0	0	0	0	0	107
745	S	32	Very low	30.9	Very low	100 Å²	100	142.4 Å²	142.4	70%	0.699	78%	0.776	S	S	*	*			cis	-155.6	164.9	10.6	-55.1	0	0	0	0	112.1
746	D	30.8	Very low	30.3	Very low	150 Å²	150	139 Å²	139	80%	0.802	76%	0.764	S	S	*	*			trans	22.5	130	144.3	-49.8	-30.4	0	0	0	123.2
747	L	30.3	Very low	29.4	Very low	147 Å²	147	142 Å²	142	77%	0.77	77%	0.768	S	S	*	*				-161.1	105.1	126	-108.4	169.2	0	0	0	113.6
748	Q	33.2	Very low	29.2	Very low	164 Å²	164	138.1 Å²	138.1	77%	0.766	76%	0.764	S	S	*	*			trans	64.8	115	147.9	-74	166.7	1.3	0	0	124.3
749	H	30.4	Very low	29	Very low	185 Å²	185	135.9 Å²	135.9	86%	0.856	77%	0.767	S	S	*	*				86.5	85.1	129.9	-79.9	21.7	0	0	0	122.8
750	D	26	Very low	28.8	Very low	146 Å²	146	134.9 Å²	134.9	78%	0.781	77%	0.772	S	S	*	*				-48.6	179	124.3	-104.6	-44.7	0	0	0	113.9
751	P	44.2	Very low	28.7	Very low	96 Å²	96	132 Å²	132	62%	0.623	78%	0.778	S	S	*	*			cis	-141.8	-175.9	16.9	39.3	-18.3	0	0	0	118.5
752	N	26.9	Very low	28.4	Very low	150 Å²	150	130.3 Å²	130.3	80%	0.802	78%	0.777	S	S	*	*			trans	86.7	140.6	152.7	-66.7	-27.2	0	0	0	120.1
753	A	27.1	Very low	28.2	Very low	77 Å²	77	130.3 Å²	130.3	64%	0.636	78%	0.777	S	S	*	*			cis	-169.4	157.8	-19.1	0	0	0	0	0	111.6
754	S	24.3	Very low	27.9	Very low	114 Å²	114	128.7 Å²	128.7	80%	0.797	77%	0.771	S	S	*	*			trans	70.1	164.8	155.1	-60.3	0	0	0	0	119.8
755	F	24.8	Very low	27.6	Very low	194 Å²	194	136.3 Å²	136.3	85%	0.851	78%	0.781	S	S	*	*			cis	-175.3	162	-49.3	-133.9	-88.8	0	0	0	107.2
756	S	26.1	Very low	27.2	Very low	86 Å²	86	136.1 Å²	136.1	60%	0.601	78%	0.78	S	S	*	*			trans	78.6	107.1	154.5	-61.2	0	0	0	0	123.4
757	Q	25	Very low	27	Very low	177 Å²	177	133.5 Å²	133.5	83%	0.827	77%	0.773	S	S	*	*				81.5	139.4	116.2	-67.2	-176.2	9.7	0	0	124.3
758	S	26.1	Very low	26.8	Very low	99 Å²	99	132.2 Å²	132.2	69%	0.692	77%	0.771	S	S	*	*			trans	103.2	109.2	135.4	-72.9	0	0	0	0	123.4
759	S	24.1	Very low	26.5	Very low	120 Å²	120	133 Å²	133	84%	0.839	77%	0.773	S	S	*	*				93.9	162.9	126.5	-62.5	0	0	0	0	121.7
760	M	25.2	Very low	26.4	Very low	175 Å²	175	130.5 Å²	130.5	86%	0.862	77%	0.766	S	S	*	*			trans	-115.8	-169.2	-156.8	-55.3	-173.4	71.4	0	0	114.8
761	T	25.5	Very low	26.5	Very low	149 Å²	149	133.2 Å²	133.2	91%	0.914	77%	0.771	S	S	*	*			trans	88	143.4	176.2	74.6	0	0	0	0	115.6
762	G	23.8	Very low	25.7	Very low	72 Å²	72	136.8 Å²	136.8	74%	0.742	78%	0.783	S	S	*	*			cis	170.4	145	-12.4	0	0	0	0	0	115.1
763	S	24.6	Very low	25.7	Very low	126 Å²	126	135.5 Å²	135.5	88%	0.881	78%	0.784	S	S	*	*			trans	67.1	118.4	159.9	-74.4	0	0	0	0	123.6
764	A	24.9	Very low	25.9	Very low	89 Å²	89	136.9 Å²	136.9	74%	0.736	79%	0.789	S	S	*	*				89.3	143.5	122.8	0	0	0	0	0	123.5
765	R	24.3	Very low	26.1	Very low	246 Å²	246	140.1 Å²	140.1	93%	0.928	79%	0.791	S	S	*	*			trans	71.4	149.2	161.5	-78.3	176.3	161.8	176.7	-6.6	117.4
766	S	24.5	Very low	26.1	Very low	96 Å²	96	141.7 Å²	141.7	67%	0.671	79%	0.793	S	S	*	*			cis	-164.3	153.3	-12.3	-176.3	0	0	0	0	110.7
767	S	25.5	Very low	26.2	Very low	95 Å²	95	148.8 Å²	148.8	66%	0.664	81%	0.806	S	S	*	*			trans	34.7	136.2	147.7	62.4	0	0	0	0	121.1
768	V	26.8	Very low	26.4	Very low	120 Å²	120	150.1 Å²	150.1	73%	0.727	81%	0.812	S	S	*	*			cis	-133.5	-140.4	22.6	-138	0	0	0	0	110.2
769	F	25.7	Very low	26.6	Very low	180 Å²	180	150.7 Å²	150.7	79%	0.789	82%	0.816	S	S	*	*			cis	-152.7	-165.4	3.8	-134.4	-32.4	0	0	0	111.6
770	D	29.8	Very low	27.2	Very low	134 Å²	134	151.9 Å²	151.9	72%	0.717	82%	0.818	S	S	*	*			trans	-93.5	139.9	-160.7	-64.4	-41	0	0	0	116.4
771	K	28	Very low	27.8	Very low	202 Å²	202	153.9 Å²	153.9	88%	0.878	82%	0.816	S	S	*	*				-178.9	125.9	103.7	-97	172.3	-177.7	178.1	0	112.1
772	L	25.7	Very low	28.3	Very low	171 Å²	171	150 Å²	150	90%	0.895	79%	0.793	S	S	*	*			trans	-143.9	133	169	-90.5	171.4	0	0	0	111.4
773	P	28.8	Very low	29.1	Very low	124 Å²	124	148.9 Å²	148.9	81%	0.805	77%	0.772	S	S	*	*			trans	-72.3	160.5	170.7	-18.5	33	0	0	0	113.7
774	S	30.7	Very low	29.9	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	76%	0.758	S	S	*	*			trans	-123.4	90.9	-165	59.1	0	0	0	0	114.6
775	H	27.7	Very low	30.8	Very low	181 Å²	181	144.9 Å²	144.9	84%	0.838	73%	0.732	S	S	*	*			trans	-136	58	175	-78.5	-82.9	0	0	0	113.4
776	Y	25.9	Very low	31.2	Very low	228 Å²	228	140.7 Å²	140.7	89%	0.894	72%	0.723	S	S	*	*			trans	-159.2	77.6	167.6	-112.1	-73.9	0	0	0	111.7
777	R	26.7	Very low	31.6	Very low	234 Å²	234	140 Å²	140	88%	0.883	72%	0.716	S	S	*	*			trans	-165.7	85.5	159.2	-80.4	-145.1	-175.9	-152.5	-0.9	112.9
778	H	30.2	Very low	31.9	Very low	206 Å²	206	142.6 Å²	142.6	95%	0.954	73%	0.728	S	S	*	*			trans	-125.3	103.2	154.5	-77.7	-59	0	0	0	110.8
779	S	30.7	Very low	32	Very low	110 Å²	110	148.8 Å²	148.8	77%	0.769	74%	0.738	S	S	*	*			trans	-134.7	144.9	165.3	-177.8	0	0	0	0	107	R781	S779-R781 PolarHBondContact O-N 2.83Å
780	T	36.6	Very low	32.6	Very low	145 Å²	145	145.9 Å²	145.9	89%	0.89	74%	0.737	S	S	*	*			trans	-61.6	103.5	-166.4	39.4	0	0	0	0	112.7
781	R	36.4	Very low	32.5	Very low	218 Å²	218	145.5 Å²	145.5	82%	0.823	75%	0.745	S	S	*	*			trans	-121.1	134.5	175.4	-108.7	-173.7	172.6	-147.2	-3.3	111.2	S779	S779-R781 PolarHBondContact O-N 2.83Å
782	P	36.5	Very low	32.5	Very low	67 Å²	67	140.1 Å²	140.1	44%	0.435	74%	0.738	S	S	.	*			trans	-70	139.1	178.3	27.4	-33.3	0	0	0	111.8	S552	S552-P782 WeakPolarHBondContact OG-CB 3.47Å
783	T	41.8	Very low	32.5	Very low	49 Å²	49	140.8 Å²	140.8	30%	0.301	74%	0.737	S	S	.	*			trans	-77.8	140.6	173.3	-40.7	0	0	0	0	110.7	Q602 A606	Q602-T783 PolarHBondContact NE2-OG1 3.22Å; Q602-T783 VanDerWaalsContact NE2-OG1 3.12Å; A606-T783 HydrophobicContact CB-CG2 4.25Å
784	V	40.7	Very low	32.3	Very low	97 Å²	97	139.9 Å²	139.9	59%	0.588	73%	0.733	S	S	*	*			trans	-129.4	128.8	171.1	-179.7	0	0	0	0	107.8
785	I	43.3	Very low	33	Very low	34 Å²	34	140.2 Å²	140.2	17%	0.174	73%	0.733	C	S	.	*			trans	-98.5	119	-170.4	-57.7	170.6	0	0	0	110.3	G547 M609 T610	G547-I785 VanDerWaalsContact O-O 3.06Å; M609-I785 HydrophobicContact CB-CD1 4.21Å; T610-I785 HydrophobicContact CG2-CG2 4.35Å
786	Q	33.1	Very low	33	Very low	158 Å²	158	137.2 Å²	137.2	74%	0.738	73%	0.733	S	S	*	*			trans	-133.3	154	168.9	-69.5	-172.4	-3.6	0	0	110.8
787	P	34	Very low	33.3	Very low	81 Å²	81	130.4 Å²	130.4	53%	0.526	72%	0.723	S	S	.	*			trans	-106.5	163.4	-167.4	39.5	-34.6	0	0	0	116.2	G546	G546-P787 WeakPolarHBondContact O-CD 3.36Å; G546-P787 WeakPolarHBondContact O-CG 3.15Å
788	T	30.5	Very low	33.4	Very low	149 Å²	149	126 Å²	126	91%	0.914	72%	0.716	S	S	*	*			trans	-135.3	167.8	170.2	48.6	0	0	0	0	111.6
789	R	29	Very low	33.3	Very low	250 Å²	250	126.2 Å²	126.2	94%	0.943	71%	0.709	S	S	*	*			trans	-111.5	160.1	-171.8	-115.5	-158.6	157.7	176	-5.7	113.7
790	P	39.6	Very low	33.1	Very low	119 Å²	119	130.8 Å²	130.8	77%	0.773	72%	0.715	S	S	*	*			trans	-115.4	172.3	-153.5	43.1	-38.5	0	0	0	118.7
791	S	26.9	Very low	32.6	Very low	126 Å²	126	128.5 Å²	128.5	88%	0.881	71%	0.711	S	S	*	*			trans	-145.6	-144.5	168	64.2	0	0	0	0	114.9
792	A	27.8	Very low	32.1	Very low	89 Å²	89	122.6 Å²	122.6	74%	0.736	71%	0.708	S	S	*	*				-159.5	159.1	-127.1	0	0	0	0	0	114.8
793	Q	25.9	Very low	31.6	Very low	185 Å²	185	124.5 Å²	124.5	86%	0.864	73%	0.73	S	S	*	*			cis	-155.7	-98.3	-15.1	-173.3	173.3	-15.4	0	0	113
794	S	24.3	Very low	30.9	Very low	105 Å²	105	126.8 Å²	126.8	73%	0.734	75%	0.753	S	S	*	*			trans	-167.4	-174.1	-170.4	-45.7	0	0	0	0	109.9
795	P	44.9	Very low	30.2	Very low	114 Å²	114	127.6 Å²	127.6	74%	0.74	76%	0.763	S	S	*	*			cis	-143.1	173.2	-2.5	43.3	-24	0	0	0	119
796	S	29.1	Very low	30.2	Very low	118 Å²	118	131.4 Å²	131.4	83%	0.825	79%	0.79	S	S	*	*			trans	37	143.5	140.7	-55.2	0	0	0	0	127
797	A	30.4	Very low	29.9	Very low	84 Å²	84	129.4 Å²	129.4	69%	0.694	79%	0.789	S	S	*	*				157	137.7	108.8	0	0	0	0	0	120.1
798	L	28.9	Very low	29.6	Very low	141 Å²	141	130.1 Å²	130.1	74%	0.738	80%	0.796	S	S	*	*			trans	39.7	139.7	136.6	-63.4	171.6	0	0	0	122
799	R	29.3	Very low	29.4	Very low	211 Å²	211	129.3 Å²	129.3	80%	0.796	79%	0.786	S	S	*	*			cis	-155.4	173.5	18.2	-68.6	113.4	-59.3	-177	-3.8	108.4
800	K	27.1	Very low	29.3	Very low	207 Å²	207	123.4 Å²	123.4	90%	0.9	77%	0.772	S	S	*	*			cis	95.7	135.6	10.3	-165.4	172.3	-179.8	175.8	0	119.3
801	A	25.3	Very low	28.6	Very low	97 Å²	97	126.8 Å²	126.8	80%	0.802	77%	0.771	S	S	*	*			trans	96.1	160.8	172.6	0	0	0	0	0	118.4
802	A	25.7	Very low	28.6	Very low	93 Å²	93	130.3 Å²	130.3	77%	0.769	77%	0.765	S	S	*	*			cis	-176.1	147.9	-42.1	0	0	0	0	0	113.3
803	A	27	Very low	29.2	Very low	107 Å²	107	131.2 Å²	131.2	88%	0.884	76%	0.763	S	S	*	*			trans	65.5	162	165.2	0	0	0	0	0	118.3
804	A	26	Very low	29.2	Very low	97 Å²	97	128 Å²	128	80%	0.802	76%	0.756	S	S	*	*			cis	-151.5	177.8	2.6	0	0	0	0	0	113
805	S	25.3	Very low	29.4	Very low	114 Å²	114	128 Å²	128	80%	0.797	76%	0.757	S	S	*	*			trans	-86.2	-154.7	179.6	-31.1	0	0	0	0	113
806	P	44.1	Very low	28.6	Very low	114 Å²	114	127.4 Å²	127.4	74%	0.74	76%	0.761	S	S	*	*			cis	-149.4	-165.3	22	33.3	-4.3	0	0	0	118.5
807	V	26	Very low	28.6	Very low	117 Å²	117	126.8 Å²	126.8	71%	0.709	76%	0.757	S	S	*	*			trans	70.5	123.4	161.2	-159.6	0	0	0	0	117.5
808	S	28.4	Very low	28.6	Very low	95 Å²	95	129.6 Å²	129.6	66%	0.664	76%	0.76	S	S	*	*			cis	101.7	140.6	10.7	90.3	0	0	0	0	118.2
809	N	25.6	Very low	28.5	Very low	132 Å²	132	129.5 Å²	129.5	71%	0.706	76%	0.76	S	S	*	*			trans	132.9	147.8	153.2	-67.2	-6.2	0	0	0	114.9
810	L	27.9	Very low	28.4	Very low	127 Å²	127	128.7 Å²	128.7	67%	0.665	76%	0.762	S	S	*	*			cis	-169.3	141.4	-16.6	-108.3	171	0	0	0	111.3
811	Y	24.9	Very low	28.4	Very low	190 Å²	190	122.8 Å²	122.8	75%	0.745	75%	0.752	S	S	*	*			trans	63.3	160.5	147.6	-90.2	-154.5	0	0	0	120.3
812	R	26.1	Very low	29.6	Very low	199 Å²	199	123.3 Å²	123.3	75%	0.751	75%	0.747	S	S	*	*			cis	-167.8	-174	-12.2	-128.3	-170.3	168.6	-176.4	-3.3	106.7
813	P	41.5	Very low	30.2	Very low	108 Å²	108	125 Å²	125	70%	0.701	75%	0.75	S	S	*	*			cis	-133.5	-160.6	-13	39.9	-18.1	0	0	0	115.7
814	T	25.7	Very low	30.4	Very low	117 Å²	117	130 Å²	130	72%	0.718	75%	0.746	S	S	*	*			trans	-64.6	173.2	-177.1	52.2	0	0	0	0	116
815	S	29.1	Very low	30.6	Very low	106 Å²	106	132.1 Å²	132.1	74%	0.741	74%	0.744	S	S	*	*				178.2	155.7	71.3	-53.6	0	0	0	0	117.7
816	A	27.8	Very low	30.8	Very low	101 Å²	101	131.8 Å²	131.8	84%	0.835	74%	0.742	S	S	*	*			trans	76.6	169.4	142.8	0	0	0	0	0	122.4
817	S	28.3	Very low	30	Very low	105 Å²	105	130.5 Å²	130.5	73%	0.734	75%	0.749	S	S	*	*			trans	-143.8	159.1	-160	-31.3	0	0	0	0	112.8
818	N	29.8	Very low	30	Very low	144 Å²	144	128.4 Å²	128.4	77%	0.77	75%	0.751	S	S	*	*				163.4	140.5	127.1	-86	-24.5	0	0	0	117.7
819	L	27.9	Very low	30.1	Very low	138 Å²	138	131.9 Å²	131.9	72%	0.723	76%	0.762	S	S	*	*			trans	46.7	121.9	137.6	-56.8	167.2	0	0	0	122.9
820	F	26.2	Very low	30.3	Very low	195 Å²	195	132.5 Å²	132.5	86%	0.855	77%	0.77	S	S	*	*				172.7	167.7	104	-107.2	-81.6	0	0	0	114.2
821	A	27	Very low	30.2	Very low	83 Å²	83	129.6 Å²	129.6	69%	0.686	77%	0.77	S	S	*	*			trans	-162.8	-178.7	173.3	0	0	0	0	0	109.2
822	P	50.9	Low	30.4	Very low	107 Å²	107	131.2 Å²	131.2	70%	0.695	78%	0.777	S	S	*	*			cis	-125.5	-154.5	-19.7	42.4	-25	0	0	0	111.5
823	P	39.4	Very low	30.4	Very low	129 Å²	129	126.5 Å²	126.5	84%	0.838	77%	0.774	S	S	*	*				-135.1	-172.1	123.9	36.5	-24.5	0	0	0	114.7
824	R	30	Very low	29.8	Very low	212 Å²	212	127 Å²	127	80%	0.8	78%	0.78	S	S	*	*			trans	-138.6	159.5	-159.7	-55.9	166.2	74.8	-179.2	7.5	115
825	N	30.9	Very low	29.9	Very low	142 Å²	142	129.1 Å²	129.1	76%	0.759	79%	0.787	S	S	*	*			trans	70.9	155.5	148.5	-85.9	24.7	0	0	0	119.8
826	S	30.3	Very low	29.9	Very low	107 Å²	107	128.7 Å²	128.7	75%	0.748	79%	0.79	S	S	*	*			cis	-168.2	149.4	-6.5	39.8	0	0	0	0	114.9
827	G	26.2	Very low	30	Very low	86 Å²	86	128.3 Å²	128.3	89%	0.887	79%	0.787	S	S	*	*			trans	97.9	144.3	155.6	0	0	0	0	0	116.9
828	G	26.8	Very low	29.9	Very low	73 Å²	73	132.9 Å²	132.9	75%	0.753	79%	0.788	S	S	*	*			cis	168.2	158.3	-12.5	0	0	0	0	0	115.4
829	L	29	Very low	29.8	Very low	169 Å²	169	132.5 Å²	132.5	89%	0.885	78%	0.782	S	S	*	*			trans	69.6	128.6	155.5	-79.2	160.2	0	0	0	122.9
830	V	30	Very low	29.9	Very low	144 Å²	144	130.8 Å²	130.8	87%	0.873	78%	0.781	S	S	*	*			trans	67.2	146.2	153.5	-174.3	0	0	0	0	117
831	G	27.6	Very low	30.7	Very low	66 Å²	66	127.9 Å²	127.9	68%	0.68	78%	0.779	S	S	*	*			cis	171.3	177.2	-7.9	0	0	0	0	0	114.4
