A0A5K4F4F1_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession A0A5K4F4F1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,381 aa.

						>A0A5K4F4F1_SCHMA|A0A5K4F4F1
MPSVTTTSTVNSSGVRLMRKASCTGANDQATNSSFQHNPDRKSLRDQPNVGKYKLIRTLGRGNFAKVKLAQHVSTGREVAVKVIDKTQLNQASLKKLFREVNIMKMLNHPNIVRLYEVIESERHVYLVMEYAENGEVFDHLVAHGRMKEREARAAFRQIVSAVEYCHQKKIVHRDLKAENLLFDGYYNIKLADFGFSNLFDGSKKLDTFCGSPPYAAPELFQGRKYDGPEVDVWSLGVILYTLVSGSLPFDAQHLKDLQERVLRGKYRVPFYMSTDCEALLRKLLVLNPAKRITLRNVMSDKWLNIGYEDNILKPYTEPPPDYNDTERLEIMRIMGYRPDDVREALIKQSFNNVTAIYLLLADPKTRLTLPAGSLFPSNQSQSLHGNIGLNHHHHQSSGSEGVTVDASSTPATVTEDETNPSSKVQSSLDNSNGNNNNKQKTNQNGLTYQSKKESGQDSSGSQHNGVRRISGISWMKQSASAGPTSNRQEKLSVDEKSRPLPRIRVCDLRERGNDSNLDDSSAQEKIDESKDIMMESSSGGDQLSVRRMNTFSMSDKVRPTGSDSQSPNLKCPLSRAPPMSNIPNSLTTPTTSSSENSPIKQSADKSSSASSSSSSPSKQNSNDKKENTKTFFEQQTIKLNQAVPYSEENPFLGWLRRTLPYQKKHKDTSIHSKPKTATLSNTTNNNSKVSTNDANSIIDILHTNDRQKHQHNDVNRSSIPYSLFNSNKSKKLKKLSSSNQSDDHQKINNMNTKISESFTFTDSHSSTLDPTSSSGTMNSAQIKQQHNNNTKQSSSPSRRIALPDSIFKALDTLNTGEKTGDDDNGDKKKSDSKSHGSKLPTTTTTTTASLKRDSIIKWSVRHRPNNTIMTKTNNNNIPSTAESTDKKIVDLNQTINCSTELKNSSDSSMTIENPSTIVSKNESSSRSRPGRFFRSLTLRIARSHTNHNNNRIISSMQKSIHKHKYTTNTNSKSYKTSLLKSPNDDAELTEEIHSSNRLHTSSLTHSTSSSPTRSSHPSTAQHHHDNNDEVNDDDNSHDTMKCLVSVNPDPWITMEPGKHQQQQRKDLISKSKRSLSSELDTDKLKQQPAPLHHYPHHHGYEFSTNNTPVNNQSIAGDGCQKKIGVEPCCLDLPTSKTVVITSDMHKLKATTYTTLSCTASSSSTTSSVLTVTTAYTTRITNCKTTTSSSDQHHHHNHHHFFYYGENENQKLWKPRRLYFVLNLPIHGTDPHILLIQMIELIKHYQCSYEFLSSYRLRCTKLIHSSTTSTSSPPCSTSNDTGNNNPIHDTDVHQRQQQQLEHCTLTSHQQEQQQDQQQHSQDVPQLPLLLYSKDKTHLLIWDMEIFQLAKPIHYGVRFKRISGNQNAFKIIMKYFIYHHKV
					

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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	26.4	Very low	29.8	Very low	207 Å²	207	125 Å²	125	100%	1.02	75%	0.75	S	S	*	*				0	115.1	0	-65.5	-58.1	175.7	0	0	106.3	S3	M1-S3 WeakPolarHBondContact SD-CB 3.4Å; M1-S3 PolarHBondContact SD-OG 2.66Å
2	P	39.7	Very low	29.8	Very low	126 Å²	126	122.7 Å²	122.7	82%	0.818	74%	0.744	S	S	*	*			cis	-58.4	152.6	-10	28.1	-34.8	0	0	0	110.8
3	S	31.7	Very low	29.9	Very low	76 Å²	76	121.8 Å²	121.8	53%	0.531	75%	0.747	S	S	.	*			cis	71.6	82.4	0.8	79.8	0	0	0	0	118.9	M1	M1-S3 WeakPolarHBondContact SD-CB 3.4Å; M1-S3 PolarHBondContact SD-OG 2.66Å
4	V	35.2	Very low	29.9	Very low	130 Å²	130	118.1 Å²	118.1	79%	0.788	75%	0.746	S	S	*	*				-124.6	120.4	112.8	-169.1	0	0	0	0	104.4
5	T	28.3	Very low	29.9	Very low	113 Å²	113	118.3 Å²	118.3	69%	0.693	74%	0.744	S	S	*	*				45.7	136	92.1	8	0	0	0	0	113.2
6	T	30.1	Very low	29.9	Very low	112 Å²	112	124.7 Å²	124.7	69%	0.687	75%	0.75	S	S	*	*			cis	-154.4	134.6	31.3	-1.5	0	0	0	0	112.8
7	T	26.3	Very low	29.7	Very low	122 Å²	122	125.9 Å²	125.9	75%	0.748	75%	0.751	S	S	*	*			trans	43.1	154.4	136.1	55.7	0	0	0	0	124.8
8	S	26.5	Very low	29.7	Very low	103 Å²	103	127.8 Å²	127.8	72%	0.72	75%	0.753	S	S	*	*			trans	79.1	126	166.6	65.3	0	0	0	0	116.2
9	T	26	Very low	29.6	Very low	124 Å²	124	131.4 Å²	131.4	76%	0.761	75%	0.752	S	S	*	*				63.5	124.4	56.2	-33	0	0	0	0	109
10	V	28.3	Very low	29.5	Very low	122 Å²	122	135 Å²	135	74%	0.739	76%	0.758	S	S	*	*				-149.2	161.9	51.4	178.4	0	0	0	0	112.2
11	N	28.9	Very low	29.5	Very low	140 Å²	140	133.3 Å²	133.3	75%	0.749	76%	0.762	S	S	*	*			trans	-22.9	165.4	152.5	-43.5	-32.1	0	0	0	115.9
12	S	30.1	Very low	29.8	Very low	97 Å²	97	129 Å²	129	68%	0.678	75%	0.752	S	S	*	*			cis	-177.8	149.8	48.5	-149.4	0	0	0	0	117
13	S	31.7	Very low	29.2	Very low	112 Å²	112	129 Å²	129	78%	0.783	75%	0.754	S	S	*	*			trans	65.4	140.8	137.6	-63.1	0	0	0	0	123.7
14	G	29.7	Very low	29	Very low	70 Å²	70	132.6 Å²	132.6	72%	0.722	77%	0.773	S	S	*	*			trans	137.8	60.6	167.1	0	0	0	0	0	114.8
15	V	29.2	Very low	28.7	Very low	120 Å²	120	129.8 Å²	129.8	73%	0.727	77%	0.77	S	S	*	*				56	120.6	74.9	-177.7	0	0	0	0	111.2
16	R	29.8	Very low	28.8	Very low	221 Å²	221	128.7 Å²	128.7	83%	0.834	77%	0.772	S	S	*	*			cis	-142.8	157.9	10.6	-106.6	153.2	-172.6	165.8	1.9	107.6
17	L	27.8	Very low	28.8	Very low	146 Å²	146	130.1 Å²	130.1	76%	0.764	78%	0.776	S	S	*	*			cis	73	96.7	24	-159.3	89.9	0	0	0	117.7
18	M	29.4	Very low	29	Very low	159 Å²	159	129.6 Å²	129.6	78%	0.783	77%	0.768	S	S	*	*			trans	-168.6	152.4	146.9	-87.3	-62.3	175.2	0	0	106.4
19	R	27.2	Very low	29.1	Very low	196 Å²	196	132.3 Å²	132.3	74%	0.74	77%	0.77	S	S	*	*			cis	172.7	137.9	-37	-115.9	-170.7	178	169	-1.8	105
20	K	27.2	Very low	29.4	Very low	203 Å²	203	130.7 Å²	130.7	88%	0.883	77%	0.769	S	S	*	*			trans	37.3	121.4	160.1	-67	-171.5	173.1	-169.8	0	120.3
21	A	31	Very low	29.4	Very low	100 Å²	100	130.6 Å²	130.6	83%	0.826	77%	0.768	S	S	*	*				-153.1	154.2	120.2	0	0	0	0	0	109.7
22	S	30.8	Very low	29.4	Very low	117 Å²	117	131.2 Å²	131.2	82%	0.818	77%	0.772	S	S	*	*			trans	-132.3	123	177.3	52.9	0	0	0	0	109.2
23	C	28.3	Very low	29.5	Very low	127 Å²	127	131.7 Å²	131.7	86%	0.858	78%	0.775	S	S	*	*			trans	-133.1	138.6	176.9	-59.9	0	0	0	0	110.1
24	T	27.3	Very low	29.5	Very low	151 Å²	151	131.8 Å²	131.8	93%	0.926	78%	0.776	S	S	*	*			trans	-94	153.6	174.3	45.9	0	0	0	0	111.5
25	G	29.6	Very low	29.7	Very low	71 Å²	71	138.7 Å²	138.7	73%	0.732	79%	0.786	S	S	*	*			trans	144.4	98.7	178.7	0	0	0	0	0	108.9
26	A	29.5	Very low	30.1	Very low	89 Å²	89	141.9 Å²	141.9	74%	0.736	79%	0.793	S	S	*	*				78.1	120.3	65.3	0	0	0	0	0	112.8
27	N	30	Very low	30.4	Very low	143 Å²	143	138.4 Å²	138.4	77%	0.765	79%	0.786	S	S	*	*			trans	47	142.3	147.5	-63.6	56	0	0	0	119.6
28	D	30	Very low	31	Very low	110 Å²	110	136.3 Å²	136.3	59%	0.588	78%	0.776	S	S	*	*			cis	-162.4	178.1	0.7	-135.3	-44.9	0	0	0	110.7
29	Q	30.1	Very low	31.3	Very low	161 Å²	161	130.3 Å²	130.3	75%	0.752	75%	0.749	S	S	*	*			trans	58.3	116.6	154	-68	158.2	51.7	0	0	117.8
30	A	31.6	Very low	32	Very low	89 Å²	89	127.6 Å²	127.6	74%	0.736	75%	0.749	S	S	*	*				56.2	123.8	97	0	0	0	0	0	114.2
31	T	28.8	Very low	32.9	Very low	120 Å²	120	128.7 Å²	128.7	74%	0.736	75%	0.747	S	S	*	*				-159.8	162.4	56.1	45.8	0	0	0	0	114.4
32	N	28.6	Very low	33.2	Very low	153 Å²	153	131.8 Å²	131.8	82%	0.818	74%	0.742	S	S	*	*			trans	39.1	113.7	146.4	-61.9	-21.9	0	0	0	121.7
33	S	32	Very low	33.4	Very low	107 Å²	107	128.1 Å²	128.1	75%	0.748	72%	0.717	S	S	*	*			trans	-148.7	93.1	146.1	31.8	0	0	0	0	113.1	F35	S33-F35 PolarHBondContact O-N 3.17Å
34	S	31.2	Very low	34.1	Very low	114 Å²	114	127.8 Å²	127.8	80%	0.797	71%	0.706	S	S	*	*			trans	16.4	96.8	144.1	39.3	0	0	0	0	119.5
35	F	35.3	Very low	34.9	Very low	216 Å²	216	131.7 Å²	131.7	95%	0.947	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-74.9	132	158.9	-97.8	-89.3	0	0	0	111.5	S33	S33-F35 PolarHBondContact O-N 3.17Å
36	Q	37.4	Very low	35.9	Very low	187 Å²	187	134.4 Å²	134.4	87%	0.874	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-75.3	141.1	-168.7	-66.9	173.2	-20	0	0	113.8
37	H	35.5	Very low	37.3	Very low	147 Å²	147	132.7 Å²	132.7	68%	0.681	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-77.5	125.5	-179.5	-165.2	-57.3	0	0	0	111.6	Q1325	H37-Q1325 PolarHBondContact O-NE2 2.77Å
38	N	40.1	Very low	39.7	Very low	103 Å²	103	129.7 Å²	129.7	55%	0.551	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-80.1	126.1	171.8	179.9	-21.6	0	0	0	110.1	D40	N38-D40 PolarHBondContact OD1-N 2.64Å
39	P	36.6	Very low	42.4	Very low	32 Å²	32	129.3 Å²	129.3	21%	0.208	66%	0.664	C	S	.	*	G	3₁₀ helix	trans	-72.7	-24.6	-175.1	27.2	-33.9	0	0	0	114.7	R41 K42 Q1325	P39-R41 PolarHBondContact O-N 3.38Å; P39-K42 PolarHBondContact O-N 3.12Å; P39-Q1325 HydrophobicContact CB-CB 4.28Å; P39-Q1325 HydrophobicContact CG-CB 4.16Å; P39-Q1325 HydrophobicContact CG-CG 4.23Å
40	D	42.1	Very low	45.3	Very low	139 Å²	139	122.6 Å²	122.6	74%	0.743	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-77.3	7.6	-169.9	-72.1	-29.7	0	0	0	114.2	N38	N38-D40 PolarHBondContact OD1-N 2.64Å
41	R	44.9	Very low	48.2	Very low	226 Å²	226	121 Å²	121	85%	0.853	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-104.6	20.8	175.2	-106.8	-172.5	-179.1	-159.5	1.3	114.7	P39 S43	P39-R41 PolarHBondContact O-N 3.38Å; R41-S43 PolarHBondContact O-N 3.21Å
42	K	36.9	Very low	51.2	Low	165 Å²	165	120.4 Å²	120.4	72%	0.717	61%	0.614	S	S	*	*	S	Bend	trans	-61	96.1	171.4	-77.5	-171.4	177	-174.4	0	111.6	P39	P39-K42 PolarHBondContact O-N 3.12Å
43	S	35	Very low	54.5	Low	41 Å²	41	113.1 Å²	113.1	29%	0.287	58%	0.575	S	S	.	*			trans	34	100.3	165.7	-168.6	0	0	0	0	117.7	R41 R45 D46	R41-S43 PolarHBondContact O-N 3.21Å; S43-R45 PolarHBondContact O-N 3.2Å; S43-R45 WeakPolarHBondContact OG-CB 3.44Å; S43-R45 PolarHBondContact OG-N 2.77Å; S43-D46 WeakPolarHBondContact CB-OD1 3.45Å; S43-D46 VanDerWaalsContact CB-OD2 3.29Å; S43-D46 WeakPolarHBondContact CB-OD2 3.08Å; S43-D46 PolarHBondContact O-N 2.87Å; S43-D46 PolarHBondContact OG-N 3.47Å; S43-D46 PolarHBondContact OG-OD1 3.39Å
44	L	44.5	Very low	57.6	Low	120 Å²	120	110.2 Å²	110.2	63%	0.628	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	1.9	159.2	-105.6	162.7	0	0	0	113.6	K54	L44-K54 WeakPolarHBondContact O-CE 3.49Å; L44-K54 PolarHBondContact O-NZ 3.27Å
45	R	43.5	Very low	60.6	Low	232 Å²	232	105.2 Å²	105.2	88%	0.875	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-16	175.6	-57	179.2	176.3	176.3	-2.3	112.9	S43 Q47	S43-R45 PolarHBondContact O-N 3.2Å; S43-R45 WeakPolarHBondContact OG-CB 3.44Å; S43-R45 PolarHBondContact OG-N 2.77Å; R45-Q47 VanDerWaalsContact C-N 3.28Å; R45-Q47 PolarHBondContact O-N 2.98Å
46	D	51.6	Low	63.5	Low	129 Å²	129	97.9 Å²	97.9	69%	0.69	48%	0.483	S	S	*	.			trans	-88.3	5.4	-174.9	-58.1	5.6	0	0	0	112.8	S43	S43-D46 WeakPolarHBondContact CB-OD1 3.45Å; S43-D46 VanDerWaalsContact CB-OD2 3.29Å; S43-D46 WeakPolarHBondContact CB-OD2 3.08Å; S43-D46 PolarHBondContact O-N 2.87Å; S43-D46 PolarHBondContact OG-N 3.47Å; S43-D46 PolarHBondContact OG-OD1 3.39Å
47	Q	58.5	Low	66.3	Low	53 Å²	53	94.9 Å²	94.9	25%	0.248	46%	0.464	C	S	.	.	S	Bend	trans	-73.5	130.9	175.5	-72.1	178.8	-9.1	0	0	110	R45 N49 K54	R45-Q47 VanDerWaalsContact C-N 3.28Å; R45-Q47 PolarHBondContact O-N 2.98Å; Q47-N49 PolarHBondContact O-N 2.88Å; Q47-K54 HydrophobicContact CB-CG 4.45Å
48	P	79.8	Confident	69.1	Low	80 Å²	80	90.5 Å²	90.5	52%	0.519	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-67.5	120.5	-175	26	-33.9	0	0	0	111.1	L55	P48-L55 VanDerWaalsContact O-CB 3.29Å; P48-L55 WeakPolarHBondContact O-CB 3.49Å; P48-L55 WeakPolarHBondContact O-CD1 3.26Å; P48-L55 WeakPolarHBondContact O-CG 3.25Å; P48-L55 PolarHBondContact O-N 3.4Å
49	N	86.5	Confident	71.6	Confident	102 Å²	102	88.6 Å²	88.6	55%	0.545	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	152.1	171.9	-65.1	-26.1	0	0	0	110.9	Q47 Y53 K54	Q47-N49 PolarHBondContact O-N 2.88Å; N49-Y53 CarbonylContact C-O 3.55Å; N49-Y53 VanDerWaalsContact CA-O 3.29Å; N49-Y53 WeakPolarHBondContact CA-O 3.3Å; N49-K54 WeakPolarHBondContact OD1-CA 3.33Å
50	V	90.8	Very high	74.1	Confident	20 Å²	20	88.5 Å²	88.5	12%	0.121	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	120	168.3	173.6	0	0	0	0	107.4	K52 Y53 L55 I119 Y126	V50-K52 PolarHBondContact O-N 3.19Å; V50-Y53 PolarHBondContact N-O 3.43Å; V50-Y53 WeakPolarHBondContact O-CB 3.42Å; V50-Y53 WeakPolarHBondContact O-CD2 3.11Å; V50-Y53 PolarHBondContact O-N 2.94Å; V50-L55 HydrophobicContact CG2-CD1 3.75Å; V50-L55 HydrophobicContact CG2-CG 4.36Å; V50-I119 HydrophobicContact CG1-CD1 4.13Å; V50-I119 HydrophobicContact CG1-CG2 4.41Å; V50-Y126 HydrophobicContact CB-CD1 4.49Å; V50-Y126 HydrophobicContact CB-CE1 4.41Å; V50-Y126 HydrophobicContact CG1-CD1 3.78Å; V50-Y126 HydrophobicContact CG1-CD2 3.8Å; V50-Y126 HydrophobicContact CG1-CE1 3.91Å; V50-Y126 HydrophobicContact CG1-CE2 3.93Å; V50-Y126 HydrophobicContact CG1-CG 3.74Å; V50-Y126 HydrophobicContact CG2-CD1 4.22Å; V50-Y126 HydrophobicContact CG2-CE1 3.7Å
51	G	91.8	Very high	76.3	Confident	55 Å²	55	91.4 Å²	91.4	57%	0.567	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	-128	-169.8	0	0	0	0	0	111.1
52	K	93.6	Very high	78	Confident	107 Å²	107	83 Å²	83	47%	0.465	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	19.2	172.6	-57.5	-58.4	-173.9	171.8	0	113.8	V50 H72 V73 N353	V50-K52 PolarHBondContact O-N 3.19Å; K52-H72 WeakPolarHBondContact CB-NE2 3.4Å; K52-H72 PolarHBondContact O-CD2 2.72Å; K52-V73 WeakPolarHBondContact O-CB 3.42Å; K52-V73 VanDerWaalsContact O-CG2 3.32Å; K52-V73 WeakPolarHBondContact O-CG2 3.33Å; K52-V73 PolarHBondContact O-N 3.33Å; K52-N353 WeakPolarHBondContact CG-OD1 3.26Å
53	Y	97	Very high	80	Confident	1 Å²	1	81 Å²	81	0%	0.004	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.9	-177.1	-53.9	-86	0	0	0	112.6	N49 V50 Q71 H72 V79 E117 I119 V128 A356	N49-Y53 CarbonylContact C-O 3.55Å; N49-Y53 VanDerWaalsContact CA-O 3.29Å; N49-Y53 WeakPolarHBondContact CA-O 3.3Å; V50-Y53 PolarHBondContact N-O 3.43Å; V50-Y53 WeakPolarHBondContact O-CB 3.42Å; V50-Y53 WeakPolarHBondContact O-CD2 3.11Å; V50-Y53 PolarHBondContact O-N 2.94Å; Y53-Q71 WeakPolarHBondContact CA-O 3.48Å; Y53-H72 HydrophobicContact CD1-CB 3.75Å; Y53-H72 AromaticContact CD1-CD2 3.8Å; Y53-H72 HydrophobicContact CE1-CB 3.6Å; Y53-H72 AromaticContact CE1-CD2 3.36Å; Y53-H72 WeakPolarHBondContact CE1-CD2 3.39Å; Y53-H72 AromaticContact CE1-CG 3.65Å; Y53-H72 AromaticContact CZ-CD2 3.64Å; Y53-V79 HydrophobicContact CD1-CG2 3.58Å; Y53-V79 HydrophobicContact CE1-CG2 3.91Å; Y53-E117 WeakPolarHBondContact CE2-OE2 3.29Å; Y53-E117 PolarHBondContact OH-OE2 3.08Å; Y53-I119 HydrophobicContact CD2-CD1 3.92Å; Y53-I119 HydrophobicContact CE2-CD1 3.93Å; Y53-V128 HydrophobicContact CD1-CG1 4.13Å; Y53-V128 HydrophobicContact CD2-CG2 4.04Å; Y53-V128 HydrophobicContact CE1-CG1 3.6Å; Y53-V128 HydrophobicContact CE2-CG1 4.3Å; Y53-V128 HydrophobicContact CE2-CG2 3.8Å; Y53-A356 WeakPolarHBondContact OH-CB 3.32Å
54	K	96.2	Very high	82.3	Confident	46 Å²	46	83.9 Å²	83.9	20%	0.2	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	114.4	174.1	-179.3	-177.3	-178.7	-179.2	0	110.1	L44 Q47 N49 I56 A70 Q71 V73	L44-K54 WeakPolarHBondContact O-CE 3.49Å; L44-K54 PolarHBondContact O-NZ 3.27Å; Q47-K54 HydrophobicContact CB-CG 4.45Å; N49-K54 WeakPolarHBondContact OD1-CA 3.33Å; K54-I56 PolarHBondContact O-N 2.78Å; K54-A70 CarbonylContact O-C 3.59Å; K54-A70 WeakPolarHBondContact O-CA 3.47Å; K54-A70 VanDerWaalsContact O-CB 3.3Å; K54-A70 WeakPolarHBondContact O-CB 3.35Å; K54-Q71 PolarHBondContact N-O 3.16Å; K54-Q71 PolarHBondContact O-N 2.98Å; K54-V73 HydrophobicContact CB-CG2 4.32Å
55	L	96	Very high	84.4	Confident	9 Å²	9	79.1 Å²	79.1	5%	0.047	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	113.5	-175.7	-57.7	179.7	0	0	0	111.9	P48 V50 K68 A70 V81	P48-L55 VanDerWaalsContact O-CB 3.29Å; P48-L55 WeakPolarHBondContact O-CB 3.49Å; P48-L55 WeakPolarHBondContact O-CD1 3.26Å; P48-L55 WeakPolarHBondContact O-CG 3.25Å; P48-L55 PolarHBondContact O-N 3.4Å; V50-L55 HydrophobicContact CG2-CD1 3.75Å; V50-L55 HydrophobicContact CG2-CG 4.36Å; L55-K68 HydrophobicContact CB-CD 4.09Å; L55-K68 HydrophobicContact CD1-CD 3.88Å; L55-K68 HydrophobicContact CD2-CB 4.48Å; L55-K68 HydrophobicContact CD2-CD 4.26Å; L55-K68 HydrophobicContact CG-CD 4.32Å; L55-A70 HydrophobicContact CD2-CB 3.82Å; L55-V81 HydrophobicContact CD2-CB 4.24Å; L55-V81 HydrophobicContact CD2-CG1 4.42Å; L55-V81 HydrophobicContact CD2-CG2 4.18Å
56	I	95.8	Very high	86.8	Confident	62 Å²	62	73.5 Å²	73.5	32%	0.318	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-66.1	-172.1	-60.6	171.8	0	0	0	112	K54 L69 Q71	K54-I56 PolarHBondContact O-N 2.78Å; I56-L69 HydrophobicContact CB-CG 4.5Å; I56-L69 HydrophobicContact CD1-CG 4.42Å; I56-L69 PolarHBondContact N-O 2.97Å; I56-Q71 HydrophobicContact CD1-CB 4.02Å
57	R	95.2	Very high	88.9	Confident	124 Å²	124	69.1 Å²	69.1	47%	0.468	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	158.6	-174.1	62.5	176.9	177.2	106.5	2.9	111.7	K68 L69 Y131	R57-K68 CarbonylContact O-C 3.57Å; R57-K68 WeakPolarHBondContact O-CA 3.29Å; R57-K68 WeakPolarHBondContact O-CB 3.46Å; R57-L69 HydrophobicContact CG-CB 3.81Å; R57-L69 HydrophobicContact CG-CD2 4.01Å; R57-L69 PolarHBondContact N-O 3.39Å; R57-L69 PolarHBondContact O-N 3.29Å; R57-Y131 PolarHBondContact NH2-OH 3.21Å
58	T	94.9	Very high	90.7	Very high	55 Å²	55	69.1 Å²	69.1	34%	0.337	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	131.1	169.7	-51.6	0	0	0	0	109.1	G60 R61 V67	T58-G60 WeakPolarHBondContact CG2-O 3.32Å; T58-R61 HydrophobicContact CG2-CG 3.78Å; T58-V67 WeakPolarHBondContact CG2-O 3.48Å
59	L	93.1	Very high	91.5	Very high	62 Å²	62	65.5 Å²	65.5	33%	0.325	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-46.8	170.5	-68.4	171.5	0	0	0	110.5	V67 L69 A80 Y131	L59-V67 HydrophobicContact CB-CB 4.48Å; L59-V67 HydrophobicContact CB-CG1 4.25Å; L59-V67 HydrophobicContact CD1-CG1 4.24Å; L59-V67 PolarHBondContact N-O 3.45Å; L59-L69 HydrophobicContact CD1-CB 4.01Å; L59-L69 HydrophobicContact CD2-CB 4.11Å; L59-L69 HydrophobicContact CG-CB 3.94Å; L59-A80 HydrophobicContact CD1-CB 4.23Å; L59-Y131 HydrophobicContact CD1-CD2 3.74Å; L59-Y131 HydrophobicContact CD1-CE2 3.72Å; L59-Y131 HydrophobicContact CD2-CE2 3.81Å; L59-Y131 HydrophobicContact CG-CE2 4.45Å
60	G	89.2	Confident	92.1	Very high	31 Å²	31	60.7 Å²	60.7	32%	0.32	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	163	-178.5	0	0	0	0	0	113.4	T58 V67	T58-G60 WeakPolarHBondContact CG2-O 3.32Å; G60-V67 PolarHBondContact N-O 2.9Å; G60-V67 PolarHBondContact O-N 3.33Å
61	R	88.2	Confident	92.3	Very high	200 Å²	200	63.4 Å²	63.4	76%	0.755	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.1	119.2	177.6	-60.9	-176.4	179.3	176.6	1.8	109.7	T58 K66	T58-R61 HydrophobicContact CG2-CG 3.78Å; R61-K66 HydrophobicContact CG-CG 4.35Å
62	G	80.7	Confident	92.5	Very high	50 Å²	50	60.8 Å²	60.8	52%	0.515	30%	0.302	S	S	.	.			trans	-107.4	-177.4	168.5	0	0	0	0	0	111.6	F64 A65	G62-F64 PolarHBondContact O-N 2.8Å; G62-A65 PolarHBondContact N-O 3.45Å
63	N	78.9	Confident	92.5	Very high	121 Å²	121	59.4 Å²	59.4	65%	0.647	30%	0.303	S	S	*	.	S	Bend	trans	-60	-39.6	-174.2	-66.9	-10.2	0	0	0	113.9
64	F	82	Confident	92.3	Very high	103 Å²	103	60.4 Å²	60.4	45%	0.452	31%	0.31	S	S	.	.	S	Bend	trans	-120.6	1.3	-174.9	-50.6	-74	0	0	0	113.4	G62 L89	G62-F64 PolarHBondContact O-N 2.8Å; F64-L89 HydrophobicContact CB-CD2 3.91Å; F64-L89 HydrophobicContact CD1-CD2 4.22Å; F64-L89 HydrophobicContact CG-CD2 4.09Å
65	A	89.8	Confident	92.2	Very high	19 Å²	19	58.2 Å²	58.2	16%	0.157	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	149.8	-169.7	0	0	0	0	0	112.4	G62 K82 V83 I84	G62-A65 PolarHBondContact N-O 3.45Å; A65-K82 HydrophobicContact CB-CG 4.25Å; A65-V83 CarbonylContact C-O 3.45Å; A65-V83 WeakPolarHBondContact CA-O 3.42Å; A65-I84 HydrophobicContact CB-CG1 3.99Å
66	K	93.1	Very high	92	Very high	114 Å²	114	58.6 Å²	58.6	50%	0.496	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	119.3	175.8	-63.8	166.8	-172.6	157.5	0	108.6	R61 V83	R61-K66 HydrophobicContact CG-CG 4.35Å; K66-V83 PolarHBondContact N-O 2.98Å; K66-V83 WeakPolarHBondContact O-CB 3.39Å; K66-V83 PolarHBondContact O-N 2.76Å
67	V	95.3	Very high	92	Very high	38 Å²	38	59.1 Å²	59.1	23%	0.23	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	128.9	176.3	-173.1	0	0	0	0	108.6	T58 L59 G60 A80 V81 K82 M129	T58-V67 WeakPolarHBondContact CG2-O 3.48Å; L59-V67 HydrophobicContact CB-CB 4.48Å; L59-V67 HydrophobicContact CB-CG1 4.25Å; L59-V67 HydrophobicContact CD1-CG1 4.24Å; L59-V67 PolarHBondContact N-O 3.45Å; G60-V67 PolarHBondContact N-O 2.9Å; G60-V67 PolarHBondContact O-N 3.33Å; V67-A80 HydrophobicContact CG1-CB 4.19Å; V67-V81 CarbonylContact C-O 3.49Å; V67-V81 WeakPolarHBondContact CA-O 3.35Å; V67-K82 HydrophobicContact CG2-CB 4.36Å; V67-K82 HydrophobicContact CG2-CG 4.21Å; V67-M129 HydrophobicContact CG1-CE 4.5Å
68	K	96.8	Very high	92	Very high	53 Å²	53	57 Å²	57	23%	0.23	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	143.3	177	-68.8	-178	175.8	-173.8	0	111	L55 R57 A80 V81 V83	L55-K68 HydrophobicContact CB-CD 4.09Å; L55-K68 HydrophobicContact CD1-CD 3.88Å; L55-K68 HydrophobicContact CD2-CB 4.48Å; L55-K68 HydrophobicContact CD2-CD 4.26Å; L55-K68 HydrophobicContact CG-CD 4.32Å; R57-K68 CarbonylContact O-C 3.57Å; R57-K68 WeakPolarHBondContact O-CA 3.29Å; R57-K68 WeakPolarHBondContact O-CB 3.46Å; K68-A80 CarbonylContact O-C 3.58Å; K68-A80 WeakPolarHBondContact O-CA 3.45Å; K68-V81 PolarHBondContact N-O 2.95Å; K68-V81 PolarHBondContact O-N 3.3Å; K68-V83 HydrophobicContact CD-CG2 4.34Å
69	L	97.4	Very high	92.2	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	134.6	160.7	-177.7	62.6	0	0	0	107.9	I56 R57 L59 E78 Y131	I56-L69 HydrophobicContact CB-CG 4.5Å; I56-L69 HydrophobicContact CD1-CG 4.42Å; I56-L69 PolarHBondContact N-O 2.97Å; R57-L69 HydrophobicContact CG-CB 3.81Å; R57-L69 HydrophobicContact CG-CD2 4.01Å; R57-L69 PolarHBondContact N-O 3.39Å; R57-L69 PolarHBondContact O-N 3.29Å; L59-L69 HydrophobicContact CD1-CB 4.01Å; L59-L69 HydrophobicContact CD2-CB 4.11Å; L59-L69 HydrophobicContact CG-CB 3.94Å; L69-E78 HydrophobicContact CD1-CB 4.04Å; L69-E78 HydrophobicContact CD1-CG 4.45Å; L69-Y131 HydrophobicContact CD1-CD1 3.61Å; L69-Y131 HydrophobicContact CD1-CD2 3.96Å; L69-Y131 HydrophobicContact CD1-CE1 3.59Å; L69-Y131 HydrophobicContact CD1-CE2 3.96Å; L69-Y131 HydrophobicContact CD1-CG 3.81Å
70	A	97.8	Very high	92.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	158.2	174.2	0	0	0	0	0	110.6	K54 L55 E78 V79 V81	K54-A70 CarbonylContact O-C 3.59Å; K54-A70 WeakPolarHBondContact O-CA 3.47Å; K54-A70 VanDerWaalsContact O-CB 3.3Å; K54-A70 WeakPolarHBondContact O-CB 3.35Å; L55-A70 HydrophobicContact CD2-CB 3.82Å; A70-E78 CarbonylContact O-C 3.51Å; A70-E78 WeakPolarHBondContact O-CA 3.27Å; A70-V79 HydrophobicContact CB-CG2 4.1Å; A70-V79 PolarHBondContact N-O 3.48Å; A70-V79 PolarHBondContact O-N 3.49Å; A70-V81 HydrophobicContact CB-CG2 3.65Å
71	Q	96.7	Very high	92.8	Very high	77 Å²	77	50.2 Å²	50.2	36%	0.36	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.6	169.4	-176.6	173.7	42.5	0	0	109.3	Y53 K54 I56 V73 G76	Y53-Q71 WeakPolarHBondContact CA-O 3.48Å; K54-Q71 PolarHBondContact N-O 3.16Å; K54-Q71 PolarHBondContact O-N 2.98Å; I56-Q71 HydrophobicContact CD1-CB 4.02Å; Q71-V73 PolarHBondContact O-N 2.88Å; Q71-G76 WeakPolarHBondContact CG-O 3.41Å; Q71-G76 PolarHBondContact NE2-O 3.38Å
72	H	95.9	Very high	93.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	121.2	169.9	-176.9	-124.7	0	0	0	109.8	K52 Y53 S74 T75 G76 R77 L360	K52-H72 WeakPolarHBondContact CB-NE2 3.4Å; K52-H72 PolarHBondContact O-CD2 2.72Å; Y53-H72 HydrophobicContact CD1-CB 3.75Å; Y53-H72 AromaticContact CD1-CD2 3.8Å; Y53-H72 HydrophobicContact CE1-CB 3.6Å; Y53-H72 AromaticContact CE1-CD2 3.36Å; Y53-H72 WeakPolarHBondContact CE1-CD2 3.39Å; Y53-H72 AromaticContact CE1-CG 3.65Å; Y53-H72 AromaticContact CZ-CD2 3.64Å; H72-S74 VanDerWaalsContact CE1-CB 3.46Å; H72-S74 WeakPolarHBondContact CE1-CB 3.21Å; H72-S74 PolarHBondContact CE1-OG 3.45Å; H72-S74 PolarHBondContact NE2-OG 3.11Å; H72-S74 PolarHBondContact O-N 3.41Å; H72-T75 PolarHBondContact ND1-N 2.78Å; H72-T75 PolarHBondContact ND1-OG1 2.89Å; H72-G76 VanDerWaalsContact O-CA 3.3Å; H72-G76 WeakPolarHBondContact O-CA 3.48Å; H72-G76 PolarHBondContact O-N 2.84Å; H72-R77 PolarHBondContact N-O 3.03Å; H72-L360 HydrophobicContact CB-CD1 3.95Å
73	V	93.7	Very high	93.8	Very high	79 Å²	79	40.1 Å²	40.1	48%	0.479	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-36.9	-170.2	174.4	0	0	0	0	111.9	K52 K54 Q71	K52-V73 WeakPolarHBondContact O-CB 3.42Å; K52-V73 VanDerWaalsContact O-CG2 3.32Å; K52-V73 WeakPolarHBondContact O-CG2 3.33Å; K52-V73 PolarHBondContact O-N 3.33Å; K54-V73 HydrophobicContact CB-CG2 4.32Å; Q71-V73 PolarHBondContact O-N 2.88Å
74	S	91.7	Very high	94.5	Very high	22 Å²	22	34.8 Å²	34.8	15%	0.154	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-23.7	-174.7	-29.8	0	0	0	0	113.8	H72 S374	H72-S74 VanDerWaalsContact CE1-CB 3.46Å; H72-S74 WeakPolarHBondContact CE1-CB 3.21Å; H72-S74 PolarHBondContact CE1-OG 3.45Å; H72-S74 PolarHBondContact NE2-OG 3.11Å; H72-S74 PolarHBondContact O-N 3.41Å; S74-S374 WeakPolarHBondContact O-CB 3.35Å; S74-S374 PolarHBondContact O-OG 3Å
75	T	93.6	Very high	94.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-2.4	-179.3	64.2	0	0	0	0	114.2	H72 R77 M335 I357 L360 L361 L370	H72-T75 PolarHBondContact ND1-N 2.78Å; H72-T75 PolarHBondContact ND1-OG1 2.89Å; T75-R77 PolarHBondContact O-N 3.33Å; T75-M335 HydrophobicContact CG2-CE 4.47Å; T75-I357 HydrophobicContact CG2-CG2 4.32Å; T75-L360 HydrophobicContact CG2-CB 4.49Å; T75-L361 HydrophobicContact CG2-CD2 4.2Å; T75-L361 HydrophobicContact CG2-CG 4.37Å; T75-L370 HydrophobicContact CG2-CD2 4.31Å
76	G	93.2	Very high	95	Very high	17 Å²	17	32.4 Å²	32.4	18%	0.175	16%	0.163	C	C	.	.			trans	70	-4.6	-179.3	0	0	0	0	0	115.4	Q71 H72	Q71-G76 WeakPolarHBondContact CG-O 3.41Å; Q71-G76 PolarHBondContact NE2-O 3.38Å; H72-G76 VanDerWaalsContact O-CA 3.3Å; H72-G76 WeakPolarHBondContact O-CA 3.48Å; H72-G76 PolarHBondContact O-N 2.84Å
77	R	94.6	Very high	94.7	Very high	72 Å²	72	31.9 Å²	31.9	27%	0.272	17%	0.17	S	C	.	.			trans	-77.9	140.8	-172.2	-169.7	52.6	171	-115	6.8	112.8	H72 T75 L360 D363 T366	H72-R77 PolarHBondContact N-O 3.03Å; T75-R77 PolarHBondContact O-N 3.33Å; R77-L360 HydrophobicContact CB-CD2 4.3Å; R77-L360 HydrophobicContact CG-CD2 4.03Å; R77-D363 IonicContact CZ-OD2 3.82Å; R77-D363 VanDerWaalsContact CZ-OD2 3.22Å; R77-D363 VanDerWaalsContact NH1-CG 3.35Å; R77-D363 IonicContact NH1-OD2 2.65Å; R77-D363 PolarHBondContact NH1-OD2 3.13Å; R77-D363 IonicContact NH2-OD2 2.62Å; R77-D363 PolarHBondContact NH2-OD2 2.88Å; R77-T366 HydrophobicContact CB-CG2 4.22Å; R77-T366 PolarHBondContact NH1-OG1 3.38Å
78	E	96.6	Very high	94.3	Very high	79 Å²	79	35.2 Å²	35.2	37%	0.369	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	140.4	171.4	-65.3	-159.7	129.1	0	0	112.1	L69 A70 Y131	L69-E78 HydrophobicContact CD1-CB 4.04Å; L69-E78 HydrophobicContact CD1-CG 4.45Å; A70-E78 CarbonylContact O-C 3.51Å; A70-E78 WeakPolarHBondContact O-CA 3.27Å; E78-Y131 HydrophobicContact CB-CD1 4.04Å
79	V	97.4	Very high	93.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	158.9	-177.9	-64.1	0	0	0	0	111	Y53 A70 V81 Y116 V128 M129 L360	Y53-V79 HydrophobicContact CD1-CG2 3.58Å; Y53-V79 HydrophobicContact CE1-CG2 3.91Å; A70-V79 HydrophobicContact CB-CG2 4.1Å; A70-V79 PolarHBondContact N-O 3.48Å; A70-V79 PolarHBondContact O-N 3.49Å; V79-V81 HydrophobicContact CG2-CG2 4.28Å; V79-Y116 HydrophobicContact CG1-CD2 4.11Å; V79-Y116 HydrophobicContact CG1-CE2 4.21Å; V79-V128 HydrophobicContact CB-CG1 3.99Å; V79-V128 HydrophobicContact CG1-CG1 4.35Å; V79-V128 HydrophobicContact CG2-CG1 3.79Å; V79-M129 WeakPolarHBondContact CB-O 3.31Å; V79-L360 HydrophobicContact CG1-CD1 4.41Å; V79-L360 HydrophobicContact CG1-CD2 3.79Å
80	A	97.8	Very high	93.4	Very high	6 Å²	6	38.5 Å²	38.5	5%	0.05	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	119.8	175.3	0	0	0	0	0	110.7	L59 V67 K68 M129	L59-A80 HydrophobicContact CD1-CB 4.23Å; V67-A80 HydrophobicContact CG1-CB 4.19Å; K68-A80 CarbonylContact O-C 3.58Å; K68-A80 WeakPolarHBondContact O-CA 3.45Å; A80-M129 HydrophobicContact CB-CE 4.2Å; A80-M129 PolarHBondContact N-O 3.28Å; A80-M129 WeakPolarHBondContact O-CB 3.39Å; A80-M129 PolarHBondContact O-N 3.35Å
81	V	97.2	Very high	92.9	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	110.2	-179.2	-174.4	0	0	0	0	110.1	L55 V67 K68 A70 V79 V83 Y126 L127 V128	L55-V81 HydrophobicContact CD2-CB 4.24Å; L55-V81 HydrophobicContact CD2-CG1 4.42Å; L55-V81 HydrophobicContact CD2-CG2 4.18Å; V67-V81 CarbonylContact C-O 3.49Å; V67-V81 WeakPolarHBondContact CA-O 3.35Å; K68-V81 PolarHBondContact N-O 2.95Å; K68-V81 PolarHBondContact O-N 3.3Å; A70-V81 HydrophobicContact CB-CG2 3.65Å; V79-V81 HydrophobicContact CG2-CG2 4.28Å; V81-V83 HydrophobicContact CG1-CG2 4.3Å; V81-V83 PolarHBondContact O-N 3.3Å; V81-Y126 HydrophobicContact CG1-CD1 4.21Å; V81-L127 CarbonylContact C-O 3.54Å; V81-L127 WeakPolarHBondContact CA-O 3.34Å; V81-V128 HydrophobicContact CG2-CG1 4.47Å; V81-V128 HydrophobicContact CG2-CG2 4.3Å
82	K	95.5	Very high	92.4	Very high	18 Å²	18	45.2 Å²	45.2	8%	0.078	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	100.7	172.9	-170.6	177	-173.5	177.3	0	108.7	A65 V67 I84 E100 Y126 L127 M129 D193	A65-K82 HydrophobicContact CB-CG 4.25Å; V67-K82 HydrophobicContact CG2-CB 4.36Å; V67-K82 HydrophobicContact CG2-CG 4.21Å; K82-I84 HydrophobicContact CD-CD1 4.24Å; K82-I84 HydrophobicContact CG-CD1 4.17Å; K82-I84 HydrophobicContact CG-CG1 4.1Å; K82-E100 IonicContact NZ-OE1 3.7Å; K82-E100 PolarHBondContact NZ-OE1 3.44Å; K82-E100 IonicContact NZ-OE2 2.63Å; K82-Y126 WeakPolarHBondContact O-CA 3.4Å; K82-L127 HydrophobicContact CB-CB 4.24Å; K82-L127 HydrophobicContact CD-CD1 4.45Å; K82-L127 PolarHBondContact N-O 2.75Å; K82-L127 PolarHBondContact O-N 3.32Å; K82-M129 HydrophobicContact CB-CE 3.87Å; K82-M129 HydrophobicContact CB-SD 4.29Å; K82-D193 IonicContact NZ-OD1 3.19Å; K82-D193 PolarHBondContact NZ-OD1 2.98Å
83	V	94.7	Very high	91.9	Very high	20 Å²	20	46.7 Å²	46.7	12%	0.121	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	122.6	177.3	-171.9	0	0	0	0	109.3	A65 K66 K68 V81 Y126	A65-V83 CarbonylContact C-O 3.45Å; A65-V83 WeakPolarHBondContact CA-O 3.42Å; K66-V83 PolarHBondContact N-O 2.98Å; K66-V83 WeakPolarHBondContact O-CB 3.39Å; K66-V83 PolarHBondContact O-N 2.76Å; K68-V83 HydrophobicContact CD-CG2 4.34Å; V81-V83 HydrophobicContact CG1-CG2 4.3Å; V81-V83 PolarHBondContact O-N 3.3Å; V83-Y126 HydrophobicContact CB-CD1 4.23Å; V83-Y126 HydrophobicContact CB-CE1 4.36Å; V83-Y126 HydrophobicContact CG1-CD1 3.9Å; V83-Y126 HydrophobicContact CG1-CE1 3.6Å; V83-Y126 HydrophobicContact CG2-CD1 3.9Å; V83-Y126 HydrophobicContact CG2-CE1 4.12Å
84	I	93.3	Very high	91.6	Very high	8 Å²	8	45.1 Å²	45.1	4%	0.041	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129.8	-176.8	-51	178.6	0	0	0	108.8	A65 K82 L89 L97 H124 V125 L127	A65-I84 HydrophobicContact CB-CG1 3.99Å; K82-I84 HydrophobicContact CD-CD1 4.24Å; K82-I84 HydrophobicContact CG-CD1 4.17Å; K82-I84 HydrophobicContact CG-CG1 4.1Å; I84-L89 HydrophobicContact CG2-CD1 3.97Å; I84-L97 HydrophobicContact CD1-CD1 3.52Å; I84-L97 HydrophobicContact CG2-CD2 4.19Å; I84-H124 CarbonylContact O-C 3.55Å; I84-H124 WeakPolarHBondContact O-CA 3.4Å; I84-H124 WeakPolarHBondContact O-CB 3.03Å; I84-V125 PolarHBondContact N-O 3.06Å; I84-V125 PolarHBondContact O-N 3.43Å; I84-L127 HydrophobicContact CD1-CD1 4.24Å; I84-L127 HydrophobicContact CD1-CG 4.44Å
85	D	91.3	Very high	91.3	Very high	31 Å²	31	51 Å²	51	17%	0.166	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	109.9	-178.8	-178.5	-13.4	0	0	0	110.3	T87 Q88	D85-T87 PolarHBondContact O-N 2.68Å; D85-T87 WeakPolarHBondContact OD1-CB 3.43Å; D85-T87 PolarHBondContact OD1-N 2.79Å; D85-T87 PolarHBondContact OD1-OG1 3.07Å; D85-T87 PolarHBondContact OD2-OG1 3.12Å; D85-Q88 HydrophobicContact CB-CG 4.39Å; D85-Q88 PolarHBondContact O-N 2.88Å; D85-Q88 PolarHBondContact OD2-NE2 2.61Å
86	K	91	Very high	91	Very high	42 Å²	42	54 Å²	54	18%	0.183	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-63.5	-28	-179.3	-71.8	-169.4	-72.8	175.6	0	112.5	Q88 L89 L94 E120 S121 E122 R123 V125	K86-Q88 PolarHBondContact O-N 2.82Å; K86-L89 PolarHBondContact O-N 3.43Å; K86-L94 HydrophobicContact CG-CD2 4.29Å; K86-E120 WeakPolarHBondContact CD-OE1 3.46Å; K86-E120 WeakPolarHBondContact CE-OE1 3.28Å; K86-E120 IonicContact NZ-OE1 2.66Å; K86-E120 PolarHBondContact NZ-OE1 2.92Å; K86-S121 WeakPolarHBondContact CE-O 3.49Å; K86-S121 PolarHBondContact NZ-O 2.68Å; K86-E122 WeakPolarHBondContact CE-O 3.34Å; K86-E122 PolarHBondContact NZ-O 2.83Å; K86-R123 WeakPolarHBondContact CB-O 3.21Å; K86-R123 PolarHBondContact N-O 3.15Å; K86-V125 HydrophobicContact CD-CG2 3.85Å; K86-V125 HydrophobicContact CG-CG2 3.96Å
87	T	88.4	Confident	90.9	Very high	102 Å²	102	53.6 Å²	53.6	63%	0.626	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-69.4	-17.5	-178.4	72.9	0	0	0	0	112.8	D85 R123	D85-T87 PolarHBondContact O-N 2.68Å; D85-T87 WeakPolarHBondContact OD1-CB 3.43Å; D85-T87 PolarHBondContact OD1-N 2.79Å; D85-T87 PolarHBondContact OD1-OG1 3.07Å; D85-T87 PolarHBondContact OD2-OG1 3.12Å; T87-R123 HydrophobicContact CG2-CB 4.31Å; T87-R123 HydrophobicContact CG2-CG 4.37Å
88	Q	86.7	Confident	90.7	Very high	108 Å²	108	55.2 Å²	55.2	51%	0.505	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-98.2	1.5	177.5	-60.8	-177.4	51.8	0	0	113.2	D85 K86	D85-Q88 HydrophobicContact CB-CG 4.39Å; D85-Q88 PolarHBondContact O-N 2.88Å; D85-Q88 PolarHBondContact OD2-NE2 2.61Å; K86-Q88 PolarHBondContact O-N 2.82Å
89	L	85.8	Confident	90.5	Very high	24 Å²	24	54.9 Å²	54.9	13%	0.126	28%	0.279	C	S	.	.			trans	-102.1	128.6	-179	-56.7	-177	0	0	0	111.1	F64 I84 K86 L94 L97	F64-L89 HydrophobicContact CB-CD2 3.91Å; F64-L89 HydrophobicContact CD1-CD2 4.22Å; F64-L89 HydrophobicContact CG-CD2 4.09Å; I84-L89 HydrophobicContact CG2-CD1 3.97Å; K86-L89 PolarHBondContact O-N 3.43Å; L89-L94 HydrophobicContact CB-CD2 3.97Å; L89-L94 HydrophobicContact CB-CG 3.87Å; L89-L94 HydrophobicContact CD1-CD2 3.77Å; L89-L94 HydrophobicContact CD1-CG 4.42Å; L89-L94 HydrophobicContact CG-CD2 4.49Å; L89-L97 HydrophobicContact CD1-CD2 3.85Å
90	N	89.4	Confident	90.3	Very high	103 Å²	103	55.6 Å²	55.6	55%	0.551	28%	0.283	S	S	*	.			trans	-75.6	167.7	164.3	69.7	28.2	0	0	0	110.7	A92 S93 L94	N90-A92 PolarHBondContact O-N 2.99Å; N90-A92 VanDerWaalsContact O-N 3.15Å; N90-A92 PolarHBondContact OD1-N 3.2Å; N90-S93 CarbonylContact O-C 3.42Å; N90-S93 WeakPolarHBondContact O-CA 3.36Å; N90-S93 WeakPolarHBondContact O-CB 3.32Å; N90-S93 PolarHBondContact O-N 3.22Å; N90-S93 PolarHBondContact OD1-N 3.46Å; N90-S93 PolarHBondContact OD1-OG 3.09Å; N90-L94 PolarHBondContact O-N 2.79Å
91	Q	86.9	Confident	90	Very high	147 Å²	147	55.9 Å²	55.9	69%	0.687	28%	0.284	S	S	*	.	H	α-helix	trans	-58.6	-31	-175.8	-159.6	-176.3	26.4	0	0	113.6	K95	Q91-K95 WeakPolarHBondContact O-CG 3.31Å; Q91-K95 PolarHBondContact O-N 3Å
92	A	85.4	Confident	89.9	Confident	71 Å²	71	60.4 Å²	60.4	59%	0.587	31%	0.308	S	S	*	.	H	α-helix	trans	-70.6	-39.6	174.7	0	0	0	0	0	112.1	N90 K95 K96	N90-A92 PolarHBondContact O-N 2.99Å; N90-A92 VanDerWaalsContact O-N 3.15Å; N90-A92 PolarHBondContact OD1-N 3.2Å; A92-K95 PolarHBondContact O-N 3.35Å; A92-K96 WeakPolarHBondContact O-CB 3.33Å; A92-K96 PolarHBondContact O-N 3.12Å
93	S	85.6	Confident	89.9	Confident	31 Å²	31	59.7 Å²	59.7	22%	0.217	31%	0.305	C	S	.	.	H	α-helix	trans	-69.6	-31.7	173.2	-66.4	0	0	0	0	112.9	N90 K96 L97	N90-S93 CarbonylContact O-C 3.42Å; N90-S93 WeakPolarHBondContact O-CA 3.36Å; N90-S93 WeakPolarHBondContact O-CB 3.32Å; N90-S93 PolarHBondContact O-N 3.22Å; N90-S93 PolarHBondContact OD1-N 3.46Å; N90-S93 PolarHBondContact OD1-OG 3.09Å; S93-K96 WeakPolarHBondContact O-CB 3.26Å; S93-K96 PolarHBondContact O-N 3Å; S93-L97 WeakPolarHBondContact O-CB 3.35Å; S93-L97 PolarHBondContact O-N 3.03Å
94	L	86.7	Confident	89.9	Confident	45 Å²	45	59.4 Å²	59.4	24%	0.236	30%	0.302	C	S	.	.	H	α-helix	trans	-66	-47.3	170	-72.2	168.8	0	0	0	111.2	K86 L89 N90 K96 L97 F98	K86-L94 HydrophobicContact CG-CD2 4.29Å; L89-L94 HydrophobicContact CB-CD2 3.97Å; L89-L94 HydrophobicContact CB-CG 3.87Å; L89-L94 HydrophobicContact CD1-CD2 3.77Å; L89-L94 HydrophobicContact CD1-CG 4.42Å; L89-L94 HydrophobicContact CG-CD2 4.49Å; N90-L94 PolarHBondContact O-N 2.79Å; L94-K96 VanDerWaalsContact C-N 3.26Å; L94-K96 PolarHBondContact O-N 3.02Å; L94-L97 WeakPolarHBondContact O-CB 3.21Å; L94-L97 PolarHBondContact O-N 3.21Å; L94-L97 VanDerWaalsContact O-N 3.07Å; L94-F98 HydrophobicContact CB-CE2 4.41Å; L94-F98 WeakPolarHBondContact O-CD2 3.4Å; L94-F98 PolarHBondContact O-N 3.37Å
95	K	87.2	Confident	90	Very high	146 Å²	146	61.8 Å²	61.8	64%	0.635	31%	0.312	S	S	*	.	H	α-helix	trans	-58.8	-37.2	172.7	-73.2	-175.8	177.3	-171.2	0	112.3	Q91 A92 R99	Q91-K95 WeakPolarHBondContact O-CG 3.31Å; Q91-K95 PolarHBondContact O-N 3Å; A92-K95 PolarHBondContact O-N 3.35Å; K95-R99 PolarHBondContact O-N 3.33Å; K95-R99 VanDerWaalsContact O-N 3.15Å
96	K	86.9	Confident	90.1	Very high	63 Å²	63	64.5 Å²	64.5	27%	0.274	33%	0.325	S	S	.	.	H	α-helix	trans	-62.3	-44.3	172.2	-175.1	-174.1	176.5	-173.9	0	111.8	A92 S93 L94 R99 E100 G195	A92-K96 WeakPolarHBondContact O-CB 3.33Å; A92-K96 PolarHBondContact O-N 3.12Å; S93-K96 WeakPolarHBondContact O-CB 3.26Å; S93-K96 PolarHBondContact O-N 3Å; L94-K96 VanDerWaalsContact C-N 3.26Å; L94-K96 PolarHBondContact O-N 3.02Å; K96-R99 PolarHBondContact O-N 2.96Å; K96-E100 PolarHBondContact O-N 3.05Å; K96-G195 WeakPolarHBondContact CE-O 3.21Å; K96-G195 WeakPolarHBondContact CG-O 3.28Å
97	L	90	Very high	90.3	Very high	8 Å²	8	63 Å²	63	4%	0.042	32%	0.319	C	S	.	.	H	α-helix	trans	-64.4	-47.8	178.1	174.5	58.7	0	0	0	112.4	I84 L89 S93 L94 R99 E100 V101 V125	I84-L97 HydrophobicContact CD1-CD1 3.52Å; I84-L97 HydrophobicContact CG2-CD2 4.19Å; L89-L97 HydrophobicContact CD1-CD2 3.85Å; S93-L97 WeakPolarHBondContact O-CB 3.35Å; S93-L97 PolarHBondContact O-N 3.03Å; L94-L97 WeakPolarHBondContact O-CB 3.21Å; L94-L97 PolarHBondContact O-N 3.21Å; L94-L97 VanDerWaalsContact O-N 3.07Å; L97-R99 VanDerWaalsContact C-N 3.27Å; L97-R99 PolarHBondContact O-N 3.24Å; L97-E100 WeakPolarHBondContact O-CB 3.48Å; L97-E100 PolarHBondContact O-N 3.47Å; L97-E100 VanDerWaalsContact O-N 3.12Å; L97-V101 HydrophobicContact CD1-CG2 4.18Å; L97-V101 WeakPolarHBondContact O-CG2 3.28Å; L97-V101 PolarHBondContact O-N 3.33Å; L97-V125 HydrophobicContact CD2-CB 4.29Å; L97-V125 HydrophobicContact CD2-CG2 4.13Å
98	F	90.8	Very high	90.6	Very high	106 Å²	106	59.7 Å²	59.7	47%	0.465	30%	0.298	S	S	.	.	H	α-helix	trans	-60.9	-37.5	177	-70.2	-62.8	0	0	0	112	L94 V101 N102	L94-F98 HydrophobicContact CB-CE2 4.41Å; L94-F98 WeakPolarHBondContact O-CD2 3.4Å; L94-F98 PolarHBondContact O-N 3.37Å; F98-V101 PolarHBondContact O-N 3.27Å; F98-N102 WeakPolarHBondContact O-CB 3.25Å; F98-N102 VanDerWaalsContact O-CG 3.25Å; F98-N102 PolarHBondContact O-N 3.4Å; F98-N102 PolarHBondContact O-OD1 3.1Å
99	R	92	Very high	91.1	Very high	73 Å²	73	55 Å²	55	28%	0.275	28%	0.276	S	S	.	.	H	α-helix	trans	-66.2	-41.7	172.6	-170.5	-179	66.9	-133.9	-11.4	112.6	K95 K96 L97 N102 I103 S197 N198	K95-R99 PolarHBondContact O-N 3.33Å; K95-R99 VanDerWaalsContact O-N 3.15Å; K96-R99 PolarHBondContact O-N 2.96Å; L97-R99 VanDerWaalsContact C-N 3.27Å; L97-R99 PolarHBondContact O-N 3.24Å; R99-N102 PolarHBondContact O-N 2.87Å; R99-I103 HydrophobicContact CG-CD1 3.82Å; R99-I103 HydrophobicContact CG-CG1 4.36Å; R99-I103 WeakPolarHBondContact O-CB 3.12Å; R99-I103 WeakPolarHBondContact O-CG1 3.31Å; R99-I103 PolarHBondContact O-N 3.08Å; R99-S197 PolarHBondContact NE-O 3.02Å; R99-S197 PolarHBondContact NH2-O 3.22Å; R99-N198 WeakPolarHBondContact CD-OD1 3.32Å; R99-N198 PolarHBondContact NE-OD1 2.91Å; R99-N198 VanDerWaalsContact NE-OD1 3.16Å; R99-N198 PolarHBondContact NH1-OD1 2.71Å
100	E	92.9	Very high	91.7	Very high	14 Å²	14	57 Å²	57	7%	0.065	29%	0.291	C	S	.	.	H	α-helix	trans	-57.8	-48.2	175	-177.9	-177.4	160.7	0	0	110.9	K82 K96 L97 I103 M104 F194 G195	K82-E100 IonicContact NZ-OE1 3.7Å; K82-E100 PolarHBondContact NZ-OE1 3.44Å; K82-E100 IonicContact NZ-OE2 2.63Å; K96-E100 PolarHBondContact O-N 3.05Å; L97-E100 WeakPolarHBondContact O-CB 3.48Å; L97-E100 PolarHBondContact O-N 3.47Å; L97-E100 VanDerWaalsContact O-N 3.12Å; E100-I103 PolarHBondContact O-N 3.3Å; E100-M104 HydrophobicContact CG-SD 4.14Å; E100-M104 WeakPolarHBondContact O-CB 3.46Å; E100-M104 VanDerWaalsContact O-CG 3.3Å; E100-M104 WeakPolarHBondContact O-CG 3.46Å; E100-M104 PolarHBondContact O-N 3.19Å; E100-F194 HydrophobicContact CG-CB 4.44Å; E100-G195 VanDerWaalsContact CD-CA 3.47Å; E100-G195 WeakPolarHBondContact OE2-CA 3.44Å
101	V	93.4	Very high	92.1	Very high	13 Å²	13	52.9 Å²	52.9	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-50	176.7	173.8	0	0	0	0	111.4	L97 F98 I103 M104 K105 V118 L127	L97-V101 HydrophobicContact CD1-CG2 4.18Å; L97-V101 WeakPolarHBondContact O-CG2 3.28Å; L97-V101 PolarHBondContact O-N 3.33Å; F98-V101 PolarHBondContact O-N 3.27Å; V101-I103 VanDerWaalsContact C-N 3.34Å; V101-I103 PolarHBondContact O-N 2.89Å; V101-M104 PolarHBondContact O-N 3.16Å; V101-K105 WeakPolarHBondContact O-CG 3.32Å; V101-K105 PolarHBondContact O-N 3.22Å; V101-V118 HydrophobicContact CG1-CG1 4.49Å; V101-V118 HydrophobicContact CG1-CG2 3.94Å; V101-L127 HydrophobicContact CG2-CD1 4.08Å; V101-L127 HydrophobicContact CG2-CD2 3.63Å
102	N	94.2	Very high	92.6	Very high	96 Å²	96	46 Å²	46	51%	0.513	24%	0.236	S	C	.	.	H	α-helix	trans	-62.4	-40.8	-179	-70.9	0.3	0	0	0	112.1	F98 R99 K105 M106	F98-N102 WeakPolarHBondContact O-CB 3.25Å; F98-N102 VanDerWaalsContact O-CG 3.25Å; F98-N102 PolarHBondContact O-N 3.4Å; F98-N102 PolarHBondContact O-OD1 3.1Å; R99-N102 PolarHBondContact O-N 2.87Å; N102-K105 PolarHBondContact O-N 3.28Å; N102-M106 WeakPolarHBondContact O-CG 3.39Å; N102-M106 PolarHBondContact O-N 3.29Å
103	I	95.2	Very high	93.2	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.015	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-44.2	174.6	-75.7	175.4	0	0	0	110.6	R99 E100 V101 K105 M106 L107 I171 F194 S197 L199	R99-I103 HydrophobicContact CG-CD1 3.82Å; R99-I103 HydrophobicContact CG-CG1 4.36Å; R99-I103 WeakPolarHBondContact O-CB 3.12Å; R99-I103 WeakPolarHBondContact O-CG1 3.31Å; R99-I103 PolarHBondContact O-N 3.08Å; E100-I103 PolarHBondContact O-N 3.3Å; V101-I103 VanDerWaalsContact C-N 3.34Å; V101-I103 PolarHBondContact O-N 2.89Å; I103-K105 VanDerWaalsContact C-N 3.32Å; I103-K105 PolarHBondContact O-N 3.48Å; I103-M106 PolarHBondContact O-N 3.01Å; I103-M106 VanDerWaalsContact O-N 3.14Å; I103-L107 HydrophobicContact CG2-CD1 3.73Å; I103-L107 WeakPolarHBondContact O-CD1 3.45Å; I103-L107 VanDerWaalsContact O-CG 3.28Å; I103-L107 WeakPolarHBondContact O-CG 3.39Å; I103-L107 PolarHBondContact O-N 2.88Å; I103-I171 HydrophobicContact CD1-CG2 4.4Å; I103-I171 HydrophobicContact CG1-CG1 4.32Å; I103-I171 HydrophobicContact CG2-CD1 4.06Å; I103-I171 HydrophobicContact CG2-CG1 4.26Å; I103-I171 HydrophobicContact CG2-CG2 3.85Å; I103-F194 HydrophobicContact CG2-CB 4.41Å; I103-F194 HydrophobicContact CG2-CD1 3.89Å; I103-F194 HydrophobicContact CG2-CG 4.4Å; I103-S197 VanDerWaalsContact CD1-OG 3.24Å; I103-S197 WeakPolarHBondContact CD1-OG 3.2Å; I103-L199 HydrophobicContact CD1-CD2 4.49Å; I103-L199 HydrophobicContact CG1-CD2 4.46Å
104	M	95.9	Very high	93.7	Very high	13 Å²	13	45.5 Å²	45.5	6%	0.064	22%	0.216	C	C	.	.	H	α-helix	trans	-63.8	-33.2	176.2	-72.9	179.8	70.6	0	0	113.3	E100 V101 M106 L107 L115 L127 M129 F194	E100-M104 HydrophobicContact CG-SD 4.14Å; E100-M104 WeakPolarHBondContact O-CB 3.46Å; E100-M104 VanDerWaalsContact O-CG 3.3Å; E100-M104 WeakPolarHBondContact O-CG 3.46Å; E100-M104 PolarHBondContact O-N 3.19Å; V101-M104 PolarHBondContact O-N 3.16Å; M104-M106 VanDerWaalsContact C-N 3.27Å; M104-M106 PolarHBondContact O-N 3Å; M104-L107 PolarHBondContact O-N 3.14Å; M104-L115 HydrophobicContact CB-CB 4.37Å; M104-L115 HydrophobicContact CB-CD2 4.11Å; M104-L115 HydrophobicContact CE-CB 4.3Å; M104-L115 HydrophobicContact CE-CD1 4.05Å; M104-L127 HydrophobicContact SD-CD1 4.29Å; M104-M129 HydrophobicContact CE-CG 4.02Å; M104-M129 HydrophobicContact CE-SD 3.7Å; M104-F194 HydrophobicContact CG-CB 4.26Å; M104-F194 HydrophobicContact CG-CD2 4.47Å
105	K	94.6	Very high	94.2	Very high	58 Å²	58	43.4 Å²	43.4	25%	0.252	21%	0.205	S	C	.	.	H	α-helix	trans	-61.9	-33.7	173.1	-73.1	-161.8	166.9	-155.5	0	112.5	V101 N102 I103 L115 Q349 S350 F351	V101-K105 WeakPolarHBondContact O-CG 3.32Å; V101-K105 PolarHBondContact O-N 3.22Å; N102-K105 PolarHBondContact O-N 3.28Å; I103-K105 VanDerWaalsContact C-N 3.32Å; I103-K105 PolarHBondContact O-N 3.48Å; K105-L115 HydrophobicContact CG-CD2 3.94Å; K105-Q349 PolarHBondContact NZ-O 3.2Å; K105-S350 PolarHBondContact NZ-O 2.86Å; K105-F351 HydrophobicContact CB-CD2 4.19Å; K105-F351 HydrophobicContact CB-CE2 3.59Å; K105-F351 HydrophobicContact CB-CZ 4.03Å; K105-F351 HydrophobicContact CD-CD2 3.48Å; K105-F351 VanDerWaalsContact CD-CD2 3.48Å; K105-F351 HydrophobicContact CD-CE2 3.73Å; K105-F351 HydrophobicContact CD-CG 4.35Å; K105-F351 HydrophobicContact CG-CD2 3.51Å; K105-F351 HydrophobicContact CG-CE2 3.45Å; K105-F351 VanDerWaalsContact CG-CE2 3.45Å; K105-F351 HydrophobicContact CG-CG 4.18Å; K105-F351 HydrophobicContact CG-CZ 4.07Å
106	M	92.8	Very high	94.7	Very high	89 Å²	89	37.8 Å²	37.8	44%	0.438	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-5.8	-176.4	-63.8	170.3	71.2	0	0	114.6	N102 I103 M104 Y165 K169	N102-M106 WeakPolarHBondContact O-CG 3.39Å; N102-M106 PolarHBondContact O-N 3.29Å; I103-M106 PolarHBondContact O-N 3.01Å; I103-M106 VanDerWaalsContact O-N 3.14Å; M104-M106 VanDerWaalsContact C-N 3.27Å; M104-M106 PolarHBondContact O-N 3Å; M106-Y165 PolarHBondContact O-OH 2.69Å; M106-K169 PolarHBondContact O-NZ 2.89Å
107	L	95.6	Very high	95.2	Very high	10 Å²	10	35.6 Å²	35.6	5%	0.052	17%	0.171	C	C	.	.			trans	-105.7	120.6	-171.3	-69.8	169.8	0	0	0	112.5	I103 M104 I112 Y165 I171 F194	I103-L107 HydrophobicContact CG2-CD1 3.73Å; I103-L107 WeakPolarHBondContact O-CD1 3.45Å; I103-L107 VanDerWaalsContact O-CG 3.28Å; I103-L107 WeakPolarHBondContact O-CG 3.39Å; I103-L107 PolarHBondContact O-N 2.88Å; M104-L107 PolarHBondContact O-N 3.14Å; L107-I112 HydrophobicContact CB-CG2 4.4Å; L107-I112 HydrophobicContact CD2-CD1 4.19Å; L107-Y165 HydrophobicContact CB-CE1 4.47Å; L107-Y165 HydrophobicContact CD2-CD1 4.07Å; L107-Y165 HydrophobicContact CD2-CE1 3.48Å; L107-Y165 VanDerWaalsContact CD2-CE1 3.48Å; L107-I171 HydrophobicContact CD2-CD1 3.82Å; L107-I171 HydrophobicContact CG-CD1 4.17Å; L107-F194 HydrophobicContact CD1-CD1 3.66Å; L107-F194 HydrophobicContact CD1-CD2 4.42Å; L107-F194 HydrophobicContact CD1-CE1 3.31Å; L107-F194 HydrophobicContact CD1-CE2 4.16Å; L107-F194 HydrophobicContact CD1-CG 4.21Å; L107-F194 HydrophobicContact CD1-CZ 3.61Å
108	N	94.9	Very high	95.5	Very high	33 Å²	33	37 Å²	37	18%	0.176	18%	0.179	C	C	.	.			trans	-142.9	87.3	-177.1	175.5	24.4	0	0	0	108.3	R114 Y165 E318	N108-R114 PolarHBondContact OD1-NH1 3.13Å; N108-Y165 PolarHBondContact N-OH 2.63Å; N108-Y165 PolarHBondContact O-OH 3.15Å; N108-E318 HydrophobicContact CB-CG 4.33Å; N108-E318 VanDerWaalsContact CB-OE1 3.25Å; N108-E318 WeakPolarHBondContact CB-OE1 3.42Å; N108-E318 PolarHBondContact ND2-OE1 3.45Å
109	H	97.6	Very high	95.8	Very high	9 Å²	9	33.4 Å²	33.4	4%	0.042	17%	0.165	C	C	.	.			trans	-143.1	138.6	-178.7	178.8	-80.6	0	0	0	108.3	N111 I112 S161 A162 Y165 Y316	H109-N111 PolarHBondContact ND1-N 3.17Å; H109-N111 PolarHBondContact O-N 2.96Å; H109-I112 HydrophobicContact CB-CB 4.24Å; H109-I112 HydrophobicContact CB-CD1 3.83Å; H109-I112 HydrophobicContact CB-CG1 3.92Å; H109-I112 PolarHBondContact O-N 3.33Å; H109-S161 PolarHBondContact NE2-O 2.83Å; H109-S161 PolarHBondContact NE2-OG 3.12Å; H109-A162 VanDerWaalsContact CE1-CA 3.5Å; H109-A162 WeakPolarHBondContact CE1-CA 3.34Å; H109-A162 PolarHBondContact CE1-N 3.48Å; H109-Y165 HydrophobicContact CB-CD1 3.68Å; H109-Y165 HydrophobicContact CB-CE1 3.79Å; H109-Y165 HydrophobicContact CB-CG 4.21Å; H109-Y165 AromaticContact CD2-CG 3.86Å; H109-Y316 HydrophobicContact CB-CE1 4.46Å; H109-Y316 AromaticContact CD2-CD1 3.42Å; H109-Y316 VanDerWaalsContact CD2-CD1 3.42Å; H109-Y316 WeakPolarHBondContact CD2-CD1 3.32Å; H109-Y316 AromaticContact CD2-CE1 3.94Å; H109-Y316 AromaticContact CD2-CG 3.46Å; H109-Y316 VanDerWaalsContact CD2-CG 3.46Å; H109-Y316 AromaticContact NE2-CG 3.8Å
110	P	97.2	Very high	95.8	Very high	67 Å²	67	34.9 Å²	34.9	44%	0.435	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-28.2	-172.9	21.5	-34.2	0	0	0	114	K190 Y316	P110-K190 WeakPolarHBondContact O-CE 3.47Å; P110-K190 PolarHBondContact O-NZ 2.9Å; P110-Y316 HydrophobicContact CG-CE2 4.18Å
111	N	98.3	Very high	95.8	Very high	15 Å²	15	36.4 Å²	36.4	8%	0.08	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	21	177.8	-53.5	110	0	0	0	115.1	H109 Q158 A162 I189 L191	H109-N111 PolarHBondContact ND1-N 3.17Å; H109-N111 PolarHBondContact O-N 2.96Å; N111-Q158 HydrophobicContact CB-CB 4.24Å; N111-Q158 VanDerWaalsContact ND2-CD 3.34Å; N111-Q158 PolarHBondContact ND2-OE1 2.96Å; N111-A162 HydrophobicContact CB-CB 4.28Å; N111-I189 WeakPolarHBondContact CA-O 3.43Å; N111-I189 WeakPolarHBondContact CB-O 3.48Å; N111-I189 PolarHBondContact ND2-O 3.18Å; N111-L191 PolarHBondContact O-N 2.92Å
112	I	98.2	Very high	95.6	Very high	4 Å²	4	44 Å²	44	2%	0.021	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-117.4	138.1	169.3	-63.7	-179.3	0	0	0	108.2	L107 H109 R114 A162 Y165 L191 F194	L107-I112 HydrophobicContact CB-CG2 4.4Å; L107-I112 HydrophobicContact CD2-CD1 4.19Å; H109-I112 HydrophobicContact CB-CB 4.24Å; H109-I112 HydrophobicContact CB-CD1 3.83Å; H109-I112 HydrophobicContact CB-CG1 3.92Å; H109-I112 PolarHBondContact O-N 3.33Å; I112-R114 PolarHBondContact O-N 2.93Å; I112-R114 VanDerWaalsContact O-N 3.12Å; I112-A162 HydrophobicContact CD1-CB 4.31Å; I112-A162 HydrophobicContact CG1-CB 3.83Å; I112-Y165 HydrophobicContact CD1-CD1 3.79Å; I112-Y165 HydrophobicContact CD1-CE1 4.09Å; I112-L191 HydrophobicContact CG1-CB 4.39Å; I112-F194 HydrophobicContact CD1-CZ 4.28Å; I112-F194 HydrophobicContact CG2-CE2 3.68Å; I112-F194 HydrophobicContact CG2-CZ 3.8Å
113	V	97.4	Very high	95.5	Very high	13 Å²	13	47.1 Å²	47.1	8%	0.079	23%	0.226	C	C	.	.			trans	-60.7	112.7	175.1	169.7	0	0	0	0	109.7	M129 E130 L182 K190 L191 A192	V113-M129 HydrophobicContact CG1-CB 3.81Å; V113-M129 HydrophobicContact CG1-SD 4.47Å; V113-E130 HydrophobicContact CG1-CB 4.22Å; V113-L182 HydrophobicContact CG2-CD1 4.37Å; V113-K190 HydrophobicContact CG2-CB 3.86Å; V113-L191 WeakPolarHBondContact CG2-O 3.46Å; V113-L191 PolarHBondContact N-O 2.87Å; V113-A192 HydrophobicContact CG2-CB 3.89Å
114	R	96.3	Very high	95.4	Very high	77 Å²	77	49.7 Å²	49.7	29%	0.291	24%	0.238	S	C	.	.			trans	-73.4	141.3	-178	-172.3	168.7	-166.9	126.3	12.7	112.3	N108 I112 Y116 M129 E130	N108-R114 PolarHBondContact OD1-NH1 3.13Å; I112-R114 PolarHBondContact O-N 2.93Å; I112-R114 VanDerWaalsContact O-N 3.12Å; R114-Y116 HydrophobicContact CB-CE1 4.46Å; R114-Y116 HydrophobicContact CG-CD1 4.45Å; R114-Y116 HydrophobicContact CG-CE1 4.19Å; R114-M129 CarbonylContact O-C 3.49Å; R114-M129 VanDerWaalsContact O-CA 3.25Å; R114-M129 WeakPolarHBondContact O-CA 3.47Å; R114-E130 HydrophobicContact CB-CB 4.39Å; R114-E130 PolarHBondContact O-N 3.37Å
115	L	97.2	Very high	95.3	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	136.9	166.3	-173.5	69.7	0	0	0	110.2	M104 K105 V118 L127 M129 F351	M104-L115 HydrophobicContact CB-CB 4.37Å; M104-L115 HydrophobicContact CB-CD2 4.11Å; M104-L115 HydrophobicContact CE-CB 4.3Å; M104-L115 HydrophobicContact CE-CD1 4.05Å; K105-L115 HydrophobicContact CG-CD2 3.94Å; L115-V118 HydrophobicContact CD1-CG2 4.29Å; L115-V118 HydrophobicContact CD2-CG2 3.87Å; L115-V118 HydrophobicContact CG-CG2 4.45Å; L115-L127 HydrophobicContact CD1-CB 4.11Å; L115-M129 HydrophobicContact CD1-CG 4.43Å; L115-F351 HydrophobicContact CB-CD1 4.21Å; L115-F351 HydrophobicContact CB-CE1 3.97Å; L115-F351 HydrophobicContact CD2-CD1 3.74Å; L115-F351 HydrophobicContact CD2-CE1 3.97Å; L115-F351 HydrophobicContact CD2-CG 4.17Å; L115-F351 HydrophobicContact CG-CD1 3.78Å; L115-F351 HydrophobicContact CG-CE1 4.04Å; L115-F351 WeakPolarHBondContact O-CE1 3.47Å
116	Y	96.7	Very high	95.4	Very high	28 Å²	28	48.2 Å²	48.2	11%	0.11	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-44	175.9	-62.2	-53	0	0	0	112.7	V79 R114 V128 E130 L359 L360	V79-Y116 HydrophobicContact CG1-CD2 4.11Å; V79-Y116 HydrophobicContact CG1-CE2 4.21Å; R114-Y116 HydrophobicContact CB-CE1 4.46Å; R114-Y116 HydrophobicContact CG-CD1 4.45Å; R114-Y116 HydrophobicContact CG-CE1 4.19Å; Y116-V128 PolarHBondContact N-O 2.94Å; Y116-E130 HydrophobicContact CE2-CB 4.18Å; Y116-L359 HydrophobicContact CD1-CB 3.71Å; Y116-L359 HydrophobicContact CD1-CD1 4.18Å; Y116-L359 HydrophobicContact CE1-CB 4.03Å; Y116-L360 HydrophobicContact CD1-CD2 4.46Å; Y116-L360 HydrophobicContact CD2-CD2 3.85Å; Y116-L360 HydrophobicContact CD2-CG 4.47Å; Y116-L360 HydrophobicContact CE1-CD2 4.26Å; Y116-L360 HydrophobicContact CE2-CD2 3.6Å; Y116-L360 HydrophobicContact CG-CD2 4.28Å; Y116-L360 HydrophobicContact CG-CG 4.46Å
117	E	97.5	Very high	95.5	Very high	16 Å²	16	44 Å²	44	8%	0.075	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	148.4	-178.3	-158.3	170.5	167.2	0	0	112	Y53 I119 V128 F351 N353 A356	Y53-E117 WeakPolarHBondContact CE2-OE2 3.29Å; Y53-E117 PolarHBondContact OH-OE2 3.08Å; E117-I119 HydrophobicContact CG-CG1 3.97Å; E117-V128 HydrophobicContact CB-CB 3.91Å; E117-V128 HydrophobicContact CB-CG2 3.95Å; E117-V128 PolarHBondContact N-O 2.98Å; E117-V128 PolarHBondContact O-N 3.08Å; E117-F351 CarbonylContact C-O 3.52Å; E117-F351 WeakPolarHBondContact CA-O 3.36Å; E117-F351 VanDerWaalsContact CG-O 3.31Å; E117-F351 WeakPolarHBondContact CG-O 3.34Å; E117-N353 VanDerWaalsContact CD-CA 3.46Å; E117-N353 WeakPolarHBondContact OE1-CA 3.32Å; E117-N353 WeakPolarHBondContact OE1-CB 3.35Å; E117-N353 PolarHBondContact OE1-N 2.85Å; E117-N353 WeakPolarHBondContact OE2-CA 3.36Å; E117-A356 HydrophobicContact CB-CB 4.01Å; E117-A356 HydrophobicContact CG-CB 4.47Å
118	V	96.9	Very high	95.6	Very high	38 Å²	38	43.5 Å²	43.5	23%	0.23	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	108.4	167.6	-177.5	0	0	0	0	107.8	V101 L115 V125 L127 F351	V101-V118 HydrophobicContact CG1-CG1 4.49Å; V101-V118 HydrophobicContact CG1-CG2 3.94Å; L115-V118 HydrophobicContact CD1-CG2 4.29Å; L115-V118 HydrophobicContact CD2-CG2 3.87Å; L115-V118 HydrophobicContact CG-CG2 4.45Å; V118-V125 HydrophobicContact CG1-CG1 4.39Å; V118-L127 HydrophobicContact CG1-CD2 3.97Å; V118-L127 HydrophobicContact CG2-CD2 4.14Å; V118-F351 HydrophobicContact CG2-CB 4.24Å; V118-F351 PolarHBondContact N-O 3.06Å
119	I	96.2	Very high	95.8	Very high	31 Å²	31	43 Å²	43	16%	0.159	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	124.6	174.9	-54.2	169.3	0	0	0	107.7	V50 Y53 E117 Y126 V128	V50-I119 HydrophobicContact CG1-CD1 4.13Å; V50-I119 HydrophobicContact CG1-CG2 4.41Å; Y53-I119 HydrophobicContact CD2-CD1 3.92Å; Y53-I119 HydrophobicContact CE2-CD1 3.93Å; E117-I119 HydrophobicContact CG-CG1 3.97Å; I119-Y126 HydrophobicContact CB-CD2 4.38Å; I119-Y126 HydrophobicContact CG2-CD2 4.37Å; I119-Y126 PolarHBondContact N-O 2.88Å; I119-Y126 WeakPolarHBondContact O-CD2 3.48Å; I119-Y126 PolarHBondContact O-N 3.12Å; I119-V128 HydrophobicContact CD1-CG2 4.38Å
120	E	93.5	Very high	95.8	Very high	103 Å²	103	44.5 Å²	44.5	48%	0.481	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	147.1	174.5	-173.9	158.5	-170	0	0	111.4	K86 V125	K86-E120 WeakPolarHBondContact CD-OE1 3.46Å; K86-E120 WeakPolarHBondContact CE-OE1 3.28Å; K86-E120 IonicContact NZ-OE1 2.66Å; K86-E120 PolarHBondContact NZ-OE1 2.92Å; E120-V125 HydrophobicContact CG-CG2 4.11Å
121	S	91.2	Very high	95.7	Very high	46 Å²	46	42.8 Å²	42.8	32%	0.322	20%	0.197	S	C	.	.			trans	-136.7	170.4	172.6	63.4	0	0	0	0	108.5	K86 R123 H124	K86-S121 WeakPolarHBondContact CE-O 3.49Å; K86-S121 PolarHBondContact NZ-O 2.68Å; S121-R123 PolarHBondContact O-N 3.04Å; S121-R123 VanDerWaalsContact O-N 3.12Å; S121-H124 PolarHBondContact N-O 2.77Å; S121-H124 WeakPolarHBondContact OG-CA 3.49Å; S121-H124 PolarHBondContact OG-N 2.94Å; S121-H124 PolarHBondContact OG-O 2.79Å
122	E	90.7	Very high	95.7	Very high	172 Å²	172	42.5 Å²	42.5	80%	0.804	20%	0.196	S	C	*	.	S	Bend	trans	-48.5	-43	177.1	-64.7	178.6	176.5	0	0	113.5	K86	K86-E122 WeakPolarHBondContact CE-O 3.34Å; K86-E122 PolarHBondContact NZ-O 2.83Å
123	R	91	Very high	95.5	Very high	162 Å²	162	46.3 Å²	46.3	61%	0.611	21%	0.214	S	C	*	.	S	Bend	trans	-106.2	-23	-170.8	-58	-174.1	-170.8	-166.4	1.8	114.5	K86 T87 S121	K86-R123 WeakPolarHBondContact CB-O 3.21Å; K86-R123 PolarHBondContact N-O 3.15Å; T87-R123 HydrophobicContact CG2-CB 4.31Å; T87-R123 HydrophobicContact CG2-CG 4.37Å; S121-R123 PolarHBondContact O-N 3.04Å; S121-R123 VanDerWaalsContact O-N 3.12Å
124	H	92.8	Very high	95.4	Very high	57 Å²	57	48.7 Å²	48.7	26%	0.264	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	147	-174.2	-59.9	96.9	0	0	0	113	I84 S121 Y126	I84-H124 CarbonylContact O-C 3.55Å; I84-H124 WeakPolarHBondContact O-CA 3.4Å; I84-H124 WeakPolarHBondContact O-CB 3.03Å; S121-H124 PolarHBondContact N-O 2.77Å; S121-H124 WeakPolarHBondContact OG-CA 3.49Å; S121-H124 PolarHBondContact OG-N 2.94Å; S121-H124 PolarHBondContact OG-O 2.79Å; H124-Y126 HydrophobicContact CB-CD2 4.24Å; H124-Y126 HydrophobicContact CB-CE1 4.38Å; H124-Y126 HydrophobicContact CB-CE2 3.53Å
125	V	94.2	Very high	95.2	Very high	6 Å²	6	46.5 Å²	46.5	4%	0.036	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	137	162	177.5	0	0	0	0	107.9	I84 K86 L97 V118 E120 L127	I84-V125 PolarHBondContact N-O 3.06Å; I84-V125 PolarHBondContact O-N 3.43Å; K86-V125 HydrophobicContact CD-CG2 3.85Å; K86-V125 HydrophobicContact CG-CG2 3.96Å; L97-V125 HydrophobicContact CD2-CB 4.29Å; L97-V125 HydrophobicContact CD2-CG2 4.13Å; V118-V125 HydrophobicContact CG1-CG1 4.39Å; E120-V125 HydrophobicContact CG-CG2 4.11Å; V125-L127 HydrophobicContact CG1-CD2 3.69Å; V125-L127 HydrophobicContact CG1-CG 4.45Å
126	Y	96.3	Very high	95.1	Very high	34 Å²	34	49.9 Å²	49.9	13%	0.133	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	114.2	178.1	-53.4	-97.3	0	0	0	108.7	V50 V81 K82 V83 I119 H124	V50-Y126 HydrophobicContact CB-CD1 4.49Å; V50-Y126 HydrophobicContact CB-CE1 4.41Å; V50-Y126 HydrophobicContact CG1-CD1 3.78Å; V50-Y126 HydrophobicContact CG1-CD2 3.8Å; V50-Y126 HydrophobicContact CG1-CE1 3.91Å; V50-Y126 HydrophobicContact CG1-CE2 3.93Å; V50-Y126 HydrophobicContact CG1-CG 3.74Å; V50-Y126 HydrophobicContact CG2-CD1 4.22Å; V50-Y126 HydrophobicContact CG2-CE1 3.7Å; V81-Y126 HydrophobicContact CG1-CD1 4.21Å; K82-Y126 WeakPolarHBondContact O-CA 3.4Å; V83-Y126 HydrophobicContact CB-CD1 4.23Å; V83-Y126 HydrophobicContact CB-CE1 4.36Å; V83-Y126 HydrophobicContact CG1-CD1 3.9Å; V83-Y126 HydrophobicContact CG1-CE1 3.6Å; V83-Y126 HydrophobicContact CG2-CD1 3.9Å; V83-Y126 HydrophobicContact CG2-CE1 4.12Å; I119-Y126 HydrophobicContact CB-CD2 4.38Å; I119-Y126 HydrophobicContact CG2-CD2 4.37Å; I119-Y126 PolarHBondContact N-O 2.88Å; I119-Y126 WeakPolarHBondContact O-CD2 3.48Å; I119-Y126 PolarHBondContact O-N 3.12Å; H124-Y126 HydrophobicContact CB-CD2 4.24Å; H124-Y126 HydrophobicContact CB-CE1 4.38Å; H124-Y126 HydrophobicContact CB-CE2 3.53Å
127	L	96.7	Very high	95	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	115.9	173.4	-46.8	-176.5	0	0	0	108.2	V81 K82 I84 V101 M104 L115 V118 V125 M129	V81-L127 CarbonylContact C-O 3.54Å; V81-L127 WeakPolarHBondContact CA-O 3.34Å; K82-L127 HydrophobicContact CB-CB 4.24Å; K82-L127 HydrophobicContact CD-CD1 4.45Å; K82-L127 PolarHBondContact N-O 2.75Å; K82-L127 PolarHBondContact O-N 3.32Å; I84-L127 HydrophobicContact CD1-CD1 4.24Å; I84-L127 HydrophobicContact CD1-CG 4.44Å; V101-L127 HydrophobicContact CG2-CD1 4.08Å; V101-L127 HydrophobicContact CG2-CD2 3.63Å; M104-L127 HydrophobicContact SD-CD1 4.29Å; L115-L127 HydrophobicContact CD1-CB 4.11Å; V118-L127 HydrophobicContact CG1-CD2 3.97Å; V118-L127 HydrophobicContact CG2-CD2 4.14Å; V125-L127 HydrophobicContact CG1-CD2 3.69Å; V125-L127 HydrophobicContact CG1-CG 4.45Å; L127-M129 HydrophobicContact CB-CG 4.38Å
128	V	97.7	Very high	94.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	121.9	177.3	-174.4	0	0	0	0	108.5	Y53 V79 V81 Y116 E117 I119	Y53-V128 HydrophobicContact CD1-CG1 4.13Å; Y53-V128 HydrophobicContact CD2-CG2 4.04Å; Y53-V128 HydrophobicContact CE1-CG1 3.6Å; Y53-V128 HydrophobicContact CE2-CG1 4.3Å; Y53-V128 HydrophobicContact CE2-CG2 3.8Å; V79-V128 HydrophobicContact CB-CG1 3.99Å; V79-V128 HydrophobicContact CG1-CG1 4.35Å; V79-V128 HydrophobicContact CG2-CG1 3.79Å; V81-V128 HydrophobicContact CG2-CG1 4.47Å; V81-V128 HydrophobicContact CG2-CG2 4.3Å; Y116-V128 PolarHBondContact N-O 2.94Å; E117-V128 HydrophobicContact CB-CB 3.91Å; E117-V128 HydrophobicContact CB-CG2 3.95Å; E117-V128 PolarHBondContact N-O 2.98Å; E117-V128 PolarHBondContact O-N 3.08Å; I119-V128 HydrophobicContact CD1-CG2 4.38Å
129	M	97.6	Very high	94.4	Very high	22 Å²	22	52.5 Å²	52.5	11%	0.108	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	164.8	-167.2	-49.2	177.1	-55.7	0	0	111.4	V67 V79 A80 K82 M104 V113 R114 L115 L127	V67-M129 HydrophobicContact CG1-CE 4.5Å; V79-M129 WeakPolarHBondContact CB-O 3.31Å; A80-M129 HydrophobicContact CB-CE 4.2Å; A80-M129 PolarHBondContact N-O 3.28Å; A80-M129 WeakPolarHBondContact O-CB 3.39Å; A80-M129 PolarHBondContact O-N 3.35Å; K82-M129 HydrophobicContact CB-CE 3.87Å; K82-M129 HydrophobicContact CB-SD 4.29Å; M104-M129 HydrophobicContact CE-CG 4.02Å; M104-M129 HydrophobicContact CE-SD 3.7Å; V113-M129 HydrophobicContact CG1-CB 3.81Å; V113-M129 HydrophobicContact CG1-SD 4.47Å; R114-M129 CarbonylContact O-C 3.49Å; R114-M129 VanDerWaalsContact O-CA 3.25Å; R114-M129 WeakPolarHBondContact O-CA 3.47Å; L115-M129 HydrophobicContact CD1-CG 4.43Å; L127-M129 HydrophobicContact CB-CG 4.38Å