832	Y	28.3	Very low	31	Very low	225 Å²	225	132.4 Å²	132.4	88%	0.882	79%	0.786	S	S	*	*			trans	-27.1	138.9	-175.2	-67.9	-84.7	0	0	0	123
833	S	25.7	Very low	30.1	Very low	99 Å²	99	133 Å²	133	69%	0.692	78%	0.784	S	S	*	*				39.3	140.9	127.9	-50.5	0	0	0	0	123.2
834	S	29.7	Very low	30	Very low	118 Å²	118	133.2 Å²	133.2	83%	0.825	78%	0.776	S	S	*	*				152.3	150.5	117.4	-66.1	0	0	0	0	114.1
835	N	27.7	Very low	30.1	Very low	163 Å²	163	131.9 Å²	131.9	87%	0.872	78%	0.779	S	S	*	*			trans	-87	166.6	-178.7	-61.5	-33.9	0	0	0	114.3
836	A	28.6	Very low	29.9	Very low	97 Å²	97	136.2 Å²	136.2	80%	0.802	78%	0.784	S	S	*	*			trans	99.4	149.4	135.7	0	0	0	0	0	121.1
837	A	29.2	Very low	29.8	Very low	92 Å²	92	135.7 Å²	135.7	76%	0.76	79%	0.787	S	S	*	*			trans	70.2	156	165.2	0	0	0	0	0	117.8
838	R	28	Very low	30.3	Very low	201 Å²	201	139.8 Å²	139.8	76%	0.758	78%	0.783	S	S	*	*			cis	-160.1	163.4	-20.2	-110.1	171.6	95.9	132.5	13.5	110.2
839	E	26.5	Very low	31.5	Very low	137 Å²	137	142.1 Å²	142.1	64%	0.64	79%	0.785	S	S	*	*			trans	20.2	119.5	148.5	-66.8	161.3	163.8	0	0	123.1
840	S	30.4	Very low	31.6	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	77%	0.774	S	S	*	*				59	121.7	125.4	73.9	0	0	0	0	125.5
841	T	41.8	Very low	31.5	Very low	134 Å²	134	138.3 Å²	138.3	82%	0.822	77%	0.77	S	S	*	*			trans	61	113.2	137.9	41.6	0	0	0	0	123.7
842	Q	34.9	Very low	31.5	Very low	178 Å²	178	141.4 Å²	141.4	83%	0.832	78%	0.775	S	S	*	*			trans	-170.3	155.3	151.1	-94	-146.9	-70.1	0	0	109.6
843	D	31.5	Very low	31.6	Very low	120 Å²	120	136.7 Å²	136.7	64%	0.642	76%	0.764	S	S	*	*			cis	-162.3	-169.9	-21.5	-138.5	-41.4	0	0	0	113.6
844	I	36.2	Very low	31.7	Very low	133 Å²	133	142.2 Å²	142.2	68%	0.682	77%	0.77	S	S	*	*			trans	-72.3	156.9	-169.4	-78.5	159.8	0	0	0	120.6
845	H	32.2	Very low	32.7	Very low	184 Å²	184	141.9 Å²	141.9	85%	0.852	76%	0.764	S	S	*	*			trans	-173.6	156.5	131.3	-89.7	-45.3	0	0	0	110.1
846	R	27.4	Very low	32.9	Very low	233 Å²	233	139.7 Å²	139.7	88%	0.879	76%	0.757	S	S	*	*			cis	-166.1	147.3	30.2	-162.8	-173.8	-179.1	115.7	-2.4	114
847	A	29	Very low	32.9	Very low	97 Å²	97	141.6 Å²	141.6	80%	0.802	75%	0.754	S	S	*	*			trans	75.6	145.4	154.5	0	0	0	0	0	124.2
848	E	37.1	Very low	33	Very low	172 Å²	172	144.5 Å²	144.5	80%	0.804	76%	0.755	S	S	*	*			trans	-129.5	-172.1	171.9	-59.1	-169.2	167.5	0	0	112
849	P	51.8	Low	32.9	Very low	122 Å²	122	141.9 Å²	141.9	79%	0.792	76%	0.757	S	S	*	*				-152.4	135.7	82.5	37.5	-17.1	0	0	0	119.8
850	A	30.4	Very low	33.1	Very low	79 Å²	79	142.5 Å²	142.5	65%	0.653	76%	0.761	S	S	*	*			trans	46.4	159.5	136.5	0	0	0	0	0	122.6
851	I	28.4	Very low	33.6	Very low	153 Å²	153	142.6 Å²	142.6	79%	0.785	76%	0.76	S	S	*	*			cis	-163.7	133.3	48.8	-85	-175.8	0	0	0	112.9
852	V	26.8	Very low	32.9	Very low	132 Å²	132	145.1 Å²	145.1	80%	0.8	76%	0.759	S	S	*	*			trans	68.3	164.1	150	150.3	0	0	0	0	122.7
853	I	30.8	Very low	32.4	Very low	126 Å²	126	141.5 Å²	141.5	65%	0.646	76%	0.759	S	S	*	*				-170.6	159.8	-55.9	-142.4	175.6	0	0	0	114.3
854	R	27.2	Very low	32.3	Very low	215 Å²	215	142.5 Å²	142.5	81%	0.811	77%	0.77	S	S	*	*			trans	85.8	153.2	155.6	-81.5	174.2	-163.8	-83.7	-3.6	122.3
855	P	50.8	Low	33.3	Very low	110 Å²	110	141.6 Å²	141.6	71%	0.714	77%	0.773	S	S	*	*			trans	-145.3	-160.1	-136.4	41.6	-17.3	0	0	0	116.8
856	V	31	Very low	33.9	Very low	117 Å²	117	138.6 Å²	138.6	71%	0.709	77%	0.77	S	S	*	*			trans	146.2	126.7	136.1	166.4	0	0	0	0	115
857	D	28.8	Very low	33.9	Very low	138 Å²	138	131.9 Å²	131.9	74%	0.738	76%	0.764	S	S	*	*			trans	42.9	157.2	153.7	-56.9	-7.2	0	0	0	123
858	L	31	Very low	33.9	Very low	152 Å²	152	132.4 Å²	132.4	80%	0.796	76%	0.762	S	S	*	*			cis	-117.3	-147.6	6.8	-68.5	76.5	0	0	0	110.2
859	N	27.1	Very low	33.5	Very low	147 Å²	147	132 Å²	132	79%	0.786	76%	0.764	S	S	*	*			cis	-161.7	-178.2	3.3	-152.5	-4.5	0	0	0	113
860	M	29.9	Very low	32.3	Very low	149 Å²	149	137.9 Å²	137.9	73%	0.734	77%	0.77	S	S	*	*			trans	-150.1	177.5	175.3	-117.5	-141.4	178.6	0	0	111.7
861	P	41.8	Very low	32	Very low	104 Å²	104	137.7 Å²	137.7	68%	0.675	78%	0.776	S	S	*	*			cis	-142.1	163.8	21.5	42.2	-22.4	0	0	0	120.5
862	K	25.8	Very low	31.9	Very low	187 Å²	187	135.1 Å²	135.1	81%	0.813	78%	0.778	S	S	*	*			trans	39.5	128.5	141.6	-62.4	174.3	-179.7	178.1	0	123.4
863	A	25.8	Very low	31.8	Very low	101 Å²	101	135.3 Å²	135.3	84%	0.835	78%	0.779	S	S	*	*				-170.6	168.1	123.9	0	0	0	0	0	112.3
864	T	28.3	Very low	32.4	Very low	141 Å²	141	134 Å²	134	87%	0.865	78%	0.779	S	S	*	*			trans	-136	173.6	-172.3	11.9	0	0	0	0	112.5
865	P	58.1	Low	32.6	Very low	114 Å²	114	130.2 Å²	130.2	74%	0.74	78%	0.78	S	S	*	*			trans	-90	-177.3	-154.9	40.1	-41.5	0	0	0	115.4
866	P	43.7	Very low	31.6	Very low	122 Å²	122	128.5 Å²	128.5	79%	0.792	78%	0.775	S	S	*	*				-154.3	165.8	100.9	41.3	-23.6	0	0	0	118.9
867	A	27.7	Very low	31.5	Very low	92 Å²	92	130.2 Å²	130.2	76%	0.76	78%	0.778	S	S	*	*			trans	29.9	130	142.7	0	0	0	0	0	125.3
868	S	29.9	Very low	31.6	Very low	108 Å²	108	129 Å²	129	76%	0.755	78%	0.776	S	S	*	*				49.6	126.9	126	-162.7	0	0	0	0	122.6
869	I	27.8	Very low	31.6	Very low	164 Å²	164	129.1 Å²	129.1	84%	0.841	77%	0.772	S	S	*	*				176.8	164.2	123.5	-93.3	160.8	0	0	0	112.1
870	R	26.4	Very low	31.8	Very low	244 Å²	244	126.3 Å²	126.3	92%	0.921	77%	0.769	S	S	*	*			trans	-64.6	154.5	176.5	-56.4	167.1	171.9	167.6	-5.5	113.6
871	G	25.7	Very low	31.8	Very low	75 Å²	75	126 Å²	126	77%	0.773	77%	0.77	S	S	*	*			trans	159.4	114.9	149.1	0	0	0	0	0	118.9
872	A	25.1	Very low	31.3	Very low	100 Å²	100	128.2 Å²	128.2	83%	0.826	77%	0.771	S	S	*	*			trans	33.9	133.8	145.9	0	0	0	0	0	124.6
873	V	25.9	Very low	31.4	Very low	135 Å²	135	125.6 Å²	125.6	82%	0.818	77%	0.766	S	S	*	*			trans	-35.7	169.7	139.4	-96.1	0	0	0	0	115.9
874	P	43.6	Very low	31.6	Very low	100 Å²	100	129 Å²	129	65%	0.649	76%	0.764	S	S	*	*			cis	-144.6	178.2	16	34.3	-11.1	0	0	0	119.4
875	T	30	Very low	32.6	Very low	135 Å²	135	126.8 Å²	126.8	83%	0.828	75%	0.752	S	S	*	*			trans	65.9	157.2	147.1	39.8	0	0	0	0	120.9
876	A	30.2	Very low	31.3	Very low	74 Å²	74	129.2 Å²	129.2	61%	0.612	76%	0.759	S	S	*	*			cis	-168.5	176.5	-10	0	0	0	0	0	112.5
877	I	28.7	Very low	30.6	Very low	153 Å²	153	127.3 Å²	127.3	79%	0.785	76%	0.762	S	S	*	*			trans	69.1	123.6	154.3	-70.3	150.9	0	0	0	117.2
878	T	31.7	Very low	30.7	Very low	112 Å²	112	127.2 Å²	127.2	69%	0.687	77%	0.769	S	S	*	*			cis	85.7	140.1	38.8	-51.2	0	0	0	0	113.3
879	Q	30.6	Very low	30.6	Very low	154 Å²	154	126 Å²	126	72%	0.72	78%	0.775	S	S	*	*			cis	-77.4	-169.6	14.4	-83.7	64.5	-104.4	0	0	116.2
880	A	31.3	Very low	30.7	Very low	88 Å²	88	123 Å²	123	73%	0.727	77%	0.774	S	S	*	*			cis	77	158.9	18.5	0	0	0	0	0	116.4
881	L	28.9	Very low	30.8	Very low	144 Å²	144	116.9 Å²	116.9	75%	0.754	76%	0.763	S	S	*	*			cis	-144.9	-159.9	20	-57.7	150	0	0	0	109.5
882	Q	33	Very low	31	Very low	149 Å²	149	122 Å²	122	70%	0.696	77%	0.772	S	S	*	*			cis	-166.9	173.3	-9.6	-135.2	174.6	-57.1	0	0	112.9
883	L	27.9	Very low	31.1	Very low	133 Å²	133	127.3 Å²	127.3	70%	0.696	77%	0.77	S	S	*	*			trans	57.6	108.3	152.2	-69.3	170	0	0	0	125.6
884	Q	30.1	Very low	31.2	Very low	172 Å²	172	130.2 Å²	130.2	80%	0.804	78%	0.775	S	S	*	*				35.6	162.3	117.3	-75.3	-163.3	7.2	0	0	124.8
885	P	48.1	Very low	30.4	Very low	94 Å²	94	131 Å²	131	61%	0.61	78%	0.778	S	S	*	*			cis	-145.1	-166.6	-33.8	42.5	-23.3	0	0	0	115.6
886	N	30.2	Very low	30.3	Very low	166 Å²	166	135.5 Å²	135.5	89%	0.888	78%	0.78	S	S	*	*			trans	76.7	149.7	162.2	-65.1	-10.2	0	0	0	120.7
887	G	30.1	Very low	30.2	Very low	82 Å²	82	138.1 Å²	138.1	85%	0.845	79%	0.791	S	S	*	*			trans	-179.5	-84.6	174.5	0	0	0	0	0	118.4
888	G	28.6	Very low	30.2	Very low	89 Å²	89	135.3 Å²	135.3	92%	0.918	79%	0.79	S	S	*	*			trans	90.4	161	-178.1	0	0	0	0	0	116.3
889	G	28.8	Very low	30.7	Very low	84 Å²	84	136.1 Å²	136.1	87%	0.866	80%	0.8	S	S	*	*			trans	123.9	140.9	178.1	0	0	0	0	0	114.4
890	A	30.6	Very low	30.7	Very low	100 Å²	100	132.2 Å²	132.2	83%	0.826	80%	0.801	S	S	*	*			trans	-153.3	167.8	-172.2	0	0	0	0	0	112.2
891	V	28.2	Very low	30.8	Very low	115 Å²	115	136.2 Å²	136.2	70%	0.697	81%	0.809	S	S	*	*			cis	-159.3	136.9	-31.4	141.8	0	0	0	0	105.1	R893	V891-R893 HydrophobicContact CG1-CG 4.21Å
892	L	29.3	Very low	31.1	Very low	182 Å²	182	137.1 Å²	137.1	95%	0.953	80%	0.803	S	S	*	*			trans	-138.8	123.9	158.9	-101.9	171.3	0	0	0	109.2
893	R	27.2	Very low	31.3	Very low	212 Å²	212	138.8 Å²	138.8	80%	0.8	81%	0.811	S	S	*	*			trans	-93.2	116.6	-169.3	-81.4	177.9	166.9	166.1	-5.5	112.3	V891 V895	V891-R893 HydrophobicContact CG1-CG 4.21Å; R893-V895 HydrophobicContact CB-CG2 4.38Å; R893-V895 HydrophobicContact CG-CG2 4.4Å
894	Q	27.9	Very low	32	Very low	196 Å²	196	144.4 Å²	144.4	92%	0.916	82%	0.823	S	S	*	*			trans	-116.2	117.7	142.3	-75.3	-170.1	-8.7	0	0	107.8
895	V	27.9	Very low	32.6	Very low	117 Å²	117	141.9 Å²	141.9	71%	0.709	81%	0.814	S	S	*	*			trans	-105	106.4	-176.3	179.2	0	0	0	0	109.3	R893	R893-V895 HydrophobicContact CB-CG2 4.38Å; R893-V895 HydrophobicContact CG-CG2 4.4Å
896	R	27.9	Very low	32.5	Very low	230 Å²	230	144.1 Å²	144.1	87%	0.868	82%	0.816	S	S	*	*			trans	-75.4	142.9	153.7	-76.9	179.6	171.9	157.7	-2.3	108.2	A898	R896-A898 PolarHBondContact O-N 2.88Å; R896-A898 VanDerWaalsContact O-N 3.13Å
897	P	27.7	Very low	33.1	Very low	129 Å²	129	139.8 Å²	139.8	84%	0.838	79%	0.793	S	S	*	*			trans	-68.4	112	-179.9	27.4	-33.4	0	0	0	110.3
898	A	28.8	Very low	33.7	Very low	93 Å²	93	138.1 Å²	138.1	77%	0.769	77%	0.771	S	S	*	*			trans	-87.9	148.3	172.7	0	0	0	0	0	110.9	R896 G900	R896-A898 PolarHBondContact O-N 2.88Å; R896-A898 VanDerWaalsContact O-N 3.13Å; A898-G900 PolarHBondContact O-N 3.02Å
899	S	40.8	Very low	34.5	Very low	130 Å²	130	137.3 Å²	137.3	91%	0.909	75%	0.746	S	S	*	*			trans	-61.2	112.8	175.6	50.3	0	0	0	0	112.1
900	G	31.8	Very low	35.4	Very low	71 Å²	71	135 Å²	135	73%	0.732	72%	0.715	S	S	*	*			trans	-126.2	56.8	-177.2	0	0	0	0	0	113.7	A898	A898-G900 PolarHBondContact O-N 3.02Å
901	L	32.4	Very low	36	Very low	172 Å²	172	136.8 Å²	136.8	90%	0.901	70%	0.7	S	S	*	*	S	Bend	trans	-121.1	19.7	-175.9	-126.5	173.1	0	0	0	113.9
902	R	34.9	Very low	36.7	Very low	164 Å²	164	135.9 Å²	135.9	62%	0.619	69%	0.691	S	S	*	*	S	Bend	trans	-134.6	12.2	-177.7	-154.6	-167.1	159.1	125.3	3.5	114.6	D907	R902-D907 IonicContact CZ-OD1 3.49Å; R902-D907 IonicContact NE-OD1 3.51Å; R902-D907 PolarHBondContact NE-OD1 3.21Å; R902-D907 IonicContact NH2-OD1 3.39Å; R902-D907 PolarHBondContact NH2-OD1 3.41Å
903	E	38.6	Very low	37.5	Very low	184 Å²	184	132 Å²	132	86%	0.86	67%	0.671	S	S	*	*			trans	-117.1	39	-169.8	-151.8	168.6	-143.2	0	0	113.7
904	R	42.1	Very low	38.2	Very low	251 Å²	251	127.3 Å²	127.3	95%	0.947	66%	0.659	S	S	*	*	S	Bend	trans	-135.6	12.3	169.4	-77	-163.6	174.4	-171.2	0.2	114.9
905	L	42.6	Very low	38.8	Very low	119 Å²	119	125 Å²	125	62%	0.623	65%	0.645	S	S	*	*	S	Bend	trans	-123.8	143.3	157.3	-70.7	169.7	0	0	0	105.6	V910	L905-V910 HydrophobicContact CB-CG2 4.07Å; L905-V910 HydrophobicContact CD1-CG2 4.39Å
906	Q	45.3	Very low	39.7	Very low	140 Å²	140	122.7 Å²	122.7	65%	0.654	63%	0.632	S	S	*	*			trans	-73.3	140.8	177.8	-50.3	-172.4	17.4	0	0	108	A908 D909 V910	Q906-A908 HydrophobicContact CB-CB 4.47Å; Q906-A908 PolarHBondContact O-N 2.88Å; Q906-D909 VanDerWaalsContact CB-OD2 3.25Å; Q906-D909 WeakPolarHBondContact CB-OD2 3.39Å; Q906-D909 WeakPolarHBondContact CG-OD2 3.29Å; Q906-D909 PolarHBondContact N-OD2 3.4Å; Q906-D909 WeakPolarHBondContact O-CB 3.4Å; Q906-D909 PolarHBondContact O-N 2.91Å; Q906-V910 PolarHBondContact O-N 2.99Å
907	D	42.8	Very low	40.5	Very low	75 Å²	75	118.6 Å²	118.6	40%	0.401	63%	0.627	S	S	.	*	H	α-helix	trans	-63.3	-7	174.9	-100.4	-23.3	0	0	0	112.1	R902 R911	R902-D907 IonicContact CZ-OD1 3.49Å; R902-D907 IonicContact NE-OD1 3.51Å; R902-D907 PolarHBondContact NE-OD1 3.21Å; R902-D907 IonicContact NH2-OD1 3.39Å; R902-D907 PolarHBondContact NH2-OD1 3.41Å; D907-R911 WeakPolarHBondContact O-CB 3.35Å; D907-R911 WeakPolarHBondContact O-CG 3.45Å; D907-R911 PolarHBondContact O-NE 2.79Å; D907-R911 PolarHBondContact O-NH2 2.83Å
908	A	43.8	Very low	41.7	Very low	47 Å²	47	113.1 Å²	113.1	39%	0.388	59%	0.591	S	S	.	*	H	α-helix	trans	-74.1	-41.5	165.6	0	0	0	0	0	112.3	Q906 R911 N912	Q906-A908 HydrophobicContact CB-CB 4.47Å; Q906-A908 PolarHBondContact O-N 2.88Å; A908-R911 CarbonylContact O-C 3.6Å; A908-N912 WeakPolarHBondContact O-CB 3.32Å; A908-N912 PolarHBondContact O-N 3.42Å; A908-N912 PolarHBondContact O-ND2 3.47Å