130	E	97.1	Very high	94.1	Very high	42 Å²	42	52.3 Å²	52.3	20%	0.196	26%	0.256	C	S	.	.			trans	-54.2	135.8	165.5	-172.4	173.6	-142.8	0	0	111.4	V113 R114 Y116 K190	V113-E130 HydrophobicContact CG1-CB 4.22Å; R114-E130 HydrophobicContact CB-CB 4.39Å; R114-E130 PolarHBondContact O-N 3.37Å; Y116-E130 HydrophobicContact CE2-CB 4.18Å; E130-K190 WeakPolarHBondContact OE1-CE 3.49Å; E130-K190 IonicContact OE1-NZ 2.86Å; E130-K190 PolarHBondContact OE1-NZ 2.87Å; E130-K190 WeakPolarHBondContact OE2-CE 3.44Å; E130-K190 IonicContact OE2-NZ 3.78Å; E130-K190 PolarHBondContact OE2-NZ 3.33Å
131	Y	96.9	Very high	94.1	Very high	30 Å²	30	47.7 Å²	47.7	12%	0.118	23%	0.234	C	C	.	.			trans	-95.4	134.4	173.1	172.8	-129.9	0	0	0	109.1	R57 L59 L69 E78 E133	R57-Y131 PolarHBondContact NH2-OH 3.21Å; L59-Y131 HydrophobicContact CD1-CD2 3.74Å; L59-Y131 HydrophobicContact CD1-CE2 3.72Å; L59-Y131 HydrophobicContact CD2-CE2 3.81Å; L59-Y131 HydrophobicContact CG-CE2 4.45Å; L69-Y131 HydrophobicContact CD1-CD1 3.61Å; L69-Y131 HydrophobicContact CD1-CD2 3.96Å; L69-Y131 HydrophobicContact CD1-CE1 3.59Å; L69-Y131 HydrophobicContact CD1-CE2 3.96Å; L69-Y131 HydrophobicContact CD1-CG 3.81Å; E78-Y131 HydrophobicContact CB-CD1 4.04Å; Y131-E133 HydrophobicContact CD1-CG 3.99Å; Y131-E133 HydrophobicContact CE1-CB 4.32Å; Y131-E133 HydrophobicContact CE1-CG 3.76Å
132	A	96.5	Very high	94.1	Very high	9 Å²	9	48.2 Å²	48.2	7%	0.074	24%	0.235	C	C	.	.			trans	-110	109.5	177	0	0	0	0	0	108.7	N134 L182 F183 K190	A132-N134 PolarHBondContact O-N 2.88Å; A132-L182 HydrophobicContact CB-CB 3.62Å; A132-L182 HydrophobicContact CB-CD1 3.94Å; A132-L182 HydrophobicContact CB-CG 4.44Å; A132-F183 CarbonylContact C-O 3.48Å; A132-F183 WeakPolarHBondContact CB-O 3.36Å; A132-K190 HydrophobicContact CB-CB 4.42Å; A132-K190 HydrophobicContact CB-CG 4.35Å
133	E	94.6	Very high	94.1	Very high	84 Å²	84	43 Å²	43	39%	0.393	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-28.9	-161.7	-60	91.2	152.3	0	0	114.1	Y131 F183 G185	Y131-E133 HydrophobicContact CD1-CG 3.99Å; Y131-E133 HydrophobicContact CE1-CB 4.32Å; Y131-E133 HydrophobicContact CE1-CG 3.76Å; E133-F183 PolarHBondContact N-O 3.34Å; E133-G185 PolarHBondContact OE2-N 2.87Å
134	N	94.8	Very high	94.1	Very high	63 Å²	63	41.1 Å²	41.1	34%	0.337	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	6.7	-175.2	-77.6	-48.6	0	0	0	114	A132 F183 D184 G185 Y187	A132-N134 PolarHBondContact O-N 2.88Å; N134-F183 HydrophobicContact CB-CB 3.67Å; N134-F183 PolarHBondContact N-O 3.24Å; N134-D184 PolarHBondContact ND2-O 3.32Å; N134-G185 WeakPolarHBondContact ND2-CA 3.29Å; N134-Y187 HydrophobicContact CB-CE1 4.24Å; N134-Y187 WeakPolarHBondContact ND2-CE2 3.44Å
135	G	93.4	Very high	94.2	Very high	32 Å²	32	39 Å²	39	33%	0.33	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	75.6	-157.2	169.8	0	0	0	0	0	114.8	L182 F183	G135-L182 CarbonylContact O-C 3.56Å; G135-L182 WeakPolarHBondContact O-CA 3.48Å; G135-F183 PolarHBondContact O-N 2.79Å
136	E	94.3	Very high	94.2	Very high	73 Å²	73	43.5 Å²	43.5	34%	0.341	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	139.8	-175.4	-68.3	178	-147.1	0	0	112.8	F138 D139 H140 E179 L182	E136-F138 PolarHBondContact O-N 3.47Å; E136-D139 PolarHBondContact O-N 3.49Å; E136-D139 VanDerWaalsContact O-N 3.13Å; E136-H140 PolarHBondContact O-N 2.95Å; E136-E179 WeakPolarHBondContact OE2-CA 3.42Å; E136-L182 HydrophobicContact CB-CD2 4.39Å; E136-L182 HydrophobicContact CG-CD2 3.67Å
137	V	94.3	Very high	94.2	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-31.8	172.3	175.8	0	0	0	0	110.9	H140 L141 M147 L181 F183 I189 L243	V137-H140 WeakPolarHBondContact O-CB 3.21Å; V137-H140 PolarHBondContact O-N 3.44Å; V137-L141 WeakPolarHBondContact O-CG 3.41Å; V137-L141 PolarHBondContact O-N 2.97Å; V137-M147 HydrophobicContact CG1-CE 4.04Å; V137-L181 HydrophobicContact CB-CB 4.06Å; V137-L181 HydrophobicContact CG2-CB 3.71Å; V137-L181 WeakPolarHBondContact CG2-O 3.41Å; V137-L181 PolarHBondContact N-O 2.87Å; V137-F183 HydrophobicContact CB-CE2 4.23Å; V137-F183 HydrophobicContact CG1-CE2 4.24Å; V137-F183 HydrophobicContact CG1-CZ 4.41Å; V137-F183 HydrophobicContact CG2-CD1 4.36Å; V137-F183 HydrophobicContact CG2-CD2 3.87Å; V137-F183 HydrophobicContact CG2-CE1 4.22Å; V137-F183 HydrophobicContact CG2-CE2 3.73Å; V137-F183 HydrophobicContact CG2-CG 4.2Å; V137-F183 HydrophobicContact CG2-CZ 3.92Å; V137-I189 HydrophobicContact CG2-CD1 3.59Å; V137-L243 HydrophobicContact CG1-CD2 3.71Å
138	F	90.4	Very high	94.2	Very high	37 Å²	37	49.7 Å²	49.7	16%	0.162	26%	0.257	C	S	.	.	H	α-helix	trans	-62.2	-45.7	174.2	-173.4	-98.5	0	0	0	112.7	E136 H140 L141 V142 A178 E179	E136-F138 PolarHBondContact O-N 3.47Å; F138-H140 VanDerWaalsContact C-N 3.3Å; F138-H140 PolarHBondContact O-N 3.01Å; F138-L141 WeakPolarHBondContact O-CB 3.36Å; F138-L141 PolarHBondContact O-N 3.07Å; F138-L141 VanDerWaalsContact O-N 3.14Å; F138-V142 HydrophobicContact CD1-CG2 4.03Å; F138-V142 HydrophobicContact CE1-CG2 3.63Å; F138-V142 HydrophobicContact CZ-CG2 4.01Å; F138-V142 WeakPolarHBondContact O-CG2 3.5Å; F138-V142 PolarHBondContact O-N 3.3Å; F138-A178 HydrophobicContact CB-CB 4.06Å; F138-A178 HydrophobicContact CD2-CB 4.15Å; F138-E179 HydrophobicContact CB-CG 4.31Å; F138-E179 HydrophobicContact CG-CG 4.34Å
139	D	91.4	Very high	94.2	Very high	99 Å²	99	51.1 Å²	51.1	53%	0.529	26%	0.264	S	S	.	.	H	α-helix	trans	-64.5	-35.9	177	-88.9	-18.7	0	0	0	111.8	E136 L141 V142 A143	E136-D139 PolarHBondContact O-N 3.49Å; E136-D139 VanDerWaalsContact O-N 3.13Å; D139-L141 PolarHBondContact O-N 3.42Å; D139-V142 PolarHBondContact O-N 3.3Å; D139-A143 WeakPolarHBondContact O-CB 3.28Å; D139-A143 PolarHBondContact O-N 2.99Å
140	H	91.4	Very high	94.2	Very high	28 Å²	28	60 Å²	60	13%	0.13	30%	0.296	C	S	.	.	H	α-helix	trans	-59.8	-44.1	171.5	-173	-92	0	0	0	112.2	E136 V137 F138 A143 H144 E151 F183	E136-H140 PolarHBondContact O-N 2.95Å; V137-H140 WeakPolarHBondContact O-CB 3.21Å; V137-H140 PolarHBondContact O-N 3.44Å; F138-H140 VanDerWaalsContact C-N 3.3Å; F138-H140 PolarHBondContact O-N 3.01Å; H140-A143 PolarHBondContact O-N 3.06Å; H140-H144 AromaticContact CD2-CE1 3.66Å; H140-H144 AromaticContact CD2-ND1 3.19Å; H140-H144 PolarHBondContact CD2-ND1 2.88Å; H140-H144 AromaticContact CE1-ND1 3.49Å; H140-H144 PolarHBondContact CE1-ND1 3.43Å; H140-H144 AromaticContact CG-ND1 3.74Å; H140-H144 AromaticContact ND1-ND1 3.89Å; H140-H144 AromaticContact NE2-CE1 3.58Å; H140-H144 AromaticContact NE2-ND1 2.97Å; H140-H144 PolarHBondContact NE2-ND1 2.95Å; H140-H144 PolarHBondContact O-N 3.11Å; H140-E151 IonicContact CE1-OE1 3.63Å; H140-F183 HydrophobicContact CB-CD2 4.27Å; H140-F183 HydrophobicContact CB-CE2 3.94Å; H140-F183 AromaticContact CG-CE2 3.87Å
141	L	93	Very high	94.2	Very high	5 Å²	5	61.9 Å²	61.9	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-66.5	-33.7	174.6	-67.9	174.3	0	0	0	112.6	V137 F138 D139 G145 M147 T242 L243	V137-L141 WeakPolarHBondContact O-CG 3.41Å; V137-L141 PolarHBondContact O-N 2.97Å; F138-L141 WeakPolarHBondContact O-CB 3.36Å; F138-L141 PolarHBondContact O-N 3.07Å; F138-L141 VanDerWaalsContact O-N 3.14Å; D139-L141 PolarHBondContact O-N 3.42Å; L141-G145 WeakPolarHBondContact CD2-O 3.46Å; L141-G145 CarbonylContact O-C 3.49Å; L141-G145 WeakPolarHBondContact O-CA 3.49Å; L141-G145 PolarHBondContact O-N 3.12Å; L141-M147 HydrophobicContact CD2-CE 4.12Å; L141-M147 HydrophobicContact CD2-CG 3.87Å; L141-M147 HydrophobicContact CD2-SD 4.37Å; L141-T242 HydrophobicContact CD1-CG2 4.07Å; L141-L243 HydrophobicContact CD1-CD2 4.26Å
142	V	90.3	Very high	94.2	Very high	58 Å²	58	60.4 Å²	60.4	35%	0.352	30%	0.3	S	S	.	.	H	α-helix	trans	-67.5	-43.4	175	170.3	0	0	0	0	111	F138 D139	F138-V142 HydrophobicContact CD1-CG2 4.03Å; F138-V142 HydrophobicContact CE1-CG2 3.63Å; F138-V142 HydrophobicContact CZ-CG2 4.01Å; F138-V142 WeakPolarHBondContact O-CG2 3.5Å; F138-V142 PolarHBondContact O-N 3.3Å; D139-V142 PolarHBondContact O-N 3.3Å
143	A	92	Very high	94.3	Very high	63 Å²	63	61 Å²	61	52%	0.521	30%	0.3	S	S	.	.	H	α-helix	trans	-69.4	-58.5	179.1	0	0	0	0	0	112.3	D139 H140	D139-A143 WeakPolarHBondContact O-CB 3.28Å; D139-A143 PolarHBondContact O-N 2.99Å; H140-A143 PolarHBondContact O-N 3.06Å
144	H	91.4	Very high	94.5	Very high	122 Å²	122	58.8 Å²	58.8	57%	0.565	30%	0.296	S	S	*	.	H	α-helix	trans	-88.8	-25.5	-171.2	-57.4	123.5	0	0	0	112.8	H140 K1214	H140-H144 AromaticContact CD2-CE1 3.66Å; H140-H144 AromaticContact CD2-ND1 3.19Å; H140-H144 PolarHBondContact CD2-ND1 2.88Å; H140-H144 AromaticContact CE1-ND1 3.49Å; H140-H144 PolarHBondContact CE1-ND1 3.43Å; H140-H144 AromaticContact CG-ND1 3.74Å; H140-H144 AromaticContact ND1-ND1 3.89Å; H140-H144 AromaticContact NE2-CE1 3.58Å; H140-H144 AromaticContact NE2-ND1 2.97Å; H140-H144 PolarHBondContact NE2-ND1 2.95Å; H140-H144 PolarHBondContact O-N 3.11Å; H144-K1214 PolarHBondContact O-NZ 3.46Å
145	G	92.8	Very high	94.6	Very high	13 Å²	13	56.1 Å²	56.1	13%	0.134	28%	0.283	C	S	.	.			trans	94	-160.2	-171.3	0	0	0	0	0	111.2	L141	L141-G145 WeakPolarHBondContact CD2-O 3.46Å; L141-G145 CarbonylContact O-C 3.49Å; L141-G145 WeakPolarHBondContact O-CA 3.49Å; L141-G145 PolarHBondContact O-N 3.12Å
146	R	94.8	Very high	94.9	Very high	99 Å²	99	54.6 Å²	54.6	37%	0.374	27%	0.267	S	S	.	.	S	Bend	trans	-57.1	140.9	175.1	79.7	-170.5	-167.6	81.4	-0.6	111.7	V244 Y272	R146-V244 WeakPolarHBondContact CD-O 3.4Å; R146-V244 PolarHBondContact NH1-O 3.24Å; R146-V244 VanDerWaalsContact NH1-O 3.13Å; R146-Y272 VanDerWaalsContact CZ-CE2 3.48Å
147	M	96.4	Very high	95.1	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.015	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-71.8	159.1	171.6	-67.2	175.5	177.1	0	0	111	V137 L141 E151 A152 F183 L243	V137-M147 HydrophobicContact CG1-CE 4.04Å; L141-M147 HydrophobicContact CD2-CE 4.12Å; L141-M147 HydrophobicContact CD2-CG 3.87Å; L141-M147 HydrophobicContact CD2-SD 4.37Å; M147-E151 VanDerWaalsContact CA-OE2 3.31Å; M147-E151 WeakPolarHBondContact CA-OE2 3.46Å; M147-E151 HydrophobicContact CB-CB 4.39Å; M147-E151 HydrophobicContact CB-CG 4.01Å; M147-E151 WeakPolarHBondContact CB-OE2 3.42Å; M147-E151 HydrophobicContact CG-CG 4.04Å; M147-E151 HydrophobicContact SD-CG 4.19Å; M147-A152 HydrophobicContact CB-CB 4.04Å; M147-F183 HydrophobicContact CE-CE2 4.01Å; M147-F183 HydrophobicContact CE-CZ 3.75Å; M147-L243 HydrophobicContact CE-CD2 3.94Å; M147-L243 PolarHBondContact N-O 3.31Å; M147-L243 HydrophobicContact SD-CB 4.3Å; M147-L243 HydrophobicContact SD-CD2 3.62Å; M147-L243 HydrophobicContact SD-CG 4.49Å
148	K	96.8	Very high	95.3	Very high	161 Å²	161	54.1 Å²	54.1	70%	0.7	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-74.5	150.6	165	-67.9	177.7	-179.2	175.1	0	109.3	R150 E151 A152	K148-R150 PolarHBondContact O-N 3.39Å; K148-R150 VanDerWaalsContact O-N 3.14Å; K148-E151 PolarHBondContact N-OE2 3.45Å; K148-E151 WeakPolarHBondContact O-CB 3.42Å; K148-E151 PolarHBondContact O-N 2.87Å; K148-A152 PolarHBondContact O-N 2.87Å
149	E	98.2	Very high	95.7	Very high	30 Å²	30	52.5 Å²	52.5	14%	0.14	26%	0.257	C	S	.	.	H	α-helix	trans	-60.2	-30.2	-176.4	-73	-169	-162.6	0	0	114	R153 V244 M273 S274 W303	E149-R153 WeakPolarHBondContact O-CB 3.32Å; E149-R153 PolarHBondContact O-N 3.12Å; E149-V244 HydrophobicContact CG-CG1 4.17Å; E149-M273 WeakPolarHBondContact OE1-CA 3.12Å; E149-S274 PolarHBondContact OE1-N 2.98Å; E149-S274 PolarHBondContact OE1-OG 2.83Å; E149-S274 WeakPolarHBondContact OE2-CB 3.19Å; E149-S274 PolarHBondContact OE2-OG 3.25Å; E149-W303 HydrophobicContact CB-CZ2 4.01Å; E149-W303 HydrophobicContact CG-CZ2 4.24Å; E149-W303 PolarHBondContact OE2-NE1 2.66Å
150	R	97.6	Very high	96	Very high	208 Å²	208	47.8 Å²	47.8	79%	0.785	23%	0.231	S	C	*	.	H	α-helix	trans	-63.6	-40.9	173.2	-177.2	179.7	178.5	-176.9	0.3	112.9	K148 A154	K148-R150 PolarHBondContact O-N 3.39Å; K148-R150 VanDerWaalsContact O-N 3.14Å; R150-A154 PolarHBondContact O-N 2.92Å
151	E	96.8	Very high	96.3	Very high	82 Å²	82	47 Å²	47	38%	0.383	23%	0.23	S	C	.	.	H	α-helix	trans	-73	-49.2	179	171.1	-166.4	-171.7	0	0	110.2	H140 M147 K148 R153 A154 A155	H140-E151 IonicContact CE1-OE1 3.63Å; M147-E151 VanDerWaalsContact CA-OE2 3.31Å; M147-E151 WeakPolarHBondContact CA-OE2 3.46Å; M147-E151 HydrophobicContact CB-CB 4.39Å; M147-E151 HydrophobicContact CB-CG 4.01Å; M147-E151 WeakPolarHBondContact CB-OE2 3.42Å; M147-E151 HydrophobicContact CG-CG 4.04Å; M147-E151 HydrophobicContact SD-CG 4.19Å; K148-E151 PolarHBondContact N-OE2 3.45Å; K148-E151 WeakPolarHBondContact O-CB 3.42Å; K148-E151 PolarHBondContact O-N 2.87Å; E151-R153 VanDerWaalsContact C-N 3.25Å; E151-R153 PolarHBondContact O-N 2.77Å; E151-A154 PolarHBondContact O-N 2.81Å; E151-A154 VanDerWaalsContact O-N 3.16Å; E151-A155 PolarHBondContact O-N 3.12Å; E151-A155 VanDerWaalsContact O-N 3.12Å
152	A	98	Very high	96.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.5	-36	174.1	0	0	0	0	0	112.3	M147 K148 F156 L243 V244 W303	M147-A152 HydrophobicContact CB-CB 4.04Å; K148-A152 PolarHBondContact O-N 2.87Å; A152-F156 WeakPolarHBondContact O-CB 3.11Å; A152-F156 PolarHBondContact O-N 3.27Å; A152-L243 HydrophobicContact CB-CB 4.01Å; A152-V244 HydrophobicContact CB-CG1 3.65Å; A152-W303 HydrophobicContact CB-CH2 4.44Å
153	R	98.3	Very high	97	Very high	21 Å²	21	44.1 Å²	44.1	8%	0.079	21%	0.212	C	C	.	.	H	α-helix	trans	-66	-45	174.7	179.4	-176.6	-57.8	130.9	12.8	112.3	E149 E151 A155 F156 R157 W303 I306 Y308	E149-R153 WeakPolarHBondContact O-CB 3.32Å; E149-R153 PolarHBondContact O-N 3.12Å; E151-R153 VanDerWaalsContact C-N 3.25Å; E151-R153 PolarHBondContact O-N 2.77Å; R153-A155 VanDerWaalsContact C-N 3.35Å; R153-A155 PolarHBondContact O-N 3.21Å; R153-F156 PolarHBondContact O-N 3.17Å; R153-R157 HydrophobicContact CG-CG 4.38Å; R153-R157 WeakPolarHBondContact O-CB 3.2Å; R153-R157 VanDerWaalsContact O-CG 3.25Å; R153-R157 WeakPolarHBondContact O-CG 3.42Å; R153-R157 PolarHBondContact O-N 2.9Å; R153-W303 HydrophobicContact CB-CH2 3.8Å; R153-W303 HydrophobicContact CB-CZ2 4.21Å; R153-W303 HydrophobicContact CB-CZ3 4.11Å; R153-W303 WeakPolarHBondContact CD-O 3.46Å; R153-W303 HydrophobicContact CG-CZ3 4.42Å; R153-W303 PolarHBondContact NE-O 3.37Å; R153-I306 WeakPolarHBondContact CD-O 3.13Å; R153-I306 PolarHBondContact NH1-O 3.19Å; R153-Y308 HydrophobicContact CG-CE2 4.18Å
154	A	97.8	Very high	97.3	Very high	37 Å²	37	41.4 Å²	41.4	31%	0.306	19%	0.188	S	C	.	.	H	α-helix	trans	-59	-47.8	177.6	0	0	0	0	0	111	R150 E151 Q158	R150-A154 PolarHBondContact O-N 2.92Å; E151-A154 PolarHBondContact O-N 2.81Å; E151-A154 VanDerWaalsContact O-N 3.16Å; A154-Q158 PolarHBondContact O-N 3.38Å
155	A	97.8	Very high	97.6	Very high	8 Å²	8	35.7 Å²	35.7	7%	0.066	16%	0.162	C	C	.	.	H	α-helix	trans	-61.5	-48.3	173	0	0	0	0	0	112.3	E151 R153 R157 Q158 I159 I189	E151-A155 PolarHBondContact O-N 3.12Å; E151-A155 VanDerWaalsContact O-N 3.12Å; R153-A155 VanDerWaalsContact C-N 3.35Å; R153-A155 PolarHBondContact O-N 3.21Å; A155-R157 VanDerWaalsContact C-N 3.35Å; A155-R157 PolarHBondContact O-N 3.28Å; A155-Q158 WeakPolarHBondContact O-CB 3.47Å; A155-Q158 PolarHBondContact O-N 3.17Å; A155-Q158 VanDerWaalsContact O-N 3.12Å; A155-I159 VanDerWaalsContact O-CG1 3.32Å; A155-I159 WeakPolarHBondContact O-CG1 3.4Å; A155-I159 PolarHBondContact O-N 2.73Å; A155-I189 HydrophobicContact CB-CD1 4.02Å; A155-I189 HydrophobicContact CB-CG1 3.91Å
156	F	98.4	Very high	97.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-69.6	-28.5	-174.9	-162.5	-111.5	0	0	0	113.4	A152 R153 I159 V160 L236 L240 L243 L280 L284 W303 L304	A152-F156 WeakPolarHBondContact O-CB 3.11Å; A152-F156 PolarHBondContact O-N 3.27Å; R153-F156 PolarHBondContact O-N 3.17Å; F156-I159 HydrophobicContact CD2-CB 4.49Å; F156-I159 HydrophobicContact CD2-CD1 4.2Å; F156-I159 PolarHBondContact O-N 2.98Å; F156-V160 HydrophobicContact CD1-CG2 3.96Å; F156-V160 HydrophobicContact CE1-CG2 3.68Å; F156-V160 HydrophobicContact CE2-CG2 4.46Å; F156-V160 HydrophobicContact CG-CG2 4.46Å; F156-V160 HydrophobicContact CZ-CG2 3.96Å; F156-V160 WeakPolarHBondContact O-CB 3.07Å; F156-V160 VanDerWaalsContact O-CG2 3.28Å; F156-V160 WeakPolarHBondContact O-CG2 3.31Å; F156-V160 PolarHBondContact O-N 2.88Å; F156-L236 HydrophobicContact CE2-CB 4.13Å; F156-L236 HydrophobicContact CE2-CD2 4.13Å; F156-L236 WeakPolarHBondContact CE2-O 3.05Å; F156-L236 HydrophobicContact CZ-CB 4.07Å; F156-L240 HydrophobicContact CD1-CD1 4.11Å; F156-L240 HydrophobicContact CD1-CD2 4.39Å; F156-L240 HydrophobicContact CD2-CB 4.17Å; F156-L240 HydrophobicContact CD2-CD1 4.41Å; F156-L240 HydrophobicContact CE1-CB 4.31Å; F156-L240 HydrophobicContact CE1-CD1 4.44Å; F156-L240 HydrophobicContact CE1-CD2 3.99Å; F156-L240 HydrophobicContact CE1-CG 4.47Å; F156-L240 HydrophobicContact CE2-CB 3.78Å; F156-L240 HydrophobicContact CG-CD1 4.1Å; F156-L240 HydrophobicContact CZ-CB 3.85Å; F156-L240 HydrophobicContact CZ-CD2 4.26Å; F156-L243 HydrophobicContact CD2-CD1 4.37Å; F156-L280 HydrophobicContact CE1-CD2 4.37Å; F156-L284 HydrophobicContact CE1-CD1 4.36Å; F156-L284 HydrophobicContact CZ-CD1 4.12Å; F156-W303 HydrophobicContact CB-CZ3 4.47Å; F156-W303 HydrophobicContact CD1-CZ3 4.2Å; F156-L304 HydrophobicContact CD1-CD1 3.78Å
157	R	98.5	Very high	97.9	Very high	21 Å²	21	31.7 Å²	31.7	8%	0.079	14%	0.144	C	C	.	.	H	α-helix	trans	-59.6	-46.7	167.6	-74.7	170.4	71.6	84.8	0	111.5	R153 A155 V160 S161 L304 N305 Y308 N311 L313	R153-R157 HydrophobicContact CG-CG 4.38Å; R153-R157 WeakPolarHBondContact O-CB 3.2Å; R153-R157 VanDerWaalsContact O-CG 3.25Å; R153-R157 WeakPolarHBondContact O-CG 3.42Å; R153-R157 PolarHBondContact O-N 2.9Å; A155-R157 VanDerWaalsContact C-N 3.35Å; A155-R157 PolarHBondContact O-N 3.28Å; R157-V160 PolarHBondContact O-N 2.84Å; R157-S161 WeakPolarHBondContact O-CB 3.48Å; R157-S161 PolarHBondContact O-N 3.12Å; R157-L304 WeakPolarHBondContact CD-O 3.46Å; R157-L304 HydrophobicContact CG-CD1 3.66Å; R157-L304 HydrophobicContact CG-CG 3.8Å; R157-L304 PolarHBondContact NH1-O 3Å; R157-N305 PolarHBondContact NH1-OD1 3.36Å; R157-Y308 VanDerWaalsContact CZ-CG 3.47Å; R157-N311 PolarHBondContact NH2-O 2.96Å; R157-L313 HydrophobicContact CB-CD2 4.3Å; R157-L313 HydrophobicContact CG-CD2 4.46Å
158	Q	98.5	Very high	97.8	Very high	42 Å²	42	35 Å²	35	20%	0.196	16%	0.16	C	C	.	.	H	α-helix	trans	-64.9	-41.3	177.4	-70.1	179.9	-16.9	0	0	112.1	N111 A154 A155 S161 A162 N188 I189	N111-Q158 HydrophobicContact CB-CB 4.24Å; N111-Q158 VanDerWaalsContact ND2-CD 3.34Å; N111-Q158 PolarHBondContact ND2-OE1 2.96Å; A154-Q158 PolarHBondContact O-N 3.38Å; A155-Q158 WeakPolarHBondContact O-CB 3.47Å; A155-Q158 PolarHBondContact O-N 3.17Å; A155-Q158 VanDerWaalsContact O-N 3.12Å; Q158-S161 PolarHBondContact O-N 3.2Å; Q158-A162 WeakPolarHBondContact O-CB 3.21Å; Q158-A162 PolarHBondContact O-N 3.32Å; Q158-N188 PolarHBondContact NE2-OD1 3.32Å; Q158-I189 HydrophobicContact CB-CB 4.02Å; Q158-I189 HydrophobicContact CB-CG1 4.3Å
159	I	98.6	Very high	97.8	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-48.8	175.3	-60.6	161.9	0	0	0	110.9	A155 F156 S161 A162 V163 L181 I189 L236 I239 L243	A155-I159 VanDerWaalsContact O-CG1 3.32Å; A155-I159 WeakPolarHBondContact O-CG1 3.4Å; A155-I159 PolarHBondContact O-N 2.73Å; F156-I159 HydrophobicContact CD2-CB 4.49Å; F156-I159 HydrophobicContact CD2-CD1 4.2Å; F156-I159 PolarHBondContact O-N 2.98Å; I159-S161 VanDerWaalsContact C-N 3.33Å; I159-S161 PolarHBondContact O-N 2.83Å; I159-A162 PolarHBondContact O-N 3.09Å; I159-V163 HydrophobicContact CG2-CG2 4.41Å; I159-V163 WeakPolarHBondContact O-CG2 3.49Å; I159-V163 PolarHBondContact O-N 3.15Å; I159-L181 HydrophobicContact CD1-CD1 3.61Å; I159-L181 HydrophobicContact CG1-CD1 4.12Å; I159-L181 HydrophobicContact CG1-CD2 4.18Å; I159-L181 HydrophobicContact CG2-CD2 4.48Å; I159-I189 HydrophobicContact CD1-CD1 4.3Å; I159-I189 HydrophobicContact CD1-CG1 4.42Å; I159-I189 HydrophobicContact CG1-CB 4.39Å; I159-I189 HydrophobicContact CG1-CD1 4.32Å; I159-I189 HydrophobicContact CG1-CG1 4.02Å; I159-I189 HydrophobicContact CG1-CG2 3.76Å; I159-L236 HydrophobicContact CG2-CD2 3.27Å; I159-I239 HydrophobicContact CD1-CG2 4.2Å; I159-L243 HydrophobicContact CD1-CD1 4.24Å
160	V	98.7	Very high	97.6	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.2	-40.4	179.3	168	0	0	0	0	111.3	F156 R157 E164 V298 M299 L304 L313	F156-V160 HydrophobicContact CD1-CG2 3.96Å; F156-V160 HydrophobicContact CE1-CG2 3.68Å; F156-V160 HydrophobicContact CE2-CG2 4.46Å; F156-V160 HydrophobicContact CG-CG2 4.46Å; F156-V160 HydrophobicContact CZ-CG2 3.96Å; F156-V160 WeakPolarHBondContact O-CB 3.07Å; F156-V160 VanDerWaalsContact O-CG2 3.28Å; F156-V160 WeakPolarHBondContact O-CG2 3.31Å; F156-V160 PolarHBondContact O-N 2.88Å; R157-V160 PolarHBondContact O-N 2.84Å; V160-E164 VanDerWaalsContact O-CB 3.29Å; V160-E164 WeakPolarHBondContact O-CB 3.48Å; V160-E164 PolarHBondContact O-N 3.23Å; V160-V298 HydrophobicContact CG1-CG1 4.27Å; V160-V298 HydrophobicContact CG2-CG1 4.09Å; V160-M299 HydrophobicContact CG1-CE 4.19Å; V160-M299 HydrophobicContact CG1-CG 3.8Å; V160-L304 HydrophobicContact CG1-CD2 4.36Å; V160-L313 HydrophobicContact CB-CD2 4.28Å; V160-L313 HydrophobicContact CG1-CD2 4.02Å
161	S	98.5	Very high	97.5	Very high	13 Å²	13	24.1 Å²	24.1	9%	0.091	12%	0.118	C	C	.	.	H	α-helix	trans	-59	-48.6	173.8	-169.3	0	0	0	0	112.1	H109 R157 Q158 I159 Y165	H109-S161 PolarHBondContact NE2-O 2.83Å; H109-S161 PolarHBondContact NE2-OG 3.12Å; R157-S161 WeakPolarHBondContact O-CB 3.48Å; R157-S161 PolarHBondContact O-N 3.12Å; Q158-S161 PolarHBondContact O-N 3.2Å; I159-S161 VanDerWaalsContact C-N 3.33Å; I159-S161 PolarHBondContact O-N 2.83Å; S161-Y165 WeakPolarHBondContact O-CB 3.39Å; S161-Y165 PolarHBondContact O-N 2.73Å
162	A	98.5	Very high	97.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64	-43.5	-179.3	0	0	0	0	0	112.9	H109 N111 I112 Q158 I159 C166 L191	H109-A162 VanDerWaalsContact CE1-CA 3.5Å; H109-A162 WeakPolarHBondContact CE1-CA 3.34Å; H109-A162 PolarHBondContact CE1-N 3.48Å; N111-A162 HydrophobicContact CB-CB 4.28Å; I112-A162 HydrophobicContact CD1-CB 4.31Å; I112-A162 HydrophobicContact CG1-CB 3.83Å; Q158-A162 WeakPolarHBondContact O-CB 3.21Å; Q158-A162 PolarHBondContact O-N 3.32Å; I159-A162 PolarHBondContact O-N 3.09Å; A162-C166 PolarHBondContact O-N 3.23Å; A162-C166 PolarHBondContact O-SG 3.47Å; A162-C166 VanDerWaalsContact O-SG 3.35Å; A162-L191 HydrophobicContact CB-CD2 4.35Å
163	V	98.4	Very high	97.3	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-75.5	-36.3	-178.2	-178.1	0	0	0	0	111.7	I159 C166 H167 L176 L191 D232 L236 L295	I159-V163 HydrophobicContact CG2-CG2 4.41Å; I159-V163 WeakPolarHBondContact O-CG2 3.49Å; I159-V163 PolarHBondContact O-N 3.15Å; V163-C166 WeakPolarHBondContact O-CB 3.45Å; V163-C166 PolarHBondContact O-N 2.78Å; V163-H167 PolarHBondContact O-CD2 2.86Å; V163-H167 VanDerWaalsContact O-CG 3.32Å; V163-H167 PolarHBondContact O-N 2.77Å; V163-L176 HydrophobicContact CG1-CD1 4.01Å; V163-L176 HydrophobicContact CG2-CD1 3.87Å; V163-L176 HydrophobicContact CG2-CD2 4.06Å; V163-L191 HydrophobicContact CG2-CD2 4.07Å; V163-D232 HydrophobicContact CG1-CB 4.14Å; V163-L236 HydrophobicContact CB-CD1 4.16Å; V163-L236 HydrophobicContact CG1-CD1 4.05Å; V163-L236 HydrophobicContact CG2-CD1 4.35Å; V163-L236 HydrophobicContact CG2-CD2 4.35Å; V163-L295 HydrophobicContact CB-CD1 4Å; V163-L295 HydrophobicContact CG1-CD1 3.72Å
164	E	98	Very high	97.1	Very high	6 Å²	6	20.1 Å²	20.1	3%	0.028	10%	0.099	C	C	.	.	H	α-helix	trans	-66.6	-39	174.9	-161.6	-84.7	163.9	0	0	111.5	V160 C166 H167 Q168 L295 R296 M299 P315	V160-E164 VanDerWaalsContact O-CB 3.29Å; V160-E164 WeakPolarHBondContact O-CB 3.48Å; V160-E164 PolarHBondContact O-N 3.23Å; E164-C166 PolarHBondContact O-N 3.19Å; E164-H167 CarbonylContact O-C 3.56Å; E164-H167 WeakPolarHBondContact O-CA 3.41Å; E164-H167 WeakPolarHBondContact O-CB 3.31Å; E164-H167 PolarHBondContact O-N 3.18Å; E164-Q168 WeakPolarHBondContact O-CG 3.44Å; E164-Q168 PolarHBondContact O-N 3.25Å; E164-Q168 PolarHBondContact OE2-NE2 3.17Å; E164-L295 HydrophobicContact CB-CB 3.94Å; E164-L295 HydrophobicContact CB-CD1 4.02Å; E164-L295 HydrophobicContact CG-CB 3.75Å; E164-R296 HydrophobicContact CG-CG 4.4Å; E164-R296 WeakPolarHBondContact OE1-CG 3.18Å; E164-R296 IonicContact OE1-NE 3.14Å; E164-R296 PolarHBondContact OE1-NE 3.41Å; E164-M299 HydrophobicContact CB-CE 3.48Å; E164-M299 VanDerWaalsContact CB-CE 3.48Å; E164-M299 HydrophobicContact CB-SD 4.46Å; E164-M299 HydrophobicContact CG-CE 3.74Å; E164-M299 HydrophobicContact CG-SD 4.1Å; E164-P315 WeakPolarHBondContact OE2-CB 3.44Å
165	Y	98	Very high	96.9	Very high	3 Å²	3	18.7 Å²	18.7	1%	0.012	9%	0.086	C	C	.	.	H	α-helix	trans	-58.2	-42.4	171	166.9	-97.8	0	0	0	112.7	M106 L107 N108 H109 I112 S161 Q168 K169 Y316 E318	M106-Y165 PolarHBondContact O-OH 2.69Å; L107-Y165 HydrophobicContact CB-CE1 4.47Å; L107-Y165 HydrophobicContact CD2-CD1 4.07Å; L107-Y165 HydrophobicContact CD2-CE1 3.48Å; L107-Y165 VanDerWaalsContact CD2-CE1 3.48Å; N108-Y165 PolarHBondContact N-OH 2.63Å; N108-Y165 PolarHBondContact O-OH 3.15Å; H109-Y165 HydrophobicContact CB-CD1 3.68Å; H109-Y165 HydrophobicContact CB-CE1 3.79Å; H109-Y165 HydrophobicContact CB-CG 4.21Å; H109-Y165 AromaticContact CD2-CG 3.86Å; I112-Y165 HydrophobicContact CD1-CD1 3.79Å; I112-Y165 HydrophobicContact CD1-CE1 4.09Å; S161-Y165 WeakPolarHBondContact O-CB 3.39Å; S161-Y165 PolarHBondContact O-N 2.73Å; Y165-Q168 WeakPolarHBondContact O-CB 3.18Å; Y165-Q168 PolarHBondContact O-N 3.22Å; Y165-K169 HydrophobicContact CE2-CD 4.22Å; Y165-K169 HydrophobicContact CE2-CG 4.47Å; Y165-K169 PolarHBondContact O-N 3.1Å; Y165-K169 VanDerWaalsContact O-N 3.1Å; Y165-K169 WeakPolarHBondContact OH-CE 3.44Å; Y165-K169 PolarHBondContact OH-NZ 3.04Å; Y165-Y316 AromaticContact CD2-CD1 3.7Å; Y165-Y316 HydrophobicContact CD2-CD1 3.7Å; Y165-Y316 HydrophobicContact CD2-CE1 4.44Å; Y165-Y316 HydrophobicContact CE2-CD1 4.12Å; Y165-Y316 HydrophobicContact CE2-CE1 4.43Å; Y165-Y316 HydrophobicContact CG-CD1 4.31Å; Y165-E318 HydrophobicContact CE2-CB 4.37Å; Y165-E318 PolarHBondContact OH-OE2 2.95Å; Y165-E318 VanDerWaalsContact OH-OE2 3.12Å
166	C	97.6	Very high	96.8	Very high	3 Å²	3	18.4 Å²	18.4	2%	0.02	8%	0.084	C	C	.	.	H	α-helix	trans	-59.9	-45.4	170.8	-69	0	0	0	0	111.6	A162 V163 E164 Q168 K169 K170 I171	A162-C166 PolarHBondContact O-N 3.23Å; A162-C166 PolarHBondContact O-SG 3.47Å; A162-C166 VanDerWaalsContact O-SG 3.35Å; V163-C166 WeakPolarHBondContact O-CB 3.45Å; V163-C166 PolarHBondContact O-N 2.78Å; E164-C166 PolarHBondContact O-N 3.19Å; C166-Q168 PolarHBondContact O-N 3.25Å; C166-K169 CarbonylContact O-C 3.58Å; C166-K169 PolarHBondContact O-N 3.04Å; C166-K170 PolarHBondContact O-N 3.47Å; C166-I171 CarbonylContact C-O 3.55Å; C166-I171 HydrophobicContact CB-CB 4.25Å; C166-I171 HydrophobicContact CB-CG2 4.32Å; C166-I171 PolarHBondContact O-N 2.67Å; C166-I171 VanDerWaalsContact O-O 3.09Å
167	H	96.6	Very high	96.6	Very high	24 Å²	24	19.6 Å²	19.6	11%	0.111	9%	0.089	C	C	.	.	H	α-helix	trans	-65.1	-35.2	179.5	-67.2	-177.9	0	0	0	112.5	V163 E164 K170 I171 F200 P229 D232	V163-H167 PolarHBondContact O-CD2 2.86Å; V163-H167 VanDerWaalsContact O-CG 3.32Å; V163-H167 PolarHBondContact O-N 2.77Å; E164-H167 CarbonylContact O-C 3.56Å; E164-H167 WeakPolarHBondContact O-CA 3.41Å; E164-H167 WeakPolarHBondContact O-CB 3.31Å; E164-H167 PolarHBondContact O-N 3.18Å; H167-K170 PolarHBondContact O-N 2.86Å; H167-I171 PolarHBondContact CD2-O 3Å; H167-F200 WeakPolarHBondContact O-CZ 3.47Å; H167-P229 PolarHBondContact CE1-O 3.17Å; H167-D232 IonicContact CD2-OD2 3.67Å; H167-D232 IonicContact CE1-OD2 2.7Å; H167-D232 IonicContact NE2-OD2 3.46Å; H167-D232 PolarHBondContact NE2-OD2 3.41Å
168	Q	95.2	Very high	96.2	Very high	73 Å²	73	18.7 Å²	18.7	34%	0.341	9%	0.086	S	C	.	.	H	α-helix	trans	-58.7	-51.4	169.5	-68.1	-178.5	37.7	0	0	110.7	E164 Y165 C166 K170 Y316	E164-Q168 WeakPolarHBondContact O-CG 3.44Å; E164-Q168 PolarHBondContact O-N 3.25Å; E164-Q168 PolarHBondContact OE2-NE2 3.17Å; Y165-Q168 WeakPolarHBondContact O-CB 3.18Å; Y165-Q168 PolarHBondContact O-N 3.22Å; C166-Q168 PolarHBondContact O-N 3.25Å; Q168-K170 PolarHBondContact O-N 3.18Å; Q168-Y316 PolarHBondContact NE2-O 3.17Å; Q168-Y316 VanDerWaalsContact NE2-O 3.15Å
169	K	95.4	Very high	95.7	Very high	67 Å²	67	19.3 Å²	19.3	29%	0.291	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	19.9	177.1	-69.3	-155.7	177	-170.7	0	114.1	M106 Y165 C166 I171 E318	M106-K169 PolarHBondContact O-NZ 2.89Å; Y165-K169 HydrophobicContact CE2-CD 4.22Å; Y165-K169 HydrophobicContact CE2-CG 4.47Å; Y165-K169 PolarHBondContact O-N 3.1Å; Y165-K169 VanDerWaalsContact O-N 3.1Å; Y165-K169 WeakPolarHBondContact OH-CE 3.44Å; Y165-K169 PolarHBondContact OH-NZ 3.04Å; C166-K169 CarbonylContact O-C 3.58Å; C166-K169 PolarHBondContact O-N 3.04Å; K169-I171 HydrophobicContact CB-CD1 4.04Å; K169-I171 PolarHBondContact O-N 3.05Å; K169-E318 VanDerWaalsContact CE-OE2 3.27Å; K169-E318 WeakPolarHBondContact CE-OE2 3.31Å; K169-E318 IonicContact NZ-OE2 3.53Å; K169-E318 PolarHBondContact NZ-OE2 3.39Å
170	K	95.2	Very high	95.5	Very high	104 Å²	104	19.9 Å²	19.9	45%	0.452	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	26	175.3	-60.6	-61.5	-168	155.7	0	114.4	C166 H167 Q168 L199 F200	C166-K170 PolarHBondContact O-N 3.47Å; H167-K170 PolarHBondContact O-N 2.86Å; Q168-K170 PolarHBondContact O-N 3.18Å; K170-L199 CarbonylContact O-C 3.49Å; K170-L199 VanDerWaalsContact O-CA 3.22Å; K170-L199 WeakPolarHBondContact O-CA 3.36Å; K170-F200 VanDerWaalsContact CA-CE1 3.46Å; K170-F200 HydrophobicContact CB-CE1 4.49Å; K170-F200 WeakPolarHBondContact CB-O 3.41Å; K170-F200 HydrophobicContact CD-CE2 4.12Å; K170-F200 HydrophobicContact CD-CZ 4.06Å; K170-F200 WeakPolarHBondContact CD-O 3.38Å; K170-F200 WeakPolarHBondContact O-CD1 3.14Å; K170-F200 PolarHBondContact O-N 3.47Å
171	I	95.4	Very high	95.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131	178.1	-66	152	0	0	0	109.4	I103 L107 C166 H167 K169 L199	I103-I171 HydrophobicContact CD1-CG2 4.4Å; I103-I171 HydrophobicContact CG1-CG1 4.32Å; I103-I171 HydrophobicContact CG2-CD1 4.06Å; I103-I171 HydrophobicContact CG2-CG1 4.26Å; I103-I171 HydrophobicContact CG2-CG2 3.85Å; L107-I171 HydrophobicContact CD2-CD1 3.82Å; L107-I171 HydrophobicContact CG-CD1 4.17Å; C166-I171 CarbonylContact C-O 3.55Å; C166-I171 HydrophobicContact CB-CB 4.25Å; C166-I171 HydrophobicContact CB-CG2 4.32Å; C166-I171 PolarHBondContact O-N 2.67Å; C166-I171 VanDerWaalsContact O-O 3.09Å; H167-I171 PolarHBondContact CD2-O 3Å; K169-I171 HydrophobicContact CB-CD1 4.04Å; K169-I171 PolarHBondContact O-N 3.05Å; I171-L199 HydrophobicContact CG1-CD2 3.64Å
172	V	95.2	Very high	95.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	142.2	167.7	-76.1	0	0	0	0	110.6	R174 S197 N198 F200 L206 P229	V172-R174 HydrophobicContact CB-CG 4.1Å; V172-R174 HydrophobicContact CG2-CG 3.93Å; V172-S197 CarbonylContact O-C 3.49Å; V172-S197 WeakPolarHBondContact O-CA 3.33Å; V172-S197 WeakPolarHBondContact O-CB 3.46Å; V172-N198 WeakPolarHBondContact CG2-O 3.2Å; V172-N198 PolarHBondContact N-O 3.06Å; V172-N198 PolarHBondContact O-N 3.07Å; V172-F200 HydrophobicContact CB-CD1 4.4Å; V172-F200 HydrophobicContact CG1-CD1 3.55Å; V172-F200 HydrophobicContact CG1-CE1 3.77Å; V172-F200 HydrophobicContact CG1-CG 4.29Å; V172-F200 HydrophobicContact CG2-CD1 4.31Å; V172-L206 HydrophobicContact CG2-CD1 3.8Å; V172-P229 HydrophobicContact CG1-CG 4.07Å
173	H	94.8	Very high	95.3	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.009	10%	0.1	C	C	.	.			trans	-86.9	-44.8	-172	-166.5	-86.4	0	0	0	112.5	D175 L176 A192 F194 F196 S197 D232	H173-D175 PolarHBondContact CE1-O 3.12Å; H173-D175 VanDerWaalsContact ND1-C 3.33Å; H173-D175 PolarHBondContact ND1-O 2.66Å; H173-D175 PolarHBondContact O-N 3.33Å; H173-L176 HydrophobicContact CB-CD2 3.9Å; H173-L176 HydrophobicContact CB-CG 3.89Å; H173-A192 PolarHBondContact NE2-O 3.22Å; H173-F194 AromaticContact CD2-CD1 3.71Å; H173-F194 AromaticContact CD2-CE1 3.62Å; H173-F196 CarbonylContact O-C 3.59Å; H173-S197 PolarHBondContact O-N 3.1Å; H173-D232 PolarHBondContact N-OD2 2.75Å
174	R	93.4	Very high	95.2	Very high	17 Å²	17	22.6 Å²	22.6	6%	0.064	10%	0.104	C	C	.	.	S	Bend	trans	62.8	-5.8	174.2	-48.9	-172	-61.8	168.8	-0.2	117.2	V172 F196 C210 G211 Y226 V231 D232	V172-R174 HydrophobicContact CB-CG 4.1Å; V172-R174 HydrophobicContact CG2-CG 3.93Å; R174-F196 PolarHBondContact NE-O 3.25Å; R174-F196 PolarHBondContact NH2-O 3.28Å; R174-C210 VanDerWaalsContact CZ-SG 3.57Å; R174-G211 WeakPolarHBondContact O-CA 3.48Å; R174-Y226 WeakPolarHBondContact CD-OH 3.43Å; R174-Y226 PolarHBondContact NH1-OH 3.46Å; R174-V231 HydrophobicContact CG-CG2 4.32Å; R174-D232 WeakPolarHBondContact CA-OD1 3.22Å; R174-D232 PolarHBondContact N-OD1 3.01Å
175	D	93.9	Very high	94.9	Very high	7 Å²	7	24.1 Å²	24.1	4%	0.037	12%	0.122	C	C	.	.			trans	-132	52.4	167.8	-167.9	32.5	0	0	0	110.8	H173 K177 N180 F196 G211 S212	H173-D175 PolarHBondContact CE1-O 3.12Å; H173-D175 VanDerWaalsContact ND1-C 3.33Å; H173-D175 PolarHBondContact ND1-O 2.66Å; H173-D175 PolarHBondContact O-N 3.33Å; D175-K177 PolarHBondContact O-N 3.46Å; D175-K177 IonicContact OD1-NZ 3.44Å; D175-K177 IonicContact OD2-NZ 3.61Å; D175-K177 PolarHBondContact OD2-NZ 3.27Å; D175-N180 PolarHBondContact O-ND2 3.4Å; D175-F196 HydrophobicContact CB-CB 3.85Å; D175-F196 HydrophobicContact CB-CD2 3.78Å; D175-F196 HydrophobicContact CB-CG 4.08Å; D175-G211 VanDerWaalsContact OD1-CA 3.29Å; D175-G211 WeakPolarHBondContact OD1-CA 3.34Å; D175-S212 PolarHBondContact OD1-N 3.19Å
176	L	96.3	Very high	94.8	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	15%	0.152	C	C	.	.			trans	-76	118.8	172.6	-71.6	177.7	0	0	0	109.7	V163 H173 L191 Y215 D232 L236 I239	V163-L176 HydrophobicContact CG1-CD1 4.01Å; V163-L176 HydrophobicContact CG2-CD1 3.87Å; V163-L176 HydrophobicContact CG2-CD2 4.06Å; H173-L176 HydrophobicContact CB-CD2 3.9Å; H173-L176 HydrophobicContact CB-CG 3.89Å; L176-L191 HydrophobicContact CD2-CD1 3.63Å; L176-L191 HydrophobicContact CD2-CD2 4.31Å; L176-Y215 WeakPolarHBondContact O-CB 3.37Å; L176-D232 HydrophobicContact CD1-CB 3.63Å; L176-L236 HydrophobicContact CD1-CD1 4.46Å; L176-L236 HydrophobicContact CD1-CD2 4.2Å; L176-L236 HydrophobicContact CD1-CG 4Å; L176-I239 HydrophobicContact CB-CD1 4.04Å
177	K	93.5	Very high	94.6	Very high	25 Å²	25	37.7 Å²	37.7	11%	0.109	18%	0.175	C	C	.	.			trans	-151.8	159	-178.4	61.2	-177.4	-168.3	-78.8	0	110.5	D175 E179 N180 S212 Y215	D175-K177 PolarHBondContact O-N 3.46Å; D175-K177 IonicContact OD1-NZ 3.44Å; D175-K177 IonicContact OD2-NZ 3.61Å; D175-K177 PolarHBondContact OD2-NZ 3.27Å; K177-E179 WeakPolarHBondContact CB-OE2 3.27Å; K177-E179 HydrophobicContact CD-CB 4.23Å; K177-E179 HydrophobicContact CG-CB 4.17Å; K177-E179 PolarHBondContact O-N 3.05Å; K177-N180 WeakPolarHBondContact CE-OD1 3.5Å; K177-N180 HydrophobicContact CG-CB 3.85Å; K177-N180 PolarHBondContact NZ-ND2 3.37Å; K177-N180 PolarHBondContact NZ-OD1 2.96Å; K177-N180 PolarHBondContact O-N 3.35Å; K177-S212 WeakPolarHBondContact CD-OG 3.49Å; K177-Y215 HydrophobicContact CB-CD1 4.24Å; K177-Y215 HydrophobicContact CB-CD2 3.61Å; K177-Y215 HydrophobicContact CB-CE1 4.06Å; K177-Y215 HydrophobicContact CB-CE2 3.36Å; K177-Y215 HydrophobicContact CB-CG 4.03Å
178	A	90.7	Very high	94.7	Very high	2 Å²	2	39.2 Å²	39.2	2%	0.017	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-62.7	-25.9	-179	0	0	0	0	0	113.1	F138 N180 L181 Y215	F138-A178 HydrophobicContact CB-CB 4.06Å; F138-A178 HydrophobicContact CD2-CB 4.15Å; A178-N180 VanDerWaalsContact C-N 3.32Å; A178-L181 PolarHBondContact O-N 2.88Å; A178-Y215 WeakPolarHBondContact CB-OH 3.42Å; A178-Y215 PolarHBondContact N-OH 2.87Å
179	E	88.3	Confident	94.8	Very high	56 Å²	56	35.8 Å²	35.8	26%	0.262	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-72.8	-21.4	174.6	-48	93.6	102.3	0	0	112.9	E136 F138 K177 Y215	E136-E179 WeakPolarHBondContact OE2-CA 3.42Å; F138-E179 HydrophobicContact CB-CG 4.31Å; F138-E179 HydrophobicContact CG-CG 4.34Å; K177-E179 WeakPolarHBondContact CB-OE2 3.27Å; K177-E179 HydrophobicContact CD-CB 4.23Å; K177-E179 HydrophobicContact CG-CB 4.17Å; K177-E179 PolarHBondContact O-N 3.05Å; E179-Y215 PolarHBondContact OE2-OH 3.11Å
180	N	94.9	Very high	94.9	Very high	13 Å²	13	33.3 Å²	33.3	7%	0.07	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-94.9	9.5	175.3	-80.2	5.7	0	0	0	112.5	D175 K177 A178 A192	D175-N180 PolarHBondContact O-ND2 3.4Å; K177-N180 WeakPolarHBondContact CE-OD1 3.5Å; K177-N180 HydrophobicContact CG-CB 3.85Å; K177-N180 PolarHBondContact NZ-ND2 3.37Å; K177-N180 PolarHBondContact NZ-OD1 2.96Å; K177-N180 PolarHBondContact O-N 3.35Å; A178-N180 VanDerWaalsContact C-N 3.32Å; N180-A192 PolarHBondContact O-N 3.01Å
181	L	97	Very high	95.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.7	174.4	-61.9	174.7	0	0	0	108.6	V137 I159 A178 I189 L191 I239	V137-L181 HydrophobicContact CB-CB 4.06Å; V137-L181 HydrophobicContact CG2-CB 3.71Å; V137-L181 WeakPolarHBondContact CG2-O 3.41Å; V137-L181 PolarHBondContact N-O 2.87Å; I159-L181 HydrophobicContact CD1-CD1 3.61Å; I159-L181 HydrophobicContact CG1-CD1 4.12Å; I159-L181 HydrophobicContact CG1-CD2 4.18Å; I159-L181 HydrophobicContact CG2-CD2 4.48Å; A178-L181 PolarHBondContact O-N 2.88Å; L181-I189 HydrophobicContact CD2-CG2 4.11Å; L181-L191 HydrophobicContact CD2-CB 4.37Å; L181-L191 HydrophobicContact CD2-CD1 3.83Å; L181-I239 HydrophobicContact CD1-CD1 4.31Å; L181-I239 HydrophobicContact CD1-CG2 3.93Å
182	L	97.3	Very high	95.1	Very high	40 Å²	40	29.1 Å²	29.1	21%	0.209	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	161.8	179	-48.3	178.9	0	0	0	110.9	V113 A132 G135 E136 I189 K190 A192	V113-L182 HydrophobicContact CG2-CD1 4.37Å; A132-L182 HydrophobicContact CB-CB 3.62Å; A132-L182 HydrophobicContact CB-CD1 3.94Å; A132-L182 HydrophobicContact CB-CG 4.44Å; G135-L182 CarbonylContact O-C 3.56Å; G135-L182 WeakPolarHBondContact O-CA 3.48Å; E136-L182 HydrophobicContact CB-CD2 4.39Å; E136-L182 HydrophobicContact CG-CD2 3.67Å; L182-I189 CarbonylContact O-C 3.59Å; L182-I189 WeakPolarHBondContact O-CA 3.5Å; L182-K190 HydrophobicContact CB-CB 4.26Å; L182-K190 PolarHBondContact N-O 3.36Å; L182-K190 PolarHBondContact O-N 3.13Å; L182-A192 HydrophobicContact CD1-CB 4.07Å; L182-A192 HydrophobicContact CG-CB 4.26Å
183	F	97.2	Very high	94.8	Very high	11 Å²	11	31.9 Å²	31.9	5%	0.048	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128.8	168.9	-78.4	-54.9	0	0	0	111.3	A132 E133 N134 G135 V137 H140 M147 Y187 N188 I189	A132-F183 CarbonylContact C-O 3.48Å; A132-F183 WeakPolarHBondContact CB-O 3.36Å; E133-F183 PolarHBondContact N-O 3.34Å; N134-F183 HydrophobicContact CB-CB 3.67Å; N134-F183 PolarHBondContact N-O 3.24Å; G135-F183 PolarHBondContact O-N 2.79Å; V137-F183 HydrophobicContact CB-CE2 4.23Å; V137-F183 HydrophobicContact CG1-CE2 4.24Å; V137-F183 HydrophobicContact CG1-CZ 4.41Å; V137-F183 HydrophobicContact CG2-CD1 4.36Å; V137-F183 HydrophobicContact CG2-CD2 3.87Å; V137-F183 HydrophobicContact CG2-CE1 4.22Å; V137-F183 HydrophobicContact CG2-CE2 3.73Å; V137-F183 HydrophobicContact CG2-CG 4.2Å; V137-F183 HydrophobicContact CG2-CZ 3.92Å; H140-F183 HydrophobicContact CB-CD2 4.27Å; H140-F183 HydrophobicContact CB-CE2 3.94Å; H140-F183 AromaticContact CG-CE2 3.87Å; M147-F183 HydrophobicContact CE-CE2 4.01Å; M147-F183 HydrophobicContact CE-CZ 3.75Å; F183-Y187 HydrophobicContact CB-CD1 4.36Å; F183-Y187 HydrophobicContact CD1-CD1 4.41Å; F183-Y187 VanDerWaalsContact CD1-O 3.3Å; F183-Y187 WeakPolarHBondContact CD1-O 3.42Å; F183-Y187 HydrophobicContact CD2-CD1 4.14Å; F183-Y187 WeakPolarHBondContact CE1-O 3.5Å; F183-Y187 HydrophobicContact CE2-CD1 4.48Å; F183-Y187 HydrophobicContact CG-CD1 4.1Å; F183-N188 WeakPolarHBondContact CA-O 3.44Å; F183-I189 HydrophobicContact CD1-CD1 4.17Å; F183-I189 HydrophobicContact CE1-CD1 3.71Å; F183-I189 HydrophobicContact CE1-CG1 4.38Å; F183-I189 HydrophobicContact CZ-CD1 4.3Å
184	D	95.5	Very high	94.5	Very high	20 Å²	20	31.9 Å²	31.9	11%	0.107	16%	0.157	C	C	.	.			trans	-71.8	175.1	166.8	75.4	7.2	0	0	0	111.7	N134 Y186 Y187 N188 K190	N134-D184 PolarHBondContact ND2-O 3.32Å; D184-Y186 PolarHBondContact O-N 2.79Å; D184-Y186 VanDerWaalsContact OD1-C 3.31Å; D184-Y186 VanDerWaalsContact OD1-CA 3.31Å; D184-Y186 WeakPolarHBondContact OD1-CA 3.22Å; D184-Y186 WeakPolarHBondContact OD1-CB 3.32Å; D184-Y186 PolarHBondContact OD1-N 3.11Å; D184-Y187 PolarHBondContact O-N 3.35Å; D184-Y187 PolarHBondContact OD1-N 3.42Å; D184-N188 PolarHBondContact N-O 3.01Å; D184-N188 PolarHBondContact OD1-N 3.04Å; D184-N188 PolarHBondContact OD1-ND2 2.86Å; D184-N188 WeakPolarHBondContact OD2-CB 3.41Å; D184-N188 PolarHBondContact OD2-ND2 3.22Å; D184-K190 HydrophobicContact CB-CG 4.18Å
185	G	92.5	Very high	93.9	Very high	39 Å²	39	31.2 Å²	31.2	40%	0.402	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-12.4	177.4	0	0	0	0	0	115.7	E133 N134	E133-G185 PolarHBondContact OE2-N 2.87Å; N134-G185 WeakPolarHBondContact ND2-CA 3.29Å
186	Y	94.3	Very high	93.3	Very high	164 Å²	164	34.1 Å²	34.1	64%	0.643	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.7	5	177.1	-66.9	-80.6	0	0	0	113.4	D184 N188 K365	D184-Y186 PolarHBondContact O-N 2.79Å; D184-Y186 VanDerWaalsContact OD1-C 3.31Å; D184-Y186 VanDerWaalsContact OD1-CA 3.31Å; D184-Y186 WeakPolarHBondContact OD1-CA 3.22Å; D184-Y186 WeakPolarHBondContact OD1-CB 3.32Å; D184-Y186 PolarHBondContact OD1-N 3.11Å; Y186-N188 VanDerWaalsContact C-N 3.3Å; Y186-N188 PolarHBondContact O-N 3.27Å; Y186-K365 PolarHBondContact OH-NZ 3.22Å
187	Y	94.3	Very high	92.8	Very high	127 Å²	127	34.1 Å²	34.1	50%	0.498	17%	0.167	S	C	.	.	S	Bend	trans	62.7	27.5	-172.9	-64.9	-95.1	0	0	0	114.6	N134 F183 D184	N134-Y187 HydrophobicContact CB-CE1 4.24Å; N134-Y187 WeakPolarHBondContact ND2-CE2 3.44Å; F183-Y187 HydrophobicContact CB-CD1 4.36Å; F183-Y187 HydrophobicContact CD1-CD1 4.41Å; F183-Y187 VanDerWaalsContact CD1-O 3.3Å; F183-Y187 WeakPolarHBondContact CD1-O 3.42Å; F183-Y187 HydrophobicContact CD2-CD1 4.14Å; F183-Y187 WeakPolarHBondContact CE1-O 3.5Å; F183-Y187 HydrophobicContact CE2-CD1 4.48Å; F183-Y187 HydrophobicContact CG-CD1 4.1Å; D184-Y187 PolarHBondContact O-N 3.35Å; D184-Y187 PolarHBondContact OD1-N 3.42Å
188	N	97.6	Very high	92.5	Very high	56 Å²	56	34.5 Å²	34.5	30%	0.299	17%	0.17	S	C	.	.			trans	-78.7	148	162	-52.9	-71	0	0	0	110.7	Q158 F183 D184 Y186	Q158-N188 PolarHBondContact NE2-OD1 3.32Å; F183-N188 WeakPolarHBondContact CA-O 3.44Å; D184-N188 PolarHBondContact N-O 3.01Å; D184-N188 PolarHBondContact OD1-N 3.04Å; D184-N188 PolarHBondContact OD1-ND2 2.86Å; D184-N188 WeakPolarHBondContact OD2-CB 3.41Å; D184-N188 PolarHBondContact OD2-ND2 3.22Å; Y186-N188 VanDerWaalsContact C-N 3.3Å; Y186-N188 PolarHBondContact O-N 3.27Å
189	I	98.3	Very high	92.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	139	172.8	-66	-68.2	0	0	0	110.9	N111 V137 A155 Q158 I159 L181 L182 F183	N111-I189 WeakPolarHBondContact CA-O 3.43Å; N111-I189 WeakPolarHBondContact CB-O 3.48Å; N111-I189 PolarHBondContact ND2-O 3.18Å; V137-I189 HydrophobicContact CG2-CD1 3.59Å; A155-I189 HydrophobicContact CB-CD1 4.02Å; A155-I189 HydrophobicContact CB-CG1 3.91Å; Q158-I189 HydrophobicContact CB-CB 4.02Å; Q158-I189 HydrophobicContact CB-CG1 4.3Å; I159-I189 HydrophobicContact CD1-CD1 4.3Å; I159-I189 HydrophobicContact CD1-CG1 4.42Å; I159-I189 HydrophobicContact CG1-CB 4.39Å; I159-I189 HydrophobicContact CG1-CD1 4.32Å; I159-I189 HydrophobicContact CG1-CG1 4.02Å; I159-I189 HydrophobicContact CG1-CG2 3.76Å; L181-I189 HydrophobicContact CD2-CG2 4.11Å; L182-I189 CarbonylContact O-C 3.59Å; L182-I189 WeakPolarHBondContact O-CA 3.5Å; F183-I189 HydrophobicContact CD1-CD1 4.17Å; F183-I189 HydrophobicContact CE1-CD1 3.71Å; F183-I189 HydrophobicContact CE1-CG1 4.38Å; F183-I189 HydrophobicContact CZ-CD1 4.3Å
190	K	98.1	Very high	92.3	Very high	15 Å²	15	37 Å²	37	7%	0.065	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	109.5	166.6	-63	-67.1	-169.3	164.3	0	109.3	P110 V113 E130 A132 L182 D184	P110-K190 WeakPolarHBondContact O-CE 3.47Å; P110-K190 PolarHBondContact O-NZ 2.9Å; V113-K190 HydrophobicContact CG2-CB 3.86Å; E130-K190 WeakPolarHBondContact OE1-CE 3.49Å; E130-K190 IonicContact OE1-NZ 2.86Å; E130-K190 PolarHBondContact OE1-NZ 2.87Å; E130-K190 WeakPolarHBondContact OE2-CE 3.44Å; E130-K190 IonicContact OE2-NZ 3.78Å; E130-K190 PolarHBondContact OE2-NZ 3.33Å; A132-K190 HydrophobicContact CB-CB 4.42Å; A132-K190 HydrophobicContact CB-CG 4.35Å; L182-K190 HydrophobicContact CB-CB 4.26Å; L182-K190 PolarHBondContact N-O 3.36Å; L182-K190 PolarHBondContact O-N 3.13Å; D184-K190 HydrophobicContact CB-CG 4.18Å
191	L	98.1	Very high	91.6	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	132.7	175.8	174.1	62.8	0	0	0	110.8	N111 I112 V113 A162 V163 L176 L181 F194	N111-L191 PolarHBondContact O-N 2.92Å; I112-L191 HydrophobicContact CG1-CB 4.39Å; V113-L191 WeakPolarHBondContact CG2-O 3.46Å; V113-L191 PolarHBondContact N-O 2.87Å; A162-L191 HydrophobicContact CB-CD2 4.35Å; V163-L191 HydrophobicContact CG2-CD2 4.07Å; L176-L191 HydrophobicContact CD2-CD1 3.63Å; L176-L191 HydrophobicContact CD2-CD2 4.31Å; L181-L191 HydrophobicContact CD2-CB 4.37Å; L181-L191 HydrophobicContact CD2-CD1 3.83Å; L191-F194 HydrophobicContact CD2-CZ 3.97Å; L191-F194 HydrophobicContact CG-CE2 4.35Å; L191-F194 HydrophobicContact CG-CZ 4.13Å
192	A	95	Very high	90.6	Very high	15 Å²	15	42.7 Å²	42.7	12%	0.124	23%	0.226	C	C	.	.			trans	-134.9	167.5	-171.4	0	0	0	0	0	114.1	V113 H173 N180 L182	V113-A192 HydrophobicContact CG2-CB 3.89Å; H173-A192 PolarHBondContact NE2-O 3.22Å; N180-A192 PolarHBondContact O-N 3.01Å; L182-A192 HydrophobicContact CD1-CB 4.07Å; L182-A192 HydrophobicContact CG-CB 4.26Å
193	D	89	Confident	89.8	Confident	57 Å²	57	45.4 Å²	45.4	31%	0.305	25%	0.249	S	C	.	.			trans	61.7	64.5	175.2	-160.3	41.4	0	0	0	116.7	K82 G195	K82-D193 IonicContact NZ-OD1 3.19Å; K82-D193 PolarHBondContact NZ-OD1 2.98Å; D193-G195 PolarHBondContact O-N 2.88Å
194	F	89.9	Confident	89.1	Confident	3 Å²	3	52 Å²	52	1%	0.013	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-67.1	8.8	175.4	-74.1	-95.9	0	0	0	114.9	E100 I103 M104 L107 I112 H173 L191 F196 S197	E100-F194 HydrophobicContact CG-CB 4.44Å; I103-F194 HydrophobicContact CG2-CB 4.41Å; I103-F194 HydrophobicContact CG2-CD1 3.89Å; I103-F194 HydrophobicContact CG2-CG 4.4Å; M104-F194 HydrophobicContact CG-CB 4.26Å; M104-F194 HydrophobicContact CG-CD2 4.47Å; L107-F194 HydrophobicContact CD1-CD1 3.66Å; L107-F194 HydrophobicContact CD1-CD2 4.42Å; L107-F194 HydrophobicContact CD1-CE1 3.31Å; L107-F194 HydrophobicContact CD1-CE2 4.16Å; L107-F194 HydrophobicContact CD1-CG 4.21Å; L107-F194 HydrophobicContact CD1-CZ 3.61Å; I112-F194 HydrophobicContact CD1-CZ 4.28Å; I112-F194 HydrophobicContact CG2-CE2 3.68Å; I112-F194 HydrophobicContact CG2-CZ 3.8Å; H173-F194 AromaticContact CD2-CD1 3.71Å; H173-F194 AromaticContact CD2-CE1 3.62Å; L191-F194 HydrophobicContact CD2-CZ 3.97Å; L191-F194 HydrophobicContact CG-CE2 4.35Å; L191-F194 HydrophobicContact CG-CZ 4.13Å; F194-F196 VanDerWaalsContact C-N 3.28Å; F194-F196 PolarHBondContact O-N 3.34Å; F194-S197 WeakPolarHBondContact O-CB 3.43Å; F194-S197 PolarHBondContact O-N 3.38Å; F194-S197 PolarHBondContact O-OG 3.26Å
195	G	80.7	Confident	88.4	Confident	3 Å²	3	56 Å²	56	3%	0.031	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-57.9	-35.8	-174.9	0	0	0	0	0	114.2	K96 E100 D193 S197	K96-G195 WeakPolarHBondContact CE-O 3.21Å; K96-G195 WeakPolarHBondContact CG-O 3.28Å; E100-G195 VanDerWaalsContact CD-CA 3.47Å; E100-G195 WeakPolarHBondContact OE2-CA 3.44Å; D193-G195 PolarHBondContact O-N 2.88Å; G195-S197 VanDerWaalsContact C-N 3.33Å
196	F	81	Confident	88	Confident	68 Å²	68	55 Å²	55	30%	0.298	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-84.3	-5.1	176.6	-70.9	-77.7	0	0	0	114.7	H173 R174 D175 F194 C210	H173-F196 CarbonylContact O-C 3.59Å; R174-F196 PolarHBondContact NE-O 3.25Å; R174-F196 PolarHBondContact NH2-O 3.28Å; D175-F196 HydrophobicContact CB-CB 3.85Å; D175-F196 HydrophobicContact CB-CD2 3.78Å; D175-F196 HydrophobicContact CB-CG 4.08Å; F194-F196 VanDerWaalsContact C-N 3.28Å; F194-F196 PolarHBondContact O-N 3.34Å; F196-C210 HydrophobicContact CD1-CB 3.73Å; F196-C210 HydrophobicContact CE1-CB 4.2Å
197	S	84.9	Confident	87.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.275	C	S	.	.			trans	-62.8	160.4	-178.5	70.9	0	0	0	0	113	R99 I103 V172 H173 F194 G195	R99-S197 PolarHBondContact NE-O 3.02Å; R99-S197 PolarHBondContact NH2-O 3.22Å; I103-S197 VanDerWaalsContact CD1-OG 3.24Å; I103-S197 WeakPolarHBondContact CD1-OG 3.2Å; V172-S197 CarbonylContact O-C 3.49Å; V172-S197 WeakPolarHBondContact O-CA 3.33Å; V172-S197 WeakPolarHBondContact O-CB 3.46Å; H173-S197 PolarHBondContact O-N 3.1Å; F194-S197 WeakPolarHBondContact O-CB 3.43Å; F194-S197 PolarHBondContact O-N 3.38Å; F194-S197 PolarHBondContact O-OG 3.26Å; G195-S197 VanDerWaalsContact C-N 3.33Å
198	N	88.5	Confident	86.5	Confident	33 Å²	33	49.6 Å²	49.6	18%	0.176	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	162.5	172.2	-160.8	47.6	0	0	0	110.5	R99 V172 L206	R99-N198 WeakPolarHBondContact CD-OD1 3.32Å; R99-N198 PolarHBondContact NE-OD1 2.91Å; R99-N198 VanDerWaalsContact NE-OD1 3.16Å; R99-N198 PolarHBondContact NH1-OD1 2.71Å; V172-N198 WeakPolarHBondContact CG2-O 3.2Å; V172-N198 PolarHBondContact N-O 3.06Å; V172-N198 PolarHBondContact O-N 3.07Å; N198-L206 VanDerWaalsContact ND2-CD2 3.29Å; N198-L206 WeakPolarHBondContact ND2-CD2 3.37Å
199	L	86	Confident	85.7	Confident	86 Å²	86	51.8 Å²	51.8	45%	0.45	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	151.6	165.9	-60.6	175.8	0	0	0	110.7	I103 K170 I171	I103-L199 HydrophobicContact CD1-CD2 4.49Å; I103-L199 HydrophobicContact CG1-CD2 4.46Å; K170-L199 CarbonylContact O-C 3.49Å; K170-L199 VanDerWaalsContact O-CA 3.22Å; K170-L199 WeakPolarHBondContact O-CA 3.36Å; I171-L199 HydrophobicContact CG1-CD2 3.64Å
200	F	88.7	Confident	84.8	Confident	24 Å²	24	52.5 Å²	52.5	11%	0.105	29%	0.285	C	S	.	.			trans	-135.4	127	170.3	75	-80.6	0	0	0	109.9	H167 K170 V172 P229	H167-F200 WeakPolarHBondContact O-CZ 3.47Å; K170-F200 VanDerWaalsContact CA-CE1 3.46Å; K170-F200 HydrophobicContact CB-CE1 4.49Å; K170-F200 WeakPolarHBondContact CB-O 3.41Å; K170-F200 HydrophobicContact CD-CE2 4.12Å; K170-F200 HydrophobicContact CD-CZ 4.06Å; K170-F200 WeakPolarHBondContact CD-O 3.38Å; K170-F200 WeakPolarHBondContact O-CD1 3.14Å; K170-F200 PolarHBondContact O-N 3.47Å; V172-F200 HydrophobicContact CB-CD1 4.4Å; V172-F200 HydrophobicContact CG1-CD1 3.55Å; V172-F200 HydrophobicContact CG1-CE1 3.77Å; V172-F200 HydrophobicContact CG1-CG 4.29Å; V172-F200 HydrophobicContact CG2-CD1 4.31Å; F200-P229 HydrophobicContact CD1-CG 4.43Å; F200-P229 HydrophobicContact CD2-CG 4.07Å; F200-P229 HydrophobicContact CE1-CG 3.85Å; F200-P229 HydrophobicContact CE2-CG 3.46Å; F200-P229 VanDerWaalsContact CE2-CG 3.46Å; F200-P229 HydrophobicContact CZ-CG 3.34Å
201	D	79.1	Confident	83.9	Confident	81 Å²	81	52.7 Å²	52.7	43%	0.433	29%	0.291	S	S	.	.			trans	-91.8	-29.1	179.1	50.3	45.4	0	0	0	112.5	S203 K204	D201-S203 WeakPolarHBondContact OD1-CA 3.39Å; D201-S203 WeakPolarHBondContact OD1-CB 3.4Å; D201-S203 PolarHBondContact OD1-N 2.87Å; D201-S203 PolarHBondContact OD1-OG 3.46Å; D201-S203 PolarHBondContact OD2-OG 2.93Å; D201-K204 PolarHBondContact OD1-N 2.83Å
202	G	77.6	Confident	83.4	Confident	52 Å²	52	53.9 Å²	53.9	54%	0.536	30%	0.299	S	S	.	.	S	Bend	trans	97.3	-9	-173.4	0	0	0	0	0	113.7
203	S	79.7	Confident	83.2	Confident	97 Å²	97	54.3 Å²	54.3	68%	0.678	30%	0.301	S	S	*	.	S	Bend	trans	-88.8	-34.7	170	75.6	0	0	0	0	112.2	D201	D201-S203 WeakPolarHBondContact OD1-CA 3.39Å; D201-S203 WeakPolarHBondContact OD1-CB 3.4Å; D201-S203 PolarHBondContact OD1-N 2.87Å; D201-S203 PolarHBondContact OD1-OG 3.46Å; D201-S203 PolarHBondContact OD2-OG 2.93Å
204	K	81.4	Confident	83.4	Confident	149 Å²	149	52.5 Å²	52.5	65%	0.648	29%	0.292	S	S	*	.	S	Bend	trans	-113.4	111.5	-175.9	-71.9	166.9	-174.4	167.3	0	110.5	D201	D201-K204 PolarHBondContact OD1-N 2.83Å
205	K	82.6	Confident	83.7	Confident	105 Å²	105	52.9 Å²	52.9	46%	0.457	29%	0.294	S	S	.	.			trans	-68.9	137.1	171.1	-60.6	-164.8	-173.8	-65.2	0	111.1	K225 Y226 D227	K205-K225 HydrophobicContact CB-CB 3.72Å; K205-K225 HydrophobicContact CB-CD 4.49Å; K205-K225 HydrophobicContact CD-CB 4.11Å; K205-Y226 CarbonylContact C-O 3.38Å; K205-Y226 VanDerWaalsContact CA-O 3.31Å; K205-Y226 WeakPolarHBondContact CA-O 3.5Å; K205-Y226 WeakPolarHBondContact CB-O 3.33Å; K205-D227 WeakPolarHBondContact CG-OD1 3.36Å; K205-D227 IonicContact NZ-OD1 2.87Å; K205-D227 PolarHBondContact NZ-OD1 3.32Å; K205-D227 IonicContact NZ-OD2 3.94Å; K205-D227 PolarHBondContact NZ-OD2 3.01Å
206	L	82.3	Confident	84.4	Confident	19 Å²	19	53 Å²	53	10%	0.099	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-74.7	146.6	172.1	-56.2	178.7	0	0	0	110.3	V172 N198 K225 Y226	V172-L206 HydrophobicContact CG2-CD1 3.8Å; N198-L206 VanDerWaalsContact ND2-CD2 3.29Å; N198-L206 WeakPolarHBondContact ND2-CD2 3.37Å; L206-K225 CarbonylContact O-C 3.47Å; L206-K225 WeakPolarHBondContact O-CA 3.15Å; L206-Y226 HydrophobicContact CB-CD1 4.33Å; L206-Y226 HydrophobicContact CB-CD2 4.01Å; L206-Y226 HydrophobicContact CB-CE1 3.94Å; L206-Y226 HydrophobicContact CB-CE2 3.59Å; L206-Y226 HydrophobicContact CB-CG 4.36Å; L206-Y226 HydrophobicContact CD1-CD2 4.39Å; L206-Y226 HydrophobicContact CD1-CE2 3.73Å; L206-Y226 HydrophobicContact CG-CE2 4.26Å; L206-Y226 PolarHBondContact N-O 2.86Å; L206-Y226 VanDerWaalsContact O-CD1 3.25Å; L206-Y226 WeakPolarHBondContact O-CD1 3.41Å; L206-Y226 PolarHBondContact O-N 3.27Å
207	D	80.2	Confident	85.1	Confident	103 Å²	103	49.7 Å²	49.7	55%	0.551	28%	0.28	S	S	*	.			trans	-122	-14.3	-177	59.7	6.9	0	0	0	113.9	F209 K225	D207-F209 PolarHBondContact O-N 2.83Å; D207-K225 HydrophobicContact CB-CD 4.49Å; D207-K225 HydrophobicContact CB-CG 4.11Å
208	T	77.9	Confident	85.6	Confident	73 Å²	73	49.7 Å²	49.7	45%	0.448	28%	0.28	S	S	.	.			trans	-79.1	122.2	-168	-47.4	0	0	0	0	110.9	C210 Y226	T208-C210 PolarHBondContact O-N 3.5Å; T208-Y226 PolarHBondContact O-OH 2.68Å
209	F	81	Confident	85.9	Confident	103 Å²	103	48.4 Å²	48.4	45%	0.452	27%	0.273	S	S	.	.			trans	-71.8	116.7	165.8	-172	-80.3	0	0	0	109.7	D207 L220 F221	D207-F209 PolarHBondContact O-N 2.83Å; F209-L220 HydrophobicContact CD2-CB 3.71Å; F209-L220 WeakPolarHBondContact CD2-O 3.49Å; F209-L220 HydrophobicContact CE2-CB 3.76Å; F209-F221 HydrophobicContact CE2-CD1 4.45Å; F209-F221 HydrophobicContact CZ-CE1 4.5Å
210	C	79.5	Confident	86.1	Confident	15 Å²	15	44.9 Å²	44.9	10%	0.101	25%	0.254	C	S	.	.			trans	-150.4	168.1	173.3	56.8	0	0	0	0	111.1	R174 F196 T208	R174-C210 VanDerWaalsContact CZ-SG 3.57Å; F196-C210 HydrophobicContact CD1-CB 3.73Å; F196-C210 HydrophobicContact CE1-CB 4.2Å; T208-C210 PolarHBondContact O-N 3.5Å
211	G	78.3	Confident	86.2	Confident	18 Å²	18	44.8 Å²	44.8	19%	0.186	25%	0.254	C	S	.	.	S	Bend	trans	95.7	164.1	-177	0	0	0	0	0	114.3	R174 D175 P213	R174-G211 WeakPolarHBondContact O-CA 3.48Å; D175-G211 VanDerWaalsContact OD1-CA 3.29Å; D175-G211 WeakPolarHBondContact OD1-CA 3.34Å; G211-P213 WeakPolarHBondContact O-CD 3.31Å
212	S	87.3	Confident	86.7	Confident	28 Å²	28	45 Å²	45	20%	0.196	25%	0.252	C	S	.	.			trans	-63.7	120.6	177.8	-88.2	0	0	0	0	112.3	D175 K177 P214 Y215 A216	D175-S212 PolarHBondContact OD1-N 3.19Å; K177-S212 WeakPolarHBondContact CD-OG 3.49Å; S212-P214 WeakPolarHBondContact O-CD 3.3Å; S212-P214 VanDerWaalsContact O-N 3.09Å; S212-Y215 PolarHBondContact O-N 3.03Å; S212-A216 PolarHBondContact O-N 2.82Å
213	P	91.8	Very high	87	Confident	23 Å²	23	45.7 Å²	45.7	15%	0.149	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-32.6	-174.2	-29.7	35.4	0	0	0	118	G211 Y215 A216 F221 L255 L258	G211-P213 WeakPolarHBondContact O-CD 3.31Å; P213-Y215 VanDerWaalsContact C-N 3.27Å; P213-Y215 PolarHBondContact O-N 2.93Å; P213-A216 PolarHBondContact O-N 2.97Å; P213-F221 HydrophobicContact CB-CZ 4.18Å; P213-F221 WeakPolarHBondContact O-CZ 3.03Å; P213-L255 HydrophobicContact CB-CD1 3.7Å; P213-L255 HydrophobicContact CG-CD1 4.09Å; P213-L258 HydrophobicContact CB-CD2 3.99Å
214	P	93.9	Very high	87.3	Confident	20 Å²	20	48.7 Å²	48.7	13%	0.13	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.5	177.6	-18.9	33.1	0	0	0	114.6	S212 L248 L258 F652	S212-P214 WeakPolarHBondContact O-CD 3.3Å; S212-P214 VanDerWaalsContact O-N 3.09Å; P214-L248 HydrophobicContact CB-CD1 3.32Å; P214-L248 HydrophobicContact CG-CD1 4.22Å; P214-L258 HydrophobicContact CB-CD2 4.39Å; P214-L258 HydrophobicContact CG-CD2 4.05Å; P214-F652 HydrophobicContact CG-CE1 4.48Å; P214-F652 HydrophobicContact CG-CZ 4.49Å
215	Y	96.2	Very high	87.5	Confident	10 Å²	10	48.2 Å²	48.2	4%	0.039	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-15.7	175.3	-58.9	-91.9	0	0	0	112.3	L176 K177 A178 E179 S212 P213 W234 S235 V238 I239 L248	L176-Y215 WeakPolarHBondContact O-CB 3.37Å; K177-Y215 HydrophobicContact CB-CD1 4.24Å; K177-Y215 HydrophobicContact CB-CD2 3.61Å; K177-Y215 HydrophobicContact CB-CE1 4.06Å; K177-Y215 HydrophobicContact CB-CE2 3.36Å; K177-Y215 HydrophobicContact CB-CG 4.03Å; A178-Y215 WeakPolarHBondContact CB-OH 3.42Å; A178-Y215 PolarHBondContact N-OH 2.87Å; E179-Y215 PolarHBondContact OE2-OH 3.11Å; S212-Y215 PolarHBondContact O-N 3.03Å; P213-Y215 VanDerWaalsContact C-N 3.27Å; P213-Y215 PolarHBondContact O-N 2.93Å; Y215-W234 VanDerWaalsContact O-CD1 3.22Å; Y215-S235 PolarHBondContact O-OG 2.95Å; Y215-V238 HydrophobicContact CD1-CB 3.94Å; Y215-V238 HydrophobicContact CD1-CG1 3.35Å; Y215-V238 HydrophobicContact CE1-CG1 3.79Å; Y215-V238 HydrophobicContact CG-CG1 4.08Å; Y215-I239 HydrophobicContact CD1-CG1 4.15Å; Y215-I239 HydrophobicContact CE1-CG1 3.94Å; Y215-L248 HydrophobicContact CE1-CD2 3.91Å
216	A	94.9	Very high	87.6	Confident	5 Å²	5	43.6 Å²	43.6	4%	0.041	23%	0.234	C	C	.	.			trans	-63.5	139.4	-176.8	0	0	0	0	0	113.4	S212 P213 L220 F221 W234	S212-A216 PolarHBondContact O-N 2.82Å; P213-A216 PolarHBondContact O-N 2.97Å; A216-L220 HydrophobicContact CB-CD1 4.06Å; A216-F221 HydrophobicContact CB-CD2 4.47Å; A216-F221 HydrophobicContact CB-CE2 3.82Å; A216-F221 HydrophobicContact CB-CZ 4.38Å; A216-W234 PolarHBondContact O-NE1 3.47Å; A216-W234 VanDerWaalsContact O-NE1 3.13Å
217	A	95.5	Very high	87.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.245	C	C	.	.			trans	-71.9	150.3	179.8	0	0	0	0	0	112.8	E219 L220 V231 W234	A217-E219 VanDerWaalsContact C-N 3.26Å; A217-E219 VanDerWaalsContact CB-CD 3.48Å; A217-E219 HydrophobicContact CB-CG 4.21Å; A217-E219 WeakPolarHBondContact CB-OE1 2.96Å; A217-E219 PolarHBondContact O-N 2.87Å; A217-L220 HydrophobicContact CB-CD1 4.44Å; A217-L220 HydrophobicContact CB-CG 4.46Å; A217-L220 WeakPolarHBondContact O-CB 3.47Å; A217-L220 PolarHBondContact O-N 3.5Å; A217-V231 HydrophobicContact CB-CB 3.97Å; A217-V231 HydrophobicContact CB-CG1 4.15Å; A217-W234 VanDerWaalsContact CA-CD1 3.47Å; A217-W234 HydrophobicContact CB-CB 3.9Å; A217-W234 HydrophobicContact CB-CD2 4.48Å; A217-W234 HydrophobicContact CB-CG 3.84Å
218	P	95.3	Very high	88.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.8	-174.6	23.3	-33.4	0	0	0	113.8	L220 F221 Q222 W234 V262 L263 L287	P218-L220 VanDerWaalsContact C-N 3.32Å; P218-L220 PolarHBondContact O-N 3.43Å; P218-F221 WeakPolarHBondContact O-CB 3.48Å; P218-F221 PolarHBondContact O-N 3.49Å; P218-Q222 WeakPolarHBondContact O-CG 3.31Å; P218-Q222 PolarHBondContact O-N 3.19Å; P218-W234 HydrophobicContact CG-CE3 4.22Å; P218-W234 HydrophobicContact CG-CH2 4.08Å; P218-W234 HydrophobicContact CG-CZ2 4.45Å; P218-W234 HydrophobicContact CG-CZ3 3.95Å; P218-V262 HydrophobicContact CB-CG1 4.06Å; P218-L263 HydrophobicContact CB-CD2 4.01Å; P218-L287 HydrophobicContact CB-CD2 4.06Å; P218-L287 HydrophobicContact CG-CD2 3.9Å
219	E	94	Very high	89	Confident	6 Å²	6	38.6 Å²	38.6	3%	0.028	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-32.4	174.1	55.5	-89.7	-153.5	0	0	113.5	A217 Q222 G223 R224 V231 R292	A217-E219 VanDerWaalsContact C-N 3.26Å; A217-E219 VanDerWaalsContact CB-CD 3.48Å; A217-E219 HydrophobicContact CB-CG 4.21Å; A217-E219 WeakPolarHBondContact CB-OE1 2.96Å; A217-E219 PolarHBondContact O-N 2.87Å; E219-Q222 WeakPolarHBondContact O-CB 3.5Å; E219-Q222 PolarHBondContact O-N 2.91Å; E219-Q222 VanDerWaalsContact O-N 3.1Å; E219-G223 PolarHBondContact O-N 3.49Å; E219-R224 PolarHBondContact O-N 2.87Å; E219-V231 HydrophobicContact CG-CG1 4.36Å; E219-R292 IonicContact OE1-CZ 2.66Å; E219-R292 IonicContact OE1-NH1 3.93Å; E219-R292 PolarHBondContact OE1-NH1 3.42Å; E219-R292 IonicContact OE1-NH2 3.73Å; E219-R292 PolarHBondContact OE1-NH2 2.73Å; E219-R292 IonicContact OE2-CZ 2.71Å; E219-R292 IonicContact OE2-NH1 2.67Å; E219-R292 IonicContact OE2-NH2 3.61Å; E219-R292 PolarHBondContact OE2-NH2 2.87Å