909	D	45.6	Very low	42.8	Very low	72 Å²	72	110.2 Å²	110.2	39%	0.385	57%	0.567	S	S	.	*	H	α-helix	trans	-68.7	-48.6	-176.5	-50.1	-38.2	0	0	0	110.6	Q906 R911 N912 L913	Q906-D909 VanDerWaalsContact CB-OD2 3.25Å; Q906-D909 WeakPolarHBondContact CB-OD2 3.39Å; Q906-D909 WeakPolarHBondContact CG-OD2 3.29Å; Q906-D909 PolarHBondContact N-OD2 3.4Å; Q906-D909 WeakPolarHBondContact O-CB 3.4Å; Q906-D909 PolarHBondContact O-N 2.91Å; D909-R911 PolarHBondContact O-N 2.97Å; D909-N912 PolarHBondContact O-N 3.29Å; D909-L913 PolarHBondContact O-N 2.89Å
910	V	46.6	Very low	43.3	Very low	37 Å²	37	110.3 Å²	110.3	22%	0.224	56%	0.557	C	S	.	*	H	α-helix	trans	-60.2	-47.5	177.4	-177.6	0	0	0	0	110.4	L905 Q906 N912 L913 E914	L905-V910 HydrophobicContact CB-CG2 4.07Å; L905-V910 HydrophobicContact CD1-CG2 4.39Å; Q906-V910 PolarHBondContact O-N 2.99Å; V910-N912 PolarHBondContact O-N 2.82Å; V910-N912 VanDerWaalsContact O-N 3.16Å; V910-L913 PolarHBondContact O-N 3.36Å; V910-E914 WeakPolarHBondContact O-CG 3.48Å; V910-E914 PolarHBondContact O-N 2.67Å
911	R	43.3	Very low	44.6	Very low	137 Å²	137	108.7 Å²	108.7	52%	0.517	53%	0.531	S	S	.	.	H	α-helix	trans	-73.6	1.7	175.9	-68.6	-177.1	-66.6	-170.8	-5.3	113.8	D907 A908 D909 K915	D907-R911 WeakPolarHBondContact O-CB 3.35Å; D907-R911 WeakPolarHBondContact O-CG 3.45Å; D907-R911 PolarHBondContact O-NE 2.79Å; D907-R911 PolarHBondContact O-NH2 2.83Å; A908-R911 CarbonylContact O-C 3.6Å; D909-R911 PolarHBondContact O-N 2.97Å; R911-K915 WeakPolarHBondContact O-CD 3.41Å; R911-K915 WeakPolarHBondContact O-CE 3.17Å; R911-K915 VanDerWaalsContact O-CG 3.32Å; R911-K915 WeakPolarHBondContact O-CG 3.14Å; R911-K915 PolarHBondContact O-NZ 3.32Å
912	N	44.3	Very low	46.2	Very low	95 Å²	95	103.6 Å²	103.6	51%	0.508	51%	0.509	S	S	.	.	H	α-helix	trans	-101.2	-35.7	168.1	-76.2	-18.7	0	0	0	111.1	A908 D909 V910 K915	A908-N912 WeakPolarHBondContact O-CB 3.32Å; A908-N912 PolarHBondContact O-N 3.42Å; A908-N912 PolarHBondContact O-ND2 3.47Å; D909-N912 PolarHBondContact O-N 3.29Å; V910-N912 PolarHBondContact O-N 2.82Å; V910-N912 VanDerWaalsContact O-N 3.16Å; N912-K915 PolarHBondContact O-N 3.42Å; N912-K915 PolarHBondContact OD1-NZ 3.33Å
913	L	44.6	Very low	47.8	Very low	100 Å²	100	99.7 Å²	99.7	52%	0.524	50%	0.495	S	S	.	.	H	α-helix	trans	-57.7	-45.8	166	-103.7	65.8	0	0	0	111.6	D909 V910 K915 A919	D909-L913 PolarHBondContact O-N 2.89Å; V910-L913 PolarHBondContact O-N 3.36Å; L913-K915 PolarHBondContact O-N 2.83Å; L913-A919 WeakPolarHBondContact O-CB 3.37Å
914	E	41.5	Very low	49.2	Very low	115 Å²	115	97.8 Å²	97.8	54%	0.537	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-2.4	-177.2	-70.3	170.6	161.5	0	0	115	V910	V910-E914 WeakPolarHBondContact O-CG 3.48Å; V910-E914 PolarHBondContact O-N 2.67Å
915	K	41.7	Very low	50.7	Low	147 Å²	147	87.3 Å²	87.3	64%	0.639	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-7.2	-172.8	-75.9	-177.3	-170.9	117.4	0	116	R911 N912 L913	R911-K915 WeakPolarHBondContact O-CD 3.41Å; R911-K915 WeakPolarHBondContact O-CE 3.17Å; R911-K915 VanDerWaalsContact O-CG 3.32Å; R911-K915 WeakPolarHBondContact O-CG 3.14Å; R911-K915 PolarHBondContact O-NZ 3.32Å; N912-K915 PolarHBondContact O-N 3.42Å; N912-K915 PolarHBondContact OD1-NZ 3.33Å; L913-K915 PolarHBondContact O-N 2.83Å
916	T	46.7	Very low	52.4	Low	69 Å²	69	81.7 Å²	81.7	42%	0.423	42%	0.424	S	S	.	.	S	Bend	trans	-115.2	134.4	177.4	57.3	0	0	0	0	111.1	T918 A919	T916-T918 PolarHBondContact O-N 3.31Å; T916-T918 VanDerWaalsContact O-N 3.09Å; T916-A919 PolarHBondContact O-N 3.05Å
917	N	44.2	Very low	54	Low	143 Å²	143	77.2 Å²	77.2	77%	0.765	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-57.4	-27.7	179.8	-82.2	-33.3	0	0	0	112.7	A919 L920	N917-A919 VanDerWaalsContact C-N 3.3Å; N917-A919 PolarHBondContact O-N 2.96Å; N917-L920 PolarHBondContact O-N 2.98Å
918	T	52.9	Low	55.9	Low	15 Å²	15	80.5 Å²	80.5	9%	0.092	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-63.6	-30.8	177.3	-32.2	0	0	0	0	112.9	T916 E950 L951 V954	T916-T918 PolarHBondContact O-N 3.31Å; T916-T918 VanDerWaalsContact O-N 3.09Å; T918-E950 WeakPolarHBondContact CB-OE1 3.42Å; T918-E950 HydrophobicContact CG2-CG 4.33Å; T918-E950 PolarHBondContact OG1-OE1 3.4Å; T918-L951 HydrophobicContact CG2-CD2 3.7Å; T918-L951 HydrophobicContact CG2-CG 4.31Å; T918-V954 HydrophobicContact CG2-CG2 4.11Å
919	A	51.4	Low	57.6	Low	32 Å²	32	80.8 Å²	80.8	26%	0.264	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-83	-16.5	-177.5	0	0	0	0	0	114.1	L913 T916 N917 M921	L913-A919 WeakPolarHBondContact O-CB 3.37Å; T916-A919 PolarHBondContact O-N 3.05Å; N917-A919 VanDerWaalsContact C-N 3.3Å; N917-A919 PolarHBondContact O-N 2.96Å; A919-M921 VanDerWaalsContact C-N 3.32Å
920	L	51.9	Low	59.4	Low	131 Å²	131	78.1 Å²	78.1	69%	0.686	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-84.8	-4.6	175.8	-70.2	172.1	0	0	0	113.3	N917	N917-L920 PolarHBondContact O-N 2.98Å
921	M	58.9	Low	61.3	Low	38 Å²	38	82 Å²	82	19%	0.187	42%	0.416	C	S	.	.	S	Bend	trans	-72.3	135.6	175.9	-65.1	-177.4	68.8	0	0	110.8	A919 A925 V926 E929 L951	A919-M921 VanDerWaalsContact C-N 3.32Å; M921-A925 HydrophobicContact CB-CB 4.47Å; M921-A925 HydrophobicContact CE-CB 4.05Å; M921-A925 WeakPolarHBondContact CE-O 3.25Å; M921-V926 HydrophobicContact CB-CG2 3.5Å; M921-E929 HydrophobicContact CE-CB 4.17Å; M921-E929 VanDerWaalsContact CE-OE2 3.3Å; M921-E929 WeakPolarHBondContact CE-OE2 3.07Å; M921-L951 HydrophobicContact SD-CD2 4.08Å
922	S	66.8	Low	63.3	Low	64 Å²	64	84.5 Å²	84.5	45%	0.448	43%	0.425	S	S	.	.			trans	-63.7	153.3	172.2	68.6	0	0	0	0	110.5	E924 A925 V926	S922-E924 PolarHBondContact O-N 2.99Å; S922-E924 VanDerWaalsContact O-N 3.09Å; S922-A925 PolarHBondContact O-N 3.49Å; S922-A925 WeakPolarHBondContact OG-CB 3.49Å; S922-A925 PolarHBondContact OG-N 2.86Å; S922-V926 WeakPolarHBondContact O-CG2 3.44Å; S922-V926 PolarHBondContact O-N 3.33Å
923	Y	67.4	Low	65.3	Low	82 Å²	82	80.5 Å²	80.5	32%	0.322	40%	0.404	S	S	.	.	H	α-helix	trans	-52.2	-34.1	176.8	-176.8	-92.9	0	0	0	112.5	N927	Y923-N927 WeakPolarHBondContact CE1-ND2 3.49Å; Y923-N927 VanDerWaalsContact O-CG 3.22Å; Y923-N927 PolarHBondContact O-N 2.95Å; Y923-N927 PolarHBondContact O-ND2 3.43Å; Y923-N927 VanDerWaalsContact O-ND2 3.15Å
924	E	68.8	Low	67.2	Low	145 Å²	145	79.4 Å²	79.4	68%	0.678	40%	0.398	S	S	*	.	H	α-helix	trans	-69.3	-48.9	174.9	-67.3	164	166.2	0	0	111.5	S922 V926 N927 E928	S922-E924 PolarHBondContact O-N 2.99Å; S922-E924 VanDerWaalsContact O-N 3.09Å; E924-V926 VanDerWaalsContact C-N 3.34Å; E924-V926 PolarHBondContact O-N 3.06Å; E924-N927 PolarHBondContact O-N 3.07Å; E924-E928 PolarHBondContact O-N 3.07Å
925	A	74	Confident	69.3	Low	31 Å²	31	78 Å²	78	26%	0.256	41%	0.406	S	S	.	.	H	α-helix	trans	-65.3	-33.4	178.4	0	0	0	0	0	113.4	M921 S922 E929	M921-A925 HydrophobicContact CB-CB 4.47Å; M921-A925 HydrophobicContact CE-CB 4.05Å; M921-A925 WeakPolarHBondContact CE-O 3.25Å; S922-A925 PolarHBondContact O-N 3.49Å; S922-A925 WeakPolarHBondContact OG-CB 3.49Å; S922-A925 PolarHBondContact OG-N 2.86Å; A925-E929 PolarHBondContact O-N 3.37Å; A925-E929 VanDerWaalsContact O-N 3.08Å
926	V	77.8	Confident	71.2	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-63.7	-43	173.4	174	0	0	0	0	110.6	M921 S922 E924 L930 L951 V954 V955	M921-V926 HydrophobicContact CB-CG2 3.5Å; S922-V926 WeakPolarHBondContact O-CG2 3.44Å; S922-V926 PolarHBondContact O-N 3.33Å; E924-V926 VanDerWaalsContact C-N 3.34Å; E924-V926 PolarHBondContact O-N 3.06Å; V926-L930 HydrophobicContact CG1-CD1 4.21Å; V926-L930 WeakPolarHBondContact O-CB 3.35Å; V926-L930 WeakPolarHBondContact O-CG 3.44Å; V926-L930 PolarHBondContact O-N 2.96Å; V926-L951 HydrophobicContact CG1-CB 4.39Å; V926-L951 HydrophobicContact CG1-CD2 4.01Å; V926-L951 HydrophobicContact CG2-CD2 4.42Å; V926-V954 HydrophobicContact CG2-CG1 4.29Å; V926-V955 HydrophobicContact CG1-CG2 3.4Å; V926-V955 VanDerWaalsContact CG1-CG2 3.4Å
927	N	79.1	Confident	72.6	Confident	47 Å²	47	78.3 Å²	78.3	25%	0.251	40%	0.404	S	S	.	.	H	α-helix	trans	-70.9	-43.5	178	-66.6	-21	0	0	0	111.8	Y923 E924 E929 L930 D931	Y923-N927 WeakPolarHBondContact CE1-ND2 3.49Å; Y923-N927 VanDerWaalsContact O-CG 3.22Å; Y923-N927 PolarHBondContact O-N 2.95Å; Y923-N927 PolarHBondContact O-ND2 3.43Å; Y923-N927 VanDerWaalsContact O-ND2 3.15Å; E924-N927 PolarHBondContact O-N 3.07Å; N927-E929 VanDerWaalsContact C-N 3.26Å; N927-E929 PolarHBondContact O-N 3.42Å; N927-L930 PolarHBondContact O-N 3.03Å; N927-L930 VanDerWaalsContact O-N 3.16Å; N927-D931 PolarHBondContact O-N 3.16Å
928	E	81.4	Confident	73.9	Confident	143 Å²	143	79.5 Å²	79.5	67%	0.668	41%	0.41	S	S	*	.	H	α-helix	trans	-57.2	-39.1	175.1	-76.2	-171.9	173.2	0	0	112.2	E924 R932	E924-E928 PolarHBondContact O-N 3.07Å; E928-R932 WeakPolarHBondContact O-CB 3.37Å; E928-R932 PolarHBondContact O-N 2.96Å; E928-R932 VanDerWaalsContact O-N 3.08Å
929	E	79.8	Confident	75.4	Confident	54 Å²	54	84.1 Å²	84.1	25%	0.252	44%	0.439	S	S	.	.	H	α-helix	trans	-79.6	-27.7	178.3	-165	152.9	-146.5	0	0	113.1	M921 A925 N927 L933 R947 L951	M921-E929 HydrophobicContact CE-CB 4.17Å; M921-E929 VanDerWaalsContact CE-OE2 3.3Å; M921-E929 WeakPolarHBondContact CE-OE2 3.07Å; A925-E929 PolarHBondContact O-N 3.37Å; A925-E929 VanDerWaalsContact O-N 3.08Å; N927-E929 VanDerWaalsContact C-N 3.26Å; N927-E929 PolarHBondContact O-N 3.42Å; E929-L933 HydrophobicContact CG-CD1 4.41Å; E929-L933 WeakPolarHBondContact O-CB 3.39Å; E929-L933 WeakPolarHBondContact O-CG 3.42Å; E929-L933 PolarHBondContact O-N 3.04Å; E929-L933 VanDerWaalsContact O-N 3.14Å; E929-R947 VanDerWaalsContact CD-NH2 3.35Å; E929-R947 IonicContact OE1-CZ 3.69Å; E929-R947 IonicContact OE1-NH1 2.73Å; E929-R947 PolarHBondContact OE1-NH1 3.44Å; E929-R947 IonicContact OE1-NH2 3.69Å; E929-R947 IonicContact OE2-CZ 3.17Å; E929-R947 IonicContact OE2-NH1 3.72Å; E929-R947 PolarHBondContact OE2-NH1 3.29Å; E929-R947 IonicContact OE2-NH2 2.75Å; E929-R947 PolarHBondContact OE2-NH2 3.4Å; E929-L951 HydrophobicContact CB-CD1 4.26Å; E929-L951 HydrophobicContact CG-CD1 4.12Å
930	L	84.9	Confident	77.1	Confident	16 Å²	16	83.6 Å²	83.6	8%	0.084	43%	0.431	C	S	.	.	H	α-helix	trans	-63.6	-51.7	166.5	-81.2	168.6	0	0	0	111.5	V926 N927 R932 L933 D934 Y948 L951 L952 V955	V926-L930 HydrophobicContact CG1-CD1 4.21Å; V926-L930 WeakPolarHBondContact O-CB 3.35Å; V926-L930 WeakPolarHBondContact O-CG 3.44Å; V926-L930 PolarHBondContact O-N 2.96Å; N927-L930 PolarHBondContact O-N 3.03Å; N927-L930 VanDerWaalsContact O-N 3.16Å; L930-R932 VanDerWaalsContact C-N 3.26Å; L930-R932 PolarHBondContact O-N 3.48Å; L930-L933 CarbonylContact O-C 2.94Å; L930-L933 PolarHBondContact O-N 3.4Å; L930-L933 VanDerWaalsContact O-N 3.07Å; L930-D934 WeakPolarHBondContact O-CB 3.32Å; L930-D934 PolarHBondContact O-N 3.39Å; L930-Y948 HydrophobicContact CD2-CD2 3.74Å; L930-Y948 HydrophobicContact CD2-CE2 3.96Å; L930-Y948 HydrophobicContact CD2-CG 4.26Å; L930-L951 HydrophobicContact CD1-CB 4.23Å; L930-L951 HydrophobicContact CD2-CB 3.66Å; L930-L951 HydrophobicContact CD2-CD1 4.47Å; L930-L951 HydrophobicContact CG-CB 3.78Å; L930-L951 HydrophobicContact CG-CD1 4.42Å; L930-L952 HydrophobicContact CD1-CD2 4.18Å; L930-L952 HydrophobicContact CD2-CD2 4Å; L930-L952 HydrophobicContact CD2-CG 3.9Å; L930-V955 HydrophobicContact CD1-CG2 3.61Å
931	D	84.9	Confident	78.8	Confident	117 Å²	117	81.1 Å²	81.1	63%	0.626	42%	0.422	S	S	*	.	H	α-helix	trans	-57.6	-40.9	178.3	-72.5	-19.2	0	0	0	111.4	N927 L933 D934 A935	N927-D931 PolarHBondContact O-N 3.16Å; D931-L933 VanDerWaalsContact C-N 3.29Å; D931-L933 PolarHBondContact O-N 2.76Å; D931-D934 PolarHBondContact O-N 3.01Å; D931-A935 WeakPolarHBondContact O-CB 3.27Å; D931-A935 PolarHBondContact O-N 3.43Å
932	R	87.1	Confident	79.9	Confident	191 Å²	191	85.6 Å²	85.6	72%	0.721	45%	0.445	S	S	*	.	H	α-helix	trans	-69.4	-23.6	179	-167.3	175.3	-164.5	151	4.5	113.9	E928 L930	E928-R932 WeakPolarHBondContact O-CB 3.37Å; E928-R932 PolarHBondContact O-N 2.96Å; E928-R932 VanDerWaalsContact O-N 3.08Å; L930-R932 VanDerWaalsContact C-N 3.26Å; L930-R932 PolarHBondContact O-N 3.48Å
933	L	85.4	Confident	80.2	Confident	11 Å²	11	87.4 Å²	87.4	6%	0.058	45%	0.449	C	S	.	.	H	α-helix	trans	-88.4	-39.7	172.8	-73.5	175.2	0	0	0	111.4	E929 L930 D931 A935 K936 M940 E944 Y948 L951	E929-L933 HydrophobicContact CG-CD1 4.41Å; E929-L933 WeakPolarHBondContact O-CB 3.39Å; E929-L933 WeakPolarHBondContact O-CG 3.42Å; E929-L933 PolarHBondContact O-N 3.04Å; E929-L933 VanDerWaalsContact O-N 3.14Å; L930-L933 CarbonylContact O-C 2.94Å; L930-L933 PolarHBondContact O-N 3.4Å; L930-L933 VanDerWaalsContact O-N 3.07Å; D931-L933 VanDerWaalsContact C-N 3.29Å; D931-L933 PolarHBondContact O-N 2.76Å; L933-A935 VanDerWaalsContact C-N 3.3Å; L933-A935 PolarHBondContact O-N 3.13Å; L933-K936 WeakPolarHBondContact O-CB 3.44Å; L933-K936 PolarHBondContact O-N 3.23Å; L933-M940 HydrophobicContact CB-SD 3.84Å; L933-M940 HydrophobicContact CD2-SD 4.01Å; L933-M940 HydrophobicContact CG-SD 4.41Å; L933-E944 HydrophobicContact CD2-CB 3.95Å; L933-E944 HydrophobicContact CD2-CG 4.07Å; L933-Y948 HydrophobicContact CB-CD2 3.78Å; L933-L951 HydrophobicContact CD1-CD1 4Å
934	D	84.9	Confident	80.9	Confident	76 Å²	76	85.7 Å²	85.7	41%	0.406	44%	0.444	S	S	.	.	H	α-helix	trans	-60.8	-39.7	176.5	-154.8	74.3	0	0	0	111.6	L930 D931 K936 Q937 Y948	L930-D934 WeakPolarHBondContact O-CB 3.32Å; L930-D934 PolarHBondContact O-N 3.39Å; D931-D934 PolarHBondContact O-N 3.01Å; D934-K936 PolarHBondContact O-N 3.45Å; D934-Q937 WeakPolarHBondContact O-CG 3.43Å; D934-Q937 PolarHBondContact O-N 3.41Å; D934-Y948 HydrophobicContact CB-CE2 4Å; D934-Y948 PolarHBondContact OD1-OH 3.26Å
935	A	84.4	Confident	81.6	Confident	85 Å²	85	82.2 Å²	82.2	70%	0.702	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-15.1	173.3	0	0	0	0	0	114.6	D931 L933	D931-A935 WeakPolarHBondContact O-CB 3.27Å; D931-A935 PolarHBondContact O-N 3.43Å; L933-A935 VanDerWaalsContact C-N 3.3Å; L933-A935 PolarHBondContact O-N 3.13Å
936	K	81.3	Confident	81.9	Confident	82 Å²	82	88 Å²	88	36%	0.357	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-21.2	173.9	-60	-170.2	176.9	-168.4	0	113.4	L933 D934 N938 T939 M940 E944	L933-K936 WeakPolarHBondContact O-CB 3.44Å; L933-K936 PolarHBondContact O-N 3.23Å; D934-K936 PolarHBondContact O-N 3.45Å; K936-N938 PolarHBondContact O-N 3.01Å; K936-T939 WeakPolarHBondContact O-CB 3.35Å; K936-T939 PolarHBondContact O-N 3Å; K936-T939 PolarHBondContact O-OG1 3Å; K936-M940 HydrophobicContact CB-CB 4.14Å; K936-E944 IonicContact NZ-OE1 2.69Å; K936-E944 PolarHBondContact NZ-OE1 3.22Å; K936-E944 IonicContact NZ-OE2 3.5Å
937	Q	76.8	Confident	81.8	Confident	142 Å²	142	92.5 Å²	92.5	66%	0.664	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	40.9	-120.8	-177	-59.3	-171.4	-18	0	0	112.2	D934 T939 M940	D934-Q937 WeakPolarHBondContact O-CG 3.43Å; D934-Q937 PolarHBondContact O-N 3.41Å; Q937-T939 PolarHBondContact O-N 2.95Å; Q937-T939 VanDerWaalsContact O-N 3.12Å; Q937-M940 WeakPolarHBondContact O-CB 3.49Å; Q937-M940 PolarHBondContact O-N 3.47Å
938	N	71.9	Confident	82.1	Confident	167 Å²	167	92.9 Å²	92.9	89%	0.893	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-70.1	-4.3	-177	-65.9	1	0	0	0	114.8	K936	K936-N938 PolarHBondContact O-N 3.01Å
939	T	84.8	Confident	82.2	Confident	112 Å²	112	93.6 Å²	93.6	69%	0.687	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-92.7	-3.3	176.1	68.8	0	0	0	0	113.7	K936 Q937 T941	K936-T939 WeakPolarHBondContact O-CB 3.35Å; K936-T939 PolarHBondContact O-N 3Å; K936-T939 PolarHBondContact O-OG1 3Å; Q937-T939 PolarHBondContact O-N 2.95Å; Q937-T939 VanDerWaalsContact O-N 3.12Å; T939-T941 PolarHBondContact O-N 3.25Å
940	M	86.4	Confident	82.2	Confident	22 Å²	22	94.9 Å²	94.9	11%	0.108	46%	0.461	C	S	.	.			trans	-68.9	126.6	-177.5	-171.7	161	46.6	0	0	112.1	L933 K936 Q937 E944 Q945 Y948	L933-M940 HydrophobicContact CB-SD 3.84Å; L933-M940 HydrophobicContact CD2-SD 4.01Å; L933-M940 HydrophobicContact CG-SD 4.41Å; K936-M940 HydrophobicContact CB-CB 4.14Å; Q937-M940 WeakPolarHBondContact O-CB 3.49Å; Q937-M940 PolarHBondContact O-N 3.47Å; M940-E944 HydrophobicContact CG-CB 3.33Å; M940-E944 HydrophobicContact CG-CG 4.5Å; M940-E944 HydrophobicContact SD-CB 3.96Å; M940-Q945 HydrophobicContact CB-CG 4.17Å; M940-Q945 HydrophobicContact CE-CG 4.06Å; M940-Q945 HydrophobicContact CG-CG 3.92Å; M940-Q945 PolarHBondContact O-NE2 3Å; M940-Y948 HydrophobicContact CE-CD1 4.33Å; M940-Y948 HydrophobicContact CE-CD2 4.21Å; M940-Y948 HydrophobicContact CE-CG 3.95Å; M940-Y948 HydrophobicContact SD-CG 4.42Å
941	T	88.9	Confident	82	Confident	79 Å²	79	94.1 Å²	94.1	49%	0.485	46%	0.457	S	S	.	.			trans	-69.3	165.5	-178.4	62.9	0	0	0	0	112.6	T939 D943 E944 Q945	T939-T941 PolarHBondContact O-N 3.25Å; T941-D943 VanDerWaalsContact C-N 3.31Å; T941-D943 PolarHBondContact O-N 2.72Å; T941-E944 WeakPolarHBondContact CB-OE2 3.09Å; T941-E944 WeakPolarHBondContact CG2-OE2 3.32Å; T941-E944 PolarHBondContact N-OE2 3.12Å; T941-E944 PolarHBondContact O-N 2.99Å; T941-E944 VanDerWaalsContact OG1-CD 3.22Å; T941-E944 VanDerWaalsContact OG1-CG 3.23Å; T941-E944 WeakPolarHBondContact OG1-CG 3.31Å; T941-E944 PolarHBondContact OG1-OE2 3.4Å; T941-Q945 WeakPolarHBondContact O-CB 3.23Å; T941-Q945 WeakPolarHBondContact O-CG 3.47Å; T941-Q945 PolarHBondContact O-N 3.46Å
942	I	81.4	Confident	81.8	Confident	132 Å²	132	92.3 Å²	92.3	68%	0.677	45%	0.447	S	S	*	.	H	α-helix	trans	-59.3	-39.3	-174.8	-63.4	174.8	0	0	0	112.4	R946	I942-R946 PolarHBondContact O-N 3.23Å
943	D	73.3	Confident	81.4	Confident	101 Å²	101	88.7 Å²	88.7	54%	0.54	44%	0.442	S	S	.	.	H	α-helix	trans	-78.5	-30.2	179.5	-63.3	-50.3	0	0	0	112.7	T941 R946 R947	T941-D943 VanDerWaalsContact C-N 3.31Å; T941-D943 PolarHBondContact O-N 2.72Å; D943-R946 WeakPolarHBondContact O-CB 3.33Å; D943-R946 PolarHBondContact O-N 3.41Å; D943-R946 IonicContact OD1-CZ 3.31Å; D943-R946 IonicContact OD1-NE 3.68Å; D943-R946 IonicContact OD1-NH2 3.9Å; D943-R946 PolarHBondContact OD1-NH2 3.26Å; D943-R947 WeakPolarHBondContact O-CB 3.33Å; D943-R947 PolarHBondContact O-N 3.06Å
944	E	82.1	Confident	80.9	Confident	46 Å²	46	89.2 Å²	89.2	22%	0.215	45%	0.446	C	S	.	.	H	α-helix	trans	-68.1	-40.5	168.8	-69.6	172.4	131	0	0	111.7	L933 K936 M940 T941 R946 R947 Y948	L933-E944 HydrophobicContact CD2-CB 3.95Å; L933-E944 HydrophobicContact CD2-CG 4.07Å; K936-E944 IonicContact NZ-OE1 2.69Å; K936-E944 PolarHBondContact NZ-OE1 3.22Å; K936-E944 IonicContact NZ-OE2 3.5Å; M940-E944 HydrophobicContact CG-CB 3.33Å; M940-E944 HydrophobicContact CG-CG 4.5Å; M940-E944 HydrophobicContact SD-CB 3.96Å; T941-E944 WeakPolarHBondContact CB-OE2 3.09Å; T941-E944 WeakPolarHBondContact CG2-OE2 3.32Å; T941-E944 PolarHBondContact N-OE2 3.12Å; T941-E944 PolarHBondContact O-N 2.99Å; T941-E944 VanDerWaalsContact OG1-CD 3.22Å; T941-E944 VanDerWaalsContact OG1-CG 3.23Å; T941-E944 WeakPolarHBondContact OG1-CG 3.31Å; T941-E944 PolarHBondContact OG1-OE2 3.4Å; E944-R946 PolarHBondContact O-N 3.46Å; E944-R947 PolarHBondContact O-N 2.99Å; E944-Y948 WeakPolarHBondContact O-CB 3.37Å; E944-Y948 PolarHBondContact O-N 2.97Å
945	Q	82.3	Confident	80.5	Confident	72 Å²	72	86.9 Å²	86.9	34%	0.336	43%	0.434	S	S	.	.	H	α-helix	trans	-62.1	-33.4	172.2	-72.1	-180	33	0	0	111.9	M940 T941 R949	M940-Q945 HydrophobicContact CB-CG 4.17Å; M940-Q945 HydrophobicContact CE-CG 4.06Å; M940-Q945 HydrophobicContact CG-CG 3.92Å; M940-Q945 PolarHBondContact O-NE2 3Å; T941-Q945 WeakPolarHBondContact O-CB 3.23Å; T941-Q945 WeakPolarHBondContact O-CG 3.47Å; T941-Q945 PolarHBondContact O-N 3.46Å; Q945-R949 WeakPolarHBondContact O-CG 3.31Å; Q945-R949 PolarHBondContact O-N 3.31Å; Q945-R949 PolarHBondContact O-NE 3.46Å
946	R	80.7	Confident	80	Confident	153 Å²	153	84.6 Å²	84.6	58%	0.577	42%	0.415	S	S	*	.	H	α-helix	trans	-66.2	-50	172.2	-165.6	-167.1	-48.6	-147.7	8.6	110.4	I942 D943 E944 Y948 R949 E950	I942-R946 PolarHBondContact O-N 3.23Å; D943-R946 WeakPolarHBondContact O-CB 3.33Å; D943-R946 PolarHBondContact O-N 3.41Å; D943-R946 IonicContact OD1-CZ 3.31Å; D943-R946 IonicContact OD1-NE 3.68Å; D943-R946 IonicContact OD1-NH2 3.9Å; D943-R946 PolarHBondContact OD1-NH2 3.26Å; E944-R946 PolarHBondContact O-N 3.46Å; R946-Y948 PolarHBondContact O-N 2.92Å; R946-R949 PolarHBondContact O-N 2.72Å; R946-E950 PolarHBondContact O-N 2.99Å
947	R	76.5	Confident	79.4	Confident	94 Å²	94	85.7 Å²	85.7	36%	0.355	42%	0.421	S	S	.	.	H	α-helix	trans	-67	-34.7	-177.3	-166.8	159.6	178.8	-108	-13.1	113.2	E929 D943 E944 E950 L951	E929-R947 VanDerWaalsContact CD-NH2 3.35Å; E929-R947 IonicContact OE1-CZ 3.69Å; E929-R947 IonicContact OE1-NH1 2.73Å; E929-R947 PolarHBondContact OE1-NH1 3.44Å; E929-R947 IonicContact OE1-NH2 3.69Å; E929-R947 IonicContact OE2-CZ 3.17Å; E929-R947 IonicContact OE2-NH1 3.72Å; E929-R947 PolarHBondContact OE2-NH1 3.29Å; E929-R947 IonicContact OE2-NH2 2.75Å; E929-R947 PolarHBondContact OE2-NH2 3.4Å; D943-R947 WeakPolarHBondContact O-CB 3.33Å; D943-R947 PolarHBondContact O-N 3.06Å; E944-R947 PolarHBondContact O-N 2.99Å; R947-E950 WeakPolarHBondContact O-CB 3.21Å; R947-E950 PolarHBondContact O-N 3.42Å; R947-L951 HydrophobicContact CG-CD1 4.34Å; R947-L951 VanDerWaalsContact O-CG 3.32Å; R947-L951 WeakPolarHBondContact O-CG 3.09Å; R947-L951 PolarHBondContact O-N 3.09Å
948	Y	85.7	Confident	78.8	Confident	56 Å²	56	81.2 Å²	81.2	22%	0.22	40%	0.401	C	S	.	.	H	α-helix	trans	-60.3	-46	170.9	-179.8	-92.4	0	0	0	111.8	L930 L933 D934 M940 E944 R946 E950 L951 L952	L930-Y948 HydrophobicContact CD2-CD2 3.74Å; L930-Y948 HydrophobicContact CD2-CE2 3.96Å; L930-Y948 HydrophobicContact CD2-CG 4.26Å; L933-Y948 HydrophobicContact CB-CD2 3.78Å; D934-Y948 HydrophobicContact CB-CE2 4Å; D934-Y948 PolarHBondContact OD1-OH 3.26Å; M940-Y948 HydrophobicContact CE-CD1 4.33Å; M940-Y948 HydrophobicContact CE-CD2 4.21Å; M940-Y948 HydrophobicContact CE-CG 3.95Å; M940-Y948 HydrophobicContact SD-CG 4.42Å; E944-Y948 WeakPolarHBondContact O-CB 3.37Å; E944-Y948 PolarHBondContact O-N 2.97Å; R946-Y948 PolarHBondContact O-N 2.92Å; Y948-E950 VanDerWaalsContact C-N 3.32Å; Y948-E950 PolarHBondContact O-N 3.35Å; Y948-L951 PolarHBondContact O-N 3.1Å; Y948-L952 HydrophobicContact CD1-CD1 3.87Å; Y948-L952 HydrophobicContact CD1-CG 4.48Å; Y948-L952 HydrophobicContact CE1-CD1 3.5Å; Y948-L952 HydrophobicContact CE1-CG 4.29Å; Y948-L952 WeakPolarHBondContact O-CG 2.94Å; Y948-L952 PolarHBondContact O-N 3.4Å
949	R	83.4	Confident	78.6	Confident	158 Å²	158	75.9 Å²	75.9	60%	0.596	38%	0.376	S	S	*	.	H	α-helix	trans	-65.2	-35.1	174.7	-65.1	172.7	-150.9	169.1	8.1	112.5	Q945 R946 N953	Q945-R949 WeakPolarHBondContact O-CG 3.31Å; Q945-R949 PolarHBondContact O-N 3.31Å; Q945-R949 PolarHBondContact O-NE 3.46Å; R946-R949 PolarHBondContact O-N 2.72Å; R949-N953 PolarHBondContact O-N 3.21Å
950	E	78.9	Confident	77.6	Confident	80 Å²	80	78.2 Å²	78.2	37%	0.374	37%	0.372	S	S	.	.	H	α-helix	trans	-65.2	-48.3	176.2	-162.6	-177.2	136.5	0	0	111.3	T918 R946 R947 Y948 L952 N953 V954	T918-E950 WeakPolarHBondContact CB-OE1 3.42Å; T918-E950 HydrophobicContact CG2-CG 4.33Å; T918-E950 PolarHBondContact OG1-OE1 3.4Å; R946-E950 PolarHBondContact O-N 2.99Å; R947-E950 WeakPolarHBondContact O-CB 3.21Å; R947-E950 PolarHBondContact O-N 3.42Å; Y948-E950 VanDerWaalsContact C-N 3.32Å; Y948-E950 PolarHBondContact O-N 3.35Å; E950-L952 PolarHBondContact O-N 3.49Å; E950-N953 WeakPolarHBondContact O-CB 3.32Å; E950-N953 PolarHBondContact O-N 3.14Å; E950-N953 VanDerWaalsContact O-N 3.15Å; E950-V954 PolarHBondContact O-N 3.46Å
951	L	81.4	Confident	76.2	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-61.7	-40.5	176	-70.1	164.8	0	0	0	112.1	T918 M921 V926 E929 L930 L933 R947 Y948 N953 V954 V955	T918-L951 HydrophobicContact CG2-CD2 3.7Å; T918-L951 HydrophobicContact CG2-CG 4.31Å; M921-L951 HydrophobicContact SD-CD2 4.08Å; V926-L951 HydrophobicContact CG1-CB 4.39Å; V926-L951 HydrophobicContact CG1-CD2 4.01Å; V926-L951 HydrophobicContact CG2-CD2 4.42Å; E929-L951 HydrophobicContact CB-CD1 4.26Å; E929-L951 HydrophobicContact CG-CD1 4.12Å; L930-L951 HydrophobicContact CD1-CB 4.23Å; L930-L951 HydrophobicContact CD2-CB 3.66Å; L930-L951 HydrophobicContact CD2-CD1 4.47Å; L930-L951 HydrophobicContact CG-CB 3.78Å; L930-L951 HydrophobicContact CG-CD1 4.42Å; L933-L951 HydrophobicContact CD1-CD1 4Å; R947-L951 HydrophobicContact CG-CD1 4.34Å; R947-L951 VanDerWaalsContact O-CG 3.32Å; R947-L951 WeakPolarHBondContact O-CG 3.09Å; R947-L951 PolarHBondContact O-N 3.09Å; Y948-L951 PolarHBondContact O-N 3.1Å; L951-N953 VanDerWaalsContact C-N 3.3Å; L951-N953 PolarHBondContact O-N 3.2Å; L951-V954 PolarHBondContact O-N 2.92Å; L951-V954 VanDerWaalsContact O-N 3.12Å; L951-V955 WeakPolarHBondContact O-CG2 3.38Å; L951-V955 PolarHBondContact O-N 2.85Å