220	L	91.9	Very high	89.7	Confident	12 Å²	12	35 Å²	35	6%	0.063	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-65.7	-44.1	174.2	-60.1	175.5	0	0	0	109.9	F209 A216 A217 P218 Q222 G223 Y226 V231	F209-L220 HydrophobicContact CD2-CB 3.71Å; F209-L220 WeakPolarHBondContact CD2-O 3.49Å; F209-L220 HydrophobicContact CE2-CB 3.76Å; A216-L220 HydrophobicContact CB-CD1 4.06Å; A217-L220 HydrophobicContact CB-CD1 4.44Å; A217-L220 HydrophobicContact CB-CG 4.46Å; A217-L220 WeakPolarHBondContact O-CB 3.47Å; A217-L220 PolarHBondContact O-N 3.5Å; P218-L220 VanDerWaalsContact C-N 3.32Å; P218-L220 PolarHBondContact O-N 3.43Å; L220-Q222 PolarHBondContact O-N 3.14Å; L220-Q222 VanDerWaalsContact O-N 3.12Å; L220-G223 PolarHBondContact O-N 2.93Å; L220-Y226 HydrophobicContact CD2-CD1 3.6Å; L220-Y226 HydrophobicContact CD2-CE1 3.37Å; L220-Y226 HydrophobicContact CD2-CE2 4.38Å; L220-Y226 HydrophobicContact CD2-CG 4.22Å; L220-V231 HydrophobicContact CD1-CB 4.49Å; L220-V231 HydrophobicContact CD2-CG1 4.44Å; L220-V231 HydrophobicContact CG-CG1 4.46Å
221	F	89.9	Confident	90.5	Very high	21 Å²	21	34.4 Å²	34.4	9%	0.092	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-65.4	-8.8	173	-75.3	-75.8	0	0	0	114.6	F209 P213 A216 P218 L255 Q259 V262 L263	F209-F221 HydrophobicContact CE2-CD1 4.45Å; F209-F221 HydrophobicContact CZ-CE1 4.5Å; P213-F221 HydrophobicContact CB-CZ 4.18Å; P213-F221 WeakPolarHBondContact O-CZ 3.03Å; A216-F221 HydrophobicContact CB-CD2 4.47Å; A216-F221 HydrophobicContact CB-CE2 3.82Å; A216-F221 HydrophobicContact CB-CZ 4.38Å; P218-F221 WeakPolarHBondContact O-CB 3.48Å; P218-F221 PolarHBondContact O-N 3.49Å; F221-L255 HydrophobicContact CE1-CD1 4Å; F221-Q259 HydrophobicContact CB-CG 4.07Å; F221-Q259 HydrophobicContact CD1-CB 3.72Å; F221-Q259 HydrophobicContact CD1-CG 3.64Å; F221-Q259 HydrophobicContact CE1-CB 3.92Å; F221-Q259 HydrophobicContact CE1-CG 4.36Å; F221-Q259 HydrophobicContact CG-CB 4.43Å; F221-Q259 HydrophobicContact CG-CG 4.08Å; F221-Q259 PolarHBondContact O-NE2 3.05Å; F221-V262 HydrophobicContact CD2-CB 4.32Å; F221-V262 HydrophobicContact CD2-CG1 3.73Å; F221-V262 HydrophobicContact CE2-CB 4.18Å; F221-V262 HydrophobicContact CE2-CG1 3.85Å; F221-V262 HydrophobicContact CE2-CG2 4.14Å; F221-L263 HydrophobicContact CB-CD2 4.28Å
222	Q	88.8	Confident	91.4	Very high	85 Å²	85	33.5 Å²	33.5	40%	0.397	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-101.3	-1.7	173.9	-66.1	166	9.5	0	0	112.5	P218 E219 L220 R224 L263	P218-Q222 WeakPolarHBondContact O-CG 3.31Å; P218-Q222 PolarHBondContact O-N 3.19Å; E219-Q222 WeakPolarHBondContact O-CB 3.5Å; E219-Q222 PolarHBondContact O-N 2.91Å; E219-Q222 VanDerWaalsContact O-N 3.1Å; L220-Q222 PolarHBondContact O-N 3.14Å; L220-Q222 VanDerWaalsContact O-N 3.12Å; Q222-R224 HydrophobicContact CB-CG 3.88Å; Q222-R224 PolarHBondContact O-N 2.79Å; Q222-R224 VanDerWaalsContact OE1-CD 3.24Å; Q222-L263 HydrophobicContact CG-CD2 3.8Å
223	G	85.5	Confident	91.9	Very high	68 Å²	68	32.4 Å²	32.4	70%	0.701	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.3	21.8	-175.4	0	0	0	0	0	113.8	E219 L220	E219-G223 PolarHBondContact O-N 3.49Å; L220-G223 PolarHBondContact O-N 2.93Å
224	R	85.4	Confident	92.2	Very high	159 Å²	159	31.3 Å²	31.3	60%	0.6	16%	0.162	S	C	*	.			trans	-82.5	142.4	-177.3	-70.9	-180	176.2	179.1	-6.9	110.6	E219 Q222	E219-R224 PolarHBondContact O-N 2.87Å; Q222-R224 HydrophobicContact CB-CG 3.88Å; Q222-R224 PolarHBondContact O-N 2.79Å; Q222-R224 VanDerWaalsContact OE1-CD 3.24Å
225	K	85.4	Confident	92.4	Very high	140 Å²	140	30.6 Å²	30.6	61%	0.609	16%	0.158	S	C	*	.			trans	-66	135.6	168.2	-60	-165.8	176.3	-171.5	0	109.7	K205 L206 D207	K205-K225 HydrophobicContact CB-CB 3.72Å; K205-K225 HydrophobicContact CB-CD 4.49Å; K205-K225 HydrophobicContact CD-CB 4.11Å; L206-K225 CarbonylContact O-C 3.47Å; L206-K225 WeakPolarHBondContact O-CA 3.15Å; D207-K225 HydrophobicContact CB-CD 4.49Å; D207-K225 HydrophobicContact CB-CG 4.11Å
226	Y	85.5	Confident	92.5	Very high	7 Å²	7	30.1 Å²	30.1	3%	0.027	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-126.5	154.4	-171.7	60.7	-84.7	0	0	0	110.4	R174 K205 L206 T208 L220 E230 V231	R174-Y226 WeakPolarHBondContact CD-OH 3.43Å; R174-Y226 PolarHBondContact NH1-OH 3.46Å; K205-Y226 CarbonylContact C-O 3.38Å; K205-Y226 VanDerWaalsContact CA-O 3.31Å; K205-Y226 WeakPolarHBondContact CA-O 3.5Å; K205-Y226 WeakPolarHBondContact CB-O 3.33Å; L206-Y226 HydrophobicContact CB-CD1 4.33Å; L206-Y226 HydrophobicContact CB-CD2 4.01Å; L206-Y226 HydrophobicContact CB-CE1 3.94Å; L206-Y226 HydrophobicContact CB-CE2 3.59Å; L206-Y226 HydrophobicContact CB-CG 4.36Å; L206-Y226 HydrophobicContact CD1-CD2 4.39Å; L206-Y226 HydrophobicContact CD1-CE2 3.73Å; L206-Y226 HydrophobicContact CG-CE2 4.26Å; L206-Y226 PolarHBondContact N-O 2.86Å; L206-Y226 VanDerWaalsContact O-CD1 3.25Å; L206-Y226 WeakPolarHBondContact O-CD1 3.41Å; L206-Y226 PolarHBondContact O-N 3.27Å; T208-Y226 PolarHBondContact O-OH 2.68Å; L220-Y226 HydrophobicContact CD2-CD1 3.6Å; L220-Y226 HydrophobicContact CD2-CE1 3.37Å; L220-Y226 HydrophobicContact CD2-CE2 4.38Å; L220-Y226 HydrophobicContact CD2-CG 4.22Å; Y226-E230 WeakPolarHBondContact CB-OE1 3.25Å; Y226-V231 HydrophobicContact CD2-CG1 3.64Å; Y226-V231 HydrophobicContact CD2-CG2 4.47Å; Y226-V231 HydrophobicContact CE2-CG1 4.2Å; Y226-V231 HydrophobicContact CE2-CG2 4.3Å; Y226-V231 HydrophobicContact CG-CG1 4.09Å
227	D	85.3	Confident	92.7	Very high	62 Å²	62	29.9 Å²	29.9	33%	0.332	15%	0.154	S	C	.	.			trans	-82.8	-30.9	-175.8	-68	-68	0	0	0	111.6	K205 E230	K205-D227 WeakPolarHBondContact CG-OD1 3.36Å; K205-D227 IonicContact NZ-OD1 2.87Å; K205-D227 PolarHBondContact NZ-OD1 3.32Å; K205-D227 IonicContact NZ-OD2 3.94Å; K205-D227 PolarHBondContact NZ-OD2 3.01Å; D227-E230 PolarHBondContact N-OE1 2.83Å
228	G	88.6	Confident	92.8	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	132	-74.8	169.6	0	0	0	0	0	113.2	E230 V231	G228-E230 VanDerWaalsContact C-OE2 3.27Å; G228-E230 VanDerWaalsContact N-CD 3.31Å; G228-E230 PolarHBondContact N-OE1 2.88Å; G228-E230 PolarHBondContact N-OE2 3.27Å; G228-E230 PolarHBondContact O-N 2.74Å; G228-V231 WeakPolarHBondContact O-CG2 3.29Å; G228-V231 PolarHBondContact O-N 3.21Å
229	P	95.1	Very high	92.9	Very high	28 Å²	28	30 Å²	30	18%	0.182	16%	0.155	C	C	.	.	H	α-helix	trans	-49.7	-36.4	-170.1	-33.5	39.6	0	0	0	115.2	H167 V172 F200 V231 D232 V233	H167-P229 PolarHBondContact CE1-O 3.17Å; V172-P229 HydrophobicContact CG1-CG 4.07Å; F200-P229 HydrophobicContact CD1-CG 4.43Å; F200-P229 HydrophobicContact CD2-CG 4.07Å; F200-P229 HydrophobicContact CE1-CG 3.85Å; F200-P229 HydrophobicContact CE2-CG 3.46Å; F200-P229 VanDerWaalsContact CE2-CG 3.46Å; F200-P229 HydrophobicContact CZ-CG 3.34Å; P229-V231 VanDerWaalsContact C-N 3.31Å; P229-V231 PolarHBondContact O-N 2.93Å; P229-D232 WeakPolarHBondContact O-CB 3.18Å; P229-D232 PolarHBondContact O-N 2.88Å; P229-V233 WeakPolarHBondContact O-CG2 3.41Å; P229-V233 PolarHBondContact O-N 2.99Å; P229-V233 VanDerWaalsContact O-N 3.12Å
230	E	95.8	Very high	93.1	Very high	27 Å²	27	29.7 Å²	29.7	13%	0.126	15%	0.153	C	C	.	.	H	α-helix	trans	-61.4	-31.3	-179.2	67.9	-73.8	172.8	0	0	113.9	Y226 D227 G228 V233 W234 P289 R292	Y226-E230 WeakPolarHBondContact CB-OE1 3.25Å; D227-E230 PolarHBondContact N-OE1 2.83Å; G228-E230 VanDerWaalsContact C-OE2 3.27Å; G228-E230 VanDerWaalsContact N-CD 3.31Å; G228-E230 PolarHBondContact N-OE1 2.88Å; G228-E230 PolarHBondContact N-OE2 3.27Å; G228-E230 PolarHBondContact O-N 2.74Å; E230-V233 WeakPolarHBondContact O-CB 3.43Å; E230-V233 PolarHBondContact O-N 2.88Å; E230-W234 PolarHBondContact O-N 2.99Å; E230-W234 VanDerWaalsContact O-N 3.08Å; E230-P289 HydrophobicContact CB-CB 4.2Å; E230-P289 HydrophobicContact CG-CB 3.66Å; E230-R292 VanDerWaalsContact C-NH1 3.32Å; E230-R292 WeakPolarHBondContact O-CD 3.46Å; E230-R292 PolarHBondContact O-NH1 3.16Å
231	V	95.7	Very high	93.4	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.018	15%	0.153	C	C	.	.	H	α-helix	trans	-73.8	-32.4	179.5	-44.3	0	0	0	0	111.3	R174 A217 E219 L220 Y226 G228 P229 S235	R174-V231 HydrophobicContact CG-CG2 4.32Å; A217-V231 HydrophobicContact CB-CB 3.97Å; A217-V231 HydrophobicContact CB-CG1 4.15Å; E219-V231 HydrophobicContact CG-CG1 4.36Å; L220-V231 HydrophobicContact CD1-CB 4.49Å; L220-V231 HydrophobicContact CD2-CG1 4.44Å; L220-V231 HydrophobicContact CG-CG1 4.46Å; Y226-V231 HydrophobicContact CD2-CG1 3.64Å; Y226-V231 HydrophobicContact CD2-CG2 4.47Å; Y226-V231 HydrophobicContact CE2-CG1 4.2Å; Y226-V231 HydrophobicContact CE2-CG2 4.3Å; Y226-V231 HydrophobicContact CG-CG1 4.09Å; G228-V231 WeakPolarHBondContact O-CG2 3.29Å; G228-V231 PolarHBondContact O-N 3.21Å; P229-V231 VanDerWaalsContact C-N 3.31Å; P229-V231 PolarHBondContact O-N 2.93Å; V231-S235 PolarHBondContact O-N 3.02Å; V231-S235 VanDerWaalsContact O-N 3.11Å; V231-S235 PolarHBondContact O-OG 3.12Å
232	D	97.3	Very high	93.8	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-67.3	-40.9	170.7	-73.4	-22.2	0	0	0	110.3	V163 H167 H173 R174 L176 P229 W234 S235 L236	V163-D232 HydrophobicContact CG1-CB 4.14Å; H167-D232 IonicContact CD2-OD2 3.67Å; H167-D232 IonicContact CE1-OD2 2.7Å; H167-D232 IonicContact NE2-OD2 3.46Å; H167-D232 PolarHBondContact NE2-OD2 3.41Å; H173-D232 PolarHBondContact N-OD2 2.75Å; R174-D232 WeakPolarHBondContact CA-OD1 3.22Å; R174-D232 PolarHBondContact N-OD1 3.01Å; L176-D232 HydrophobicContact CD1-CB 3.63Å; P229-D232 WeakPolarHBondContact O-CB 3.18Å; P229-D232 PolarHBondContact O-N 2.88Å; D232-W234 PolarHBondContact O-N 3Å; D232-S235 WeakPolarHBondContact O-CB 3.25Å; D232-S235 PolarHBondContact O-N 3.37Å; D232-L236 VanDerWaalsContact O-CG 3.31Å; D232-L236 WeakPolarHBondContact O-CG 3.07Å; D232-L236 PolarHBondContact O-N 2.65Å
233	V	98.2	Very high	94.2	Very high	4 Å²	4	25 Å²	25	2%	0.024	13%	0.131	C	C	.	.	H	α-helix	trans	-59	-43.6	175.1	176.8	0	0	0	0	112.2	P229 E230 L236 G237 L284 R292 I293 L295	P229-V233 WeakPolarHBondContact O-CG2 3.41Å; P229-V233 PolarHBondContact O-N 2.99Å; P229-V233 VanDerWaalsContact O-N 3.12Å; E230-V233 WeakPolarHBondContact O-CB 3.43Å; E230-V233 PolarHBondContact O-N 2.88Å; V233-L236 WeakPolarHBondContact O-CB 3.28Å; V233-L236 PolarHBondContact O-N 3.38Å; V233-G237 PolarHBondContact O-N 3.5Å; V233-L284 HydrophobicContact CG1-CD2 3.6Å; V233-R292 HydrophobicContact CB-CG 4.45Å; V233-R292 HydrophobicContact CG1-CG 3.82Å; V233-I293 HydrophobicContact CG1-CG2 4.37Å; V233-I293 WeakPolarHBondContact CG1-O 3.29Å; V233-L295 HydrophobicContact CG2-CD2 3.87Å; V233-L295 HydrophobicContact CG2-CG 3.95Å
234	W	98.1	Very high	94.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.6	-46.7	175.2	173.4	-82.8	0	0	0	111.1	Y215 A216 A217 P218 E230 D232 L236 G237 V238 F250 V262 L285 L287	Y215-W234 VanDerWaalsContact O-CD1 3.22Å; A216-W234 PolarHBondContact O-NE1 3.47Å; A216-W234 VanDerWaalsContact O-NE1 3.13Å; A217-W234 VanDerWaalsContact CA-CD1 3.47Å; A217-W234 HydrophobicContact CB-CB 3.9Å; A217-W234 HydrophobicContact CB-CD2 4.48Å; A217-W234 HydrophobicContact CB-CG 3.84Å; P218-W234 HydrophobicContact CG-CE3 4.22Å; P218-W234 HydrophobicContact CG-CH2 4.08Å; P218-W234 HydrophobicContact CG-CZ2 4.45Å; P218-W234 HydrophobicContact CG-CZ3 3.95Å; E230-W234 PolarHBondContact O-N 2.99Å; E230-W234 VanDerWaalsContact O-N 3.08Å; D232-W234 PolarHBondContact O-N 3Å; W234-L236 PolarHBondContact O-N 3.49Å; W234-G237 WeakPolarHBondContact O-CA 3.38Å; W234-G237 PolarHBondContact O-N 3.19Å; W234-V238 PolarHBondContact O-N 3.45Å; W234-F250 AromaticContact CH2-CE2 3.9Å; W234-F250 HydrophobicContact CH2-CE2 3.9Å; W234-F250 HydrophobicContact CH2-CZ 4.02Å; W234-F250 HydrophobicContact CZ2-CD2 4.05Å; W234-F250 AromaticContact CZ2-CE2 3.35Å; W234-F250 HydrophobicContact CZ2-CE2 3.35Å; W234-F250 AromaticContact CZ2-CZ 3.96Å; W234-F250 HydrophobicContact CZ2-CZ 3.96Å; W234-V262 HydrophobicContact CZ2-CG1 3.95Å; W234-L285 HydrophobicContact CD2-CD2 4.03Å; W234-L285 HydrophobicContact CE3-CD2 4.18Å; W234-L285 HydrophobicContact CG-CD2 4.49Å; W234-L285 HydrophobicContact CZ2-CD2 4.41Å; W234-L285 VanDerWaalsContact CZ3-C 3.45Å; W234-L285 HydrophobicContact CZ3-CB 4.28Å; W234-L285 HydrophobicContact CZ3-CD2 4.46Å; W234-L285 WeakPolarHBondContact CZ3-O 3.48Å; W234-L287 HydrophobicContact CH2-CD2 4.03Å; W234-L287 HydrophobicContact CZ3-CD2 4.23Å
235	S	97.9	Very high	95.3	Very high	6 Å²	6	14.8 Å²	14.8	4%	0.042	7%	0.074	C	C	.	.	H	α-helix	trans	-58.1	-37.2	176.9	-52.4	0	0	0	0	111.9	Y215 V231 D232 V238 I239	Y215-S235 PolarHBondContact O-OG 2.95Å; V231-S235 PolarHBondContact O-N 3.02Å; V231-S235 VanDerWaalsContact O-N 3.11Å; V231-S235 PolarHBondContact O-OG 3.12Å; D232-S235 WeakPolarHBondContact O-CB 3.25Å; D232-S235 PolarHBondContact O-N 3.37Å; S235-V238 WeakPolarHBondContact O-CB 3.09Å; S235-V238 PolarHBondContact O-N 2.73Å; S235-I239 WeakPolarHBondContact O-CG1 3.46Å; S235-I239 PolarHBondContact O-N 2.84Å
236	L	98.4	Very high	95.7	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-66.8	-35.8	173.8	-71.4	170.6	0	0	0	113	F156 I159 V163 L176 D232 V233 W234 V238 I239 L240 L295	F156-L236 HydrophobicContact CE2-CB 4.13Å; F156-L236 HydrophobicContact CE2-CD2 4.13Å; F156-L236 WeakPolarHBondContact CE2-O 3.05Å; F156-L236 HydrophobicContact CZ-CB 4.07Å; I159-L236 HydrophobicContact CG2-CD2 3.27Å; V163-L236 HydrophobicContact CB-CD1 4.16Å; V163-L236 HydrophobicContact CG1-CD1 4.05Å; V163-L236 HydrophobicContact CG2-CD1 4.35Å; V163-L236 HydrophobicContact CG2-CD2 4.35Å; L176-L236 HydrophobicContact CD1-CD1 4.46Å; L176-L236 HydrophobicContact CD1-CD2 4.2Å; L176-L236 HydrophobicContact CD1-CG 4Å; D232-L236 VanDerWaalsContact O-CG 3.31Å; D232-L236 WeakPolarHBondContact O-CG 3.07Å; D232-L236 PolarHBondContact O-N 2.65Å; V233-L236 WeakPolarHBondContact O-CB 3.28Å; V233-L236 PolarHBondContact O-N 3.38Å; W234-L236 PolarHBondContact O-N 3.49Å; L236-V238 VanDerWaalsContact C-N 3.31Å; L236-I239 HydrophobicContact CD2-CD1 4.32Å; L236-I239 PolarHBondContact O-N 2.82Å; L236-L240 WeakPolarHBondContact O-CB 3.49Å; L236-L240 PolarHBondContact O-N 3.47Å; L236-L295 HydrophobicContact CD1-CD1 4.09Å; L236-L295 HydrophobicContact CD1-CD2 3.73Å
237	G	98.4	Very high	96.1	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-61.7	-38.6	169.3	0	0	0	0	0	112.9	V233 W234 Y241 L281	V233-G237 PolarHBondContact O-N 3.5Å; W234-G237 WeakPolarHBondContact O-CA 3.38Å; W234-G237 PolarHBondContact O-N 3.19Å; G237-Y241 WeakPolarHBondContact O-CB 3.18Å; G237-Y241 PolarHBondContact O-N 2.7Å; G237-Y241 VanDerWaalsContact O-N 3.17Å; G237-L281 VanDerWaalsContact O-CD2 3.28Å; G237-L281 WeakPolarHBondContact O-CD2 3.27Å
238	V	98.2	Very high	96.5	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-66.6	-43.9	174.9	176.7	0	0	0	0	111.2	Y215 W234 S235 L236 T242 L248 P249 F250 L285	Y215-V238 HydrophobicContact CD1-CB 3.94Å; Y215-V238 HydrophobicContact CD1-CG1 3.35Å; Y215-V238 HydrophobicContact CE1-CG1 3.79Å; Y215-V238 HydrophobicContact CG-CG1 4.08Å; W234-V238 PolarHBondContact O-N 3.45Å; S235-V238 WeakPolarHBondContact O-CB 3.09Å; S235-V238 PolarHBondContact O-N 2.73Å; L236-V238 VanDerWaalsContact C-N 3.31Å; V238-T242 WeakPolarHBondContact O-CB 3.42Å; V238-T242 PolarHBondContact O-N 3.34Å; V238-T242 VanDerWaalsContact O-N 3.12Å; V238-T242 PolarHBondContact O-OG1 3.3Å; V238-L248 HydrophobicContact CG1-CD2 3.45Å; V238-L248 VanDerWaalsContact CG1-CD2 3.45Å; V238-P249 HydrophobicContact CB-CG 4.29Å; V238-P249 HydrophobicContact CG1-CG 4.08Å; V238-P249 HydrophobicContact CG2-CG 4.05Å; V238-F250 HydrophobicContact CG2-CE2 4.49Å; V238-L285 HydrophobicContact CG2-CD2 3.93Å
239	I	98	Very high	96.9	Very high	2 Å²	2	8 Å²	8	1%	0.01	5%	0.05	C	C	.	.	H	α-helix	trans	-62	-50.1	175.8	-70.8	161.8	0	0	0	111	I159 L176 L181 Y215 S235 L236 Y241 T242 L243	I159-I239 HydrophobicContact CD1-CG2 4.2Å; L176-I239 HydrophobicContact CB-CD1 4.04Å; L181-I239 HydrophobicContact CD1-CD1 4.31Å; L181-I239 HydrophobicContact CD1-CG2 3.93Å; Y215-I239 HydrophobicContact CD1-CG1 4.15Å; Y215-I239 HydrophobicContact CE1-CG1 3.94Å; S235-I239 WeakPolarHBondContact O-CG1 3.46Å; S235-I239 PolarHBondContact O-N 2.84Å; L236-I239 HydrophobicContact CD2-CD1 4.32Å; L236-I239 PolarHBondContact O-N 2.82Å; I239-Y241 PolarHBondContact O-N 3.2Å; I239-T242 CarbonylContact O-C 3.58Å; I239-T242 WeakPolarHBondContact O-CA 3.49Å; I239-T242 WeakPolarHBondContact O-CB 3.32Å; I239-T242 PolarHBondContact O-N 3.42Å; I239-L243 HydrophobicContact CG2-CD1 3.97Å; I239-L243 HydrophobicContact CG2-CG 4.29Å; I239-L243 WeakPolarHBondContact O-CG 3.34Å; I239-L243 PolarHBondContact O-N 3.39Å
240	L	98.4	Very high	96.9	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-55.5	-49.7	179.4	175.4	58.9	0	0	0	111.8	F156 L236 T242 L243 V244 L280 L281 L284 W303	F156-L240 HydrophobicContact CD1-CD1 4.11Å; F156-L240 HydrophobicContact CD1-CD2 4.39Å; F156-L240 HydrophobicContact CD2-CB 4.17Å; F156-L240 HydrophobicContact CD2-CD1 4.41Å; F156-L240 HydrophobicContact CE1-CB 4.31Å; F156-L240 HydrophobicContact CE1-CD1 4.44Å; F156-L240 HydrophobicContact CE1-CD2 3.99Å; F156-L240 HydrophobicContact CE1-CG 4.47Å; F156-L240 HydrophobicContact CE2-CB 3.78Å; F156-L240 HydrophobicContact CG-CD1 4.1Å; F156-L240 HydrophobicContact CZ-CB 3.85Å; F156-L240 HydrophobicContact CZ-CD2 4.26Å; L236-L240 WeakPolarHBondContact O-CB 3.49Å; L236-L240 PolarHBondContact O-N 3.47Å; L240-T242 PolarHBondContact O-N 2.87Å; L240-L243 PolarHBondContact O-N 3.05Å; L240-V244 HydrophobicContact CD1-CG1 4.21Å; L240-V244 WeakPolarHBondContact O-CG2 3.21Å; L240-V244 PolarHBondContact O-N 3.41Å; L240-L280 HydrophobicContact CD2-CD2 3.75Å; L240-L280 HydrophobicContact CD2-CG 3.94Å; L240-L281 HydrophobicContact CB-CD2 4.09Å; L240-L281 HydrophobicContact CD2-CD2 3.87Å; L240-L281 HydrophobicContact CD2-CG 4.05Å; L240-L281 HydrophobicContact CG-CD2 3.96Å; L240-L281 HydrophobicContact CG-CG 4.39Å; L240-L284 HydrophobicContact CD2-CD1 3.89Å; L240-W303 HydrophobicContact CD1-CE3 4.48Å; L240-W303 HydrophobicContact CD1-CH2 3.53Å; L240-W303 HydrophobicContact CD1-CZ2 4.32Å; L240-W303 HydrophobicContact CD1-CZ3 3.63Å
241	Y	98.3	Very high	96.8	Very high	12 Å²	12	7 Å²	7	5%	0.047	4%	0.043	C	C	.	.	H	α-helix	trans	-58.2	-37	177	179.3	-80.3	0	0	0	111.6	G237 I239 S245 S247 L248 P249 Y267 R268 M273 L281	G237-Y241 WeakPolarHBondContact O-CB 3.18Å; G237-Y241 PolarHBondContact O-N 2.7Å; G237-Y241 VanDerWaalsContact O-N 3.17Å; I239-Y241 PolarHBondContact O-N 3.2Å; Y241-S245 WeakPolarHBondContact CD1-OG 3.44Å; Y241-S245 WeakPolarHBondContact CE1-OG 3.48Å; Y241-S245 WeakPolarHBondContact O-CB 3.33Å; Y241-S245 PolarHBondContact O-N 3.4Å; Y241-S245 PolarHBondContact O-OG 2.98Å; Y241-S247 WeakPolarHBondContact CD1-O 3.39Å; Y241-S247 WeakPolarHBondContact CE1-O 3.44Å; Y241-L248 WeakPolarHBondContact CE1-O 3.39Å; Y241-P249 HydrophobicContact CD1-CB 3.73Å; Y241-P249 VanDerWaalsContact CD1-CD 3.44Å; Y241-P249 HydrophobicContact CD1-CG 4.03Å; Y241-P249 VanDerWaalsContact CD1-N 3.27Å; Y241-P249 HydrophobicContact CD2-CB 4.1Å; Y241-P249 VanDerWaalsContact CE1-CA 3.45Å; Y241-P249 HydrophobicContact CE1-CB 3.96Å; Y241-P249 VanDerWaalsContact CE1-N 3.29Å; Y241-P249 HydrophobicContact CE2-CB 4.3Å; Y241-P249 HydrophobicContact CG-CB 3.81Å; Y241-P249 HydrophobicContact CG-CG 4.17Å; Y241-Y267 HydrophobicContact CD2-CD2 4.01Å; Y241-Y267 AromaticContact CE2-CD2 3.83Å; Y241-Y267 HydrophobicContact CE2-CD2 3.83Å; Y241-Y267 HydrophobicContact CE2-CG 4.43Å; Y241-R268 WeakPolarHBondContact CE2-O 3.47Å; Y241-R268 PolarHBondContact OH-O 2.75Å; Y241-M273 HydrophobicContact CD2-CE 4.04Å; Y241-M273 HydrophobicContact CE2-CE 4.31Å; Y241-L281 HydrophobicContact CD2-CD1 4.14Å
242	T	97	Very high	96.6	Very high	5 Å²	5	7.3 Å²	7.3	3%	0.031	5%	0.046	C	C	.	.	H	α-helix	trans	-73.5	-37.4	-179.6	-54.8	0	0	0	0	112.5	L141 V238 I239 L240 G246 S247 L248	L141-T242 HydrophobicContact CD1-CG2 4.07Å; V238-T242 WeakPolarHBondContact O-CB 3.42Å; V238-T242 PolarHBondContact O-N 3.34Å; V238-T242 VanDerWaalsContact O-N 3.12Å; V238-T242 PolarHBondContact O-OG1 3.3Å; I239-T242 CarbonylContact O-C 3.58Å; I239-T242 WeakPolarHBondContact O-CA 3.49Å; I239-T242 WeakPolarHBondContact O-CB 3.32Å; I239-T242 PolarHBondContact O-N 3.42Å; L240-T242 PolarHBondContact O-N 2.87Å; T242-G246 CarbonylContact O-C 3Å; T242-G246 WeakPolarHBondContact O-CA 3.46Å; T242-G246 PolarHBondContact O-N 3.25Å; T242-S247 WeakPolarHBondContact CA-O 3.47Å; T242-S247 PolarHBondContact OG1-O 2.72Å; T242-L248 HydrophobicContact CG2-CD2 4.36Å; T242-L248 WeakPolarHBondContact OG1-CD2 3.34Å
243	L	97.5	Very high	96.3	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.01	7%	0.07	C	C	.	.	H	α-helix	trans	-60.9	-49.8	173.1	-64.2	166.4	0	0	0	111.2	V137 L141 M147 A152 F156 I159 I239 L240	V137-L243 HydrophobicContact CG1-CD2 3.71Å; L141-L243 HydrophobicContact CD1-CD2 4.26Å; M147-L243 HydrophobicContact CE-CD2 3.94Å; M147-L243 PolarHBondContact N-O 3.31Å; M147-L243 HydrophobicContact SD-CB 4.3Å; M147-L243 HydrophobicContact SD-CD2 3.62Å; M147-L243 HydrophobicContact SD-CG 4.49Å; A152-L243 HydrophobicContact CB-CB 4.01Å; F156-L243 HydrophobicContact CD2-CD1 4.37Å; I159-L243 HydrophobicContact CD1-CD1 4.24Å; I239-L243 HydrophobicContact CG2-CD1 3.97Å; I239-L243 HydrophobicContact CG2-CG 4.29Å; I239-L243 WeakPolarHBondContact O-CG 3.34Å; I239-L243 PolarHBondContact O-N 3.39Å; L240-L243 PolarHBondContact O-N 3.05Å
244	V	97.6	Very high	95.9	Very high	1 Å²	1	18 Å²	18	1%	0.006	10%	0.096	C	C	.	.	H	α-helix	trans	-83.5	-25	-172	-55.5	0	0	0	0	114.8	R146 E149 A152 L240 M273 W303	R146-V244 WeakPolarHBondContact CD-O 3.4Å; R146-V244 PolarHBondContact NH1-O 3.24Å; R146-V244 VanDerWaalsContact NH1-O 3.13Å; E149-V244 HydrophobicContact CG-CG1 4.17Å; A152-V244 HydrophobicContact CB-CG1 3.65Å; L240-V244 HydrophobicContact CD1-CG1 4.21Å; L240-V244 WeakPolarHBondContact O-CG2 3.21Å; L240-V244 PolarHBondContact O-N 3.41Å; V244-M273 HydrophobicContact CG2-CE 3.54Å; V244-W303 HydrophobicContact CG1-CZ2 4.34Å
245	S	96.1	Very high	95.6	Very high	12 Å²	12	23 Å²	23	8%	0.084	12%	0.122	C	C	.	.	H	α-helix	trans	-102.6	-20.7	177.2	80.6	0	0	0	0	114.2	Y241 S247 Y272	Y241-S245 WeakPolarHBondContact CD1-OG 3.44Å; Y241-S245 WeakPolarHBondContact CE1-OG 3.48Å; Y241-S245 WeakPolarHBondContact O-CB 3.33Å; Y241-S245 PolarHBondContact O-N 3.4Å; Y241-S245 PolarHBondContact O-OG 2.98Å; S245-S247 VanDerWaalsContact C-N 3.27Å; S245-S247 PolarHBondContact OG-N 2.92Å; S245-S247 VanDerWaalsContact OG-N 3.12Å; S245-S247 PolarHBondContact OG-O 2.79Å; S245-S247 PolarHBondContact OG-OG 3.14Å; S245-Y272 WeakPolarHBondContact CA-OH 3.45Å; S245-Y272 PolarHBondContact O-OH 2.98Å
246	G	93.9	Very high	95.3	Very high	9 Å²	9	29 Å²	29	9%	0.093	15%	0.147	C	C	.	.	S	Bend	trans	81.6	-8.3	-171.1	0	0	0	0	0	114.6	T242 W655	T242-G246 CarbonylContact O-C 3Å; T242-G246 WeakPolarHBondContact O-CA 3.46Å; T242-G246 PolarHBondContact O-N 3.25Å; G246-W655 WeakPolarHBondContact O-CH2 3.21Å; G246-W655 WeakPolarHBondContact O-CZ3 3.45Å
247	S	93.3	Very high	95.2	Very high	30 Å²	30	31.7 Å²	31.7	21%	0.21	16%	0.162	C	C	.	.	S	Bend	trans	-131.3	161.9	-172.4	64.3	0	0	0	0	111.8	Y241 T242 S245	Y241-S247 WeakPolarHBondContact CD1-O 3.39Å; Y241-S247 WeakPolarHBondContact CE1-O 3.44Å; T242-S247 WeakPolarHBondContact CA-O 3.47Å; T242-S247 PolarHBondContact OG1-O 2.72Å; S245-S247 VanDerWaalsContact C-N 3.27Å; S245-S247 PolarHBondContact OG-N 2.92Å; S245-S247 VanDerWaalsContact OG-N 3.12Å; S245-S247 PolarHBondContact OG-O 2.79Å; S245-S247 PolarHBondContact OG-OG 3.14Å
248	L	94.8	Very high	95	Very high	13 Å²	13	32.1 Å²	32.1	7%	0.068	16%	0.164	C	C	.	.			trans	-74.6	151.5	175.5	-72.7	-178.6	0	0	0	113	P214 Y215 V238 Y241 T242 F250 F652	P214-L248 HydrophobicContact CB-CD1 3.32Å; P214-L248 HydrophobicContact CG-CD1 4.22Å; Y215-L248 HydrophobicContact CE1-CD2 3.91Å; V238-L248 HydrophobicContact CG1-CD2 3.45Å; V238-L248 VanDerWaalsContact CG1-CD2 3.45Å; Y241-L248 WeakPolarHBondContact CE1-O 3.39Å; T242-L248 HydrophobicContact CG2-CD2 4.36Å; T242-L248 WeakPolarHBondContact OG1-CD2 3.34Å; L248-F250 VanDerWaalsContact C-N 3.34Å; L248-F652 HydrophobicContact CD1-CE2 3.36Å; L248-F652 HydrophobicContact CD1-CZ 3.49Å; L248-F652 VanDerWaalsContact CD1-CZ 3.49Å; L248-F652 HydrophobicContact CG-CE2 3.99Å; L248-F652 HydrophobicContact CG-CZ 4.45Å
249	P	96.8	Very high	94.8	Very high	14 Å²	14	35.2 Å²	35.2	9%	0.091	18%	0.179	C	C	.	.	S	Bend	trans	-71.5	-30.1	174	27.9	-30.8	0	0	0	112.2	V238 Y241 Y267 L285	V238-P249 HydrophobicContact CB-CG 4.29Å; V238-P249 HydrophobicContact CG1-CG 4.08Å; V238-P249 HydrophobicContact CG2-CG 4.05Å; Y241-P249 HydrophobicContact CD1-CB 3.73Å; Y241-P249 VanDerWaalsContact CD1-CD 3.44Å; Y241-P249 HydrophobicContact CD1-CG 4.03Å; Y241-P249 VanDerWaalsContact CD1-N 3.27Å; Y241-P249 HydrophobicContact CD2-CB 4.1Å; Y241-P249 VanDerWaalsContact CE1-CA 3.45Å; Y241-P249 HydrophobicContact CE1-CB 3.96Å; Y241-P249 VanDerWaalsContact CE1-N 3.29Å; Y241-P249 HydrophobicContact CE2-CB 4.3Å; Y241-P249 HydrophobicContact CG-CB 3.81Å; Y241-P249 HydrophobicContact CG-CG 4.17Å; P249-Y267 HydrophobicContact CB-CG 4.32Å; P249-L285 HydrophobicContact CB-CD1 4.41Å; P249-L285 HydrophobicContact CG-CD1 4.44Å
250	F	96.2	Very high	94.7	Very high	3 Å²	3	40 Å²	40	1%	0.013	20%	0.201	C	C	.	.	S	Bend	trans	-131	119.3	178.8	-39.6	-66.8	0	0	0	109	W234 V238 L248 L258 R261 V262 Y267 L285	W234-F250 AromaticContact CH2-CE2 3.9Å; W234-F250 HydrophobicContact CH2-CE2 3.9Å; W234-F250 HydrophobicContact CH2-CZ 4.02Å; W234-F250 HydrophobicContact CZ2-CD2 4.05Å; W234-F250 AromaticContact CZ2-CE2 3.35Å; W234-F250 HydrophobicContact CZ2-CE2 3.35Å; W234-F250 AromaticContact CZ2-CZ 3.96Å; W234-F250 HydrophobicContact CZ2-CZ 3.96Å; V238-F250 HydrophobicContact CG2-CE2 4.49Å; L248-F250 VanDerWaalsContact C-N 3.34Å; F250-L258 HydrophobicContact CB-CD1 4.1Å; F250-R261 HydrophobicContact CB-CB 4.49Å; F250-V262 HydrophobicContact CB-CG2 3.83Å; F250-V262 HydrophobicContact CD2-CG2 4.09Å; F250-V262 HydrophobicContact CG-CG2 4.03Å; F250-Y267 HydrophobicContact CE1-CD1 4.47Å; F250-Y267 HydrophobicContact CZ-CD1 4.25Å; F250-L285 HydrophobicContact CE2-CD1 4.47Å; F250-L285 HydrophobicContact CE2-CD2 4.29Å; F250-L285 HydrophobicContact CZ-CD1 4.41Å
251	D	91.9	Very high	94.5	Very high	30 Å²	30	46 Å²	46	16%	0.16	22%	0.223	C	C	.	.			trans	-142.7	148.4	175.1	169.8	48.5	0	0	0	109	R261 F652 L656	D251-R261 WeakPolarHBondContact O-CD 3.43Å; D251-R261 PolarHBondContact O-NE 2.68Å; D251-R261 PolarHBondContact O-NH1 2.88Å; D251-F652 HydrophobicContact CB-CZ 4.31Å; D251-F652 WeakPolarHBondContact OD1-CE1 3.14Å; D251-F652 WeakPolarHBondContact OD1-CZ 3.37Å; D251-L656 HydrophobicContact CB-CD1 4.09Å; D251-L656 HydrophobicContact CB-CD2 4.29Å
252	A	92.8	Very high	94.4	Very high	10 Å²	10	45.4 Å²	45.4	8%	0.083	22%	0.221	C	C	.	.			trans	-160.7	162.9	166.7	0	0	0	0	0	112	H254 D257 L258	A252-H254 VanDerWaalsContact C-N 3.3Å; A252-H254 PolarHBondContact O-N 2.8Å; A252-D257 HydrophobicContact CB-CB 3.46Å; A252-D257 VanDerWaalsContact CB-CB 3.46Å; A252-L258 HydrophobicContact CB-CB 4.02Å
253	Q	89.9	Confident	94.3	Very high	107 Å²	107	48 Å²	48	50%	0.5	24%	0.235	S	C	.	.	S	Bend	trans	-77.6	-14.8	-178.3	-57.4	-175.1	29.1	0	0	113.6
254	H	91.2	Very high	94.2	Very high	122 Å²	122	56.1 Å²	56.1	57%	0.565	27%	0.265	S	S	*	.	S	Bend	trans	-134.1	144.5	-179.4	-56.7	-43.8	0	0	0	110.1	A252 K256 D257 L258	A252-H254 VanDerWaalsContact C-N 3.3Å; A252-H254 PolarHBondContact O-N 2.8Å; H254-K256 VanDerWaalsContact C-N 3.26Å; H254-K256 PolarHBondContact O-N 3.39Å; H254-D257 IonicContact CD2-OD2 2.65Å; H254-D257 PolarHBondContact O-N 2.95Å; H254-D257 VanDerWaalsContact O-N 3.14Å; H254-L258 PolarHBondContact O-N 2.86Å
255	L	90.8	Very high	94.1	Very high	105 Å²	105	56.8 Å²	56.8	55%	0.55	27%	0.272	S	S	.	.	H	α-helix	trans	-59.6	-34.9	-175.3	-175.7	61.2	0	0	0	112.9	P213 F221 L258 Q259	P213-L255 HydrophobicContact CB-CD1 3.7Å; P213-L255 HydrophobicContact CG-CD1 4.09Å; F221-L255 HydrophobicContact CE1-CD1 4Å; L255-L258 HydrophobicContact CD1-CD2 4.48Å; L255-L258 PolarHBondContact O-N 2.95Å; L255-Q259 VanDerWaalsContact O-CB 3.32Å; L255-Q259 WeakPolarHBondContact O-CB 3.47Å; L255-Q259 PolarHBondContact O-N 3.23Å
256	K	92.4	Very high	94	Very high	131 Å²	131	63.3 Å²	63.3	57%	0.57	30%	0.299	S	S	*	.	H	α-helix	trans	-64.8	-47.7	175.5	-172.1	177.4	-175.4	-82.8	0	112	H254 L258 Q259 E260	H254-K256 VanDerWaalsContact C-N 3.26Å; H254-K256 PolarHBondContact O-N 3.39Å; K256-L258 PolarHBondContact O-N 2.99Å; K256-Q259 WeakPolarHBondContact O-CB 3.46Å; K256-Q259 PolarHBondContact O-N 3.43Å; K256-E260 IonicContact NZ-OE1 3.6Å; K256-E260 PolarHBondContact NZ-OE1 2.99Å; K256-E260 WeakPolarHBondContact O-CG 3.42Å; K256-E260 PolarHBondContact O-N 2.69Å
257	D	94.8	Very high	94.2	Very high	58 Å²	58	65.1 Å²	65.1	31%	0.31	30%	0.303	S	S	.	.	H	α-helix	trans	-62.9	-31.1	177.6	-58.9	4.3	0	0	0	111.9	A252 H254 R261	A252-D257 HydrophobicContact CB-CB 3.46Å; A252-D257 VanDerWaalsContact CB-CB 3.46Å; H254-D257 IonicContact CD2-OD2 2.65Å; H254-D257 PolarHBondContact O-N 2.95Å; H254-D257 VanDerWaalsContact O-N 3.14Å; D257-R261 VanDerWaalsContact O-CD 3.28Å; D257-R261 WeakPolarHBondContact O-CD 3.28Å; D257-R261 WeakPolarHBondContact O-CG 3.33Å; D257-R261 PolarHBondContact O-N 3Å; D257-R261 PolarHBondContact O-NE 3.12Å
258	L	94.8	Very high	94.3	Very high	9 Å²	9	72.4 Å²	72.4	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-73	-48.6	174.4	177.1	61.3	0	0	0	110.8	P213 P214 F250 A252 H254 L255 K256 E260 R261 V262	P213-L258 HydrophobicContact CB-CD2 3.99Å; P214-L258 HydrophobicContact CB-CD2 4.39Å; P214-L258 HydrophobicContact CG-CD2 4.05Å; F250-L258 HydrophobicContact CB-CD1 4.1Å; A252-L258 HydrophobicContact CB-CB 4.02Å; H254-L258 PolarHBondContact O-N 2.86Å; L255-L258 HydrophobicContact CD1-CD2 4.48Å; L255-L258 PolarHBondContact O-N 2.95Å; K256-L258 PolarHBondContact O-N 2.99Å; L258-E260 VanDerWaalsContact C-N 3.31Å; L258-E260 PolarHBondContact O-N 3.18Å; L258-R261 WeakPolarHBondContact O-CA 3.49Å; L258-R261 WeakPolarHBondContact O-CB 3.35Å; L258-R261 PolarHBondContact O-N 3.29Å; L258-V262 HydrophobicContact CD1-CG2 4.13Å; L258-V262 HydrophobicContact CG-CG2 4.41Å; L258-V262 WeakPolarHBondContact O-CG2 3.48Å; L258-V262 PolarHBondContact O-N 2.82Å
259	Q	94.3	Very high	94.4	Very high	65 Å²	65	74.3 Å²	74.3	30%	0.304	34%	0.338	S	S	.	.	H	α-helix	trans	-53.9	-46.4	174	176.7	177.1	32	0	0	111.3	F221 L255 K256 R261 V262 L263	F221-Q259 HydrophobicContact CB-CG 4.07Å; F221-Q259 HydrophobicContact CD1-CB 3.72Å; F221-Q259 HydrophobicContact CD1-CG 3.64Å; F221-Q259 HydrophobicContact CE1-CB 3.92Å; F221-Q259 HydrophobicContact CE1-CG 4.36Å; F221-Q259 HydrophobicContact CG-CB 4.43Å; F221-Q259 HydrophobicContact CG-CG 4.08Å; F221-Q259 PolarHBondContact O-NE2 3.05Å; L255-Q259 VanDerWaalsContact O-CB 3.32Å; L255-Q259 WeakPolarHBondContact O-CB 3.47Å; L255-Q259 PolarHBondContact O-N 3.23Å; K256-Q259 WeakPolarHBondContact O-CB 3.46Å; K256-Q259 PolarHBondContact O-N 3.43Å; Q259-R261 VanDerWaalsContact C-N 3.28Å; Q259-R261 PolarHBondContact O-N 2.78Å; Q259-V262 PolarHBondContact O-N 2.87Å; Q259-L263 HydrophobicContact CG-CD1 3.66Å; Q259-L263 HydrophobicContact CG-CG 4.24Å; Q259-L263 VanDerWaalsContact O-CB 3.29Å; Q259-L263 WeakPolarHBondContact O-CB 3Å; Q259-L263 VanDerWaalsContact O-CG 3.22Å; Q259-L263 WeakPolarHBondContact O-CG 3.42Å; Q259-L263 PolarHBondContact O-N 2.66Å
260	E	95.2	Very high	94.3	Very high	102 Å²	102	74.1 Å²	74.1	48%	0.477	34%	0.337	S	S	.	.	H	α-helix	trans	-62	-31.3	176	-73.9	178.1	-159.8	0	0	113.1	K256 L258 R264	K256-E260 IonicContact NZ-OE1 3.6Å; K256-E260 PolarHBondContact NZ-OE1 2.99Å; K256-E260 WeakPolarHBondContact O-CG 3.42Å; K256-E260 PolarHBondContact O-N 2.69Å; L258-E260 VanDerWaalsContact C-N 3.31Å; L258-E260 PolarHBondContact O-N 3.18Å; E260-R264 WeakPolarHBondContact O-CB 3.45Å; E260-R264 PolarHBondContact O-N 3.05Å
261	R	96.1	Very high	94.3	Very high	125 Å²	125	83.1 Å²	83.1	47%	0.472	38%	0.377	S	S	.	.	H	α-helix	trans	-77.2	-44	175.7	-69.8	164.3	-159.7	-142.7	-4	112.1	F250 D251 D257 L258 Q259 R264 G265	F250-R261 HydrophobicContact CB-CB 4.49Å; D251-R261 WeakPolarHBondContact O-CD 3.43Å; D251-R261 PolarHBondContact O-NE 2.68Å; D251-R261 PolarHBondContact O-NH1 2.88Å; D257-R261 VanDerWaalsContact O-CD 3.28Å; D257-R261 WeakPolarHBondContact O-CD 3.28Å; D257-R261 WeakPolarHBondContact O-CG 3.33Å; D257-R261 PolarHBondContact O-N 3Å; D257-R261 PolarHBondContact O-NE 3.12Å; L258-R261 WeakPolarHBondContact O-CA 3.49Å; L258-R261 WeakPolarHBondContact O-CB 3.35Å; L258-R261 PolarHBondContact O-N 3.29Å; Q259-R261 VanDerWaalsContact C-N 3.28Å; Q259-R261 PolarHBondContact O-N 2.78Å; R261-R264 PolarHBondContact O-N 2.87Å; R261-G265 PolarHBondContact O-N 2.83Å; R261-G265 VanDerWaalsContact O-N 3.11Å
262	V	95.7	Very high	94.6	Very high	0 Å²	0	85.3 Å²	85.3	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-62.4	-50.8	177.5	168.5	0	0	0	0	110.6	P218 F221 W234 F250 L258 Q259 R264 G265 L287	P218-V262 HydrophobicContact CB-CG1 4.06Å; F221-V262 HydrophobicContact CD2-CB 4.32Å; F221-V262 HydrophobicContact CD2-CG1 3.73Å; F221-V262 HydrophobicContact CE2-CB 4.18Å; F221-V262 HydrophobicContact CE2-CG1 3.85Å; F221-V262 HydrophobicContact CE2-CG2 4.14Å; W234-V262 HydrophobicContact CZ2-CG1 3.95Å; F250-V262 HydrophobicContact CB-CG2 3.83Å; F250-V262 HydrophobicContact CD2-CG2 4.09Å; F250-V262 HydrophobicContact CG-CG2 4.03Å; L258-V262 HydrophobicContact CD1-CG2 4.13Å; L258-V262 HydrophobicContact CG-CG2 4.41Å; L258-V262 WeakPolarHBondContact O-CG2 3.48Å; L258-V262 PolarHBondContact O-N 2.82Å; Q259-V262 PolarHBondContact O-N 2.87Å; V262-R264 PolarHBondContact O-N 3.13Å; V262-G265 PolarHBondContact O-N 3.4Å; V262-L287 WeakPolarHBondContact O-CD2 3.24Å
263	L	95.1	Very high	94.8	Very high	60 Å²	60	85.7 Å²	85.7	31%	0.314	38%	0.383	S	S	.	.	H	α-helix	trans	-62.6	-24.9	177.2	-68.1	174.2	0	0	0	113.3	P218 F221 Q222 Q259	P218-L263 HydrophobicContact CB-CD2 4.01Å; F221-L263 HydrophobicContact CB-CD2 4.28Å; Q222-L263 HydrophobicContact CG-CD2 3.8Å; Q259-L263 HydrophobicContact CG-CD1 3.66Å; Q259-L263 HydrophobicContact CG-CG 4.24Å; Q259-L263 VanDerWaalsContact O-CB 3.29Å; Q259-L263 WeakPolarHBondContact O-CB 3Å; Q259-L263 VanDerWaalsContact O-CG 3.22Å; Q259-L263 WeakPolarHBondContact O-CG 3.42Å; Q259-L263 PolarHBondContact O-N 2.66Å
264	R	95.6	Very high	95.2	Very high	172 Å²	172	82.3 Å²	82.3	65%	0.649	37%	0.372	S	S	*	.	H	α-helix	trans	-81.1	-22.1	174.5	-169.5	-179.6	-169.4	-143.9	6.4	113	E260 R261 V262 K266	E260-R264 WeakPolarHBondContact O-CB 3.45Å; E260-R264 PolarHBondContact O-N 3.05Å; R261-R264 PolarHBondContact O-N 2.87Å; V262-R264 PolarHBondContact O-N 3.13Å; R264-K266 HydrophobicContact CG-CB 4.46Å; R264-K266 HydrophobicContact CG-CD 4.37Å; R264-K266 HydrophobicContact CG-CG 4.25Å; R264-K266 PolarHBondContact O-N 2.7Å
265	G	94.4	Very high	95.5	Very high	15 Å²	15	81.8 Å²	81.8	16%	0.155	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	17.8	175.4	0	0	0	0	0	115.9	R261 V262	R261-G265 PolarHBondContact O-N 2.83Å; R261-G265 VanDerWaalsContact O-N 3.11Å; V262-G265 PolarHBondContact O-N 3.4Å
266	K	95.2	Very high	95.9	Very high	149 Å²	149	78.6 Å²	78.6	65%	0.648	36%	0.361	S	S	*	.			trans	-106.2	106	-174.9	-67.6	-170.6	-174.8	-164.1	0	112.4	R264	R264-K266 HydrophobicContact CG-CB 4.46Å; R264-K266 HydrophobicContact CG-CD 4.37Å; R264-K266 HydrophobicContact CG-CG 4.25Å; R264-K266 PolarHBondContact O-N 2.7Å
267	Y	96.6	Very high	96.2	Very high	48 Å²	48	72.4 Å²	72.4	19%	0.188	33%	0.334	C	S	.	.			trans	-100	172.9	172.3	57.7	-87.9	0	0	0	111.8	Y241 P249 F250 V269 L281 R282 L285	Y241-Y267 HydrophobicContact CD2-CD2 4.01Å; Y241-Y267 AromaticContact CE2-CD2 3.83Å; Y241-Y267 HydrophobicContact CE2-CD2 3.83Å; Y241-Y267 HydrophobicContact CE2-CG 4.43Å; P249-Y267 HydrophobicContact CB-CG 4.32Å; F250-Y267 HydrophobicContact CE1-CD1 4.47Å; F250-Y267 HydrophobicContact CZ-CD1 4.25Å; Y267-V269 HydrophobicContact CE2-CG2 4.17Å; Y267-L281 HydrophobicContact CE2-CB 4.44Å; Y267-R282 WeakPolarHBondContact OH-CG 3.27Å; Y267-R282 PolarHBondContact OH-N 2.8Å; Y267-L285 HydrophobicContact CD1-CD1 3.8Å; Y267-L285 HydrophobicContact CE1-CB 4.13Å; Y267-L285 HydrophobicContact CE1-CD1 3.77Å; Y267-L285 HydrophobicContact CG-CD1 4.41Å
268	R	95.7	Very high	96.3	Very high	183 Å²	183	71.7 Å²	71.7	69%	0.691	33%	0.329	S	S	*	.			trans	-104.2	118	179.1	174.3	-172.4	168.8	93.6	3.6	110.3	Y241 P270	Y241-R268 WeakPolarHBondContact CE2-O 3.47Å; Y241-R268 PolarHBondContact OH-O 2.75Å; R268-P270 VanDerWaalsContact O-CD 3.31Å; R268-P270 WeakPolarHBondContact O-CD 3.12Å
269	V	96.2	Very high	96.5	Very high	53 Å²	53	73 Å²	73	32%	0.321	34%	0.341	S	S	.	.			trans	-72	123.3	167.9	-177.5	0	0	0	0	109.4	Y267 M273 E278	Y267-V269 HydrophobicContact CE2-CG2 4.17Å; V269-M273 HydrophobicContact CG1-CB 4.37Å; V269-M273 HydrophobicContact CG1-SD 3.96Å; V269-E278 HydrophobicContact CG1-CG 4.38Å; V269-E278 HydrophobicContact CG2-CG 3.78Å
270	P	96.2	Very high	96.7	Very high	10 Å²	10	69.9 Å²	69.9	7%	0.065	33%	0.326	C	S	.	.			trans	-78.1	149.1	171.3	-11.9	29.2	0	0	0	111.6	R268 Y272 M273	R268-P270 VanDerWaalsContact O-CD 3.31Å; R268-P270 WeakPolarHBondContact O-CD 3.12Å; P270-Y272 HydrophobicContact CB-CD1 3.97Å; P270-Y272 HydrophobicContact CB-CD2 3.91Å; P270-Y272 HydrophobicContact CB-CE1 3.58Å; P270-Y272 HydrophobicContact CB-CE2 3.49Å; P270-Y272 VanDerWaalsContact CB-CE2 3.49Å; P270-Y272 HydrophobicContact CB-CG 4.14Å; P270-Y272 HydrophobicContact CG-CE1 4.48Å; P270-Y272 HydrophobicContact CG-CE2 3.8Å; P270-Y272 PolarHBondContact O-N 2.79Å; P270-M273 HydrophobicContact CG-CE 4.38Å; P270-M273 WeakPolarHBondContact O-CB 3.4Å; P270-M273 PolarHBondContact O-N 3.44Å; P270-M273 VanDerWaalsContact O-N 3.09Å
271	F	96.3	Very high	96.9	Very high	192 Å²	192	65 Å²	65	84%	0.842	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-12.5	-179.6	71.2	-93.2	0	0	0	115.2
272	Y	96.5	Very high	97	Very high	75 Å²	75	66.9 Å²	66.9	29%	0.294	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	2.3	-178.5	56.7	-114.3	0	0	0	113.4	R146 S245 P270	R146-Y272 VanDerWaalsContact CZ-CE2 3.48Å; S245-Y272 WeakPolarHBondContact CA-OH 3.45Å; S245-Y272 PolarHBondContact O-OH 2.98Å; P270-Y272 HydrophobicContact CB-CD1 3.97Å; P270-Y272 HydrophobicContact CB-CD2 3.91Å; P270-Y272 HydrophobicContact CB-CE1 3.58Å; P270-Y272 HydrophobicContact CB-CE2 3.49Å; P270-Y272 VanDerWaalsContact CB-CE2 3.49Å; P270-Y272 HydrophobicContact CB-CG 4.14Å; P270-Y272 HydrophobicContact CG-CE1 4.48Å; P270-Y272 HydrophobicContact CG-CE2 3.8Å; P270-Y272 PolarHBondContact O-N 2.79Å
273	M	98	Very high	97.1	Very high	18 Å²	18	71 Å²	71	9%	0.089	33%	0.329	C	S	.	.	S	Bend	trans	-87.9	134	176.1	177.7	-178.1	-81.1	0	0	108.6	E149 Y241 V244 V269 P270 C277 E278 L281	E149-M273 WeakPolarHBondContact OE1-CA 3.12Å; Y241-M273 HydrophobicContact CD2-CE 4.04Å; Y241-M273 HydrophobicContact CE2-CE 4.31Å; V244-M273 HydrophobicContact CG2-CE 3.54Å; V269-M273 HydrophobicContact CG1-CB 4.37Å; V269-M273 HydrophobicContact CG1-SD 3.96Å; P270-M273 HydrophobicContact CG-CE 4.38Å; P270-M273 WeakPolarHBondContact O-CB 3.4Å; P270-M273 PolarHBondContact O-N 3.44Å; P270-M273 VanDerWaalsContact O-N 3.09Å; M273-C277 HydrophobicContact CG-CB 3.83Å; M273-E278 HydrophobicContact SD-CB 4.41Å; M273-L281 HydrophobicContact CE-CD1 3.51Å; M273-L281 HydrophobicContact SD-CD1 3.73Å
274	S	98.2	Very high	97.2	Very high	37 Å²	37	68.1 Å²	68.1	26%	0.259	31%	0.314	S	S	.	.			trans	-69.4	152.5	177.6	67.3	0	0	0	0	111.8	E149 D276 C277 E278	E149-S274 PolarHBondContact OE1-N 2.98Å; E149-S274 PolarHBondContact OE1-OG 2.83Å; E149-S274 WeakPolarHBondContact OE2-CB 3.19Å; E149-S274 PolarHBondContact OE2-OG 3.25Å; S274-D276 PolarHBondContact O-N 3.19Å; S274-C277 WeakPolarHBondContact O-CB 3.43Å; S274-C277 PolarHBondContact O-N 2.91Å; S274-C277 VanDerWaalsContact O-N 3.12Å; S274-C277 VanDerWaalsContact OG-CB 3.27Å; S274-C277 WeakPolarHBondContact OG-CB 3.46Å; S274-C277 PolarHBondContact OG-N 3.14Å; S274-C277 VanDerWaalsContact OG-N 3.07Å; S274-E278 PolarHBondContact O-N 3.12Å
275	T	98.1	Very high	97.4	Very high	111 Å²	111	60.5 Å²	60.5	68%	0.681	29%	0.285	S	S	*	.	H	α-helix	trans	-58.7	-34.7	172.8	44.5	0	0	0	0	112	E278 A279	T275-E278 PolarHBondContact O-N 3.38Å; T275-A279 VanDerWaalsContact O-CB 3.3Å; T275-A279 WeakPolarHBondContact O-CB 3.34Å; T275-A279 PolarHBondContact O-N 3.05Å
276	D	98.3	Very high	97.5	Very high	38 Å²	38	61.3 Å²	61.3	20%	0.203	29%	0.287	C	S	.	.	H	α-helix	trans	-66.8	-41.4	174.5	-66.5	-39.3	0	0	0	111.6	S274 A279 L280 K302 W303 I306	S274-D276 PolarHBondContact O-N 3.19Å; D276-A279 PolarHBondContact O-N 3.02Å; D276-L280 PolarHBondContact O-N 3.26Å; D276-K302 WeakPolarHBondContact OD1-CD 3.46Å; D276-K302 WeakPolarHBondContact OD1-CE 3.22Å; D276-K302 IonicContact OD1-NZ 2.68Å; D276-K302 PolarHBondContact OD1-NZ 3.13Å; D276-K302 WeakPolarHBondContact OD2-CE 3.44Å; D276-K302 IonicContact OD2-NZ 3.73Å; D276-K302 PolarHBondContact OD2-NZ 2.94Å; D276-W303 HydrophobicContact CB-CB 4Å; D276-W303 HydrophobicContact CB-CG 4.35Å; D276-I306 HydrophobicContact CB-CD1 4.33Å
277	C	98.5	Very high	97.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.5	-43	174.7	-169.6	0	0	0	0	111.5	M273 S274 A279 L280 L281 W303	M273-C277 HydrophobicContact CG-CB 3.83Å; S274-C277 WeakPolarHBondContact O-CB 3.43Å; S274-C277 PolarHBondContact O-N 2.91Å; S274-C277 VanDerWaalsContact O-N 3.12Å; S274-C277 VanDerWaalsContact OG-CB 3.27Å; S274-C277 WeakPolarHBondContact OG-CB 3.46Å; S274-C277 PolarHBondContact OG-N 3.14Å; S274-C277 VanDerWaalsContact OG-N 3.07Å; C277-A279 VanDerWaalsContact C-N 3.33Å; C277-A279 PolarHBondContact O-N 3.23Å; C277-L280 PolarHBondContact O-N 2.92Å; C277-L281 WeakPolarHBondContact O-CG 3.22Å; C277-L281 PolarHBondContact O-N 3.41Å; C277-W303 HydrophobicContact CB-CG 4.3Å; C277-W303 VanDerWaalsContact N-CD1 3.28Å
278	E	98.2	Very high	97.5	Very high	43 Å²	43	59.1 Å²	59.1	20%	0.201	29%	0.286	C	S	.	.	H	α-helix	trans	-61.5	-41.9	174	-169.6	-170.9	157	0	0	111.5	V269 M273 S274 T275 L280 L281 R282	V269-E278 HydrophobicContact CG1-CG 4.38Å; V269-E278 HydrophobicContact CG2-CG 3.78Å; M273-E278 HydrophobicContact SD-CB 4.41Å; S274-E278 PolarHBondContact O-N 3.12Å; T275-E278 PolarHBondContact O-N 3.38Å; E278-L280 PolarHBondContact O-N 3.21Å; E278-L281 PolarHBondContact O-N 2.95Å; E278-R282 HydrophobicContact CG-CG 4.49Å; E278-R282 WeakPolarHBondContact O-CB 3.47Å; E278-R282 VanDerWaalsContact O-CG 3.29Å; E278-R282 WeakPolarHBondContact O-CG 3.24Å; E278-R282 PolarHBondContact O-N 2.9Å; E278-R282 IonicContact OE1-CZ 2.77Å; E278-R282 IonicContact OE1-NE 2.64Å; E278-R282 PolarHBondContact OE1-NE 2.71Å; E278-R282 IonicContact OE1-NH2 2.76Å; E278-R282 PolarHBondContact OE1-NH2 2.67Å
279	A	98.3	Very high	97.5	Very high	37 Å²	37	52.4 Å²	52.4	31%	0.306	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-40	178.6	0	0	0	0	0	112.3	T275 D276 C277 K283	T275-A279 VanDerWaalsContact O-CB 3.3Å; T275-A279 WeakPolarHBondContact O-CB 3.34Å; T275-A279 PolarHBondContact O-N 3.05Å; D276-A279 PolarHBondContact O-N 3.02Å; C277-A279 VanDerWaalsContact C-N 3.33Å; C277-A279 PolarHBondContact O-N 3.23Å; A279-K283 WeakPolarHBondContact O-CG 3.48Å; A279-K283 PolarHBondContact O-N 2.93Å
280	L	98.5	Very high	97.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-67.2	-45.3	172.9	176.9	54.9	0	0	0	111.7	F156 L240 D276 C277 E278 R282 K283 L284 V298 D301 W303	F156-L280 HydrophobicContact CE1-CD2 4.37Å; L240-L280 HydrophobicContact CD2-CD2 3.75Å; L240-L280 HydrophobicContact CD2-CG 3.94Å; D276-L280 PolarHBondContact O-N 3.26Å; C277-L280 PolarHBondContact O-N 2.92Å; E278-L280 PolarHBondContact O-N 3.21Å; L280-R282 VanDerWaalsContact C-N 3.27Å; L280-R282 PolarHBondContact O-N 2.85Å; L280-K283 WeakPolarHBondContact O-CB 3.37Å; L280-K283 PolarHBondContact O-N 2.81Å; L280-L284 HydrophobicContact CD1-CD1 3.98Å; L280-L284 HydrophobicContact CD1-CG 4.07Å; L280-L284 HydrophobicContact CG-CD1 3.91Å; L280-L284 HydrophobicContact CG-CG 4.45Å; L280-L284 WeakPolarHBondContact O-CG 3.24Å; L280-L284 PolarHBondContact O-N 3.35Å; L280-L284 VanDerWaalsContact O-N 3.08Å; L280-V298 HydrophobicContact CD1-CG1 4.16Å; L280-D301 HydrophobicContact CD1-CB 4.12Å; L280-W303 HydrophobicContact CB-CB 4.35Å; L280-W303 HydrophobicContact CD2-CB 4.28Å; L280-W303 HydrophobicContact CD2-CD2 4.34Å; L280-W303 HydrophobicContact CD2-CE3 3.64Å; L280-W303 HydrophobicContact CD2-CZ3 4.39Å
281	L	98.6	Very high	97.4	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58.9	-37.1	176.7	-75.7	168.4	0	0	0	112.7	G237 L240 Y241 Y267 M273 C277 E278 K283 L284 L285	G237-L281 VanDerWaalsContact O-CD2 3.28Å; G237-L281 WeakPolarHBondContact O-CD2 3.27Å; L240-L281 HydrophobicContact CB-CD2 4.09Å; L240-L281 HydrophobicContact CD2-CD2 3.87Å; L240-L281 HydrophobicContact CD2-CG 4.05Å; L240-L281 HydrophobicContact CG-CD2 3.96Å; L240-L281 HydrophobicContact CG-CG 4.39Å; Y241-L281 HydrophobicContact CD2-CD1 4.14Å; Y267-L281 HydrophobicContact CE2-CB 4.44Å; M273-L281 HydrophobicContact CE-CD1 3.51Å; M273-L281 HydrophobicContact SD-CD1 3.73Å; C277-L281 WeakPolarHBondContact O-CG 3.22Å; C277-L281 PolarHBondContact O-N 3.41Å; E278-L281 PolarHBondContact O-N 2.95Å; L281-K283 PolarHBondContact O-N 2.93Å; L281-L284 PolarHBondContact O-N 3.05Å; L281-L285 HydrophobicContact CD2-CD1 4.31Å; L281-L285 WeakPolarHBondContact O-CB 3.42Å; L281-L285 PolarHBondContact O-N 3.04Å
282	R	97.9	Very high	97.5	Very high	163 Å²	163	53.3 Å²	53.3	62%	0.615	28%	0.281	S	S	*	.	H	α-helix	trans	-65.2	-22.5	174.5	-76.3	171	174.6	-101.1	5.6	113.9	Y267 E278 L280 V286	Y267-R282 WeakPolarHBondContact OH-CG 3.27Å; Y267-R282 PolarHBondContact OH-N 2.8Å; E278-R282 HydrophobicContact CG-CG 4.49Å; E278-R282 WeakPolarHBondContact O-CB 3.47Å; E278-R282 VanDerWaalsContact O-CG 3.29Å; E278-R282 WeakPolarHBondContact O-CG 3.24Å; E278-R282 PolarHBondContact O-N 2.9Å; E278-R282 IonicContact OE1-CZ 2.77Å; E278-R282 IonicContact OE1-NE 2.64Å; E278-R282 PolarHBondContact OE1-NE 2.71Å; E278-R282 IonicContact OE1-NH2 2.76Å; E278-R282 PolarHBondContact OE1-NH2 2.67Å; L280-R282 VanDerWaalsContact C-N 3.27Å; L280-R282 PolarHBondContact O-N 2.85Å; R282-V286 VanDerWaalsContact O-CG2 3.26Å; R282-V286 WeakPolarHBondContact O-CG2 3.36Å
283	K	98.1	Very high	97.5	Very high	87 Å²	87	51 Å²	51	38%	0.378	27%	0.274	S	S	.	.	H	α-helix	trans	-87.4	-32.8	175.5	-62.5	166.2	-166.7	-177.9	0	112.1	A279 L280 L281 V286 I293 D301	A279-K283 WeakPolarHBondContact O-CG 3.48Å; A279-K283 PolarHBondContact O-N 2.93Å; L280-K283 WeakPolarHBondContact O-CB 3.37Å; L280-K283 PolarHBondContact O-N 2.81Å; L281-K283 PolarHBondContact O-N 2.93Å; K283-V286 VanDerWaalsContact O-CG2 3.31Å; K283-V286 WeakPolarHBondContact O-CG2 3.11Å; K283-I293 HydrophobicContact CB-CB 4.01Å; K283-I293 HydrophobicContact CB-CD1 4.13Å; K283-I293 HydrophobicContact CB-CG2 3.79Å; K283-I293 HydrophobicContact CD-CD1 3.95Å; K283-I293 HydrophobicContact CG-CD1 4.5Å; K283-I293 WeakPolarHBondContact O-CG2 3.46Å; K283-I293 PolarHBondContact O-N 2.84Å; K283-D301 IonicContact NZ-OD2 2.77Å; K283-D301 PolarHBondContact NZ-OD2 3.41Å
284	L	98.4	Very high	97.4	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-80.3	-47.9	179.5	-65.2	169.8	0	0	0	112.9	F156 V233 L240 L280 L281 V286 R292 I293 V298	F156-L284 HydrophobicContact CE1-CD1 4.36Å; F156-L284 HydrophobicContact CZ-CD1 4.12Å; V233-L284 HydrophobicContact CG1-CD2 3.6Å; L240-L284 HydrophobicContact CD2-CD1 3.89Å; L280-L284 HydrophobicContact CD1-CD1 3.98Å; L280-L284 HydrophobicContact CD1-CG 4.07Å; L280-L284 HydrophobicContact CG-CD1 3.91Å; L280-L284 HydrophobicContact CG-CG 4.45Å; L280-L284 WeakPolarHBondContact O-CG 3.24Å; L280-L284 PolarHBondContact O-N 3.35Å; L280-L284 VanDerWaalsContact O-N 3.08Å; L281-L284 PolarHBondContact O-N 3.05Å; L284-V286 PolarHBondContact O-N 3.31Å; L284-R292 VanDerWaalsContact O-CD 3.28Å; L284-R292 WeakPolarHBondContact O-CD 3.33Å; L284-R292 WeakPolarHBondContact O-CG 3.34Å; L284-I293 HydrophobicContact CD2-CG2 3.78Å; L284-I293 HydrophobicContact CG-CG2 4.33Å; L284-V298 HydrophobicContact CD2-CG2 3.79Å
285	L	98.3	Very high	97.4	Very high	11 Å²	11	52.6 Å²	52.6	6%	0.058	28%	0.282	C	S	.	.	S	Bend	trans	-87.2	44.9	-174.3	-63.9	178.3	0	0	0	112.8	W234 V238 P249 F250 Y267 L281	W234-L285 HydrophobicContact CD2-CD2 4.03Å; W234-L285 HydrophobicContact CE3-CD2 4.18Å; W234-L285 HydrophobicContact CG-CD2 4.49Å; W234-L285 HydrophobicContact CZ2-CD2 4.41Å; W234-L285 VanDerWaalsContact CZ3-C 3.45Å; W234-L285 HydrophobicContact CZ3-CB 4.28Å; W234-L285 HydrophobicContact CZ3-CD2 4.46Å; W234-L285 WeakPolarHBondContact CZ3-O 3.48Å; V238-L285 HydrophobicContact CG2-CD2 3.93Å; P249-L285 HydrophobicContact CB-CD1 4.41Å; P249-L285 HydrophobicContact CG-CD1 4.44Å; F250-L285 HydrophobicContact CE2-CD1 4.47Å; F250-L285 HydrophobicContact CE2-CD2 4.29Å; F250-L285 HydrophobicContact CZ-CD1 4.41Å; Y267-L285 HydrophobicContact CD1-CD1 3.8Å; Y267-L285 HydrophobicContact CE1-CB 4.13Å; Y267-L285 HydrophobicContact CE1-CD1 3.77Å; Y267-L285 HydrophobicContact CG-CD1 4.41Å; L281-L285 HydrophobicContact CD2-CD1 4.31Å; L281-L285 WeakPolarHBondContact O-CB 3.42Å; L281-L285 PolarHBondContact O-N 3.04Å
286	V	97.8	Very high	97.3	Very high	32 Å²	32	54.8 Å²	54.8	19%	0.194	28%	0.278	C	S	.	.			trans	-86.8	126.6	-179.9	-178.1	0	0	0	0	110.7	R282 K283 L284 N288 K291 R292	R282-V286 VanDerWaalsContact O-CG2 3.26Å; R282-V286 WeakPolarHBondContact O-CG2 3.36Å; K283-V286 VanDerWaalsContact O-CG2 3.31Å; K283-V286 WeakPolarHBondContact O-CG2 3.11Å; L284-V286 PolarHBondContact O-N 3.31Å; V286-N288 VanDerWaalsContact C-N 3.33Å; V286-N288 WeakPolarHBondContact CG1-O 3.16Å; V286-N288 PolarHBondContact O-N 2.87Å; V286-K291 HydrophobicContact CG1-CB 3.9Å; V286-R292 HydrophobicContact CB-CB 4.25Å; V286-R292 HydrophobicContact CB-CG 4.27Å; V286-R292 PolarHBondContact O-NE 2.89Å; V286-R292 PolarHBondContact O-NH2 3.04Å
287	L	96.7	Very high	97.2	Very high	73 Å²	73	57.3 Å²	57.3	38%	0.382	29%	0.292	S	S	.	.	S	Bend	trans	-65.2	-29.9	-177.8	-71.6	177.7	0	0	0	114.4	P218 W234 V262	P218-L287 HydrophobicContact CB-CD2 4.06Å; P218-L287 HydrophobicContact CG-CD2 3.9Å; W234-L287 HydrophobicContact CH2-CD2 4.03Å; W234-L287 HydrophobicContact CZ3-CD2 4.23Å; V262-L287 WeakPolarHBondContact O-CD2 3.24Å
288	N	94.7	Very high	97.2	Very high	79 Å²	79	57.3 Å²	57.3	42%	0.422	29%	0.292	S	S	.	.	S	Bend	trans	-92.3	114.4	173.3	-179.4	-12	0	0	0	108.8	V286 A290 K291 R292	V286-N288 VanDerWaalsContact C-N 3.33Å; V286-N288 WeakPolarHBondContact CG1-O 3.16Å; V286-N288 PolarHBondContact O-N 2.87Å; N288-A290 VanDerWaalsContact C-N 3.27Å; N288-A290 PolarHBondContact O-N 3.34Å; N288-A290 PolarHBondContact OD1-N 3.44Å; N288-K291 HydrophobicContact CB-CB 4.31Å; N288-K291 HydrophobicContact CB-CG 4.44Å; N288-K291 PolarHBondContact O-N 3.44Å; N288-R292 PolarHBondContact O-N 2.95Å
289	P	95.5	Very high	97.2	Very high	41 Å²	41	55.4 Å²	55.4	27%	0.266	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-54.6	-40.2	179.6	17.1	-29.4	0	0	0	113.4	E230 K291 R292	E230-P289 HydrophobicContact CB-CB 4.2Å; E230-P289 HydrophobicContact CG-CB 3.66Å; P289-K291 PolarHBondContact O-N 2.8Å; P289-K291 VanDerWaalsContact O-N 3.12Å; P289-R292 WeakPolarHBondContact O-CB 3.39Å; P289-R292 PolarHBondContact O-N 3.15Å
290	A	94	Very high	97.1	Very high	95 Å²	95	57.6 Å²	57.6	79%	0.785	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-70.6	-6.4	179.7	0	0	0	0	0	114.3	N288	N288-A290 VanDerWaalsContact C-N 3.27Å; N288-A290 PolarHBondContact O-N 3.34Å; N288-A290 PolarHBondContact OD1-N 3.44Å
291	K	96.3	Very high	97.1	Very high	161 Å²	161	58 Å²	58	70%	0.7	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-111.5	5.8	171.3	-64.4	-167.7	175.7	-168.6	0	112.7	V286 N288 P289	V286-K291 HydrophobicContact CG1-CB 3.9Å; N288-K291 HydrophobicContact CB-CB 4.31Å; N288-K291 HydrophobicContact CB-CG 4.44Å; N288-K291 PolarHBondContact O-N 3.44Å; P289-K291 PolarHBondContact O-N 2.8Å; P289-K291 VanDerWaalsContact O-N 3.12Å
292	R	97.6	Very high	97	Very high	18 Å²	18	64.2 Å²	64.2	7%	0.068	33%	0.325	C	S	.	.	S	Bend	trans	-81.9	141.1	177.4	-156.4	175.6	-64.7	144.5	4.3	109.2	E219 E230 V233 L284 V286 N288 P289	E219-R292 IonicContact OE1-CZ 2.66Å; E219-R292 IonicContact OE1-NH1 3.93Å; E219-R292 PolarHBondContact OE1-NH1 3.42Å; E219-R292 IonicContact OE1-NH2 3.73Å; E219-R292 PolarHBondContact OE1-NH2 2.73Å; E219-R292 IonicContact OE2-CZ 2.71Å; E219-R292 IonicContact OE2-NH1 2.67Å; E219-R292 IonicContact OE2-NH2 3.61Å; E219-R292 PolarHBondContact OE2-NH2 2.87Å; E230-R292 VanDerWaalsContact C-NH1 3.32Å; E230-R292 WeakPolarHBondContact O-CD 3.46Å; E230-R292 PolarHBondContact O-NH1 3.16Å; V233-R292 HydrophobicContact CB-CG 4.45Å; V233-R292 HydrophobicContact CG1-CG 3.82Å; L284-R292 VanDerWaalsContact O-CD 3.28Å; L284-R292 WeakPolarHBondContact O-CD 3.33Å; L284-R292 WeakPolarHBondContact O-CG 3.34Å; V286-R292 HydrophobicContact CB-CB 4.25Å; V286-R292 HydrophobicContact CB-CG 4.27Å; V286-R292 PolarHBondContact O-NE 2.89Å; V286-R292 PolarHBondContact O-NH2 3.04Å; N288-R292 PolarHBondContact O-N 2.95Å; P289-R292 WeakPolarHBondContact O-CB 3.39Å; P289-R292 PolarHBondContact O-N 3.15Å
293	I	97.6	Very high	97.1	Very high	28 Å²	28	56.5 Å²	56.5	14%	0.144	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-67.3	138.9	-176.3	-169.7	167.1	0	0	0	112.2	V233 K283 L284 N297 V298	V233-I293 HydrophobicContact CG1-CG2 4.37Å; V233-I293 WeakPolarHBondContact CG1-O 3.29Å; K283-I293 HydrophobicContact CB-CB 4.01Å; K283-I293 HydrophobicContact CB-CD1 4.13Å; K283-I293 HydrophobicContact CB-CG2 3.79Å; K283-I293 HydrophobicContact CD-CD1 3.95Å; K283-I293 HydrophobicContact CG-CD1 4.5Å; K283-I293 WeakPolarHBondContact O-CG2 3.46Å; K283-I293 PolarHBondContact O-N 2.84Å; L284-I293 HydrophobicContact CD2-CG2 3.78Å; L284-I293 HydrophobicContact CG-CG2 4.33Å; I293-N297 HydrophobicContact CD1-CB 3.85Å; I293-N297 HydrophobicContact CG1-CB 3.61Å; I293-V298 HydrophobicContact CB-CG2 4.3Å; I293-V298 HydrophobicContact CD1-CG2 4.05Å; I293-V298 HydrophobicContact CG1-CG2 3.97Å; I293-V298 HydrophobicContact CG2-CG2 3.44Å; I293-V298 VanDerWaalsContact CG2-CG2 3.44Å
294	T	96.7	Very high	97.1	Very high	80 Å²	80	52.3 Å²	52.3	49%	0.491	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-76.2	150.6	173	58.4	0	0	0	0	111	R296 N297 V298	T294-R296 VanDerWaalsContact C-N 3.27Å; T294-R296 PolarHBondContact O-N 3.06Å; T294-N297 PolarHBondContact O-N 3.14Å; T294-N297 VanDerWaalsContact OG1-CG 3.3Å; T294-N297 PolarHBondContact OG1-OD1 3.39Å; T294-V298 PolarHBondContact O-N 3.03Å
295	L	97.4	Very high	97	Very high	7 Å²	7	53 Å²	53	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-61.5	-32.3	-177.3	-68.2	-173.8	0	0	0	113.8	V163 E164 V233 L236 N297 V298 M299	V163-L295 HydrophobicContact CB-CD1 4Å; V163-L295 HydrophobicContact CG1-CD1 3.72Å; E164-L295 HydrophobicContact CB-CB 3.94Å; E164-L295 HydrophobicContact CB-CD1 4.02Å; E164-L295 HydrophobicContact CG-CB 3.75Å; V233-L295 HydrophobicContact CG2-CD2 3.87Å; V233-L295 HydrophobicContact CG2-CG 3.95Å; L236-L295 HydrophobicContact CD1-CD1 4.09Å; L236-L295 HydrophobicContact CD1-CD2 3.73Å; L295-N297 VanDerWaalsContact C-N 3.26Å; L295-N297 PolarHBondContact O-N 3.34Å; L295-V298 HydrophobicContact CD2-CB 4.45Å; L295-V298 HydrophobicContact CD2-CG2 4.27Å; L295-V298 WeakPolarHBondContact O-CB 3.49Å; L295-V298 PolarHBondContact O-N 3.46Å; L295-V298 VanDerWaalsContact O-N 3.1Å; L295-M299 WeakPolarHBondContact O-CG 3.25Å; L295-M299 PolarHBondContact O-N 2.89Å
296	R	95.4	Very high	97	Very high	157 Å²	157	55 Å²	55	59%	0.592	29%	0.292	S	S	*	.	H	α-helix	trans	-58.4	-37	171.6	-66.7	-177.8	-179.8	176.9	-1.3	112.8	E164 T294 M299	E164-R296 HydrophobicContact CG-CG 4.4Å; E164-R296 WeakPolarHBondContact OE1-CG 3.18Å; E164-R296 IonicContact OE1-NE 3.14Å; E164-R296 PolarHBondContact OE1-NE 3.41Å; T294-R296 VanDerWaalsContact C-N 3.27Å; T294-R296 PolarHBondContact O-N 3.06Å; R296-M299 WeakPolarHBondContact O-CB 3.24Å
297	N	97	Very high	97	Very high	92 Å²	92	56.1 Å²	56.1	49%	0.492	31%	0.31	S	S	.	.	H	α-helix	trans	-79.8	-28.4	177	-64.1	13.6	0	0	0	111.4	I293 T294 L295 S300 D301	I293-N297 HydrophobicContact CD1-CB 3.85Å; I293-N297 HydrophobicContact CG1-CB 3.61Å; T294-N297 PolarHBondContact O-N 3.14Å; T294-N297 VanDerWaalsContact OG1-CG 3.3Å; T294-N297 PolarHBondContact OG1-OD1 3.39Å; L295-N297 VanDerWaalsContact C-N 3.26Å; L295-N297 PolarHBondContact O-N 3.34Å; N297-S300 PolarHBondContact O-N 3.33Å; N297-S300 PolarHBondContact O-OG 2.92Å; N297-D301 PolarHBondContact O-N 3.41Å
298	V	98.1	Very high	96.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.8	-39.2	169.7	175.9	0	0	0	0	111.3	V160 L280 L284 I293 T294 L295 S300 D301 L304	V160-V298 HydrophobicContact CG1-CG1 4.27Å; V160-V298 HydrophobicContact CG2-CG1 4.09Å; L280-V298 HydrophobicContact CD1-CG1 4.16Å; L284-V298 HydrophobicContact CD2-CG2 3.79Å; I293-V298 HydrophobicContact CB-CG2 4.3Å; I293-V298 HydrophobicContact CD1-CG2 4.05Å; I293-V298 HydrophobicContact CG1-CG2 3.97Å; I293-V298 HydrophobicContact CG2-CG2 3.44Å; I293-V298 VanDerWaalsContact CG2-CG2 3.44Å; T294-V298 PolarHBondContact O-N 3.03Å; L295-V298 HydrophobicContact CD2-CB 4.45Å; L295-V298 HydrophobicContact CD2-CG2 4.27Å; L295-V298 WeakPolarHBondContact O-CB 3.49Å; L295-V298 PolarHBondContact O-N 3.46Å; L295-V298 VanDerWaalsContact O-N 3.1Å; V298-S300 PolarHBondContact O-N 3.18Å; V298-D301 VanDerWaalsContact O-CB 3.26Å; V298-D301 WeakPolarHBondContact O-CB 3.26Å; V298-D301 PolarHBondContact O-N 3.43Å; V298-L304 HydrophobicContact CG1-CD2 4.14Å; V298-L304 VanDerWaalsContact O-CD2 3.25Å; V298-L304 WeakPolarHBondContact O-CD2 3.44Å
299	M	98	Very high	96.9	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.015	31%	0.311	C	S	.	.	H	α-helix	trans	-56.7	-35.6	176.1	-74.1	174.5	161.2	0	0	112.4	V160 E164 L295 R296 N305 L313 P315	V160-M299 HydrophobicContact CG1-CE 4.19Å; V160-M299 HydrophobicContact CG1-CG 3.8Å; E164-M299 HydrophobicContact CB-CE 3.48Å; E164-M299 VanDerWaalsContact CB-CE 3.48Å; E164-M299 HydrophobicContact CB-SD 4.46Å; E164-M299 HydrophobicContact CG-CE 3.74Å; E164-M299 HydrophobicContact CG-SD 4.1Å; L295-M299 WeakPolarHBondContact O-CG 3.25Å; L295-M299 PolarHBondContact O-N 2.89Å; R296-M299 WeakPolarHBondContact O-CB 3.24Å; M299-N305 PolarHBondContact O-ND2 3.4Å; M299-L313 HydrophobicContact CB-CB 4.38Å; M299-L313 HydrophobicContact CB-CD2 4.49Å; M299-L313 HydrophobicContact CB-CG 4.35Å; M299-L313 HydrophobicContact CE-CD2 4.47Å; M299-L313 HydrophobicContact CE-CG 4.45Å; M299-L313 HydrophobicContact CG-CD2 3.88Å; M299-L313 HydrophobicContact CG-CG 3.97Å; M299-P315 HydrophobicContact SD-CB 4.44Å; M299-P315 HydrophobicContact SD-CG 3.95Å
300	S	96.7	Very high	96.7	Very high	83 Å²	83	64.2 Å²	64.2	58%	0.58	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-0.2	173.6	57.9	0	0	0	0	115.7	N297 V298	N297-S300 PolarHBondContact O-N 3.33Å; N297-S300 PolarHBondContact O-OG 2.92Å; V298-S300 PolarHBondContact O-N 3.18Å
301	D	98	Very high	96.8	Very high	9 Å²	9	65 Å²	65	5%	0.048	33%	0.334	C	S	.	.			trans	-68	139.3	-175.3	-170.3	-85.8	0	0	0	112.2	L280 K283 N297 V298 W303 L304 N305	L280-D301 HydrophobicContact CD1-CB 4.12Å; K283-D301 IonicContact NZ-OD2 2.77Å; K283-D301 PolarHBondContact NZ-OD2 3.41Å; N297-D301 PolarHBondContact O-N 3.41Å; V298-D301 VanDerWaalsContact O-CB 3.26Å; V298-D301 WeakPolarHBondContact O-CB 3.26Å; V298-D301 PolarHBondContact O-N 3.43Å; D301-W303 VanDerWaalsContact C-N 3.34Å; D301-W303 PolarHBondContact O-N 2.92Å; D301-W303 PolarHBondContact OD1-N 2.95Å; D301-L304 PolarHBondContact O-N 2.61Å; D301-L304 VanDerWaalsContact O-N 3.11Å; D301-N305 PolarHBondContact O-N 2.87Å; D301-N305 PolarHBondContact O-ND2 2.92Å
302	K	97.5	Very high	96.7	Very high	130 Å²	130	61.4 Å²	61.4	57%	0.565	32%	0.321	S	S	*	.	H	α-helix	trans	-51.1	-50.3	178.3	-176.8	-171.8	169.7	-152.1	0	111.8	D276 L304 N305 I306	D276-K302 WeakPolarHBondContact OD1-CD 3.46Å; D276-K302 WeakPolarHBondContact OD1-CE 3.22Å; D276-K302 IonicContact OD1-NZ 2.68Å; D276-K302 PolarHBondContact OD1-NZ 3.13Å; D276-K302 WeakPolarHBondContact OD2-CE 3.44Å; D276-K302 IonicContact OD2-NZ 3.73Å; D276-K302 PolarHBondContact OD2-NZ 2.94Å; K302-L304 PolarHBondContact O-N 2.93Å; K302-N305 PolarHBondContact O-N 3.18Å; K302-N305 VanDerWaalsContact O-N 3.12Å; K302-I306 HydrophobicContact CG-CG1 4.47Å; K302-I306 WeakPolarHBondContact O-CG1 3.4Å; K302-I306 PolarHBondContact O-N 3.41Å