952	L	80.7	Confident	74.7	Confident	80 Å²	80	82.5 Å²	82.5	42%	0.419	39%	0.389	S	S	.	.	H	α-helix	trans	-59.4	-38.5	173.6	-75.9	176.8	0	0	0	112.7	L930 Y948 E950 A956	L930-L952 HydrophobicContact CD1-CD2 4.18Å; L930-L952 HydrophobicContact CD2-CD2 4Å; L930-L952 HydrophobicContact CD2-CG 3.9Å; Y948-L952 HydrophobicContact CD1-CD1 3.87Å; Y948-L952 HydrophobicContact CD1-CG 4.48Å; Y948-L952 HydrophobicContact CE1-CD1 3.5Å; Y948-L952 HydrophobicContact CE1-CG 4.29Å; Y948-L952 WeakPolarHBondContact O-CG 2.94Å; Y948-L952 PolarHBondContact O-N 3.4Å; E950-L952 PolarHBondContact O-N 3.49Å; L952-A956 PolarHBondContact O-N 3.02Å; L952-A956 VanDerWaalsContact O-N 3.09Å
953	N	78.3	Confident	73.4	Confident	115 Å²	115	82.3 Å²	82.3	62%	0.615	38%	0.383	S	S	*	.	H	α-helix	trans	-66	-42.2	173.4	-106.6	0.7	0	0	0	111.5	R949 E950 L951 V955 A956 E957	R949-N953 PolarHBondContact O-N 3.21Å; E950-N953 WeakPolarHBondContact O-CB 3.32Å; E950-N953 PolarHBondContact O-N 3.14Å; E950-N953 VanDerWaalsContact O-N 3.15Å; L951-N953 VanDerWaalsContact C-N 3.3Å; L951-N953 PolarHBondContact O-N 3.2Å; N953-V955 PolarHBondContact O-N 3Å; N953-A956 WeakPolarHBondContact O-CB 3.32Å; N953-A956 PolarHBondContact O-N 2.82Å; N953-A956 VanDerWaalsContact O-N 3.16Å; N953-E957 PolarHBondContact O-N 2.99Å
954	V	75.8	Confident	72.3	Confident	22 Å²	22	82.3 Å²	82.3	13%	0.133	38%	0.382	C	S	.	.	H	α-helix	trans	-60.8	-42.8	176.1	174.1	0	0	0	0	111.4	T918 V926 E950 L951 A956 E957 Q958	T918-V954 HydrophobicContact CG2-CG2 4.11Å; V926-V954 HydrophobicContact CG2-CG1 4.29Å; E950-V954 PolarHBondContact O-N 3.46Å; L951-V954 PolarHBondContact O-N 2.92Å; L951-V954 VanDerWaalsContact O-N 3.12Å; V954-A956 VanDerWaalsContact C-N 3.33Å; V954-A956 PolarHBondContact O-N 3.44Å; V954-E957 PolarHBondContact O-N 2.82Å; V954-Q958 HydrophobicContact CG1-CG 4.25Å; V954-Q958 WeakPolarHBondContact O-CB 3.37Å; V954-Q958 WeakPolarHBondContact O-CG 3.17Å; V954-Q958 PolarHBondContact O-N 3.33Å
955	V	75.3	Confident	70.5	Confident	27 Å²	27	85.8 Å²	85.8	16%	0.164	40%	0.402	C	S	.	.	H	α-helix	trans	-60.5	-42.4	173.7	175.4	0	0	0	0	111.4	V926 L930 L951 N953 E957 S959	V926-V955 HydrophobicContact CG1-CG2 3.4Å; V926-V955 VanDerWaalsContact CG1-CG2 3.4Å; L930-V955 HydrophobicContact CD1-CG2 3.61Å; L951-V955 WeakPolarHBondContact O-CG2 3.38Å; L951-V955 PolarHBondContact O-N 2.85Å; N953-V955 PolarHBondContact O-N 3Å; V955-E957 PolarHBondContact O-N 2.85Å; V955-S959 VanDerWaalsContact O-CB 3.27Å; V955-S959 WeakPolarHBondContact O-CB 3.21Å; V955-S959 PolarHBondContact O-N 3.07Å; V955-S959 PolarHBondContact O-OG 3.03Å
956	A	74.1	Confident	68.6	Low	36 Å²	36	85.8 Å²	85.8	30%	0.298	41%	0.41	S	S	.	.	H	α-helix	trans	-63.8	-39.3	178.3	0	0	0	0	0	112.5	L952 N953 V954 R960	L952-A956 PolarHBondContact O-N 3.02Å; L952-A956 VanDerWaalsContact O-N 3.09Å; N953-A956 WeakPolarHBondContact O-CB 3.32Å; N953-A956 PolarHBondContact O-N 2.82Å; N953-A956 VanDerWaalsContact O-N 3.16Å; V954-A956 VanDerWaalsContact C-N 3.33Å; V954-A956 PolarHBondContact O-N 3.44Å; A956-R960 WeakPolarHBondContact O-CG 3.1Å; A956-R960 PolarHBondContact O-N 2.81Å; A956-R960 VanDerWaalsContact O-N 3.09Å
957	E	67.9	Low	66.9	Low	105 Å²	105	82.9 Å²	82.9	49%	0.491	40%	0.403	S	S	.	.	H	α-helix	trans	-73.5	-43.7	176.3	-66.8	-160.1	144.6	0	0	113	N953 V954 V955 S959 R960 A961	N953-E957 PolarHBondContact O-N 2.99Å; V954-E957 PolarHBondContact O-N 2.82Å; V955-E957 PolarHBondContact O-N 2.85Å; E957-S959 PolarHBondContact O-N 3Å; E957-R960 PolarHBondContact O-N 2.83Å; E957-R960 VanDerWaalsContact O-N 3.15Å; E957-A961 WeakPolarHBondContact O-CB 3.34Å; E957-A961 PolarHBondContact O-N 3.06Å
958	Q	65.6	Low	65.3	Low	49 Å²	49	84.5 Å²	84.5	23%	0.229	42%	0.417	C	S	.	.	H	α-helix	trans	-59.6	-34.3	173.7	-70.9	-173.9	7.8	0	0	111.6	V954 R962	V954-Q958 HydrophobicContact CG1-CG 4.25Å; V954-Q958 WeakPolarHBondContact O-CB 3.37Å; V954-Q958 WeakPolarHBondContact O-CG 3.17Å; V954-Q958 PolarHBondContact O-N 3.33Å; Q958-R962 WeakPolarHBondContact O-CB 3.36Å; Q958-R962 PolarHBondContact O-N 3.36Å
959	S	67	Low	62.9	Low	54 Å²	54	92.7 Å²	92.7	38%	0.378	45%	0.448	S	S	.	.	H	α-helix	trans	-68.2	-43.6	174.2	-60.1	0	0	0	0	112.7	V955 E957 R962 K963	V955-S959 VanDerWaalsContact O-CB 3.27Å; V955-S959 WeakPolarHBondContact O-CB 3.21Å; V955-S959 PolarHBondContact O-N 3.07Å; V955-S959 PolarHBondContact O-OG 3.03Å; E957-S959 PolarHBondContact O-N 3Å; S959-R962 PolarHBondContact O-N 3.4Å; S959-K963 PolarHBondContact O-N 2.86Å
960	R	64.9	Low	60.5	Low	162 Å²	162	88.7 Å²	88.7	61%	0.611	44%	0.444	S	S	*	.	H	α-helix	trans	-61.7	-44.3	173.8	-73.1	169.6	-178.1	150.3	1.3	111.7	A956 E957 K963 L964	A956-R960 WeakPolarHBondContact O-CG 3.1Å; A956-R960 PolarHBondContact O-N 2.81Å; A956-R960 VanDerWaalsContact O-N 3.09Å; E957-R960 PolarHBondContact O-N 2.83Å; E957-R960 VanDerWaalsContact O-N 3.15Å; R960-K963 PolarHBondContact O-N 2.72Å; R960-L964 PolarHBondContact O-N 2.91Å
961	A	55.4	Low	58.2	Low	48 Å²	48	90.3 Å²	90.3	40%	0.397	46%	0.461	S	S	.	.	H	α-helix	trans	-61.8	-43.9	177.5	0	0	0	0	0	111.8	E957 K963 L964 L965	E957-A961 WeakPolarHBondContact O-CB 3.34Å; E957-A961 PolarHBondContact O-N 3.06Å; A961-K963 PolarHBondContact O-N 3.17Å; A961-L964 PolarHBondContact O-N 2.92Å; A961-L965 WeakPolarHBondContact O-CB 3.35Å; A961-L965 VanDerWaalsContact O-CG 3.32Å; A961-L965 WeakPolarHBondContact O-CG 3.39Å; A961-L965 PolarHBondContact O-N 2.91Å
962	R	59.1	Low	55.8	Low	143 Å²	143	96.5 Å²	96.5	54%	0.54	50%	0.501	S	S	.	.	H	α-helix	trans	-61	-39.9	173.2	-83.2	-179.5	165.3	169.7	-3.4	112.8	Q958 S959 L965 S966	Q958-R962 WeakPolarHBondContact O-CB 3.36Å; Q958-R962 PolarHBondContact O-N 3.36Å; S959-R962 PolarHBondContact O-N 3.4Å; R962-L965 PolarHBondContact O-N 3.26Å; R962-S966 PolarHBondContact O-N 3.36Å
963	K	53.7	Low	53.3	Low	128 Å²	128	99.3 Å²	99.3	56%	0.557	52%	0.522	S	S	*	.	H	α-helix	trans	-62.2	-49.6	176.7	-165.4	177	-171.8	-87	0	111.6	S959 R960 A961 L965 S966 E967	S959-K963 PolarHBondContact O-N 2.86Å; R960-K963 PolarHBondContact O-N 2.72Å; A961-K963 PolarHBondContact O-N 3.17Å; K963-L965 VanDerWaalsContact C-N 3.33Å; K963-L965 PolarHBondContact O-N 3.31Å; K963-S966 PolarHBondContact O-N 2.89Å; K963-S966 PolarHBondContact O-OG 2.72Å; K963-E967 IonicContact NZ-OE1 3.24Å; K963-E967 PolarHBondContact NZ-OE1 3Å; K963-E967 WeakPolarHBondContact O-CG 3.47Å; K963-E967 PolarHBondContact O-N 3.09Å
964	L	49.3	Very low	51.1	Low	101 Å²	101	98.1 Å²	98.1	53%	0.529	52%	0.523	S	S	.	.	H	α-helix	trans	-59.2	-41.5	176.2	-73	165.9	0	0	0	112.3	R960 A961 S966 E967 I968	R960-L964 PolarHBondContact O-N 2.91Å; A961-L964 PolarHBondContact O-N 2.92Å; L964-S966 VanDerWaalsContact C-N 3.3Å; L964-S966 PolarHBondContact O-N 3.02Å; L964-E967 PolarHBondContact O-N 2.93Å; L964-I968 WeakPolarHBondContact O-CB 3.48Å; L964-I968 WeakPolarHBondContact O-CD1 3.38Å; L964-I968 VanDerWaalsContact O-CG1 3.24Å; L964-I968 WeakPolarHBondContact O-CG1 3.44Å; L964-I968 PolarHBondContact O-N 2.87Å
965	L	43.8	Very low	48.8	Very low	118 Å²	118	107.5 Å²	107.5	62%	0.618	56%	0.557	S	S	*	*	H	α-helix	trans	-65.8	-29.8	175.1	-72.9	168.6	0	0	0	113.2	A961 R962 K963 R969	A961-L965 WeakPolarHBondContact O-CB 3.35Å; A961-L965 VanDerWaalsContact O-CG 3.32Å; A961-L965 WeakPolarHBondContact O-CG 3.39Å; A961-L965 PolarHBondContact O-N 2.91Å; R962-L965 PolarHBondContact O-N 3.26Å; K963-L965 VanDerWaalsContact C-N 3.33Å; K963-L965 PolarHBondContact O-N 3.31Å; L965-R969 PolarHBondContact O-N 2.73Å
966	S	44.2	Very low	46.4	Very low	72 Å²	72	115.4 Å²	115.4	50%	0.503	59%	0.592	S	S	.	*	H	α-helix	trans	-72.9	-42.8	173.5	72	0	0	0	0	112	R962 K963 L964 I968 R969	R962-S966 PolarHBondContact O-N 3.36Å; K963-S966 PolarHBondContact O-N 2.89Å; K963-S966 PolarHBondContact O-OG 2.72Å; L964-S966 VanDerWaalsContact C-N 3.3Å; L964-S966 PolarHBondContact O-N 3.02Å; S966-I968 VanDerWaalsContact C-N 3.33Å; S966-I968 PolarHBondContact O-N 2.95Å; S966-R969 PolarHBondContact O-N 2.95Å
967	E	43.4	Very low	44.2	Very low	92 Å²	92	122.7 Å²	122.7	43%	0.43	62%	0.62	S	S	.	*	H	α-helix	trans	-61.7	-40.9	177.4	-70.3	166	-176.1	0	0	111.3	K963 L964 R969 S970	K963-E967 IonicContact NZ-OE1 3.24Å; K963-E967 PolarHBondContact NZ-OE1 3Å; K963-E967 WeakPolarHBondContact O-CG 3.47Å; K963-E967 PolarHBondContact O-N 3.09Å; L964-E967 PolarHBondContact O-N 2.93Å; E967-R969 PolarHBondContact O-N 2.96Å; E967-S970 WeakPolarHBondContact O-CB 3.3Å; E967-S970 PolarHBondContact O-N 3.48Å; E967-S970 PolarHBondContact O-OG 3.29Å
968	I	43.6	Very low	42.2	Very low	128 Å²	128	128.8 Å²	128.8	66%	0.656	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-22	175.2	-70	165.2	0	0	0	113	L964 S966 S970	L964-I968 WeakPolarHBondContact O-CB 3.48Å; L964-I968 WeakPolarHBondContact O-CD1 3.38Å; L964-I968 VanDerWaalsContact O-CG1 3.24Å; L964-I968 WeakPolarHBondContact O-CG1 3.44Å; L964-I968 PolarHBondContact O-N 2.87Å; S966-I968 VanDerWaalsContact C-N 3.33Å; S966-I968 PolarHBondContact O-N 2.95Å; I968-S970 VanDerWaalsContact C-N 3.3Å
969	R	35.1	Very low	40.3	Very low	229 Å²	229	135.8 Å²	135.8	86%	0.864	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-1.2	-178.9	-149.4	174.3	-173	-174.7	1.5	113.5	L965 S966 E967	L965-R969 PolarHBondContact O-N 2.73Å; S966-R969 PolarHBondContact O-N 2.95Å; E967-R969 PolarHBondContact O-N 2.96Å
970	S	33.8	Very low	38.4	Very low	74 Å²	74	139.7 Å²	139.7	52%	0.517	69%	0.687	S	S	.	*	S	Bend	trans	-84.7	137.1	178	-31.3	0	0	0	0	110.9	E967 I968	E967-S970 WeakPolarHBondContact O-CB 3.3Å; E967-S970 PolarHBondContact O-N 3.48Å; E967-S970 PolarHBondContact O-OG 3.29Å; I968-S970 VanDerWaalsContact C-N 3.3Å
971	P	29.9	Very low	36.5	Very low	113 Å²	113	138 Å²	138	73%	0.734	70%	0.697	S	S	*	*			trans	-69.3	145.3	169.1	30.6	-34	0	0	0	110.6	T973	P971-T973 PolarHBondContact O-N 3.29Å
972	P	31.4	Very low	35	Very low	130 Å²	130	143.6 Å²	143.6	84%	0.844	72%	0.718	S	S	*	*			trans	-79.3	105	-175.7	30.9	-34.4	0	0	0	112.1	S974	P972-S974 PolarHBondContact O-N 2.99Å
973	T	28.7	Very low	33.3	Very low	140 Å²	140	145.1 Å²	145.1	86%	0.859	73%	0.731	S	S	*	*			trans	-73.8	115.9	157.8	45.7	0	0	0	0	109.2	P971	P971-T973 PolarHBondContact O-N 3.29Å
974	S	30.2	Very low	31.8	Very low	90 Å²	90	143.3 Å²	143.3	63%	0.629	73%	0.731	S	S	*	*			trans	-76.2	167.7	177.6	51.6	0	0	0	0	112.8	P972	P972-S974 PolarHBondContact O-N 2.99Å
975	Y	28	Very low	30.5	Very low	218 Å²	218	146.1 Å²	146.1	86%	0.855	74%	0.741	S	S	*	*			trans	76.7	79.3	177.3	-49.6	-71.7	0	0	0	116.3
976	Q	26.4	Very low	29.7	Very low	193 Å²	193	148 Å²	148	90%	0.902	74%	0.744	S	S	*	*			trans	-111	130.6	131.1	-81.3	-174.1	-30.7	0	0	108.1
977	E	26.9	Very low	28.7	Very low	190 Å²	190	151.6 Å²	151.6	89%	0.888	75%	0.753	S	S	*	*			trans	-67.7	145.3	168.3	-68.5	176.2	108	0	0	109.6
978	R	26.6	Very low	27.9	Very low	232 Å²	232	155 Å²	155	88%	0.875	77%	0.769	S	S	*	*			trans	-101.7	103.4	169.3	-70.2	-173.8	-177.6	-174.8	1	108.7	I980	R978-I980 PolarHBondContact O-N 3.37Å
979	E	24.4	Very low	27	Very low	196 Å²	196	155.4 Å²	155.4	92%	0.916	77%	0.768	S	S	*	*			trans	-62.3	128.2	157.5	-66.8	-163.7	129.9	0	0	108.9
980	I	27.4	Very low	26.6	Very low	137 Å²	137	151.3 Å²	151.3	70%	0.703	76%	0.759	S	S	*	*			trans	-109.6	130.4	171.9	-62.7	177.6	0	0	0	106.4	R978 I982	R978-I980 PolarHBondContact O-N 3.37Å; I980-I982 PolarHBondContact O-N 2.85Å
981	P	25.3	Very low	26.3	Very low	126 Å²	126	154.9 Å²	154.9	82%	0.818	77%	0.767	S	S	*	*			trans	-62.6	127.8	-175.6	-22.2	33	0	0	0	112.3
982	I	23.3	Very low	26	Very low	165 Å²	165	157.9 Å²	157.9	85%	0.846	76%	0.764	S	S	*	*			trans	-86.2	125.4	173.2	-62.6	177.5	0	0	0	109.3	I980	I980-I982 PolarHBondContact O-N 2.85Å
983	H	24.3	Very low	25.7	Very low	175 Å²	175	160.1 Å²	160.1	81%	0.81	76%	0.756	S	S	*	*			trans	-130	90.1	169.7	-153.2	74.6	0	0	0	112.6
984	V	22.6	Very low	25.5	Very low	90 Å²	90	159.4 Å²	159.4	55%	0.545	74%	0.742	S	S	.	*			trans	52.8	113.7	140.1	-172.9	0	0	0	0	119.3
985	Q	21.7	Very low	25.2	Very low	161 Å²	161	160.7 Å²	160.7	75%	0.752	75%	0.746	S	S	*	*			trans	72	151.4	159.1	-66.4	169.6	30.3	0	0	116.3
986	K	25.7	Very low	25.1	Very low	156 Å²	156	156.1 Å²	156.1	68%	0.678	74%	0.741	S	S	*	*			cis	-153.5	136.5	20	-148.9	161	-175	175.1	0	114.1
987	E	23.9	Very low	25.2	Very low	149 Å²	149	153.3 Å²	153.3	70%	0.696	73%	0.731	S	S	*	*			trans	39.3	152.5	149.7	-60.5	177.4	92.6	0	0	124.3
988	Q	26.1	Very low	25.1	Very low	163 Å²	163	150.6 Å²	150.6	76%	0.762	72%	0.723	S	S	*	*			trans	88	138.7	161	-49.1	-168.8	20.9	0	0	118.8
989	Q	25.5	Very low	25.1	Very low	137 Å²	137	146.8 Å²	146.8	64%	0.64	72%	0.719	S	S	*	*			cis	-160.6	153.4	-19.6	-118	-173.4	39.9	0	0	111.3
990	Q	26.9	Very low	25.6	Very low	142 Å²	142	144.4 Å²	144.4	66%	0.664	71%	0.711	S	S	*	*			trans	66	136	146.3	-70.4	-166	37.7	0	0	124
991	H	26.8	Very low	26.2	Very low	150 Å²	150	142.9 Å²	142.9	69%	0.694	71%	0.71	S	S	*	*			trans	62.1	154.6	146.8	-72.8	86.1	0	0	0	121
992	R	24.3	Very low	26.3	Very low	176 Å²	176	145.2 Å²	145.2	66%	0.664	71%	0.71	S	S	*	*			cis	159	122.9	-40.5	167.4	-174.9	-164	-148.2	5.1	108.2
993	R	25.4	Very low	26.6	Very low	177 Å²	177	142.9 Å²	142.9	67%	0.668	71%	0.709	S	S	*	*			trans	65.5	165.8	166	-70.9	167.7	164.6	-136.1	2	115.1
994	E	24.3	Very low	26.7	Very low	124 Å²	124	139.6 Å²	139.6	58%	0.579	71%	0.705	S	S	*	*			cis	-149.8	137.4	-9.6	-125	139.5	-162.4	0	0	110.4
995	T	23.9	Very low	26.8	Very low	117 Å²	117	141 Å²	141	72%	0.718	72%	0.719	S	S	*	*			trans	29.3	150.6	138.3	64.5	0	0	0	0	124.8
996	V	25.6	Very low	27	Very low	122 Å²	122	138.9 Å²	138.9	74%	0.739	72%	0.722	S	S	*	*				110.2	123.4	123.1	122.7	0	0	0	0	121.8
997	I	27.6	Very low	27.1	Very low	134 Å²	134	138.6 Å²	138.6	69%	0.687	73%	0.733	S	S	*	*			trans	84.2	125.8	140.5	-84.8	170.5	0	0	0	124.7
998	D	25.9	Very low	27.3	Very low	134 Å²	134	139.2 Å²	139.2	72%	0.717	74%	0.736	S	S	*	*			trans	49.6	162.2	141.7	-46.7	-16.3	0	0	0	121
999	D	25.6	Very low	27.2	Very low	151 Å²	151	137.8 Å²	137.8	81%	0.807	73%	0.733	S	S	*	*			cis	-159.1	-177.3	23.9	-150.7	-18.9	0	0	0	113.4
1000	I	35.3	Very low	27.2	Very low	146 Å²	146	137.8 Å²	137.8	75%	0.749	74%	0.743	S	S	*	*			trans	-129.4	142.2	-179.6	-41.8	174.2	0	0	0	112
1001	P	40.5	Very low	27.2	Very low	105 Å²	105	136.2 Å²	136.2	68%	0.682	75%	0.747	S	S	*	*			trans	-151.4	132.4	135.4	29.5	-8.4	0	0	0	119.7
1002	H	28	Very low	27.8	Very low	175 Å²	175	134.9 Å²	134.9	81%	0.81	75%	0.752	S	S	*	*			trans	60.6	151.6	131.3	-53.4	-44.3	0	0	0	126.9
1003	S	29.1	Very low	27.8	Very low	117 Å²	117	133 Å²	133	82%	0.818	76%	0.76	S	S	*	*			trans	87.9	153.8	152.3	78.2	0	0	0	0	120.8
1004	S	26.9	Very low	27.8	Very low	106 Å²	106	129.7 Å²	129.7	74%	0.741	76%	0.763	S	S	*	*			cis	-171.6	172.7	-30.4	62.3	0	0	0	0	113.8
1005	S	24.6	Very low	28.3	Very low	118 Å²	118	129.3 Å²	129.3	83%	0.825	77%	0.772	S	S	*	*			trans	87.2	161.3	156.6	79.3	0	0	0	0	121.9
1006	S	25.3	Very low	28.7	Very low	118 Å²	118	129.5 Å²	129.5	83%	0.825	78%	0.775	S	S	*	*			trans	-151.7	172	-157.6	-38	0	0	0	0	112.9
1007	V	27.6	Very low	28.7	Very low	149 Å²	149	132.8 Å²	132.8	90%	0.903	78%	0.782	S	S	*	*			trans	-175.1	168.8	149.2	137.3	0	0	0	0	111.3
1008	E	27.3	Very low	28.8	Very low	163 Å²	163	132.1 Å²	132.1	76%	0.762	79%	0.789	S	S	*	*			trans	-119.2	171.7	-156.6	-39.1	170.4	91.2	0	0	118.5
1009	N	24.7	Very low	28.8	Very low	132 Å²	132	136.8 Å²	136.8	71%	0.706	80%	0.797	S	S	*	*			trans	63.3	122.2	141.4	-68.6	-39.1	0	0	0	123.1
1010	V	25.1	Very low	28.8	Very low	138 Å²	138	139.2 Å²	139.2	84%	0.836	80%	0.8	S	S	*	*				172.5	141.7	107.4	156.3	0	0	0	0	110.8
1011	S	27.8	Very low	28.4	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	80%	0.802	S	S	*	*			trans	-122.8	162.7	174.4	-43.6	0	0	0	0	110
1012	P	38.8	Very low	27.6	Very low	121 Å²	121	140.4 Å²	140.4	79%	0.786	80%	0.802	S	S	*	*				-157.7	-166.4	76.8	36.7	-12.1	0	0	0	117.2
1013	V	24.9	Very low	27.4	Very low	137 Å²	137	142.3 Å²	142.3	83%	0.83	81%	0.809	S	S	*	*			trans	100.1	110.5	161.2	-170.8	0	0	0	0	118.3
1014	S	25.5	Very low	27.3	Very low	107 Å²	107	142.3 Å²	142.3	75%	0.748	80%	0.798	S	S	*	*			trans	-96	-178.5	166.1	-20.1	0	0	0	0	110.3
1015	P	34.4	Very low	27.2	Very low	116 Å²	116	144.7 Å²	144.7	75%	0.753	80%	0.803	S	S	*	*			cis	-141.3	-156.6	25.1	46.3	-26.5	0	0	0	113.4
1016	P	31.5	Very low	27.2	Very low	121 Å²	121	147.1 Å²	147.1	79%	0.786	80%	0.801	S	S	*	*			cis	-115.8	-178.2	-27.7	21.8	0.7	0	0	0	112.6
1017	E	25.5	Very low	27.2	Very low	192 Å²	192	147.5 Å²	147.5	90%	0.897	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-73.9	142.3	-176.1	-58.3	164.2	122.2	0	0	114.1
1018	S	29.6	Very low	27.1	Very low	119 Å²	119	146 Å²	146	83%	0.832	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-80.5	121.1	165.9	47.2	0	0	0	0	110.6	K1020	S1018-K1020 PolarHBondContact O-N 2.75Å
1019	R	27.9	Very low	26.8	Very low	233 Å²	233	146 Å²	146	88%	0.879	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-57.5	130.8	178.5	-74.6	176.5	170.4	155.5	-4.9	111.6
1020	K	25.4	Very low	26.8	Very low	201 Å²	201	149.3 Å²	149.3	87%	0.874	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-63.7	137.3	148	-69.5	-178.5	179	178.6	0	108.2	S1018	S1018-K1020 PolarHBondContact O-N 2.75Å
1021	V	25.8	Very low	26.7	Very low	129 Å²	129	150.7 Å²	150.7	78%	0.782	79%	0.79	S	S	*	*			trans	-122.9	128.3	161.8	177.2	0	0	0	0	106.7
1022	Q	24.3	Very low	26.4	Very low	147 Å²	147	151.5 Å²	151.5	69%	0.687	79%	0.79	S	S	*	*			trans	-83.3	151.8	177.5	-64.1	140.7	-85.5	0	0	109.6	I1024	Q1022-I1024 HydrophobicContact CB-CD1 4.48Å; Q1022-I1024 HydrophobicContact CB-CG1 3.84Å
1023	F	24.1	Very low	25.7	Very low	216 Å²	216	151.8 Å²	151.8	95%	0.947	79%	0.792	S	S	*	*			trans	-86.7	134.9	144.9	-76.9	-84.3	0	0	0	107.2
1024	I	26.2	Very low	25.6	Very low	117 Å²	117	151.7 Å²	151.7	60%	0.6	79%	0.792	S	S	*	*			trans	-116.8	130.5	-168.2	-67.7	176	0	0	0	108.7	Q1022 E1026	Q1022-I1024 HydrophobicContact CB-CD1 4.48Å; Q1022-I1024 HydrophobicContact CB-CG1 3.84Å; I1024-E1026 HydrophobicContact CG2-CG 4.02Å
1025	D	25.3	Very low	25.6	Very low	156 Å²	156	152.5 Å²	152.5	83%	0.834	80%	0.798	S	S	*	*			trans	-71.2	119.8	160	-74.4	-58.9	0	0	0	109.4
1026	E	24.4	Very low	25	Very low	169 Å²	169	150.6 Å²	150.6	79%	0.79	80%	0.8	S	S	*	*			trans	-105.5	78.8	163.6	-72.9	-157.2	148.8	0	0	110.9	I1024 V1028	I1024-E1026 HydrophobicContact CG2-CG 4.02Å; E1026-V1028 PolarHBondContact O-N 3.49Å
1027	V	24.7	Very low	24.7	Very low	125 Å²	125	149.3 Å²	149.3	76%	0.758	80%	0.799	S	S	*	*			trans	-74.1	109.7	155.1	175.2	0	0	0	0	107.9
1028	V	25.2	Very low	24.7	Very low	117 Å²	117	148 Å²	148	71%	0.709	80%	0.798	S	S	*	*			trans	-103.7	100.7	170.4	-178.1	0	0	0	0	109.8	E1026	E1026-V1028 PolarHBondContact O-N 3.49Å
1029	Q	22.6	Very low	24.8	Very low	164 Å²	164	151.6 Å²	151.6	77%	0.766	80%	0.801	S	S	*	*			trans	-99.7	129.1	158.4	-77	-169.2	-11.9	0	0	109.5
1030	Y	23.2	Very low	24.7	Very low	201 Å²	201	144.3 Å²	144.3	79%	0.788	79%	0.791	S	S	*	*			trans	-138.7	93	154.1	-92.8	-71.6	0	0	0	112.1
1031	Q	22.7	Very low	24.6	Very low	167 Å²	167	143.6 Å²	143.6	78%	0.78	79%	0.788	S	S	*	*			trans	44.1	110.2	134.5	-62.8	175.4	-17.8	0	0	118.9
1032	T	22.7	Very low	24.7	Very low	126 Å²	126	145.8 Å²	145.8	77%	0.773	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-68.8	137.8	149.8	46.7	0	0	0	0	110.9
1033	P	24.3	Very low	24.7	Very low	127 Å²	127	145 Å²	145	83%	0.825	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-74.4	132.5	166.4	31.1	-32.7	0	0	0	110.6
1034	T	23.2	Very low	24.8	Very low	135 Å²	135	141.7 Å²	141.7	83%	0.828	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-86.1	124.4	177.3	49.6	0	0	0	0	112.1
1035	S	25	Very low	24.7	Very low	124 Å²	124	143 Å²	143	87%	0.867	79%	0.793	S	S	*	*			trans	-148	115	166	-81.5	0	0	0	0	112.3
1036	G	22.2	Very low	24.9	Very low	77 Å²	77	141 Å²	141	79%	0.794	79%	0.789	S	S	*	*			trans	63.7	88.5	141.9	0	0	0	0	0	121.2
1037	A	24.8	Very low	25	Very low	93 Å²	93	139.7 Å²	139.7	77%	0.769	79%	0.792	S	S	*	*			trans	79.1	157.4	132.8	0	0	0	0	0	122.5
1038	N	26	Very low	25.2	Very low	164 Å²	164	141.1 Å²	141.1	88%	0.877	80%	0.795	S	S	*	*			trans	81.5	128.9	163.9	-58.8	-24.2	0	0	0	119.8
1039	H	30.5	Very low	25.4	Very low	195 Å²	195	143 Å²	143	90%	0.903	80%	0.801	S	S	*	*			trans	-78.6	152.7	167.4	-92.6	-102.7	0	0	0	111.9
1040	A	25.4	Very low	25.5	Very low	80 Å²	80	139.8 Å²	139.8	66%	0.661	80%	0.797	S	S	*	*				120.6	147.9	129.8	0	0	0	0	0	119.3
1041	F	24.8	Very low	25.8	Very low	187 Å²	187	136.1 Å²	136.1	82%	0.82	80%	0.797	S	S	*	*			trans	67.3	104.9	162.3	-67.5	-77.9	0	0	0	122.5
1042	F	26.7	Very low	26.1	Very low	174 Å²	174	131.8 Å²	131.8	76%	0.763	80%	0.797	S	S	*	*				59.5	138.8	124.7	-85.1	-100.6	0	0	0	124.9
1043	D	25.2	Very low	26.2	Very low	132 Å²	132	133.2 Å²	133.2	71%	0.706	80%	0.799	S	S	*	*			trans	84.4	144	142.5	-71.9	-21.6	0	0	0	127
1044	D	25.3	Very low	26.4	Very low	145 Å²	145	133.7 Å²	133.7	78%	0.775	80%	0.799	S	S	*	*			trans	58.1	108.4	152	-75.2	-22.7	0	0	0	124
1045	V	24.7	Very low	26.7	Very low	144 Å²	144	130 Å²	130	87%	0.873	79%	0.788	S	S	*	*				-153.9	157.4	114.5	-101.9	0	0	0	0	110.8
1046	P	28.8	Very low	26.8	Very low	116 Å²	116	130.2 Å²	130.2	75%	0.753	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-100.4	158.2	-147.6	37.6	-38.2	0	0	0	117.2
1047	V	28	Very low	27.1	Very low	140 Å²	140	133.9 Å²	133.9	85%	0.848	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-89.8	140.4	162.3	178.3	0	0	0	0	109.2	D1049	V1047-D1049 PolarHBondContact O-N 3.16Å
1048	L	27.3	Very low	27.4	Very low	156 Å²	156	137.1 Å²	137.1	82%	0.817	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-71.4	121.5	172.5	-96.8	74.1	0	0	0	110.7
1049	D	29.5	Very low	27.7	Very low	157 Å²	157	136 Å²	136	84%	0.84	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-72.1	148.9	167.1	-136.5	-18.3	0	0	0	110.4	V1047	V1047-D1049 PolarHBondContact O-N 3.16Å
1050	S	26	Very low	27.7	Very low	96 Å²	96	135 Å²	135	67%	0.671	77%	0.767	S	S	*	*			trans	-154	142.9	172.5	-80.8	0	0	0	0	110.3
1051	P	29.6	Very low	28.1	Very low	123 Å²	123	141 Å²	141	80%	0.799	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-74.1	132.2	-144.5	26.1	-35.6	0	0	0	114.1	I1053	P1051-I1053 PolarHBondContact O-N 2.81Å
1052	G	27.7	Very low	28.8	Very low	76 Å²	76	134.5 Å²	134.5	78%	0.784	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-64.5	125.3	171.8	0	0	0	0	0	112.1
1053	I	25.8	Very low	29.2	Very low	157 Å²	157	129.9 Å²	129.9	81%	0.805	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-82	126.5	174.6	-63.7	176.1	0	0	0	108.9	P1051 G1055	P1051-I1053 PolarHBondContact O-N 2.81Å; I1053-G1055 PolarHBondContact O-N 3.2Å
1054	V	27.4	Very low	29.8	Very low	136 Å²	136	128.2 Å²	128.2	82%	0.824	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-72.2	123.6	178.5	178	0	0	0	0	109.8
1055	G	29.2	Very low	30.6	Very low	59 Å²	59	127.6 Å²	127.6	61%	0.608	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-72.8	145.6	-175.1	0	0	0	0	0	114.8	I1053 N1057	I1053-G1055 PolarHBondContact O-N 3.2Å; G1055-N1057 PolarHBondContact O-N 3.31Å
1056	T	28.7	Very low	31.7	Very low	127 Å²	127	129.1 Å²	129.1	78%	0.779	70%	0.7	S	S	*	*			trans	-85.3	102.5	170	46.8	0	0	0	0	110.3	E1058	T1056-E1058 PolarHBondContact O-N 3.43Å
1057	N	27	Very low	32.3	Very low	155 Å²	155	128.6 Å²	128.6	83%	0.829	68%	0.683	S	S	*	*			trans	-71.3	83.9	177.6	-76.8	-8.8	0	0	0	112.2	G1055 I1059	G1055-N1057 PolarHBondContact O-N 3.31Å; N1057-I1059 PolarHBondContact O-N 2.94Å; N1057-I1059 VanDerWaalsContact O-N 3.15Å
1058	E	31.3	Very low	33.2	Very low	160 Å²	160	124.7 Å²	124.7	75%	0.748	66%	0.657	S	S	*	*			trans	-75.3	96.3	168.5	-66.5	-151.2	124.2	0	0	110.9	T1056 Y1060	T1056-E1058 PolarHBondContact O-N 3.43Å; E1058-Y1060 PolarHBondContact O-N 2.7Å
1059	I	33.2	Very low	34.3	Very low	141 Å²	141	121.3 Å²	121.3	72%	0.723	64%	0.64	S	S	*	*			trans	-74.1	98.2	177.4	-57.3	175.3	0	0	0	109.6	N1057 R1061	N1057-I1059 PolarHBondContact O-N 2.94Å; N1057-I1059 VanDerWaalsContact O-N 3.15Å; I1059-R1061 PolarHBondContact O-N 3.16Å
1060	Y	30.5	Very low	35.3	Very low	173 Å²	173	118.6 Å²	118.6	68%	0.678	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-58.9	117.9	168	-176.2	-97.1	0	0	0	110.1	E1058	E1058-Y1060 PolarHBondContact O-N 2.7Å
1061	R	34.5	Very low	36.5	Very low	206 Å²	206	116.4 Å²	116.4	78%	0.777	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-98.7	117.3	-179.5	-70.3	-173.6	178.4	-175.5	1.2	110.7	I1059 P1063	I1059-R1061 PolarHBondContact O-N 3.16Å; R1061-P1063 WeakPolarHBondContact O-CD 3.11Å