303	W	98.4	Very high	96.7	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.1	-31.9	-176	-175.8	84.4	0	0	0	112.2	E149 A152 R153 F156 L240 V244 D276 C277 L280 D301 N305	E149-W303 HydrophobicContact CB-CZ2 4.01Å; E149-W303 HydrophobicContact CG-CZ2 4.24Å; E149-W303 PolarHBondContact OE2-NE1 2.66Å; A152-W303 HydrophobicContact CB-CH2 4.44Å; R153-W303 HydrophobicContact CB-CH2 3.8Å; R153-W303 HydrophobicContact CB-CZ2 4.21Å; R153-W303 HydrophobicContact CB-CZ3 4.11Å; R153-W303 WeakPolarHBondContact CD-O 3.46Å; R153-W303 HydrophobicContact CG-CZ3 4.42Å; R153-W303 PolarHBondContact NE-O 3.37Å; F156-W303 HydrophobicContact CB-CZ3 4.47Å; F156-W303 HydrophobicContact CD1-CZ3 4.2Å; L240-W303 HydrophobicContact CD1-CE3 4.48Å; L240-W303 HydrophobicContact CD1-CH2 3.53Å; L240-W303 HydrophobicContact CD1-CZ2 4.32Å; L240-W303 HydrophobicContact CD1-CZ3 3.63Å; V244-W303 HydrophobicContact CG1-CZ2 4.34Å; D276-W303 HydrophobicContact CB-CB 4Å; D276-W303 HydrophobicContact CB-CG 4.35Å; C277-W303 HydrophobicContact CB-CG 4.3Å; C277-W303 VanDerWaalsContact N-CD1 3.28Å; L280-W303 HydrophobicContact CB-CB 4.35Å; L280-W303 HydrophobicContact CD2-CB 4.28Å; L280-W303 HydrophobicContact CD2-CD2 4.34Å; L280-W303 HydrophobicContact CD2-CE3 3.64Å; L280-W303 HydrophobicContact CD2-CZ3 4.39Å; D301-W303 VanDerWaalsContact C-N 3.34Å; D301-W303 PolarHBondContact O-N 2.92Å; D301-W303 PolarHBondContact OD1-N 2.95Å; W303-N305 VanDerWaalsContact C-N 3.28Å; W303-N305 PolarHBondContact O-N 2.93Å
304	L	97.9	Very high	96.7	Very high	0 Å²	0	68 Å²	68	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-74.6	-20.6	-177.9	-162.7	64.4	0	0	0	113	F156 R157 V160 V298 D301 K302 L313	F156-L304 HydrophobicContact CD1-CD1 3.78Å; R157-L304 WeakPolarHBondContact CD-O 3.46Å; R157-L304 HydrophobicContact CG-CD1 3.66Å; R157-L304 HydrophobicContact CG-CG 3.8Å; R157-L304 PolarHBondContact NH1-O 3Å; V160-L304 HydrophobicContact CG1-CD2 4.36Å; V298-L304 HydrophobicContact CG1-CD2 4.14Å; V298-L304 VanDerWaalsContact O-CD2 3.25Å; V298-L304 WeakPolarHBondContact O-CD2 3.44Å; D301-L304 PolarHBondContact O-N 2.61Å; D301-L304 VanDerWaalsContact O-N 3.11Å; K302-L304 PolarHBondContact O-N 2.93Å; L304-L313 HydrophobicContact CD2-CD2 3.75Å
305	N	98.2	Very high	96.7	Very high	14 Å²	14	67 Å²	67	8%	0.075	35%	0.345	C	S	.	.	H	α-helix	trans	-113.8	0	-172.5	-62.3	-70.7	0	0	0	114.8	R157 M299 D301 K302 W303 G307 Y308 I312 L313	R157-N305 PolarHBondContact NH1-OD1 3.36Å; M299-N305 PolarHBondContact O-ND2 3.4Å; D301-N305 PolarHBondContact O-N 2.87Å; D301-N305 PolarHBondContact O-ND2 2.92Å; K302-N305 PolarHBondContact O-N 3.18Å; K302-N305 VanDerWaalsContact O-N 3.12Å; W303-N305 VanDerWaalsContact C-N 3.28Å; W303-N305 PolarHBondContact O-N 2.93Å; N305-G307 PolarHBondContact O-N 2.99Å; N305-Y308 CarbonylContact O-C 3.37Å; N305-Y308 WeakPolarHBondContact O-CA 3.4Å; N305-Y308 PolarHBondContact O-N 3.24Å; N305-I312 WeakPolarHBondContact OD1-CA 3.48Å; N305-L313 PolarHBondContact OD1-N 3.32Å
306	I	97.7	Very high	96.7	Very high	53 Å²	53	69.2 Å²	69.2	27%	0.272	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	118	171.3	-68.2	160.3	0	0	0	110.2	R153 D276 K302 E309	R153-I306 WeakPolarHBondContact CD-O 3.13Å; R153-I306 PolarHBondContact NH1-O 3.19Å; D276-I306 HydrophobicContact CB-CD1 4.33Å; K302-I306 HydrophobicContact CG-CG1 4.47Å; K302-I306 WeakPolarHBondContact O-CG1 3.4Å; K302-I306 PolarHBondContact O-N 3.41Å; I306-E309 WeakPolarHBondContact CA-OE1 3.35Å
307	G	96.6	Very high	96.8	Very high	56 Å²	56	67.5 Å²	67.5	58%	0.577	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	17.9	-172.9	0	0	0	0	0	114.3	N305 E309	N305-G307 PolarHBondContact O-N 2.99Å; G307-E309 VanDerWaalsContact C-OE2 3.25Å; G307-E309 WeakPolarHBondContact CA-OE2 3.19Å; G307-E309 VanDerWaalsContact N-CD 3.3Å; G307-E309 PolarHBondContact N-OE1 3.31Å; G307-E309 PolarHBondContact N-OE2 2.85Å
308	Y	96.5	Very high	96.6	Very high	74 Å²	74	66 Å²	66	29%	0.29	35%	0.351	S	S	.	.			trans	-144	30.9	177.1	-63.4	-84.1	0	0	0	110.8	R153 R157 N305 D310 N311 I312	R153-Y308 HydrophobicContact CG-CE2 4.18Å; R157-Y308 VanDerWaalsContact CZ-CG 3.47Å; N305-Y308 CarbonylContact O-C 3.37Å; N305-Y308 WeakPolarHBondContact O-CA 3.4Å; N305-Y308 PolarHBondContact O-N 3.24Å; Y308-D310 VanDerWaalsContact C-N 3.35Å; Y308-D310 PolarHBondContact O-N 2.86Å; Y308-N311 CarbonylContact O-C 3.46Å; Y308-N311 WeakPolarHBondContact O-CA 3.01Å; Y308-N311 PolarHBondContact O-N 2.94Å; Y308-I312 PolarHBondContact O-N 2.83Å; Y308-I312 VanDerWaalsContact O-N 3.16Å
309	E	92.8	Very high	96.3	Very high	114 Å²	114	69.4 Å²	69.4	53%	0.533	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-60.1	-41.6	-173.5	-69.9	72.6	-166.6	0	0	112	I306 G307 N311	I306-E309 WeakPolarHBondContact CA-OE1 3.35Å; G307-E309 VanDerWaalsContact C-OE2 3.25Å; G307-E309 WeakPolarHBondContact CA-OE2 3.19Å; G307-E309 VanDerWaalsContact N-CD 3.3Å; G307-E309 PolarHBondContact N-OE1 3.31Å; G307-E309 PolarHBondContact N-OE2 2.85Å; E309-N311 PolarHBondContact O-N 3.45Å
310	D	93.1	Very high	96	Very high	175 Å²	175	74.9 Å²	74.9	94%	0.936	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-75.3	-10.9	175.1	-50.5	-59.9	0	0	0	113.6	Y308	Y308-D310 VanDerWaalsContact C-N 3.35Å; Y308-D310 PolarHBondContact O-N 2.86Å
311	N	94.2	Very high	95.6	Very high	111 Å²	111	74.8 Å²	74.8	59%	0.594	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-138	57	-174.5	-168.5	-3	0	0	0	110.4	R157 Y308 E309 L313	R157-N311 PolarHBondContact NH2-O 2.96Å; Y308-N311 CarbonylContact O-C 3.46Å; Y308-N311 WeakPolarHBondContact O-CA 3.01Å; Y308-N311 PolarHBondContact O-N 2.94Å; E309-N311 PolarHBondContact O-N 3.45Å; N311-L313 PolarHBondContact O-N 3.19Å
312	I	96	Very high	95.2	Very high	86 Å²	86	78.4 Å²	78.4	44%	0.441	43%	0.425	S	S	.	.			trans	-53.8	133.6	174.1	-62	175.5	0	0	0	109	N305 Y308 K314	N305-I312 WeakPolarHBondContact OD1-CA 3.48Å; Y308-I312 PolarHBondContact O-N 2.83Å; Y308-I312 VanDerWaalsContact O-N 3.16Å; I312-K314 PolarHBondContact O-N 2.95Å
313	L	97.5	Very high	94.8	Very high	25 Å²	25	74.7 Å²	74.7	13%	0.131	41%	0.408	C	S	.	.			trans	-61.4	130.5	-178.5	-174	62	0	0	0	110.1	R157 V160 M299 L304 N305 N311	R157-L313 HydrophobicContact CB-CD2 4.3Å; R157-L313 HydrophobicContact CG-CD2 4.46Å; V160-L313 HydrophobicContact CB-CD2 4.28Å; V160-L313 HydrophobicContact CG1-CD2 4.02Å; M299-L313 HydrophobicContact CB-CB 4.38Å; M299-L313 HydrophobicContact CB-CD2 4.49Å; M299-L313 HydrophobicContact CB-CG 4.35Å; M299-L313 HydrophobicContact CE-CD2 4.47Å; M299-L313 HydrophobicContact CE-CG 4.45Å; M299-L313 HydrophobicContact CG-CD2 3.88Å; M299-L313 HydrophobicContact CG-CG 3.97Å; L304-L313 HydrophobicContact CD2-CD2 3.75Å; N305-L313 PolarHBondContact OD1-N 3.32Å; N311-L313 PolarHBondContact O-N 3.19Å
314	K	96.7	Very high	94.4	Very high	159 Å²	159	79 Å²	79	69%	0.691	43%	0.431	S	S	*	.			trans	-118.6	157.1	177.8	-69.9	170.4	-173.4	174.5	0	109.7	I312 Y316	I312-K314 PolarHBondContact O-N 2.95Å; K314-Y316 PolarHBondContact O-N 3.17Å
315	P	97.3	Very high	94.2	Very high	59 Å²	59	80.2 Å²	80.2	38%	0.383	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-51	134.5	169.1	-27.5	36.7	0	0	0	110.9	E164 M299 T317	E164-P315 WeakPolarHBondContact OE2-CB 3.44Å; M299-P315 HydrophobicContact SD-CB 4.44Å; M299-P315 HydrophobicContact SD-CG 3.95Å; P315-T317 PolarHBondContact O-N 3.38Å
316	Y	97.8	Very high	94	Very high	54 Å²	54	85 Å²	85	21%	0.212	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-72	130.1	-179.9	-179.9	-100.8	0	0	0	110.3	H109 P110 Y165 Q168 K314 E318 P319	H109-Y316 HydrophobicContact CB-CE1 4.46Å; H109-Y316 AromaticContact CD2-CD1 3.42Å; H109-Y316 VanDerWaalsContact CD2-CD1 3.42Å; H109-Y316 WeakPolarHBondContact CD2-CD1 3.32Å; H109-Y316 AromaticContact CD2-CE1 3.94Å; H109-Y316 AromaticContact CD2-CG 3.46Å; H109-Y316 VanDerWaalsContact CD2-CG 3.46Å; H109-Y316 AromaticContact NE2-CG 3.8Å; P110-Y316 HydrophobicContact CG-CE2 4.18Å; Y165-Y316 AromaticContact CD2-CD1 3.7Å; Y165-Y316 HydrophobicContact CD2-CD1 3.7Å; Y165-Y316 HydrophobicContact CD2-CE1 4.44Å; Y165-Y316 HydrophobicContact CE2-CD1 4.12Å; Y165-Y316 HydrophobicContact CE2-CE1 4.43Å; Y165-Y316 HydrophobicContact CG-CD1 4.31Å; Q168-Y316 PolarHBondContact NE2-O 3.17Å; Q168-Y316 VanDerWaalsContact NE2-O 3.15Å; K314-Y316 PolarHBondContact O-N 3.17Å; Y316-E318 HydrophobicContact CE1-CB 4.24Å; Y316-P319 VanDerWaalsContact OH-CD 3.32Å; Y316-P319 WeakPolarHBondContact OH-CD 3.47Å
317	T	96.4	Very high	93.7	Very high	120 Å²	120	87.3 Å²	87.3	74%	0.736	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-102.5	123.3	170.1	-55.6	0	0	0	0	108.3	P315	P315-T317 PolarHBondContact O-N 3.38Å
318	E	93.4	Very high	93.6	Very high	62 Å²	62	86.1 Å²	86.1	29%	0.29	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-69.8	129.6	176.9	-169.6	178.5	163	0	0	110.3	N108 Y165 K169 Y316	N108-E318 HydrophobicContact CB-CG 4.33Å; N108-E318 VanDerWaalsContact CB-OE1 3.25Å; N108-E318 WeakPolarHBondContact CB-OE1 3.42Å; N108-E318 PolarHBondContact ND2-OE1 3.45Å; Y165-E318 HydrophobicContact CE2-CB 4.37Å; Y165-E318 PolarHBondContact OH-OE2 2.95Å; Y165-E318 VanDerWaalsContact OH-OE2 3.12Å; K169-E318 VanDerWaalsContact CE-OE2 3.27Å; K169-E318 WeakPolarHBondContact CE-OE2 3.31Å; K169-E318 IonicContact NZ-OE2 3.53Å; K169-E318 PolarHBondContact NZ-OE2 3.39Å; Y316-E318 HydrophobicContact CE1-CB 4.24Å
319	P	92	Very high	93.5	Very high	71 Å²	71	83.2 Å²	83.2	46%	0.461	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-67.5	147.2	175.6	28.7	-34.6	0	0	0	110.5	Y316	Y316-P319 VanDerWaalsContact OH-CD 3.32Å; Y316-P319 WeakPolarHBondContact OH-CD 3.47Å
320	P	90.6	Very high	93.5	Very high	118 Å²	118	81.5 Å²	81.5	77%	0.766	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-52.8	140	173.2	-26.2	35	0	0	0	111.7	D322	P320-D322 PolarHBondContact O-N 2.9Å
321	P	88.1	Confident	93.6	Very high	81 Å²	81	74 Å²	74	53%	0.526	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-71.6	116.1	-176.9	28.8	-34.4	0	0	0	111	Y323	P321-Y323 HydrophobicContact CB-CD1 4.33Å; P321-Y323 HydrophobicContact CB-CE1 3.69Å; P321-Y323 HydrophobicContact CB-CE2 4.27Å; P321-Y323 HydrophobicContact CG-CE1 4.48Å; P321-Y323 HydrophobicContact CG-CE2 4.21Å; P321-Y323 PolarHBondContact O-N 3.07Å
322	D	89.6	Confident	93.6	Very high	85 Å²	85	68.8 Å²	68.8	46%	0.455	37%	0.369	S	S	.	.			trans	-80.6	111.2	171.7	-179.9	14.9	0	0	0	110.8	P320 N324 D325 Y358	P320-D322 PolarHBondContact O-N 2.9Å; D322-N324 WeakPolarHBondContact OD1-CA 3.47Å; D322-N324 PolarHBondContact OD1-N 2.99Å; D322-D325 PolarHBondContact OD1-N 3.2Å; D322-Y358 WeakPolarHBondContact O-CE1 3.43Å; D322-Y358 PolarHBondContact O-OH 3.43Å
323	Y	89.8	Confident	93.5	Very high	51 Å²	51	71.2 Å²	71.2	20%	0.2	37%	0.372	C	S	.	.			trans	-106	8	173.7	-56	-34.8	0	0	0	113	P321 L346 I347 Y358	P321-Y323 HydrophobicContact CB-CD1 4.33Å; P321-Y323 HydrophobicContact CB-CE1 3.69Å; P321-Y323 HydrophobicContact CB-CE2 4.27Å; P321-Y323 HydrophobicContact CG-CE1 4.48Å; P321-Y323 HydrophobicContact CG-CE2 4.21Å; P321-Y323 PolarHBondContact O-N 3.07Å; Y323-L346 HydrophobicContact CD1-CB 3.66Å; Y323-L346 HydrophobicContact CD1-CD1 3.89Å; Y323-L346 HydrophobicContact CD1-CD2 4.32Å; Y323-L346 HydrophobicContact CD1-CG 4.17Å; Y323-L346 HydrophobicContact CE1-CB 3.75Å; Y323-L346 HydrophobicContact CE1-CD2 4.36Å; Y323-L346 HydrophobicContact CE1-CG 4.48Å; Y323-L346 HydrophobicContact CG-CB 4.05Å; Y323-L346 HydrophobicContact CG-CD1 4.31Å; Y323-L346 PolarHBondContact OH-O 2.93Å; Y323-I347 HydrophobicContact CD2-CG1 3.79Å; Y323-I347 HydrophobicContact CE2-CG1 3.8Å; Y323-Y358 WeakPolarHBondContact CA-OH 3.39Å
324	N	90.9	Very high	93.3	Very high	90 Å²	90	73 Å²	73	48%	0.481	38%	0.381	S	S	.	.			trans	-126.9	20.4	-175	-72.1	-54.2	0	0	0	113.5	D322 T326 R343 Y358	D322-N324 WeakPolarHBondContact OD1-CA 3.47Å; D322-N324 PolarHBondContact OD1-N 2.99Å; N324-T326 PolarHBondContact O-N 2.91Å; N324-R343 PolarHBondContact OD1-NE 3.25Å; N324-R343 PolarHBondContact OD1-NH2 3.41Å; N324-Y358 PolarHBondContact N-OH 3.48Å
325	D	93	Very high	93.1	Very high	26 Å²	26	66.6 Å²	66.6	14%	0.139	35%	0.354	C	S	.	.			trans	-55.4	104.5	169	-177.4	-44.2	0	0	0	109	D322 E327 R328 L329 Y358 R367	D322-D325 PolarHBondContact OD1-N 3.2Å; D325-E327 VanDerWaalsContact C-N 3.3Å; D325-E327 PolarHBondContact O-N 2.97Å; D325-E327 PolarHBondContact OD1-N 2.7Å; D325-R328 HydrophobicContact CB-CB 4.11Å; D325-R328 HydrophobicContact CB-CG 4.29Å; D325-R328 PolarHBondContact O-N 3.09Å; D325-R328 PolarHBondContact OD1-N 3.39Å; D325-R328 IonicContact OD1-NE 2.67Å; D325-R328 IonicContact OD2-CZ 3.23Å; D325-R328 IonicContact OD2-NE 3.39Å; D325-R328 PolarHBondContact OD2-NE 2.8Å; D325-R328 IonicContact OD2-NH2 3.88Å; D325-R328 PolarHBondContact OD2-NH2 3.23Å; D325-L329 WeakPolarHBondContact O-CG 3.39Å; D325-L329 PolarHBondContact O-N 3.45Å; D325-Y358 WeakPolarHBondContact CB-OH 3.47Å; D325-Y358 PolarHBondContact N-OH 3.23Å; D325-R367 IonicContact OD1-CZ 3.48Å; D325-R367 IonicContact OD1-NH1 2.69Å; D325-R367 IonicContact OD1-NH2 3.93Å; D325-R367 IonicContact OD2-CZ 3.54Å; D325-R367 IonicContact OD2-NH1 2.8Å; D325-R367 IonicContact OD2-NH2 3.54Å; D325-R367 PolarHBondContact OD2-NH2 2.9Å
326	T	92.9	Very high	92.9	Very high	116 Å²	116	66.5 Å²	66.5	71%	0.712	36%	0.364	S	S	*	.	H	α-helix	trans	-65.9	-33.3	-169.2	48.9	0	0	0	0	112.3	N324 E330	N324-T326 PolarHBondContact O-N 2.91Å; T326-E330 VanDerWaalsContact O-CB 3.24Å; T326-E330 WeakPolarHBondContact O-CB 3.37Å; T326-E330 PolarHBondContact O-N 2.84Å
327	E	92.4	Very high	92.7	Very high	101 Å²	101	66.6 Å²	66.6	47%	0.472	36%	0.364	S	S	.	.	H	α-helix	trans	-68.8	-41.6	176.2	-164.5	-167.6	152.9	0	0	110.6	D325 I331 R367	D325-E327 VanDerWaalsContact C-N 3.3Å; D325-E327 PolarHBondContact O-N 2.97Å; D325-E327 PolarHBondContact OD1-N 2.7Å; E327-I331 HydrophobicContact CG-CD1 4.2Å; E327-I331 WeakPolarHBondContact O-CB 3.4Å; E327-I331 WeakPolarHBondContact O-CD1 3.29Å; E327-I331 VanDerWaalsContact O-CG1 3.22Å; E327-I331 WeakPolarHBondContact O-CG1 3.45Å; E327-I331 PolarHBondContact O-N 3.33Å; E327-R367 VanDerWaalsContact CD-CD 3.48Å; E327-R367 VanDerWaalsContact CD-NH1 3.26Å; E327-R367 WeakPolarHBondContact OE1-CD 3.45Å; E327-R367 IonicContact OE1-NH1 2.63Å; E327-R367 IonicContact OE2-CZ 2.75Å; E327-R367 IonicContact OE2-NH1 3.98Å; E327-R367 PolarHBondContact OE2-NH1 3.05Å
328	R	94.5	Very high	92.7	Very high	31 Å²	31	67.9 Å²	67.9	12%	0.117	36%	0.355	C	S	.	.	H	α-helix	trans	-65.1	-45.5	173.8	-74.6	-171.8	-106.9	178.6	2.3	112.6	D325 E330 I331 M332 Y358 L361	D325-R328 HydrophobicContact CB-CB 4.11Å; D325-R328 HydrophobicContact CB-CG 4.29Å; D325-R328 PolarHBondContact O-N 3.09Å; D325-R328 PolarHBondContact OD1-N 3.39Å; D325-R328 IonicContact OD1-NE 2.67Å; D325-R328 IonicContact OD2-CZ 3.23Å; D325-R328 IonicContact OD2-NE 3.39Å; D325-R328 PolarHBondContact OD2-NE 2.8Å; D325-R328 IonicContact OD2-NH2 3.88Å; D325-R328 PolarHBondContact OD2-NH2 3.23Å; R328-E330 VanDerWaalsContact C-N 3.31Å; R328-E330 PolarHBondContact O-N 2.86Å; R328-I331 PolarHBondContact O-N 3.03Å; R328-M332 WeakPolarHBondContact O-CB 3.45Å; R328-M332 VanDerWaalsContact O-CG 3.29Å; R328-M332 WeakPolarHBondContact O-CG 3.43Å; R328-M332 PolarHBondContact O-N 2.7Å; R328-Y358 HydrophobicContact CB-CD2 3.85Å; R328-Y358 HydrophobicContact CB-CE2 3.64Å; R328-Y358 WeakPolarHBondContact CD-O 3.5Å; R328-Y358 HydrophobicContact CG-CE2 4.46Å; R328-Y358 PolarHBondContact NH1-O 3.33Å; R328-L361 HydrophobicContact CG-CB 3.73Å
329	L	94.7	Very high	92.7	Very high	13 Å²	13	66.5 Å²	66.5	7%	0.068	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-37.3	179.1	-70	179.8	0	0	0	111.6	D325 M332 R333 P339 V342 Y358	D325-L329 WeakPolarHBondContact O-CG 3.39Å; D325-L329 PolarHBondContact O-N 3.45Å; L329-M332 PolarHBondContact O-N 3.08Å; L329-R333 WeakPolarHBondContact O-CB 3.26Å; L329-R333 PolarHBondContact O-N 3.14Å; L329-P339 HydrophobicContact CD2-CB 4.41Å; L329-V342 HydrophobicContact CD2-CB 4.11Å; L329-V342 HydrophobicContact CD2-CG1 3.8Å; L329-Y358 HydrophobicContact CD2-CD2 4.48Å; L329-Y358 HydrophobicContact CD2-CE2 4.17Å; L329-Y358 HydrophobicContact CG-CE2 4.4Å
330	E	93.5	Very high	92.9	Very high	77 Å²	77	67 Å²	67	36%	0.36	35%	0.351	S	S	.	.	H	α-helix	trans	-68.8	-44.8	175.4	179.6	58.1	-166.9	0	0	112.3	T326 R328 M332 R333 I334	T326-E330 VanDerWaalsContact O-CB 3.24Å; T326-E330 WeakPolarHBondContact O-CB 3.37Å; T326-E330 PolarHBondContact O-N 2.84Å; R328-E330 VanDerWaalsContact C-N 3.31Å; R328-E330 PolarHBondContact O-N 2.86Å; E330-M332 VanDerWaalsContact C-N 3.27Å; E330-M332 PolarHBondContact O-N 2.81Å; E330-R333 WeakPolarHBondContact O-CB 3.45Å; E330-R333 PolarHBondContact O-N 2.87Å; E330-R333 VanDerWaalsContact O-N 3.15Å; E330-R333 IonicContact OE1-CZ 2.69Å; E330-R333 IonicContact OE1-NE 3.73Å; E330-R333 IonicContact OE1-NH2 3.68Å; E330-R333 PolarHBondContact OE1-NH2 3.42Å; E330-R333 IonicContact OE2-CZ 3.76Å; E330-R333 IonicContact OE2-NE 2.8Å; E330-R333 PolarHBondContact OE2-NE 3.2Å; E330-R333 IonicContact OE2-NH2 3.95Å; E330-R333 PolarHBondContact OE2-NH2 2.98Å; E330-I334 HydrophobicContact CG-CD1 4.24Å; E330-I334 WeakPolarHBondContact O-CG1 3.3Å; E330-I334 PolarHBondContact O-N 3.47Å
331	I	93.3	Very high	93.1	Very high	19 Å²	19	64.6 Å²	64.6	10%	0.097	33%	0.331	C	S	.	.	H	α-helix	trans	-57.2	-43.2	172.5	-70.7	165.6	0	0	0	110.4	E327 R328 I334 M335 L361 R367 L370	E327-I331 HydrophobicContact CG-CD1 4.2Å; E327-I331 WeakPolarHBondContact O-CB 3.4Å; E327-I331 WeakPolarHBondContact O-CD1 3.29Å; E327-I331 VanDerWaalsContact O-CG1 3.22Å; E327-I331 WeakPolarHBondContact O-CG1 3.45Å; E327-I331 PolarHBondContact O-N 3.33Å; R328-I331 PolarHBondContact O-N 3.03Å; I331-I334 PolarHBondContact O-N 3.03Å; I331-M335 HydrophobicContact CG2-CE 3.73Å; I331-M335 HydrophobicContact CG2-SD 4.27Å; I331-M335 WeakPolarHBondContact O-CG 3.32Å; I331-M335 PolarHBondContact O-N 3.43Å; I331-L361 HydrophobicContact CB-CD1 4.22Å; I331-L361 HydrophobicContact CG2-CD1 3.7Å; I331-L361 HydrophobicContact CG2-CD2 3.93Å; I331-R367 HydrophobicContact CD1-CB 4.02Å; I331-R367 HydrophobicContact CD1-CG 4.02Å; I331-L370 HydrophobicContact CD1-CD1 4.49Å; I331-L370 HydrophobicContact CG2-CD1 3.68Å
332	M	94.9	Very high	93.4	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-69.5	-32.4	177.9	-71.8	-173.1	73.1	0	0	113.2	R328 L329 E330 M335 G336 Y337 V342 V354 I357 Y358 L361	R328-M332 WeakPolarHBondContact O-CB 3.45Å; R328-M332 VanDerWaalsContact O-CG 3.29Å; R328-M332 WeakPolarHBondContact O-CG 3.43Å; R328-M332 PolarHBondContact O-N 2.7Å; L329-M332 PolarHBondContact O-N 3.08Å; E330-M332 VanDerWaalsContact C-N 3.27Å; E330-M332 PolarHBondContact O-N 2.81Å; M332-M335 CarbonylContact O-C 3.22Å; M332-M335 PolarHBondContact O-N 3.43Å; M332-G336 PolarHBondContact O-N 2.9Å; M332-Y337 HydrophobicContact CB-CD2 4.43Å; M332-Y337 HydrophobicContact CE-CD2 4.18Å; M332-Y337 HydrophobicContact CE-CG 4.26Å; M332-Y337 WeakPolarHBondContact O-CD2 3.42Å; M332-Y337 PolarHBondContact O-N 3.15Å; M332-V342 HydrophobicContact CB-CG2 4.44Å; M332-V342 HydrophobicContact CE-CB 4.39Å; M332-V342 HydrophobicContact CE-CG1 3.86Å; M332-V342 HydrophobicContact CE-CG2 3.56Å; M332-V342 HydrophobicContact SD-CG1 3.82Å; M332-V342 HydrophobicContact SD-CG2 4.21Å; M332-V354 HydrophobicContact CE-CG1 3.69Å; M332-V354 VanDerWaalsContact CE-O 3.3Å; M332-V354 WeakPolarHBondContact CE-O 3.15Å; M332-I357 HydrophobicContact CE-CB 3.98Å; M332-I357 HydrophobicContact CE-CG2 3.82Å; M332-I357 HydrophobicContact CG-CG2 3.69Å; M332-I357 HydrophobicContact SD-CB 4.42Å; M332-I357 HydrophobicContact SD-CG2 3.84Å; M332-Y358 HydrophobicContact SD-CD2 3.87Å; M332-Y358 HydrophobicContact SD-CG 4.3Å; M332-L361 HydrophobicContact CG-CD1 3.83Å; M332-L361 HydrophobicContact SD-CD1 4.45Å
333	R	94.5	Very high	93.6	Very high	137 Å²	137	60.3 Å²	60.3	52%	0.517	30%	0.298	S	S	.	.	H	α-helix	trans	-63.2	-42.7	171.4	-167.1	-174.9	70.4	83.6	2.2	111.4	L329 E330 M335 G336 Y337	L329-R333 WeakPolarHBondContact O-CB 3.26Å; L329-R333 PolarHBondContact O-N 3.14Å; E330-R333 WeakPolarHBondContact O-CB 3.45Å; E330-R333 PolarHBondContact O-N 2.87Å; E330-R333 VanDerWaalsContact O-N 3.15Å; E330-R333 IonicContact OE1-CZ 2.69Å; E330-R333 IonicContact OE1-NE 3.73Å; E330-R333 IonicContact OE1-NH2 3.68Å; E330-R333 PolarHBondContact OE1-NH2 3.42Å; E330-R333 IonicContact OE2-CZ 3.76Å; E330-R333 IonicContact OE2-NE 2.8Å; E330-R333 PolarHBondContact OE2-NE 3.2Å; E330-R333 IonicContact OE2-NH2 3.95Å; E330-R333 PolarHBondContact OE2-NH2 2.98Å; R333-M335 VanDerWaalsContact C-N 3.33Å; R333-G336 PolarHBondContact O-N 3.49Å; R333-Y337 WeakPolarHBondContact CA-O 3.41Å
334	I	92.5	Very high	93.8	Very high	62 Å²	62	62.6 Å²	62.6	32%	0.318	31%	0.311	S	S	.	.	H	α-helix	trans	-65.3	-36.2	174.4	-64	163.5	0	0	0	111.2	E330 I331 G336 L375	E330-I334 HydrophobicContact CG-CD1 4.24Å; E330-I334 WeakPolarHBondContact O-CG1 3.3Å; E330-I334 PolarHBondContact O-N 3.47Å; I331-I334 PolarHBondContact O-N 3.03Å; I334-G336 PolarHBondContact O-N 2.87Å; I334-L375 HydrophobicContact CG2-CB 4.1Å; I334-L375 HydrophobicContact CG2-CD2 3.86Å; I334-L375 VanDerWaalsContact CG2-O 3.3Å; I334-L375 WeakPolarHBondContact CG2-O 3.49Å
335	M	92.3	Very high	94	Very high	25 Å²	25	58.8 Å²	58.8	12%	0.123	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-1.1	170.9	-67.2	179.2	179.1	0	0	114.3	T75 I331 M332 R333 Y337 I357 L370 S374	T75-M335 HydrophobicContact CG2-CE 4.47Å; I331-M335 HydrophobicContact CG2-CE 3.73Å; I331-M335 HydrophobicContact CG2-SD 4.27Å; I331-M335 WeakPolarHBondContact O-CG 3.32Å; I331-M335 PolarHBondContact O-N 3.43Å; M332-M335 CarbonylContact O-C 3.22Å; M332-M335 PolarHBondContact O-N 3.43Å; R333-M335 VanDerWaalsContact C-N 3.33Å; M335-Y337 HydrophobicContact CB-CD2 3.95Å; M335-Y337 HydrophobicContact CB-CE2 3.93Å; M335-I357 HydrophobicContact SD-CG2 3.97Å; M335-L370 HydrophobicContact CE-CD1 3.96Å; M335-L370 HydrophobicContact CE-CD2 3.81Å; M335-L370 HydrophobicContact CE-CG 4.46Å; M335-S374 WeakPolarHBondContact CG-O 3.44Å
336	G	93.7	Very high	94.1	Very high	57 Å²	57	58.1 Å²	58.1	59%	0.588	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	13.6	174.7	0	0	0	0	0	116.5	M332 R333 I334	M332-G336 PolarHBondContact O-N 2.9Å; R333-G336 PolarHBondContact O-N 3.49Å; I334-G336 PolarHBondContact O-N 2.87Å
337	Y	94.7	Very high	94	Very high	56 Å²	56	57.4 Å²	57.4	22%	0.22	28%	0.279	C	S	.	.			trans	-95.4	135.5	174.2	-57.1	-84.3	0	0	0	111	M332 R333 M335 N353 V354 I357	M332-Y337 HydrophobicContact CB-CD2 4.43Å; M332-Y337 HydrophobicContact CE-CD2 4.18Å; M332-Y337 HydrophobicContact CE-CG 4.26Å; M332-Y337 WeakPolarHBondContact O-CD2 3.42Å; M332-Y337 PolarHBondContact O-N 3.15Å; R333-Y337 WeakPolarHBondContact CA-O 3.41Å; M335-Y337 HydrophobicContact CB-CD2 3.95Å; M335-Y337 HydrophobicContact CB-CE2 3.93Å; Y337-N353 PolarHBondContact OH-ND2 3.34Å; Y337-N353 VanDerWaalsContact OH-ND2 3.08Å; Y337-V354 HydrophobicContact CD1-CG1 4.21Å; Y337-V354 HydrophobicContact CD1-CG2 4.01Å; Y337-V354 HydrophobicContact CE1-CG2 3.91Å; Y337-I357 HydrophobicContact CE2-CD1 3.58Å; Y337-I357 WeakPolarHBondContact OH-CD1 3.33Å
338	R	95.5	Very high	94	Very high	146 Å²	146	57.7 Å²	57.7	55%	0.551	28%	0.279	S	S	*	.			trans	-72.9	134.3	172.8	-51.5	170.7	64.4	-116.4	1.6	108.8	D340 D341 V342	R338-D340 PolarHBondContact O-N 2.65Å; R338-D340 VanDerWaalsContact O-N 3.09Å; R338-D341 HydrophobicContact CB-CB 4.47Å; R338-D341 WeakPolarHBondContact CB-OD2 3.49Å; R338-D341 WeakPolarHBondContact CD-OD2 3.45Å; R338-D341 IonicContact CZ-OD1 3.85Å; R338-D341 IonicContact NH1-OD1 2.69Å; R338-D341 PolarHBondContact NH1-OD1 3.01Å; R338-D341 PolarHBondContact O-N 3.48Å; R338-D341 VanDerWaalsContact O-N 3.16Å; R338-V342 WeakPolarHBondContact O-CG2 3.23Å; R338-V342 PolarHBondContact O-N 3.37Å
339	P	93.9	Very high	93.9	Very high	34 Å²	34	60.7 Å²	60.7	22%	0.221	29%	0.294	C	S	.	.	H	α-helix	trans	-55.7	-29.5	-179.1	-30.2	37.2	0	0	0	114.6	L329 V342 R343	L329-P339 HydrophobicContact CD2-CB 4.41Å; P339-V342 WeakPolarHBondContact O-CB 2.77Å; P339-V342 PolarHBondContact O-N 3.42Å; P339-R343 WeakPolarHBondContact O-CG 3.4Å; P339-R343 PolarHBondContact O-N 2.91Å
340	D	94.6	Very high	93.8	Very high	82 Å²	82	61.9 Å²	61.9	44%	0.439	30%	0.304	S	S	.	.	H	α-helix	trans	-71.8	-44.6	179.2	-51.5	-48.5	0	0	0	111.9	R338 V342 R343 E344	R338-D340 PolarHBondContact O-N 2.65Å; R338-D340 VanDerWaalsContact O-N 3.09Å; D340-V342 PolarHBondContact O-N 2.75Å; D340-R343 PolarHBondContact O-N 3.15Å; D340-R343 VanDerWaalsContact O-N 3.15Å; D340-R343 IonicContact OD1-CZ 2.69Å; D340-R343 IonicContact OD1-NH1 3.3Å; D340-R343 PolarHBondContact OD1-NH1 2.83Å; D340-E344 WeakPolarHBondContact O-CB 3.4Å; D340-E344 PolarHBondContact O-N 3.27Å
341	D	94.9	Very high	93.8	Very high	66 Å²	66	59 Å²	59	35%	0.353	29%	0.29	S	S	.	.	H	α-helix	trans	-57.8	-36.3	173	-45.1	-4.3	0	0	0	110.9	R338 A345	R338-D341 HydrophobicContact CB-CB 4.47Å; R338-D341 WeakPolarHBondContact CB-OD2 3.49Å; R338-D341 WeakPolarHBondContact CD-OD2 3.45Å; R338-D341 IonicContact CZ-OD1 3.85Å; R338-D341 IonicContact NH1-OD1 2.69Å; R338-D341 PolarHBondContact NH1-OD1 3.01Å; R338-D341 PolarHBondContact O-N 3.48Å; R338-D341 VanDerWaalsContact O-N 3.16Å; D341-A345 VanDerWaalsContact O-CB 3.27Å; D341-A345 WeakPolarHBondContact O-CB 3.45Å; D341-A345 PolarHBondContact O-N 3.4Å
342	V	95	Very high	94	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-66.7	-49.5	175.6	-179.8	0	0	0	0	110.9	L329 M332 R338 P339 D340 E344 A345 L346 V354 Y358	L329-V342 HydrophobicContact CD2-CB 4.11Å; L329-V342 HydrophobicContact CD2-CG1 3.8Å; M332-V342 HydrophobicContact CB-CG2 4.44Å; M332-V342 HydrophobicContact CE-CB 4.39Å; M332-V342 HydrophobicContact CE-CG1 3.86Å; M332-V342 HydrophobicContact CE-CG2 3.56Å; M332-V342 HydrophobicContact SD-CG1 3.82Å; M332-V342 HydrophobicContact SD-CG2 4.21Å; R338-V342 WeakPolarHBondContact O-CG2 3.23Å; R338-V342 PolarHBondContact O-N 3.37Å; P339-V342 WeakPolarHBondContact O-CB 2.77Å; P339-V342 PolarHBondContact O-N 3.42Å; D340-V342 PolarHBondContact O-N 2.75Å; V342-E344 PolarHBondContact O-N 2.9Å; V342-A345 PolarHBondContact O-N 3.36Å; V342-L346 HydrophobicContact CG1-CD1 3.85Å; V342-L346 WeakPolarHBondContact O-CB 3.23Å; V342-L346 WeakPolarHBondContact O-CD1 3.41Å; V342-L346 VanDerWaalsContact O-CG 3.23Å; V342-L346 WeakPolarHBondContact O-CG 3.45Å; V342-L346 PolarHBondContact O-N 3.38Å; V342-V354 HydrophobicContact CB-CG1 4.24Å; V342-V354 HydrophobicContact CG1-CG1 4.41Å; V342-V354 HydrophobicContact CG2-CG1 3.76Å; V342-Y358 HydrophobicContact CG1-CD2 4.06Å
343	R	94	Very high	93.9	Very high	76 Å²	76	62.1 Å²	62.1	29%	0.287	31%	0.307	S	S	.	.	H	α-helix	trans	-59.1	-46	176	-71.2	169.3	-174.6	122.8	2.1	111.5	N324 P339 D340 A345 L346 I347	N324-R343 PolarHBondContact OD1-NE 3.25Å; N324-R343 PolarHBondContact OD1-NH2 3.41Å; P339-R343 WeakPolarHBondContact O-CG 3.4Å; P339-R343 PolarHBondContact O-N 2.91Å; D340-R343 PolarHBondContact O-N 3.15Å; D340-R343 VanDerWaalsContact O-N 3.15Å; D340-R343 IonicContact OD1-CZ 2.69Å; D340-R343 IonicContact OD1-NH1 3.3Å; D340-R343 PolarHBondContact OD1-NH1 2.83Å; R343-A345 PolarHBondContact O-N 3.04Å; R343-L346 PolarHBondContact O-N 3.49Å; R343-I347 HydrophobicContact CB-CD1 4.49Å; R343-I347 WeakPolarHBondContact O-CB 3.3Å; R343-I347 WeakPolarHBondContact O-CD1 3.4Å; R343-I347 VanDerWaalsContact O-CG1 3.24Å; R343-I347 WeakPolarHBondContact O-CG1 3.29Å; R343-I347 PolarHBondContact O-N 2.86Å
344	E	94.9	Very high	94	Very high	99 Å²	99	56.8 Å²	56.8	46%	0.463	29%	0.289	S	S	.	.	H	α-helix	trans	-60.2	-47	178.9	-166.4	-161.2	144.3	0	0	111.2	D340 V342 L346 I347 K348	D340-E344 WeakPolarHBondContact O-CB 3.4Å; D340-E344 PolarHBondContact O-N 3.27Å; V342-E344 PolarHBondContact O-N 2.9Å; E344-L346 VanDerWaalsContact C-N 3.29Å; E344-L346 PolarHBondContact O-N 2.97Å; E344-I347 PolarHBondContact O-N 2.92Å; E344-K348 HydrophobicContact CG-CD 4.05Å; E344-K348 VanDerWaalsContact O-CB 3.32Å; E344-K348 WeakPolarHBondContact O-CB 3.2Å; E344-K348 WeakPolarHBondContact O-CG 3.33Å; E344-K348 PolarHBondContact O-N 3.12Å; E344-K348 VanDerWaalsContact OE1-CE 3.28Å; E344-K348 WeakPolarHBondContact OE1-CE 3.15Å; E344-K348 IonicContact OE1-NZ 3.51Å; E344-K348 PolarHBondContact OE1-NZ 2.99Å
345	A	95.3	Very high	94.1	Very high	11 Å²	11	54 Å²	54	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-63.2	-34	178.5	0	0	0	0	0	113	D341 V342 R343 Q349 S350 V354 T355	D341-A345 VanDerWaalsContact O-CB 3.27Å; D341-A345 WeakPolarHBondContact O-CB 3.45Å; D341-A345 PolarHBondContact O-N 3.4Å; V342-A345 PolarHBondContact O-N 3.36Å; R343-A345 PolarHBondContact O-N 3.04Å; A345-Q349 PolarHBondContact O-N 3.42Å; A345-S350 PolarHBondContact O-N 3.11Å; A345-S350 VanDerWaalsContact O-N 3.08Å; A345-S350 PolarHBondContact O-OG 3.08Å; A345-S350 VanDerWaalsContact O-OG 3.11Å; A345-V354 HydrophobicContact CB-CB 4.33Å; A345-V354 HydrophobicContact CB-CG1 4.38Å; A345-T355 VanDerWaalsContact C-CG2 3.43Å; A345-T355 HydrophobicContact CB-CG2 3.86Å; A345-T355 WeakPolarHBondContact O-CG2 3.38Å
346	L	93.2	Very high	94.3	Very high	11 Å²	11	52.9 Å²	52.9	6%	0.058	27%	0.27	C	S	.	.	H	α-helix	trans	-72.8	-47.6	175.8	-72.8	166.5	0	0	0	112.2	Y323 V342 R343 E344 Q349 T355 Y358	Y323-L346 HydrophobicContact CD1-CB 3.66Å; Y323-L346 HydrophobicContact CD1-CD1 3.89Å; Y323-L346 HydrophobicContact CD1-CD2 4.32Å; Y323-L346 HydrophobicContact CD1-CG 4.17Å; Y323-L346 HydrophobicContact CE1-CB 3.75Å; Y323-L346 HydrophobicContact CE1-CD2 4.36Å; Y323-L346 HydrophobicContact CE1-CG 4.48Å; Y323-L346 HydrophobicContact CG-CB 4.05Å; Y323-L346 HydrophobicContact CG-CD1 4.31Å; Y323-L346 PolarHBondContact OH-O 2.93Å; V342-L346 HydrophobicContact CG1-CD1 3.85Å; V342-L346 WeakPolarHBondContact O-CB 3.23Å; V342-L346 WeakPolarHBondContact O-CD1 3.41Å; V342-L346 VanDerWaalsContact O-CG 3.23Å; V342-L346 WeakPolarHBondContact O-CG 3.45Å; V342-L346 PolarHBondContact O-N 3.38Å; R343-L346 PolarHBondContact O-N 3.49Å; E344-L346 VanDerWaalsContact C-N 3.29Å; E344-L346 PolarHBondContact O-N 2.97Å; L346-Q349 PolarHBondContact O-N 3.4Å; L346-T355 HydrophobicContact CD2-CG2 3.97Å; L346-T355 HydrophobicContact CG-CG2 4.25Å; L346-Y358 HydrophobicContact CD1-CD1 3.62Å; L346-Y358 HydrophobicContact CD1-CD2 3.99Å; L346-Y358 HydrophobicContact CD1-CE1 3.77Å; L346-Y358 HydrophobicContact CD1-CE2 4.14Å; L346-Y358 HydrophobicContact CD1-CG 3.73Å; L346-Y358 HydrophobicContact CD2-CD1 3.61Å; L346-Y358 HydrophobicContact CD2-CE1 4.25Å; L346-Y358 HydrophobicContact CD2-CG 4.09Å; L346-Y358 HydrophobicContact CG-CD1 4.27Å; L346-Y358 HydrophobicContact CG-CG 4.46Å