1062	D	39	Very low	37.5	Very low	52 Å²	52	115.4 Å²	115.4	28%	0.278	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-61.6	119.9	178.5	-170.9	-18.3	0	0	0	112.1	R1064 Q1065	D1062-R1064 PolarHBondContact O-N 2.85Å; D1062-R1064 VanDerWaalsContact O-N 3.16Å; D1062-R1064 VanDerWaalsContact OD1-CB 3.24Å; D1062-R1064 WeakPolarHBondContact OD1-CB 3.44Å; D1062-R1064 WeakPolarHBondContact OD1-CG 3.33Å; D1062-R1064 PolarHBondContact OD1-N 2.96Å; D1062-R1064 IonicContact OD1-NH1 3.57Å; D1062-R1064 WeakPolarHBondContact OD2-CD 3.32Å; D1062-R1064 IonicContact OD2-CZ 2.79Å; D1062-R1064 IonicContact OD2-NE 3.34Å; D1062-R1064 IonicContact OD2-NH1 3.82Å; D1062-R1064 PolarHBondContact OD2-NH1 3.03Å; D1062-Q1065 PolarHBondContact O-N 3.02Å; D1062-Q1065 VanDerWaalsContact O-N 3.1Å
1063	P	34.2	Very low	38.4	Very low	76 Å²	76	116.5 Å²	116.5	49%	0.494	58%	0.575	S	S	.	*	H	α-helix	trans	-57.3	-24	174.4	-25.4	35.9	0	0	0	114.6	R1061 Q1065 R1066 R1067	R1061-P1063 WeakPolarHBondContact O-CD 3.11Å; P1063-Q1065 VanDerWaalsContact C-N 3.34Å; P1063-R1066 PolarHBondContact O-N 2.76Å; P1063-R1067 PolarHBondContact O-N 3.12Å
1064	R	38.1	Very low	39.3	Very low	98 Å²	98	117.2 Å²	117.2	37%	0.37	57%	0.568	S	S	.	*	H	α-helix	trans	-59.4	-44	173	-66.4	173.8	-165.9	113	1.5	112.1	D419 D1062 R1066 R1067 L1068	D419-R1064 VanDerWaalsContact CG-NE 3.33Å; D419-R1064 WeakPolarHBondContact OD1-CG 3.45Å; D419-R1064 IonicContact OD1-NE 3.43Å; D419-R1064 PolarHBondContact OD1-NE 3.36Å; D419-R1064 IonicContact OD2-CZ 3.17Å; D419-R1064 IonicContact OD2-NE 3.49Å; D419-R1064 PolarHBondContact OD2-NE 2.75Å; D419-R1064 IonicContact OD2-NH2 3.59Å; D419-R1064 PolarHBondContact OD2-NH2 3.34Å; D1062-R1064 PolarHBondContact O-N 2.85Å; D1062-R1064 VanDerWaalsContact O-N 3.16Å; D1062-R1064 VanDerWaalsContact OD1-CB 3.24Å; D1062-R1064 WeakPolarHBondContact OD1-CB 3.44Å; D1062-R1064 WeakPolarHBondContact OD1-CG 3.33Å; D1062-R1064 PolarHBondContact OD1-N 2.96Å; D1062-R1064 IonicContact OD1-NH1 3.57Å; D1062-R1064 WeakPolarHBondContact OD2-CD 3.32Å; D1062-R1064 IonicContact OD2-CZ 2.79Å; D1062-R1064 IonicContact OD2-NE 3.34Å; D1062-R1064 IonicContact OD2-NH1 3.82Å; D1062-R1064 PolarHBondContact OD2-NH1 3.03Å; R1064-R1066 PolarHBondContact O-N 2.91Å; R1064-R1067 CarbonylContact O-C 3.58Å; R1064-R1067 WeakPolarHBondContact O-CA 3.22Å; R1064-R1067 WeakPolarHBondContact O-CB 3.32Å; R1064-R1067 PolarHBondContact O-N 3.02Å; R1064-L1068 WeakPolarHBondContact O-CB 3.31Å; R1064-L1068 PolarHBondContact O-N 3.45Å
1065	Q	43	Very low	40.1	Very low	131 Å²	131	116 Å²	116	61%	0.612	56%	0.557	S	S	*	*	H	α-helix	trans	-69.8	-25.2	-170.9	-148	159.8	26.5	0	0	111.2	D1062 P1063 N1069	D1062-Q1065 PolarHBondContact O-N 3.02Å; D1062-Q1065 VanDerWaalsContact O-N 3.1Å; P1063-Q1065 VanDerWaalsContact C-N 3.34Å; Q1065-N1069 PolarHBondContact O-N 2.94Å; Q1065-N1069 PolarHBondContact O-ND2 3.07Å; Q1065-N1069 PolarHBondContact O-OD1 3.37Å
1066	R	46.5	Very low	40.7	Very low	177 Å²	177	121.5 Å²	121.5	67%	0.668	56%	0.559	S	S	*	*	H	α-helix	trans	-67.5	-53.4	164.9	-179.3	176.5	176.9	165.7	2.8	112.2	P1063 R1064 L1068 N1069 E1070	P1063-R1066 PolarHBondContact O-N 2.76Å; R1064-R1066 PolarHBondContact O-N 2.91Å; R1066-L1068 VanDerWaalsContact C-N 3.27Å; R1066-L1068 PolarHBondContact O-N 2.79Å; R1066-N1069 PolarHBondContact O-N 3.46Å; R1066-E1070 HydrophobicContact CG-CG 4.45Å; R1066-E1070 VanDerWaalsContact CG-OE1 3.32Å; R1066-E1070 WeakPolarHBondContact CG-OE1 3.2Å; R1066-E1070 IonicContact CZ-OE1 3.67Å; R1066-E1070 IonicContact NE-OE1 2.68Å; R1066-E1070 PolarHBondContact NE-OE1 2.92Å; R1066-E1070 IonicContact NH2-OE1 3.77Å; R1066-E1070 PolarHBondContact NH2-OE1 3.15Å; R1066-E1070 WeakPolarHBondContact O-CB 3.47Å; R1066-E1070 WeakPolarHBondContact O-CG 3.38Å; R1066-E1070 PolarHBondContact O-N 3.39Å
1067	R	41.6	Very low	41.2	Very low	104 Å²	104	119.5 Å²	119.5	39%	0.392	55%	0.551	S	S	.	*	H	α-helix	trans	-55.7	-40.5	176.5	-92.7	-173.1	-78.5	-166.4	-5.9	112.3	E418 D419 P1063 R1064 E1070 L1071	E418-R1067 PolarHBondContact O-NH1 2.76Å; D419-R1067 PolarHBondContact O-NH1 3.17Å; D419-R1067 PolarHBondContact O-NH2 3.24Å; D419-R1067 IonicContact OD1-NH2 2.65Å; D419-R1067 PolarHBondContact OD1-NH2 3.39Å; P1063-R1067 PolarHBondContact O-N 3.12Å; R1064-R1067 CarbonylContact O-C 3.58Å; R1064-R1067 WeakPolarHBondContact O-CA 3.22Å; R1064-R1067 WeakPolarHBondContact O-CB 3.32Å; R1064-R1067 PolarHBondContact O-N 3.02Å; R1067-E1070 PolarHBondContact O-N 3.47Å; R1067-L1071 WeakPolarHBondContact O-CB 3.35Å; R1067-L1071 VanDerWaalsContact O-CG 3.29Å; R1067-L1071 WeakPolarHBondContact O-CG 3.46Å; R1067-L1071 PolarHBondContact O-N 3.07Å
1068	L	46.5	Very low	41.9	Very low	59 Å²	59	116.9 Å²	116.9	31%	0.309	54%	0.544	S	S	.	.	H	α-helix	trans	-67.6	-40.3	-179.9	-172.5	63.3	0	0	0	112.1	R1064 R1066 L1071 Q1072	R1064-L1068 WeakPolarHBondContact O-CB 3.31Å; R1064-L1068 PolarHBondContact O-N 3.45Å; R1066-L1068 VanDerWaalsContact C-N 3.27Å; R1066-L1068 PolarHBondContact O-N 2.79Å; L1068-L1071 PolarHBondContact O-N 2.94Å; L1068-Q1072 WeakPolarHBondContact O-CG 3.48Å; L1068-Q1072 PolarHBondContact O-N 3.44Å
1069	N	51.2	Low	42.4	Very low	85 Å²	85	117.3 Å²	117.3	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-67.1	-44.7	172.9	-70	-10.5	0	0	0	111.3	Q1065 R1066 L1071 Q1072 D1073	Q1065-N1069 PolarHBondContact O-N 2.94Å; Q1065-N1069 PolarHBondContact O-ND2 3.07Å; Q1065-N1069 PolarHBondContact O-OD1 3.37Å; R1066-N1069 PolarHBondContact O-N 3.46Å; N1069-L1071 PolarHBondContact O-N 2.81Å; N1069-Q1072 PolarHBondContact O-N 2.86Å; N1069-Q1072 VanDerWaalsContact O-N 3.07Å; N1069-D1073 PolarHBondContact O-N 3.45Å
1070	E	51.2	Low	42.6	Very low	99 Å²	99	117.5 Å²	117.5	46%	0.463	55%	0.549	S	S	.	.	H	α-helix	trans	-59.9	-33.3	175.5	-71.7	170.8	-179.4	0	0	111.8	R1066 R1067 R1074	R1066-E1070 HydrophobicContact CG-CG 4.45Å; R1066-E1070 VanDerWaalsContact CG-OE1 3.32Å; R1066-E1070 WeakPolarHBondContact CG-OE1 3.2Å; R1066-E1070 IonicContact CZ-OE1 3.67Å; R1066-E1070 IonicContact NE-OE1 2.68Å; R1066-E1070 PolarHBondContact NE-OE1 2.92Å; R1066-E1070 IonicContact NH2-OE1 3.77Å; R1066-E1070 PolarHBondContact NH2-OE1 3.15Å; R1066-E1070 WeakPolarHBondContact O-CB 3.47Å; R1066-E1070 WeakPolarHBondContact O-CG 3.38Å; R1066-E1070 PolarHBondContact O-N 3.39Å; R1067-E1070 PolarHBondContact O-N 3.47Å; E1070-R1074 VanDerWaalsContact O-CB 3.27Å; E1070-R1074 WeakPolarHBondContact O-CB 3.21Å; E1070-R1074 PolarHBondContact O-N 3.36Å; E1070-R1074 VanDerWaalsContact O-N 3.11Å
1071	L	51.1	Low	43.1	Very low	51 Å²	51	113.3 Å²	113.3	27%	0.267	56%	0.558	S	S	.	*	H	α-helix	trans	-72.5	-38.4	171.7	-76.2	166.6	0	0	0	113.3	R1067 L1068 N1069 R1074 N1075	R1067-L1071 WeakPolarHBondContact O-CB 3.35Å; R1067-L1071 VanDerWaalsContact O-CG 3.29Å; R1067-L1071 WeakPolarHBondContact O-CG 3.46Å; R1067-L1071 PolarHBondContact O-N 3.07Å; L1068-L1071 PolarHBondContact O-N 2.94Å; N1069-L1071 PolarHBondContact O-N 2.81Å; L1071-R1074 PolarHBondContact O-N 2.74Å; L1071-N1075 PolarHBondContact O-N 3.04Å
1072	Q	50.5	Low	43.4	Very low	102 Å²	102	108.2 Å²	108.2	48%	0.477	56%	0.56	S	S	.	*	H	α-helix	trans	-67.3	-42.1	176.5	-74	179.7	26.5	0	0	112	L1068 N1069 R1074 N1075 R1076	L1068-Q1072 WeakPolarHBondContact O-CG 3.48Å; L1068-Q1072 PolarHBondContact O-N 3.44Å; N1069-Q1072 PolarHBondContact O-N 2.86Å; N1069-Q1072 VanDerWaalsContact O-N 3.07Å; Q1072-R1074 VanDerWaalsContact C-N 3.35Å; Q1072-N1075 PolarHBondContact O-N 3.01Å; Q1072-R1076 WeakPolarHBondContact O-CG 3.33Å; Q1072-R1076 PolarHBondContact O-N 3.41Å
1073	D	45.2	Very low	43.4	Very low	98 Å²	98	110 Å²	110	52%	0.524	58%	0.582	S	S	.	*	H	α-helix	trans	-68	-34.5	174.9	-75	-26.2	0	0	0	112.1	N1069 N1075 R1076 S1077	N1069-D1073 PolarHBondContact O-N 3.45Å; D1073-N1075 VanDerWaalsContact C-N 3.34Å; D1073-R1076 PolarHBondContact O-N 2.96Å; D1073-S1077 PolarHBondContact O-N 3.05Å; D1073-S1077 PolarHBondContact O-OG 3.41Å
1074	R	45.3	Very low	43.9	Very low	173 Å²	173	111.9 Å²	111.9	65%	0.653	59%	0.588	S	S	*	*	H	α-helix	trans	-69.4	-29.5	174.1	-161.9	169.4	71.8	-170.7	2.6	113.2	E1070 L1071 Q1072 S1077	E1070-R1074 VanDerWaalsContact O-CB 3.27Å; E1070-R1074 WeakPolarHBondContact O-CB 3.21Å; E1070-R1074 PolarHBondContact O-N 3.36Å; E1070-R1074 VanDerWaalsContact O-N 3.11Å; L1071-R1074 PolarHBondContact O-N 2.74Å; Q1072-R1074 VanDerWaalsContact C-N 3.35Å; R1074-S1077 WeakPolarHBondContact CA-OG 3.49Å; R1074-S1077 PolarHBondContact O-OG 3.27Å
1075	N	43.7	Very low	44.3	Very low	111 Å²	111	109 Å²	109	59%	0.594	59%	0.589	S	S	*	*	H	α-helix	trans	-74.3	-43.2	171	-76	-4.1	0	0	0	111.6	L1071 Q1072 D1073 S1077 S1078	L1071-N1075 PolarHBondContact O-N 3.04Å; Q1072-N1075 PolarHBondContact O-N 3.01Å; D1073-N1075 VanDerWaalsContact C-N 3.34Å; N1075-S1077 PolarHBondContact O-N 3.49Å; N1075-S1078 WeakPolarHBondContact O-CB 3.4Å; N1075-S1078 PolarHBondContact O-N 2.88Å
1076	R	41.5	Very low	44.6	Very low	173 Å²	173	106.1 Å²	106.1	65%	0.653	59%	0.587	S	S	*	*	H	α-helix	trans	-59.6	-33.4	176.2	-79.1	176.8	161.8	-176.4	-4.7	113.6	Q1072 D1073 S1078	Q1072-R1076 WeakPolarHBondContact O-CG 3.33Å; Q1072-R1076 PolarHBondContact O-N 3.41Å; D1073-R1076 PolarHBondContact O-N 2.96Å; R1076-S1078 PolarHBondContact O-N 3.32Å
1077	S	40.6	Very low	44.8	Very low	86 Å²	86	106.9 Å²	106.9	60%	0.601	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-1.7	174.4	41.6	0	0	0	0	114.3	D1073 R1074 N1075	D1073-S1077 PolarHBondContact O-N 3.05Å; D1073-S1077 PolarHBondContact O-OG 3.41Å; R1074-S1077 WeakPolarHBondContact CA-OG 3.49Å; R1074-S1077 PolarHBondContact O-OG 3.27Å; N1075-S1077 PolarHBondContact O-N 3.49Å
1078	S	42.3	Very low	45.2	Very low	99 Å²	99	104.6 Å²	104.6	69%	0.692	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-10.6	174.4	-168.5	0	0	0	0	114.7	N1075 R1076	N1075-S1078 WeakPolarHBondContact O-CB 3.4Å; N1075-S1078 PolarHBondContact O-N 2.88Å; R1076-S1078 PolarHBondContact O-N 3.32Å
1079	E	40.7	Very low	45.9	Very low	169 Å²	169	103.6 Å²	103.6	79%	0.79	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-22.4	-178.4	-65.9	-173.5	133.6	0	0	113.4	G1081	E1079-G1081 PolarHBondContact O-N 3.13Å
1080	N	37.4	Very low	45.6	Very low	146 Å²	146	107.5 Å²	107.5	78%	0.781	61%	0.608	S	S	*	*	S	Bend	trans	-91.6	97.1	173.5	-74.4	-43.2	0	0	0	110.8	A1082	N1080-A1082 PolarHBondContact O-N 2.63Å
1081	G	40.7	Very low	45.6	Very low	85 Å²	85	111.1 Å²	111.1	88%	0.876	62%	0.617	S	S	*	*			trans	-74.1	101.4	-169.5	0	0	0	0	0	115.9	E1079	E1079-G1081 PolarHBondContact O-N 3.13Å
1082	A	41.3	Very low	46	Very low	98 Å²	98	112.3 Å²	112.3	81%	0.81	62%	0.624	S	S	*	*			trans	-160.2	79.6	154.2	0	0	0	0	0	110.3	N1080 D1084	N1080-A1082 PolarHBondContact O-N 2.63Å; A1082-D1084 PolarHBondContact O-N 3Å
1083	A	39.5	Very low	46.5	Very low	91 Å²	91	111.3 Å²	111.3	75%	0.752	62%	0.618	S	S	*	*			trans	-85	110.7	-172.7	0	0	0	0	0	113.1	G1085	A1083-G1085 PolarHBondContact O-N 2.92Å
1084	D	45.1	Very low	46.9	Very low	115 Å²	115	112.3 Å²	112.3	62%	0.615	62%	0.619	S	S	*	*			trans	-66.2	114.8	166.5	173.3	11.1	0	0	0	110.5	A1082 A1086	A1082-D1084 PolarHBondContact O-N 3Å; D1084-A1086 PolarHBondContact O-N 3.32Å; D1084-A1086 VanDerWaalsContact O-N 3.12Å; D1084-A1086 PolarHBondContact OD1-N 3.4Å
1085	G	46.1	Very low	47.4	Very low	38 Å²	38	111.5 Å²	111.5	39%	0.392	62%	0.616	S	S	.	*	G	3₁₀ helix	trans	-65.5	-13.8	-171.7	0	0	0	0	0	115.4	A1083 K1087 K1093	A1083-G1085 PolarHBondContact O-N 2.92Å; G1085-K1087 VanDerWaalsContact C-N 3.29Å; G1085-K1087 PolarHBondContact O-N 3.16Å; G1085-K1093 VanDerWaalsContact O-CE 3.27Å; G1085-K1093 WeakPolarHBondContact O-CE 3.2Å
1086	A	49.7	Very low	48	Very low	69 Å²	69	110.7 Å²	110.7	57%	0.57	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-55.6	-42.8	-179.6	0	0	0	0	0	112.4	D1084 K1093	D1084-A1086 PolarHBondContact O-N 3.32Å; D1084-A1086 VanDerWaalsContact O-N 3.12Å; D1084-A1086 PolarHBondContact OD1-N 3.4Å; A1086-K1093 PolarHBondContact O-NZ 3.08Å; A1086-K1093 VanDerWaalsContact O-NZ 3.12Å
1087	K	48.9	Very low	48.2	Very low	193 Å²	193	109.1 Å²	109.1	84%	0.839	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-91	0.3	-167.7	-67.8	177.9	-179.8	170.8	0	116.1	G1085	G1085-K1087 VanDerWaalsContact C-N 3.29Å; G1085-K1087 PolarHBondContact O-N 3.16Å
1088	L	50.5	Low	48.7	Very low	57 Å²	57	106.9 Å²	106.9	30%	0.298	60%	0.596	S	S	.	*			trans	-73.2	140.8	-179	-68.2	173.4	0	0	0	112.9	D1092 K1093 L1096	L1088-D1092 HydrophobicContact CD2-CB 4.48Å; L1088-K1093 HydrophobicContact CB-CD 4.34Å; L1088-K1093 HydrophobicContact CB-CG 3.76Å; L1088-K1093 WeakPolarHBondContact O-CD 3.42Å; L1088-K1093 VanDerWaalsContact O-CE 3.23Å; L1088-K1093 WeakPolarHBondContact O-CE 3.35Å; L1088-K1093 PolarHBondContact O-NZ 2.87Å; L1088-L1096 HydrophobicContact CD1-CD2 4.24Å
1089	G	61.6	Low	49.2	Very low	37 Å²	37	112.1 Å²	112.1	38%	0.381	60%	0.601	S	S	.	*			trans	-74.7	166.8	175.4	0	0	0	0	0	113.3	R1091 D1092 K1093	G1089-R1091 PolarHBondContact O-N 3.07Å; G1089-D1092 PolarHBondContact O-N 3.35Å; G1089-D1092 VanDerWaalsContact O-N 3.14Å; G1089-K1093 PolarHBondContact O-N 2.96Å
1090	F	45.8	Very low	49.3	Very low	168 Å²	168	111.4 Å²	111.4	74%	0.737	60%	0.598	S	S	*	*	H	α-helix	trans	-57.9	-48.6	-172.5	-175.5	-95.7	0	0	0	113.6	D1092 K1093 Q1094	F1090-D1092 VanDerWaalsContact C-N 3.27Å; F1090-D1092 PolarHBondContact O-N 3.34Å; F1090-K1093 PolarHBondContact O-N 3.23Å; F1090-Q1094 WeakPolarHBondContact O-CB 3.48Å; F1090-Q1094 PolarHBondContact O-N 3.23Å
1091	R	51.1	Low	49.9	Very low	174 Å²	174	110.7 Å²	110.7	66%	0.657	59%	0.592	S	S	*	*	H	α-helix	trans	-61.5	-33	177.3	-88	173.1	61.8	169	-1.3	113.1	G1089 R1095	G1089-R1091 PolarHBondContact O-N 3.07Å; R1091-R1095 WeakPolarHBondContact O-CG 3.46Å; R1091-R1095 PolarHBondContact O-N 2.92Å; R1091-R1095 VanDerWaalsContact O-N 3.08Å
1092	D	58.5	Low	49.9	Very low	76 Å²	76	109.5 Å²	109.5	41%	0.406	58%	0.58	S	S	.	*	H	α-helix	trans	-83.4	-35.9	-177.4	-54.7	-54.2	0	0	0	111.3	L1088 G1089 F1090 R1095 L1096	L1088-D1092 HydrophobicContact CD2-CB 4.48Å; G1089-D1092 PolarHBondContact O-N 3.35Å; G1089-D1092 VanDerWaalsContact O-N 3.14Å; F1090-D1092 VanDerWaalsContact C-N 3.27Å; F1090-D1092 PolarHBondContact O-N 3.34Å; D1092-R1095 PolarHBondContact O-N 3.4Å; D1092-L1096 WeakPolarHBondContact O-CB 3.25Å; D1092-L1096 PolarHBondContact O-N 2.91Å
1093	K	61.8	Low	50	Low	82 Å²	82	111.4 Å²	111.4	36%	0.357	57%	0.572	S	S	.	*	H	α-helix	trans	-58.8	-45.2	165.2	-78.5	173.4	167.6	141.1	0	111.2	G1085 A1086 L1088 G1089 F1090 R1095 L1096 F1097	G1085-K1093 VanDerWaalsContact O-CE 3.27Å; G1085-K1093 WeakPolarHBondContact O-CE 3.2Å; A1086-K1093 PolarHBondContact O-NZ 3.08Å; A1086-K1093 VanDerWaalsContact O-NZ 3.12Å; L1088-K1093 HydrophobicContact CB-CD 4.34Å; L1088-K1093 HydrophobicContact CB-CG 3.76Å; L1088-K1093 WeakPolarHBondContact O-CD 3.42Å; L1088-K1093 VanDerWaalsContact O-CE 3.23Å; L1088-K1093 WeakPolarHBondContact O-CE 3.35Å; L1088-K1093 PolarHBondContact O-NZ 2.87Å; G1089-K1093 PolarHBondContact O-N 2.96Å; F1090-K1093 PolarHBondContact O-N 3.23Å; K1093-R1095 VanDerWaalsContact C-N 3.33Å; K1093-R1095 PolarHBondContact O-N 2.89Å; K1093-L1096 WeakPolarHBondContact O-CB 3.43Å; K1093-L1096 PolarHBondContact O-N 2.69Å; K1093-F1097 WeakPolarHBondContact O-CD2 3.39Å; K1093-F1097 PolarHBondContact O-N 2.71Å
1094	Q	53	Low	50	Low	118 Å²	118	114.4 Å²	114.4	55%	0.551	58%	0.575	S	S	*	*	H	α-helix	trans	-62.2	-38.2	177.8	-163.7	174.6	18.7	0	0	112.5	F1090 A1098	F1090-Q1094 WeakPolarHBondContact O-CB 3.48Å; F1090-Q1094 PolarHBondContact O-N 3.23Å; Q1094-A1098 PolarHBondContact O-N 3.33Å; Q1094-A1098 VanDerWaalsContact O-N 3.09Å
1095	R	55	Low	49.8	Very low	157 Å²	157	114.6 Å²	114.6	59%	0.592	58%	0.581	S	S	*	*	H	α-helix	trans	-68.9	-37.7	172.1	-77.1	169	161.7	-172.9	-10.6	113.5	R1091 D1092 K1093 R1099	R1091-R1095 WeakPolarHBondContact O-CG 3.46Å; R1091-R1095 PolarHBondContact O-N 2.92Å; R1091-R1095 VanDerWaalsContact O-N 3.08Å; D1092-R1095 PolarHBondContact O-N 3.4Å; K1093-R1095 VanDerWaalsContact C-N 3.33Å; K1093-R1095 PolarHBondContact O-N 2.89Å; R1095-R1099 PolarHBondContact O-N 3.24Å
1096	L	57.8	Low	49.2	Very low	93 Å²	93	117.3 Å²	117.3	49%	0.487	60%	0.6	S	S	.	*	H	α-helix	trans	-63.9	-45.8	176.2	-149.4	84.3	0	0	0	110.4	L1088 D1092 K1093 R1099 Q1100	L1088-L1096 HydrophobicContact CD1-CD2 4.24Å; D1092-L1096 WeakPolarHBondContact O-CB 3.25Å; D1092-L1096 PolarHBondContact O-N 2.91Å; K1093-L1096 WeakPolarHBondContact O-CB 3.43Å; K1093-L1096 PolarHBondContact O-N 2.69Å; L1096-R1099 PolarHBondContact O-N 3.45Å; L1096-Q1100 PolarHBondContact O-N 2.92Å
1097	F	45.4	Very low	48.4	Very low	140 Å²	140	120 Å²	120	61%	0.614	61%	0.611	S	S	*	*	H	α-helix	trans	-58.6	-49.7	174.6	-95.9	-86.6	0	0	0	112	K1093 R1099 Q1100 I1101	K1093-F1097 WeakPolarHBondContact O-CD2 3.39Å; K1093-F1097 PolarHBondContact O-N 2.71Å; F1097-R1099 VanDerWaalsContact C-N 3.33Å; F1097-R1099 PolarHBondContact O-N 2.83Å; F1097-Q1100 WeakPolarHBondContact O-CA 3.46Å; F1097-Q1100 WeakPolarHBondContact O-CB 3.42Å; F1097-Q1100 PolarHBondContact O-N 3.4Å; F1097-I1101 WeakPolarHBondContact O-CG1 3.35Å; F1097-I1101 PolarHBondContact O-N 3.45Å
1098	A	49.8	Very low	48	Very low	39 Å²	39	122.3 Å²	122.3	32%	0.322	62%	0.615	S	S	.	*	H	α-helix	trans	-55.4	-45.1	180	0	0	0	0	0	112.9	Q1094 Q1100 I1101	Q1094-A1098 PolarHBondContact O-N 3.33Å; Q1094-A1098 VanDerWaalsContact O-N 3.09Å; A1098-Q1100 PolarHBondContact O-N 3.16Å; A1098-I1101 PolarHBondContact O-N 3.35Å
1099	R	53.3	Low	47.2	Very low	210 Å²	210	129 Å²	129	79%	0.792	64%	0.644	S	S	*	*	H	α-helix	trans	-60.9	-29.6	173	-87.9	-176	164.6	175.7	-4.2	113.7	R1095 L1096 F1097	R1095-R1099 PolarHBondContact O-N 3.24Å; L1096-R1099 PolarHBondContact O-N 3.45Å; F1097-R1099 VanDerWaalsContact C-N 3.33Å; F1097-R1099 PolarHBondContact O-N 2.83Å
1100	Q	43.6	Very low	45.7	Very low	154 Å²	154	137.8 Å²	137.8	72%	0.72	67%	0.666	S	S	*	*	H	α-helix	trans	-83.5	-11.1	-177.1	-156.6	165.1	10.6	0	0	113.3	L1096 F1097 A1098	L1096-Q1100 PolarHBondContact O-N 2.92Å; F1097-Q1100 WeakPolarHBondContact O-CA 3.46Å; F1097-Q1100 WeakPolarHBondContact O-CB 3.42Å; F1097-Q1100 PolarHBondContact O-N 3.4Å; A1098-Q1100 PolarHBondContact O-N 3.16Å
1101	I	50.4	Low	45.1	Very low	130 Å²	130	136 Å²	136	67%	0.667	66%	0.662	S	S	*	*	H	α-helix	trans	-100.1	-5	172.4	-10.8	-176.2	0	0	0	113.3	F1097 A1098	F1097-I1101 WeakPolarHBondContact O-CG1 3.35Å; F1097-I1101 PolarHBondContact O-N 3.45Å; A1098-I1101 PolarHBondContact O-N 3.35Å
1102	G	40.1	Very low	44.4	Very low	60 Å²	60	135.9 Å²	135.9	62%	0.619	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	84.9	12.3	176.2	0	0	0	0	0	116	D1104	G1102-D1104 PolarHBondContact O-N 3.17Å
1103	E	42.7	Very low	43.1	Very low	139 Å²	139	136.7 Å²	136.7	65%	0.65	68%	0.675	S	S	*	*			trans	-84.4	89.6	173.3	-70.5	-166.9	133.4	0	0	111.5	T1105	E1103-T1105 PolarHBondContact O-N 2.99Å; E1103-T1105 VanDerWaalsContact O-N 3.09Å
1104	D	40.9	Very low	42.1	Very low	153 Å²	153	136.9 Å²	136.9	82%	0.818	69%	0.687	S	S	*	*			trans	-72.9	7.5	179.4	-96	-35.4	0	0	0	115	G1102	G1102-D1104 PolarHBondContact O-N 3.17Å
1105	T	39.2	Very low	41.3	Very low	120 Å²	120	136.3 Å²	136.3	74%	0.736	70%	0.696	S	S	*	*			trans	-131.9	95.9	174.6	57.5	0	0	0	0	113	E1103	E1103-T1105 PolarHBondContact O-N 2.99Å; E1103-T1105 VanDerWaalsContact O-N 3.09Å
1106	A	34.6	Very low	40.6	Very low	94 Å²	94	132.2 Å²	132.2	78%	0.777	70%	0.696	S	S	*	*			trans	-63	131.3	160.2	0	0	0	0	0	109.6	R1108	A1106-R1108 PolarHBondContact O-N 3.08Å
1107	P	33.4	Very low	39.8	Very low	125 Å²	125	133.6 Å²	133.6	81%	0.812	70%	0.699	S	S	*	*			trans	-68.4	129.2	-169.1	24.6	-33.9	0	0	0	112.9	Q1109	P1107-Q1109 PolarHBondContact O-N 3.23Å
1108	R	39.3	Very low	39.7	Very low	243 Å²	243	134.7 Å²	134.7	92%	0.917	70%	0.7	S	S	*	*			trans	-68.1	105.2	166.9	-79.3	176.1	160.9	173.8	-7	109.7	A1106	A1106-R1108 PolarHBondContact O-N 3.08Å
1109	Q	33.1	Very low	39.3	Very low	197 Å²	197	139.2 Å²	139.2	92%	0.921	72%	0.718	S	S	*	*			trans	-68.9	135.4	160.9	-87.3	-174.4	-27.1	0	0	110.1	P1107	P1107-Q1109 PolarHBondContact O-N 3.23Å
1110	R	30	Very low	39	Very low	221 Å²	221	134.8 Å²	134.8	83%	0.834	71%	0.708	S	S	*	*			trans	-93.9	149.6	177.7	-69.8	-178.9	176	179.9	-1.6	110.5
1111	M	34.7	Very low	38.8	Very low	132 Å²	132	134.9 Å²	134.9	65%	0.65	71%	0.709	S	S	*	*			trans	61.7	135.6	148.3	-69.2	169.5	69.6	0	0	120.3	E1113	M1111-E1113 HydrophobicContact CB-CG 4.05Å; M1111-E1113 HydrophobicContact CE-CG 3.72Å
1112	N	35.2	Very low	38.4	Very low	170 Å²	170	133.3 Å²	133.3	91%	0.909	71%	0.705	S	S	*	*			trans	-69.3	122.1	139.1	-68.3	-27.5	0	0	0	107.7
1113	E	32.8	Very low	38.5	Very low	94 Å²	94	137 Å²	137	44%	0.439	71%	0.711	S	S	.	*			trans	-118.8	127	165.7	-78	171.6	176.3	0	0	108.5	M1111 R1118	M1111-E1113 HydrophobicContact CB-CG 4.05Å; M1111-E1113 HydrophobicContact CE-CG 3.72Å; E1113-R1118 IonicContact OE2-NE 3.27Å; E1113-R1118 IonicContact OE2-NH2 3.34Å
1114	S	38.9	Very low	38.5	Very low	86 Å²	86	136.7 Å²	136.7	60%	0.601	71%	0.713	S	S	*	*			trans	-71	137.3	178.7	-62.9	0	0	0	0	110.6	A1116 Q1117	S1114-A1116 PolarHBondContact O-N 2.93Å; S1114-Q1117 PolarHBondContact O-N 2.97Å
1115	S	38	Very low	38.1	Very low	105 Å²	105	133.9 Å²	133.9	73%	0.734	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-12.8	-176.8	-51.5	0	0	0	0	115.5
1116	A	39.7	Very low	38.3	Very low	71 Å²	71	132.6 Å²	132.6	59%	0.587	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-31.5	174.6	0	0	0	0	0	114.1	S1114	S1114-A1116 PolarHBondContact O-N 2.93Å
1117	Q	41	Very low	38.4	Very low	122 Å²	122	134.1 Å²	134.1	57%	0.57	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-76.7	-29.5	-177.2	-76.8	176.3	-79.2	0	0	112.9	S1114 L1119 I1120	S1114-Q1117 PolarHBondContact O-N 2.97Å; Q1117-L1119 PolarHBondContact O-N 2.75Å; Q1117-L1119 VanDerWaalsContact O-N 3.13Å; Q1117-I1120 PolarHBondContact O-N 3.35Å
1118	R	43.1	Very low	39	Very low	163 Å²	163	134.3 Å²	134.3	62%	0.615	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-69	-7.9	179.5	-65.9	-172.7	-177.2	167	4.8	115	E1113	E1113-R1118 IonicContact OE2-NE 3.27Å; E1113-R1118 IonicContact OE2-NH2 3.34Å
1119	L	41.3	Very low	38.7	Very low	134 Å²	134	129.9 Å²	129.9	70%	0.702	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-97.9	1.4	176.5	-82.8	163.7	0	0	0	113.6	Q1117	Q1117-L1119 PolarHBondContact O-N 2.75Å; Q1117-L1119 VanDerWaalsContact O-N 3.13Å
1120	I	47.5	Very low	38.6	Very low	117 Å²	117	128.4 Å²	128.4	60%	0.6	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-32.5	-179.5	-60	177.6	0	0	0	111.1	Q1117	Q1117-I1120 PolarHBondContact O-N 3.35Å
1121	E	39.3	Very low	39.3	Very low	157 Å²	157	127.3 Å²	127.3	73%	0.734	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-82.1	-14.2	-178.7	-62.4	-172.3	148.7	0	0	114.2	D1123	E1121-D1123 VanDerWaalsContact C-N 3.34Å; E1121-D1123 PolarHBondContact O-N 3.13Å
1122	T	42.2	Very low	39.5	Very low	96 Å²	96	127.1 Å²	127.1	59%	0.589	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-71.3	-24.9	-179.3	46.3	0	0	0	0	114.4
1123	D	42.4	Very low	39.7	Very low	137 Å²	137	124.8 Å²	124.8	73%	0.733	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-98	-4.6	-165.9	-71.8	20.9	0	0	0	113.5	E1121	E1121-D1123 VanDerWaalsContact C-N 3.34Å; E1121-D1123 PolarHBondContact O-N 3.13Å
1124	I	42	Very low	40.1	Very low	134 Å²	134	126.5 Å²	126.5	69%	0.687	72%	0.723	S	S	*	*	S	Bend	trans	-108.8	-17.8	-167.7	-63.8	178.8	0	0	0	113.4	A1126	I1124-A1126 PolarHBondContact O-N 3.39Å
1125	A	33.6	Very low	40.2	Very low	93 Å²	93	128.9 Å²	128.9	77%	0.769	73%	0.73	S	S	*	*			trans	-96.2	25.1	-169.8	0	0	0	0	0	115.8
1126	A	41.8	Very low	40.3	Very low	94 Å²	94	130.4 Å²	130.4	78%	0.777	73%	0.73	S	S	*	*			trans	-105.5	51.3	-173.5	0	0	0	0	0	114.7	I1124	I1124-A1126 PolarHBondContact O-N 3.39Å
1127	T	37.2	Very low	40.4	Very low	125 Å²	125	134.3 Å²	134.3	77%	0.767	74%	0.739	S	S	*	*			trans	-147.2	140.3	173.2	17.3	0	0	0	0	113
1128	P	45.6	Very low	40.3	Very low	130 Å²	130	135.2 Å²	135.2	84%	0.844	75%	0.751	S	S	*	*			trans	-89.7	178.2	-176	36.3	-36.5	0	0	0	114.9
1129	Q	32.9	Very low	40.1	Very low	150 Å²	150	133.1 Å²	133.1	70%	0.701	76%	0.762	S	S	*	*			trans	-71.7	159.4	-166.5	-58.9	-176.2	-2.2	0	0	117.4
1130	K	31.8	Very low	40	Very low	166 Å²	166	133 Å²	133	72%	0.722	77%	0.767	S	S	*	*			trans	78.4	160.9	140.8	-86.7	165.4	-177.5	152.8	0	119.3
1131	P	43.8	Very low	39.3	Very low	197 Å²	197	134.5 Å²	134.5	100%	1.279	78%	0.782	S	S	*	*			cis	-75.5	0	-3.4	31.5	-33.7	0	0	0	113.8

Retrieved 1,131 of 1,131 residues in 262.4 ms (Link to these results)

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