347	I	92.4	Very high	94.4	Very high	101 Å²	101	50.1 Å²	50.1	52%	0.518	24%	0.242	S	C	.	.	H	α-helix	trans	-61.5	-45.9	177.4	-69.7	163.8	0	0	0	110.5	Y323 R343 E344 Q349	Y323-I347 HydrophobicContact CD2-CG1 3.79Å; Y323-I347 HydrophobicContact CE2-CG1 3.8Å; R343-I347 HydrophobicContact CB-CD1 4.49Å; R343-I347 WeakPolarHBondContact O-CB 3.3Å; R343-I347 WeakPolarHBondContact O-CD1 3.4Å; R343-I347 VanDerWaalsContact O-CG1 3.24Å; R343-I347 WeakPolarHBondContact O-CG1 3.29Å; R343-I347 PolarHBondContact O-N 2.86Å; E344-I347 PolarHBondContact O-N 2.92Å; I347-Q349 PolarHBondContact O-N 2.92Å; I347-Q349 VanDerWaalsContact O-N 3.15Å
348	K	92.8	Very high	94.5	Very high	107 Å²	107	47.6 Å²	47.6	47%	0.465	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-1.9	175.8	-69.2	-177.9	176	178.3	0	113.8	E344 S350 I807	E344-K348 HydrophobicContact CG-CD 4.05Å; E344-K348 VanDerWaalsContact O-CB 3.32Å; E344-K348 WeakPolarHBondContact O-CB 3.2Å; E344-K348 WeakPolarHBondContact O-CG 3.33Å; E344-K348 PolarHBondContact O-N 3.12Å; E344-K348 VanDerWaalsContact OE1-CE 3.28Å; E344-K348 WeakPolarHBondContact OE1-CE 3.15Å; E344-K348 IonicContact OE1-NZ 3.51Å; E344-K348 PolarHBondContact OE1-NZ 2.99Å; K348-S350 VanDerWaalsContact C-N 3.25Å; K348-S350 PolarHBondContact O-N 3.09Å; K348-I807 HydrophobicContact CG-CD1 4.27Å
349	Q	90.6	Very high	94.4	Very high	94 Å²	94	42 Å²	42	44%	0.439	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	42.5	52.7	-175.4	-63.5	-166.1	2.4	0	0	112.4	K105 A345 L346 I347 F351	K105-Q349 PolarHBondContact NZ-O 3.2Å; A345-Q349 PolarHBondContact O-N 3.42Å; L346-Q349 PolarHBondContact O-N 3.4Å; I347-Q349 PolarHBondContact O-N 2.92Å; I347-Q349 VanDerWaalsContact O-N 3.15Å; Q349-F351 VanDerWaalsContact C-N 3.32Å; Q349-F351 HydrophobicContact CB-CD2 4.44Å; Q349-F351 HydrophobicContact CB-CE2 4.07Å; Q349-F351 VanDerWaalsContact O-CD2 3.26Å; Q349-F351 WeakPolarHBondContact O-CD2 3.28Å; Q349-F351 PolarHBondContact O-N 3.1Å
350	S	92.8	Very high	94.5	Very high	39 Å²	39	40.6 Å²	40.6	27%	0.273	20%	0.203	S	C	.	.			trans	-63.3	-38.6	-173.3	61.3	0	0	0	0	112.2	K105 A345 K348 N352 T355	K105-S350 PolarHBondContact NZ-O 2.86Å; A345-S350 PolarHBondContact O-N 3.11Å; A345-S350 VanDerWaalsContact O-N 3.08Å; A345-S350 PolarHBondContact O-OG 3.08Å; A345-S350 VanDerWaalsContact O-OG 3.11Å; K348-S350 VanDerWaalsContact C-N 3.25Å; K348-S350 PolarHBondContact O-N 3.09Å; S350-N352 VanDerWaalsContact C-N 3.3Å; S350-N352 PolarHBondContact OG-N 3.03Å; S350-N352 PolarHBondContact OG-ND2 3.41Å; S350-N352 PolarHBondContact OG-OD1 2.73Å; S350-T355 WeakPolarHBondContact OG-CG2 3.42Å
351	F	95.3	Very high	94.5	Very high	17 Å²	17	36.7 Å²	36.7	8%	0.075	18%	0.182	C	C	.	.			trans	55.9	45.3	-166.5	-67.6	-95.8	0	0	0	111.5	K105 L115 E117 V118 Q349 T355	K105-F351 HydrophobicContact CB-CD2 4.19Å; K105-F351 HydrophobicContact CB-CE2 3.59Å; K105-F351 HydrophobicContact CB-CZ 4.03Å; K105-F351 HydrophobicContact CD-CD2 3.48Å; K105-F351 VanDerWaalsContact CD-CD2 3.48Å; K105-F351 HydrophobicContact CD-CE2 3.73Å; K105-F351 HydrophobicContact CD-CG 4.35Å; K105-F351 HydrophobicContact CG-CD2 3.51Å; K105-F351 HydrophobicContact CG-CE2 3.45Å; K105-F351 VanDerWaalsContact CG-CE2 3.45Å; K105-F351 HydrophobicContact CG-CG 4.18Å; K105-F351 HydrophobicContact CG-CZ 4.07Å; L115-F351 HydrophobicContact CB-CD1 4.21Å; L115-F351 HydrophobicContact CB-CE1 3.97Å; L115-F351 HydrophobicContact CD2-CD1 3.74Å; L115-F351 HydrophobicContact CD2-CE1 3.97Å; L115-F351 HydrophobicContact CD2-CG 4.17Å; L115-F351 HydrophobicContact CG-CD1 3.78Å; L115-F351 HydrophobicContact CG-CE1 4.04Å; L115-F351 WeakPolarHBondContact O-CE1 3.47Å; E117-F351 CarbonylContact C-O 3.52Å; E117-F351 WeakPolarHBondContact CA-O 3.36Å; E117-F351 VanDerWaalsContact CG-O 3.31Å; E117-F351 WeakPolarHBondContact CG-O 3.34Å; V118-F351 HydrophobicContact CG2-CB 4.24Å; V118-F351 PolarHBondContact N-O 3.06Å; Q349-F351 VanDerWaalsContact C-N 3.32Å; Q349-F351 HydrophobicContact CB-CD2 4.44Å; Q349-F351 HydrophobicContact CB-CE2 4.07Å; Q349-F351 VanDerWaalsContact O-CD2 3.26Å; Q349-F351 WeakPolarHBondContact O-CD2 3.28Å; Q349-F351 PolarHBondContact O-N 3.1Å; F351-T355 VanDerWaalsContact CA-OG1 3.23Å; F351-T355 WeakPolarHBondContact CA-OG1 3.37Å; F351-T355 PolarHBondContact N-OG1 2.91Å
352	N	95.6	Very high	94.3	Very high	60 Å²	60	35.9 Å²	35.9	32%	0.321	19%	0.185	S	C	.	.	S	Bend	trans	-99.5	173	168.6	73.1	11	0	0	0	111.4	S350 V354 T355 A356	S350-N352 VanDerWaalsContact C-N 3.3Å; S350-N352 PolarHBondContact OG-N 3.03Å; S350-N352 PolarHBondContact OG-ND2 3.41Å; S350-N352 PolarHBondContact OG-OD1 2.73Å; N352-V354 PolarHBondContact O-N 2.62Å; N352-V354 WeakPolarHBondContact OD1-CA 3.49Å; N352-V354 VanDerWaalsContact OD1-CB 3.3Å; N352-V354 WeakPolarHBondContact OD1-CB 3.47Å; N352-V354 PolarHBondContact OD1-N 2.73Å; N352-T355 PolarHBondContact N-OG1 3.42Å; N352-T355 PolarHBondContact O-N 3.47Å; N352-T355 PolarHBondContact O-OG1 3.35Å; N352-T355 PolarHBondContact OD1-N 3.41Å; N352-T355 VanDerWaalsContact OD1-N 3.1Å; N352-A356 PolarHBondContact O-N 2.65Å
353	N	94.3	Very high	94	Very high	25 Å²	25	37.9 Å²	37.9	13%	0.134	20%	0.196	C	C	.	.	H	α-helix	trans	-49.1	-33.2	177.2	169.4	90.9	0	0	0	114.9	K52 E117 Y337 A356 I357	K52-N353 WeakPolarHBondContact CG-OD1 3.26Å; E117-N353 VanDerWaalsContact CD-CA 3.46Å; E117-N353 WeakPolarHBondContact OE1-CA 3.32Å; E117-N353 WeakPolarHBondContact OE1-CB 3.35Å; E117-N353 PolarHBondContact OE1-N 2.85Å; E117-N353 WeakPolarHBondContact OE2-CA 3.36Å; Y337-N353 PolarHBondContact OH-ND2 3.34Å; Y337-N353 VanDerWaalsContact OH-ND2 3.08Å; N353-A356 PolarHBondContact O-N 3.23Å; N353-I357 WeakPolarHBondContact O-CD1 3.44Å; N353-I357 VanDerWaalsContact O-CG1 3.31Å; N353-I357 WeakPolarHBondContact O-CG1 3.43Å; N353-I357 PolarHBondContact O-N 2.97Å
354	V	96	Very high	93.6	Very high	24 Å²	24	38.2 Å²	38.2	15%	0.145	21%	0.208	C	C	.	.	H	α-helix	trans	-66	-50.4	177.6	-171.3	0	0	0	0	109.9	M332 Y337 V342 A345 N352 A356 I357 Y358	M332-V354 HydrophobicContact CE-CG1 3.69Å; M332-V354 VanDerWaalsContact CE-O 3.3Å; M332-V354 WeakPolarHBondContact CE-O 3.15Å; Y337-V354 HydrophobicContact CD1-CG1 4.21Å; Y337-V354 HydrophobicContact CD1-CG2 4.01Å; Y337-V354 HydrophobicContact CE1-CG2 3.91Å; V342-V354 HydrophobicContact CB-CG1 4.24Å; V342-V354 HydrophobicContact CG1-CG1 4.41Å; V342-V354 HydrophobicContact CG2-CG1 3.76Å; A345-V354 HydrophobicContact CB-CB 4.33Å; A345-V354 HydrophobicContact CB-CG1 4.38Å; N352-V354 PolarHBondContact O-N 2.62Å; N352-V354 WeakPolarHBondContact OD1-CA 3.49Å; N352-V354 VanDerWaalsContact OD1-CB 3.3Å; N352-V354 WeakPolarHBondContact OD1-CB 3.47Å; N352-V354 PolarHBondContact OD1-N 2.73Å; V354-A356 VanDerWaalsContact C-N 3.31Å; V354-A356 PolarHBondContact O-N 3.15Å; V354-I357 PolarHBondContact O-N 3.43Å; V354-Y358 PolarHBondContact O-N 3.41Å
355	T	95.5	Very high	93.2	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-64.5	-35.2	174.5	58.5	0	0	0	0	112.5	A345 L346 S350 F351 N352 Y358 L359	A345-T355 VanDerWaalsContact C-CG2 3.43Å; A345-T355 HydrophobicContact CB-CG2 3.86Å; A345-T355 WeakPolarHBondContact O-CG2 3.38Å; L346-T355 HydrophobicContact CD2-CG2 3.97Å; L346-T355 HydrophobicContact CG-CG2 4.25Å; S350-T355 WeakPolarHBondContact OG-CG2 3.42Å; F351-T355 VanDerWaalsContact CA-OG1 3.23Å; F351-T355 WeakPolarHBondContact CA-OG1 3.37Å; F351-T355 PolarHBondContact N-OG1 2.91Å; N352-T355 PolarHBondContact N-OG1 3.42Å; N352-T355 PolarHBondContact O-N 3.47Å; N352-T355 PolarHBondContact O-OG1 3.35Å; N352-T355 PolarHBondContact OD1-N 3.41Å; N352-T355 VanDerWaalsContact OD1-N 3.1Å; T355-Y358 PolarHBondContact O-N 2.81Å; T355-L359 WeakPolarHBondContact O-CB 3.21Å; T355-L359 VanDerWaalsContact O-CG 3.26Å; T355-L359 WeakPolarHBondContact O-CG 3.44Å; T355-L359 PolarHBondContact O-N 2.82Å
356	A	96.3	Very high	92.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.1	-41.8	177.9	0	0	0	0	0	112	Y53 E117 N352 N353 V354 L359 L360	Y53-A356 WeakPolarHBondContact OH-CB 3.32Å; E117-A356 HydrophobicContact CB-CB 4.01Å; E117-A356 HydrophobicContact CG-CB 4.47Å; N352-A356 PolarHBondContact O-N 2.65Å; N353-A356 PolarHBondContact O-N 3.23Å; V354-A356 VanDerWaalsContact C-N 3.31Å; V354-A356 PolarHBondContact O-N 3.15Å; A356-L359 PolarHBondContact O-N 3.3Å; A356-L360 WeakPolarHBondContact O-CB 3.21Å; A356-L360 WeakPolarHBondContact O-CG 3.43Å; A356-L360 PolarHBondContact O-N 3.38Å
357	I	95.7	Very high	92.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.3	-53.1	172.8	-71.3	161.4	0	0	0	110.4	T75 M332 M335 Y337 N353 V354 L359 L360 L361	T75-I357 HydrophobicContact CG2-CG2 4.32Å; M332-I357 HydrophobicContact CE-CB 3.98Å; M332-I357 HydrophobicContact CE-CG2 3.82Å; M332-I357 HydrophobicContact CG-CG2 3.69Å; M332-I357 HydrophobicContact SD-CB 4.42Å; M332-I357 HydrophobicContact SD-CG2 3.84Å; M335-I357 HydrophobicContact SD-CG2 3.97Å; Y337-I357 HydrophobicContact CE2-CD1 3.58Å; Y337-I357 WeakPolarHBondContact OH-CD1 3.33Å; N353-I357 WeakPolarHBondContact O-CD1 3.44Å; N353-I357 VanDerWaalsContact O-CG1 3.31Å; N353-I357 WeakPolarHBondContact O-CG1 3.43Å; N353-I357 PolarHBondContact O-N 2.97Å; V354-I357 PolarHBondContact O-N 3.43Å; I357-L359 VanDerWaalsContact C-N 3.25Å; I357-L359 PolarHBondContact O-N 2.69Å; I357-L360 PolarHBondContact O-N 2.9Å; I357-L360 VanDerWaalsContact O-N 3.13Å; I357-L361 HydrophobicContact CG2-CD1 3.7Å; I357-L361 HydrophobicContact CG2-CG 4.26Å; I357-L361 VanDerWaalsContact O-CG 3.28Å; I357-L361 WeakPolarHBondContact O-CG 3.45Å; I357-L361 PolarHBondContact O-N 2.96Å
358	Y	95.7	Very high	92.1	Very high	3 Å²	3	41.5 Å²	41.5	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-58.2	-36.4	-178.5	-172.9	-94.5	0	0	0	113.1	D322 Y323 N324 D325 R328 L329 M332 V342 L346 V354 T355	D322-Y358 WeakPolarHBondContact O-CE1 3.43Å; D322-Y358 PolarHBondContact O-OH 3.43Å; Y323-Y358 WeakPolarHBondContact CA-OH 3.39Å; N324-Y358 PolarHBondContact N-OH 3.48Å; D325-Y358 WeakPolarHBondContact CB-OH 3.47Å; D325-Y358 PolarHBondContact N-OH 3.23Å; R328-Y358 HydrophobicContact CB-CD2 3.85Å; R328-Y358 HydrophobicContact CB-CE2 3.64Å; R328-Y358 WeakPolarHBondContact CD-O 3.5Å; R328-Y358 HydrophobicContact CG-CE2 4.46Å; R328-Y358 PolarHBondContact NH1-O 3.33Å; L329-Y358 HydrophobicContact CD2-CD2 4.48Å; L329-Y358 HydrophobicContact CD2-CE2 4.17Å; L329-Y358 HydrophobicContact CG-CE2 4.4Å; M332-Y358 HydrophobicContact SD-CD2 3.87Å; M332-Y358 HydrophobicContact SD-CG 4.3Å; V342-Y358 HydrophobicContact CG1-CD2 4.06Å; L346-Y358 HydrophobicContact CD1-CD1 3.62Å; L346-Y358 HydrophobicContact CD1-CD2 3.99Å; L346-Y358 HydrophobicContact CD1-CE1 3.77Å; L346-Y358 HydrophobicContact CD1-CE2 4.14Å; L346-Y358 HydrophobicContact CD1-CG 3.73Å; L346-Y358 HydrophobicContact CD2-CD1 3.61Å; L346-Y358 HydrophobicContact CD2-CE1 4.25Å; L346-Y358 HydrophobicContact CD2-CG 4.09Å; L346-Y358 HydrophobicContact CG-CD1 4.27Å; L346-Y358 HydrophobicContact CG-CG 4.46Å; V354-Y358 PolarHBondContact O-N 3.41Å; T355-Y358 PolarHBondContact O-N 2.81Å
359	L	94.7	Very high	91.7	Very high	27 Å²	27	41.1 Å²	41.1	14%	0.141	23%	0.226	C	C	.	.	H	α-helix	trans	-76.3	-36.9	176.7	-67.7	174.8	0	0	0	112.9	Y116 T355 A356 I357 L361 A362	Y116-L359 HydrophobicContact CD1-CB 3.71Å; Y116-L359 HydrophobicContact CD1-CD1 4.18Å; Y116-L359 HydrophobicContact CE1-CB 4.03Å; T355-L359 WeakPolarHBondContact O-CB 3.21Å; T355-L359 VanDerWaalsContact O-CG 3.26Å; T355-L359 WeakPolarHBondContact O-CG 3.44Å; T355-L359 PolarHBondContact O-N 2.82Å; A356-L359 PolarHBondContact O-N 3.3Å; I357-L359 VanDerWaalsContact C-N 3.25Å; I357-L359 PolarHBondContact O-N 2.69Å; L359-L361 VanDerWaalsContact C-N 3.33Å; L359-A362 WeakPolarHBondContact O-CB 3.45Å; L359-A362 PolarHBondContact O-N 3.33Å
360	L	95	Very high	91.5	Very high	5 Å²	5	38 Å²	38	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-71.8	-27.4	177	-71.7	169.8	0	0	0	112.7	H72 T75 R77 V79 Y116 A356 I357 A362 T366	H72-L360 HydrophobicContact CB-CD1 3.95Å; T75-L360 HydrophobicContact CG2-CB 4.49Å; R77-L360 HydrophobicContact CB-CD2 4.3Å; R77-L360 HydrophobicContact CG-CD2 4.03Å; V79-L360 HydrophobicContact CG1-CD1 4.41Å; V79-L360 HydrophobicContact CG1-CD2 3.79Å; Y116-L360 HydrophobicContact CD1-CD2 4.46Å; Y116-L360 HydrophobicContact CD2-CD2 3.85Å; Y116-L360 HydrophobicContact CD2-CG 4.47Å; Y116-L360 HydrophobicContact CE1-CD2 4.26Å; Y116-L360 HydrophobicContact CE2-CD2 3.6Å; Y116-L360 HydrophobicContact CG-CD2 4.28Å; Y116-L360 HydrophobicContact CG-CG 4.46Å; A356-L360 WeakPolarHBondContact O-CB 3.21Å; A356-L360 WeakPolarHBondContact O-CG 3.43Å; A356-L360 PolarHBondContact O-N 3.38Å; I357-L360 PolarHBondContact O-N 2.9Å; I357-L360 VanDerWaalsContact O-N 3.13Å; L360-A362 PolarHBondContact O-N 2.95Å; L360-T366 WeakPolarHBondContact O-CB 3.26Å; L360-T366 WeakPolarHBondContact O-CG2 3.32Å; L360-T366 PolarHBondContact O-OG1 3.35Å
361	L	94.7	Very high	91.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	3.3	170.5	-64.8	171.6	0	0	0	113.5	T75 R328 I331 M332 I357 L359 T366 R367 L370	T75-L361 HydrophobicContact CG2-CD2 4.2Å; T75-L361 HydrophobicContact CG2-CG 4.37Å; R328-L361 HydrophobicContact CG-CB 3.73Å; I331-L361 HydrophobicContact CB-CD1 4.22Å; I331-L361 HydrophobicContact CG2-CD1 3.7Å; I331-L361 HydrophobicContact CG2-CD2 3.93Å; M332-L361 HydrophobicContact CG-CD1 3.83Å; M332-L361 HydrophobicContact SD-CD1 4.45Å; I357-L361 HydrophobicContact CG2-CD1 3.7Å; I357-L361 HydrophobicContact CG2-CG 4.26Å; I357-L361 VanDerWaalsContact O-CG 3.28Å; I357-L361 WeakPolarHBondContact O-CG 3.45Å; I357-L361 PolarHBondContact O-N 2.96Å; L359-L361 VanDerWaalsContact C-N 3.33Å; L361-T366 HydrophobicContact CD2-CG2 4.44Å; L361-R367 PolarHBondContact O-NE 2.87Å; L361-R367 PolarHBondContact O-NH2 2.86Å; L361-L370 HydrophobicContact CD2-CD1 4.49Å; L361-L370 HydrophobicContact CD2-CD2 3.87Å
362	A	91.5	Very high	90.2	Very high	50 Å²	50	41 Å²	41	41%	0.413	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-28.1	175.5	0	0	0	0	0	113.4	L359 L360 P364	L359-A362 WeakPolarHBondContact O-CB 3.45Å; L359-A362 PolarHBondContact O-N 3.33Å; L360-A362 PolarHBondContact O-N 2.95Å; A362-P364 WeakPolarHBondContact O-CD 3.28Å
363	D	87.1	Confident	89.1	Confident	41 Å²	41	41.5 Å²	41.5	22%	0.219	26%	0.259	C	S	.	.	S	Bend	trans	-83.9	119.8	172.4	-177.5	-16.4	0	0	0	109.5	R77 K365 T366	R77-D363 IonicContact CZ-OD2 3.82Å; R77-D363 VanDerWaalsContact CZ-OD2 3.22Å; R77-D363 VanDerWaalsContact NH1-CG 3.35Å; R77-D363 IonicContact NH1-OD2 2.65Å; R77-D363 PolarHBondContact NH1-OD2 3.13Å; R77-D363 IonicContact NH2-OD2 2.62Å; R77-D363 PolarHBondContact NH2-OD2 2.88Å; D363-K365 PolarHBondContact O-N 3.14Å; D363-K365 VanDerWaalsContact O-N 3.13Å; D363-K365 VanDerWaalsContact OD1-CB 3.28Å; D363-K365 WeakPolarHBondContact OD1-CB 3.15Å; D363-K365 WeakPolarHBondContact OD1-CG 3.46Å; D363-K365 PolarHBondContact OD1-N 3.4Å; D363-T366 VanDerWaalsContact O-CB 3.32Å; D363-T366 WeakPolarHBondContact O-CB 3.34Å; D363-T366 PolarHBondContact O-N 3.06Å
364	P	86.5	Confident	88	Confident	83 Å²	83	41.1 Å²	41.1	54%	0.539	26%	0.258	S	S	.	.	H	α-helix	trans	-55.4	-29.1	177.5	-26.8	35.9	0	0	0	113.8	A362 T366 R367 L368	A362-P364 WeakPolarHBondContact O-CD 3.28Å; P364-T366 VanDerWaalsContact C-N 3.28Å; P364-T366 PolarHBondContact O-N 2.85Å; P364-R367 WeakPolarHBondContact O-CB 3.45Å; P364-R367 PolarHBondContact O-N 2.85Å; P364-L368 WeakPolarHBondContact O-CG 3.44Å; P364-L368 PolarHBondContact O-N 3.07Å; P364-L368 VanDerWaalsContact O-N 3.07Å
365	K	85.4	Confident	86.8	Confident	103 Å²	103	43.3 Å²	43.3	45%	0.448	27%	0.269	S	S	.	.	H	α-helix	trans	-60.2	-40	173.8	-61.3	174.1	-173	170.4	0	111.5	Y186 D363 R367 L368 T369	Y186-K365 PolarHBondContact OH-NZ 3.22Å; D363-K365 PolarHBondContact O-N 3.14Å; D363-K365 VanDerWaalsContact O-N 3.13Å; D363-K365 VanDerWaalsContact OD1-CB 3.28Å; D363-K365 WeakPolarHBondContact OD1-CB 3.15Å; D363-K365 WeakPolarHBondContact OD1-CG 3.46Å; D363-K365 PolarHBondContact OD1-N 3.4Å; K365-R367 VanDerWaalsContact C-N 3.3Å; K365-R367 PolarHBondContact O-N 2.96Å; K365-L368 PolarHBondContact O-N 2.96Å; K365-T369 WeakPolarHBondContact O-CG2 3.45Å; K365-T369 PolarHBondContact O-N 3.49Å; K365-T369 PolarHBondContact O-OG1 3.41Å; K365-T369 VanDerWaalsContact O-OG1 3.09Å
366	T	86.5	Confident	85.1	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-38.6	177.7	-52.5	0	0	0	0	110.9	R77 L360 L361 D363 P364 T369 L370	R77-T366 HydrophobicContact CB-CG2 4.22Å; R77-T366 PolarHBondContact NH1-OG1 3.38Å; L360-T366 WeakPolarHBondContact O-CB 3.26Å; L360-T366 WeakPolarHBondContact O-CG2 3.32Å; L360-T366 PolarHBondContact O-OG1 3.35Å; L361-T366 HydrophobicContact CD2-CG2 4.44Å; D363-T366 VanDerWaalsContact O-CB 3.32Å; D363-T366 WeakPolarHBondContact O-CB 3.34Å; D363-T366 PolarHBondContact O-N 3.06Å; P364-T366 VanDerWaalsContact C-N 3.28Å; P364-T366 PolarHBondContact O-N 2.85Å; T366-T369 PolarHBondContact O-N 2.84Å; T366-L370 WeakPolarHBondContact O-CD2 3.3Å; T366-L370 WeakPolarHBondContact O-CG 3.27Å; T366-L370 PolarHBondContact O-N 2.89Å
367	R	88.4	Confident	82.8	Confident	36 Å²	36	54.4 Å²	54.4	14%	0.136	33%	0.326	C	S	.	.	H	α-helix	trans	-62.6	-42	175.3	-50.6	-175.5	-168.7	-171.5	-7.9	111.3	D325 E327 I331 L361 P364 K365 L370	D325-R367 IonicContact OD1-CZ 3.48Å; D325-R367 IonicContact OD1-NH1 2.69Å; D325-R367 IonicContact OD1-NH2 3.93Å; D325-R367 IonicContact OD2-CZ 3.54Å; D325-R367 IonicContact OD2-NH1 2.8Å; D325-R367 IonicContact OD2-NH2 3.54Å; D325-R367 PolarHBondContact OD2-NH2 2.9Å; E327-R367 VanDerWaalsContact CD-CD 3.48Å; E327-R367 VanDerWaalsContact CD-NH1 3.26Å; E327-R367 WeakPolarHBondContact OE1-CD 3.45Å; E327-R367 IonicContact OE1-NH1 2.63Å; E327-R367 IonicContact OE2-CZ 2.75Å; E327-R367 IonicContact OE2-NH1 3.98Å; E327-R367 PolarHBondContact OE2-NH1 3.05Å; I331-R367 HydrophobicContact CD1-CB 4.02Å; I331-R367 HydrophobicContact CD1-CG 4.02Å; L361-R367 PolarHBondContact O-NE 2.87Å; L361-R367 PolarHBondContact O-NH2 2.86Å; P364-R367 WeakPolarHBondContact O-CB 3.45Å; P364-R367 PolarHBondContact O-N 2.85Å; K365-R367 VanDerWaalsContact C-N 3.3Å; K365-R367 PolarHBondContact O-N 2.96Å; R367-L370 WeakPolarHBondContact O-CG 3.47Å
368	L	83.4	Confident	80.2	Confident	152 Å²	152	59.4 Å²	59.4	80%	0.796	36%	0.36	S	S	*	.	H	α-helix	trans	-74.3	-21.7	179.3	-66.2	170.6	0	0	0	114.5	P364 K365	P364-L368 WeakPolarHBondContact O-CG 3.44Å; P364-L368 PolarHBondContact O-N 3.07Å; P364-L368 VanDerWaalsContact O-N 3.07Å; K365-L368 PolarHBondContact O-N 2.96Å
369	T	84.2	Confident	77.1	Confident	98 Å²	98	66.2 Å²	66.2	60%	0.601	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	31.8	-176.8	70.3	0	0	0	0	113.6	K365 T366	K365-T369 WeakPolarHBondContact O-CG2 3.45Å; K365-T369 PolarHBondContact O-N 3.49Å; K365-T369 PolarHBondContact O-OG1 3.41Å; K365-T369 VanDerWaalsContact O-OG1 3.09Å; T366-T369 PolarHBondContact O-N 2.84Å
370	L	87.3	Confident	74.4	Confident	28 Å²	28	73.3 Å²	73.3	15%	0.147	43%	0.43	C	S	.	.			trans	-62.2	135.2	177.1	-69	176.4	0	0	0	111.4	T75 I331 M335 L361 T366 R367 A372 L375	T75-L370 HydrophobicContact CG2-CD2 4.31Å; I331-L370 HydrophobicContact CD1-CD1 4.49Å; I331-L370 HydrophobicContact CG2-CD1 3.68Å; M335-L370 HydrophobicContact CE-CD1 3.96Å; M335-L370 HydrophobicContact CE-CD2 3.81Å; M335-L370 HydrophobicContact CE-CG 4.46Å; L361-L370 HydrophobicContact CD2-CD1 4.49Å; L361-L370 HydrophobicContact CD2-CD2 3.87Å; T366-L370 WeakPolarHBondContact O-CD2 3.3Å; T366-L370 WeakPolarHBondContact O-CG 3.27Å; T366-L370 PolarHBondContact O-N 2.89Å; R367-L370 WeakPolarHBondContact O-CG 3.47Å; L370-A372 PolarHBondContact O-N 3.08Å; L370-L375 HydrophobicContact CD1-CD2 3.94Å
371	P	84.1	Confident	71.4	Confident	44 Å²	44	78 Å²	78	29%	0.286	46%	0.462	S	S	.	.			trans	-59.8	132.3	174.9	-23.7	34.5	0	0	0	110.6	G373 S374	P371-G373 PolarHBondContact O-N 3.13Å; P371-G373 VanDerWaalsContact O-N 3.07Å; P371-S374 VanDerWaalsContact O-CB 3.31Å; P371-S374 WeakPolarHBondContact O-CB 3.4Å; P371-S374 PolarHBondContact O-N 3.41Å; P371-S374 PolarHBondContact O-OG 3.36Å
372	A	76	Confident	68.4	Low	77 Å²	77	85.3 Å²	85.3	64%	0.636	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-53.6	-37.2	-174.8	0	0	0	0	0	113.5	L370 S374 L375 F376	L370-A372 PolarHBondContact O-N 3.08Å; A372-S374 PolarHBondContact O-N 3.26Å; A372-L375 PolarHBondContact O-N 2.84Å; A372-F376 VanDerWaalsContact O-CD2 3.23Å; A372-F376 WeakPolarHBondContact O-CD2 3.49Å; A372-F376 WeakPolarHBondContact O-CE2 3.31Å
373	G	72.5	Confident	65.4	Low	70 Å²	70	88.1 Å²	88.1	72%	0.722	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-72.5	2.4	176	0	0	0	0	0	116.1	P371	P371-G373 PolarHBondContact O-N 3.13Å; P371-G373 VanDerWaalsContact O-N 3.07Å
374	S	71.8	Confident	62.8	Low	17 Å²	17	93.3 Å²	93.3	12%	0.119	54%	0.54	C	S	.	.	G	3₁₀ helix	trans	-92.6	-23.1	175.3	68.1	0	0	0	0	113.6	S74 M335 P371 A372	S74-S374 WeakPolarHBondContact O-CB 3.35Å; S74-S374 PolarHBondContact O-OG 3Å; M335-S374 WeakPolarHBondContact CG-O 3.44Å; P371-S374 VanDerWaalsContact O-CB 3.31Å; P371-S374 WeakPolarHBondContact O-CB 3.4Å; P371-S374 PolarHBondContact O-N 3.41Å; P371-S374 PolarHBondContact O-OG 3.36Å; A372-S374 PolarHBondContact O-N 3.26Å
375	L	70.6	Confident	60.2	Low	69 Å²	69	97.5 Å²	97.5	36%	0.361	55%	0.552	S	S	.	*	S	Bend	trans	-93.4	-1	-177.4	-64.2	175.5	0	0	0	113.4	I334 L370 A372	I334-L375 HydrophobicContact CG2-CB 4.1Å; I334-L375 HydrophobicContact CG2-CD2 3.86Å; I334-L375 VanDerWaalsContact CG2-O 3.3Å; I334-L375 WeakPolarHBondContact CG2-O 3.49Å; L370-L375 HydrophobicContact CD1-CD2 3.94Å; A372-L375 PolarHBondContact O-N 2.84Å
376	F	59.4	Low	57.7	Low	152 Å²	152	95.9 Å²	95.9	67%	0.667	57%	0.565	S	S	*	*	S	Bend	trans	-98.7	123	168.1	-63.1	-76.4	0	0	0	108.4	A372 S378	A372-F376 VanDerWaalsContact O-CD2 3.23Å; A372-F376 WeakPolarHBondContact O-CD2 3.49Å; A372-F376 WeakPolarHBondContact O-CE2 3.31Å; F376-S378 PolarHBondContact O-N 3.44Å
377	P	48.3	Very low	55	Low	87 Å²	87	103.7 Å²	103.7	57%	0.565	61%	0.607	S	S	*	*			trans	-56.3	112.5	164.4	-21.4	32.6	0	0	0	108	N379	P377-N379 PolarHBondContact O-N 3.4Å
378	S	41	Very low	52.4	Low	104 Å²	104	109.4 Å²	109.4	73%	0.727	64%	0.638	S	S	*	*			trans	-63.4	109.6	170.2	56.4	0	0	0	0	106.8	F376 Q380	F376-S378 PolarHBondContact O-N 3.44Å; S378-Q380 PolarHBondContact O-N 2.92Å
379	N	31.9	Very low	49.9	Very low	146 Å²	146	105.4 Å²	105.4	78%	0.781	63%	0.634	S	S	*	*			trans	-47.2	105.7	-179.8	-84.4	-6.5	0	0	0	109.5	P377 S381	P377-N379 PolarHBondContact O-N 3.4Å; N379-S381 PolarHBondContact O-N 3.29Å
380	Q	37.7	Very low	47.5	Very low	177 Å²	177	108.8 Å²	108.8	83%	0.827	65%	0.647	S	S	*	*			trans	-73	83.4	161.7	-70.7	-168.6	32.6	0	0	105.5	S378 Q382	S378-Q380 PolarHBondContact O-N 2.92Å; Q380-Q382 PolarHBondContact O-N 2.98Å
381	S	30.8	Very low	45	Very low	102 Å²	102	115.2 Å²	115.2	71%	0.713	68%	0.682	S	S	*	*			trans	-59.5	90.3	167.4	-60.2	0	0	0	0	107.4	N379 S383	N379-S381 PolarHBondContact O-N 3.29Å; S381-S383 VanDerWaalsContact C-N 3.25Å; S381-S383 PolarHBondContact O-N 3.44Å
382	Q	32	Very low	42.8	Very low	155 Å²	155	121 Å²	121	72%	0.724	71%	0.705	S	S	*	*			trans	-59.6	98.6	161.7	-70.5	-175	-3.5	0	0	105.6	Q380 L384	Q380-Q382 PolarHBondContact O-N 2.98Å; Q382-L384 PolarHBondContact O-N 3.38Å
383	S	29.8	Very low	41	Very low	108 Å²	108	125.7 Å²	125.7	76%	0.755	71%	0.713	S	S	*	*			trans	-76.4	50.5	177.9	61.1	0	0	0	0	110.7	S381 H385	S381-S383 VanDerWaalsContact C-N 3.25Å; S381-S383 PolarHBondContact O-N 3.44Å; S383-H385 PolarHBondContact O-N 3.18Å
384	L	30.5	Very low	39.2	Very low	150 Å²	150	130 Å²	130	79%	0.785	71%	0.714	S	S	*	*			trans	-72.6	54.8	156.2	-73.5	170	0	0	0	108.8	Q382 G386	Q382-L384 PolarHBondContact O-N 3.38Å; L384-G386 PolarHBondContact O-N 2.94Å
385	H	33	Very low	37.5	Very low	171 Å²	171	135.6 Å²	135.6	79%	0.792	74%	0.738	S	S	*	*			trans	-84.2	92.3	162.8	-89.3	44.2	0	0	0	107.2	S383 N387	S383-H385 PolarHBondContact O-N 3.18Å; H385-N387 PolarHBondContact O-N 2.88Å; H385-N387 VanDerWaalsContact O-N 3.16Å
386	G	31.9	Very low	35.7	Very low	70 Å²	70	140.7 Å²	140.7	72%	0.722	76%	0.76	S	S	*	*			trans	-58.1	116.1	167.3	0	0	0	0	0	108.7	L384 I388	L384-G386 PolarHBondContact O-N 2.94Å; G386-I388 PolarHBondContact O-N 2.82Å
387	N	30.8	Very low	34.5	Very low	164 Å²	164	138.3 Å²	138.3	88%	0.877	76%	0.763	S	S	*	*			trans	-81.3	68.9	-170.9	-167.8	41.4	0	0	0	111.5	H385	H385-N387 PolarHBondContact O-N 2.88Å; H385-N387 VanDerWaalsContact O-N 3.16Å
388	I	33.4	Very low	33.8	Very low	156 Å²	156	139.8 Å²	139.8	80%	0.8	78%	0.775	S	S	*	*			trans	-122.2	83.4	172.5	-54.9	-178.1	0	0	0	108	G386	G386-I388 PolarHBondContact O-N 2.82Å
389	G	31.9	Very low	33.6	Very low	68 Å²	68	137.9 Å²	137.9	70%	0.701	77%	0.772	S	S	*	*			trans	-70	127.3	164.3	0	0	0	0	0	109.7
390	L	32.3	Very low	33.7	Very low	170 Å²	170	136.4 Å²	136.4	89%	0.89	77%	0.773	S	S	*	*			trans	-62	135.5	174.6	-73.2	158.7	0	0	0	110.8
391	N	36	Very low	33.7	Very low	162 Å²	162	136.8 Å²	136.8	87%	0.866	78%	0.775	S	S	*	*			trans	-138	136.6	159.4	-115.1	-15.4	0	0	0	108.9
392	H	37.7	Very low	34	Very low	166 Å²	166	135.5 Å²	135.5	77%	0.769	78%	0.777	S	S	*	*			trans	-63.2	143.1	168.2	-72.1	-9.1	0	0	0	109.1
393	H	38.1	Very low	34.2	Very low	176 Å²	176	134.6 Å²	134.6	82%	0.815	78%	0.782	S	S	*	*				-165	131.9	73.8	-93.6	-85.7	0	0	0	113.9
394	H	34.5	Very low	34.4	Very low	161 Å²	161	134.7 Å²	134.7	75%	0.745	78%	0.778	S	S	*	*			trans	42.5	151.3	130.4	-119.1	33.7	0	0	0	124.7
395	H	35.3	Very low	34.5	Very low	134 Å²	134	133.1 Å²	133.1	62%	0.62	77%	0.774	S	S	*	*			trans	69.3	111.9	178.5	-62.3	-76.8	0	0	0	115.7
396	Q	32.7	Very low	34.6	Very low	175 Å²	175	132.1 Å²	132.1	82%	0.818	78%	0.775	S	S	*	*				63	119.4	79.4	-65.9	170.7	-7.8	0	0	110.8
397	S	35.3	Very low	34.7	Very low	103 Å²	103	132.8 Å²	132.8	72%	0.72	77%	0.773	S	S	*	*			cis	-159.4	127.4	46.9	151.1	0	0	0	0	108.8
398	S	34.3	Very low	34.7	Very low	118 Å²	118	130 Å²	130	83%	0.825	77%	0.767	S	S	*	*				79	145.2	86.6	99.6	0	0	0	0	116.1
399	G	35.6	Very low	34.6	Very low	64 Å²	64	127.6 Å²	127.6	66%	0.66	76%	0.764	S	S	*	*			trans	103.8	103.7	-167.4	0	0	0	0	0	111.1
400	S	35	Very low	34.6	Very low	115 Å²	115	131.4 Å²	131.4	80%	0.804	77%	0.774	S	S	*	*				70.8	131.3	59.5	81.8	0	0	0	0	112.4
401	E	37.5	Very low	34.7	Very low	185 Å²	185	129 Å²	129	86%	0.864	77%	0.768	S	S	*	*			cis	-132.2	160.9	12.8	-62.9	171.1	133.4	0	0	110.8
402	G	35.8	Very low	34.4	Very low	74 Å²	74	125.5 Å²	125.5	76%	0.763	76%	0.762	S	S	*	*				87.5	128	105.4	0	0	0	0	0	112.5
403	V	36	Very low	34.1	Very low	136 Å²	136	124.4 Å²	124.4	82%	0.824	77%	0.767	S	S	*	*			cis	-145.3	156	23	162.7	0	0	0	0	111.3
404	T	35.6	Very low	33.9	Very low	110 Å²	110	121.8 Å²	121.8	68%	0.675	76%	0.763	S	S	*	*			trans	-21.8	129.7	173.5	56.1	0	0	0	0	117.4
405	V	32.2	Very low	33.9	Very low	117 Å²	117	119.1 Å²	119.1	71%	0.709	76%	0.759	S	S	*	*				65.5	148.5	67.1	-48.9	0	0	0	0	116.6
406	D	34.1	Very low	33.9	Very low	151 Å²	151	120 Å²	120	81%	0.807	76%	0.763	S	S	*	*			trans	69.1	150.9	167.1	-61.5	-22.3	0	0	0	118.8
407	A	35.4	Very low	33.9	Very low	83 Å²	83	118.6 Å²	118.6	69%	0.686	76%	0.761	S	S	*	*			cis	-160	172.9	-25.4	0	0	0	0	0	110.5
408	S	30.2	Very low	33.9	Very low	106 Å²	106	120.5 Å²	120.5	74%	0.741	76%	0.758	S	S	*	*			trans	-30.3	136.2	173.6	51.5	0	0	0	0	119.3
409	S	30.3	Very low	33.9	Very low	105 Å²	105	119.6 Å²	119.6	73%	0.734	75%	0.748	S	S	*	*			trans	61.1	103.2	143.5	60.8	0	0	0	0	120.3
410	T	32.2	Very low	33.7	Very low	148 Å²	148	123.4 Å²	123.4	91%	0.908	75%	0.753	S	S	*	*			trans	-120.4	112.5	147.3	38.1	0	0	0	0	109.6
411	P	34.3	Very low	33.8	Very low	119 Å²	119	123 Å²	123	77%	0.773	75%	0.748	S	S	*	*			trans	-100.4	167.8	175.6	37.9	-33.1	0	0	0	112.7
412	A	30.5	Very low	33.6	Very low	89 Å²	89	119.4 Å²	119.4	74%	0.736	74%	0.743	S	S	*	*			trans	64.4	114.9	165.8	0	0	0	0	0	118.1
413	T	31.2	Very low	33.5	Very low	143 Å²	143	121 Å²	121	88%	0.877	74%	0.743	S	S	*	*			trans	-107.2	116.9	138.3	-49.3	0	0	0	0	106.4
414	V	34.4	Very low	33.2	Very low	121 Å²	121	124 Å²	124	73%	0.733	75%	0.745	S	S	*	*			trans	-122.3	130.1	168.8	171.7	0	0	0	0	106.6
415	T	34.2	Very low	33	Very low	106 Å²	106	124.8 Å²	124.8	65%	0.65	75%	0.749	S	S	*	*			trans	-129.9	140.2	157.2	53.8	0	0	0	0	107
416	E	35.2	Very low	33.1	Very low	153 Å²	153	127.8 Å²	127.8	72%	0.715	76%	0.755	S	S	*	*			cis	-157.1	165.3	-12.9	-121.9	145	-166.6	0	0	108.2
417	D	32.6	Very low	32.7	Very low	144 Å²	144	124.9 Å²	124.9	77%	0.77	75%	0.747	S	S	*	*			trans	63.4	144.9	153.1	-69.3	9.6	0	0	0	121.3
418	E	34.7	Very low	32.2	Very low	143 Å²	143	125.3 Å²	125.3	67%	0.668	75%	0.745	S	S	*	*			cis	-161.3	147.7	-14.9	-123.4	-76.7	69.6	0	0	109.8
419	T	34.2	Very low	32.4	Very low	100 Å²	100	128.4 Å²	128.4	61%	0.613	75%	0.752	S	S	*	*			trans	59.6	161.8	166.1	76.3	0	0	0	0	119
420	N	33.1	Very low	32.3	Very low	143 Å²	143	129.6 Å²	129.6	77%	0.765	75%	0.75	S	S	*	*			cis	-146.1	139.9	-3	-133.1	-37.1	0	0	0	110.1
421	P	35.4	Very low	32.2	Very low	106 Å²	106	129.1 Å²	129.1	69%	0.688	74%	0.742	S	S	*	*			trans	-109.2	168.8	-174.8	40.2	-33.8	0	0	0	114.3
422	S	33.2	Very low	32.1	Very low	110 Å²	110	128.4 Å²	128.4	77%	0.769	74%	0.74	S	S	*	*			trans	164	157.4	131.1	-79.8	0	0	0	0	115.9
423	S	34.1	Very low	32.2	Very low	108 Å²	108	131.7 Å²	131.7	76%	0.755	75%	0.746	S	S	*	*			trans	59.7	137	165	73	0	0	0	0	119.2
424	K	29.8	Very low	32.3	Very low	199 Å²	199	128 Å²	128	87%	0.865	74%	0.735	S	S	*	*			cis	88.9	62.6	6.3	-152.3	-170.5	-179.7	-176.4	0	118.1
425	V	31.9	Very low	32.3	Very low	126 Å²	126	128.9 Å²	128.9	76%	0.764	74%	0.736	S	S	*	*			trans	-141.5	129.5	156.5	-167.1	0	0	0	0	105.1
426	Q	33.4	Very low	32.6	Very low	180 Å²	180	129.5 Å²	129.5	84%	0.841	74%	0.736	S	S	*	*			cis	85.1	159.8	38.5	-154.9	165.1	-19.2	0	0	113.3
427	S	26.5	Very low	32.7	Very low	91 Å²	91	127.9 Å²	127.9	64%	0.636	73%	0.732	S	S	*	*	S	Bend	trans	-63.9	161.5	-159.6	51.4	0	0	0	0	117.6
428	S	25.2	Very low	32.9	Very low	92 Å²	92	126.1 Å²	126.1	64%	0.643	72%	0.722	S	S	*	*			trans	58.6	103.5	145.3	58.3	0	0	0	0	119.3
429	L	33.3	Very low	32.7	Very low	170 Å²	170	127.1 Å²	127.1	89%	0.89	72%	0.724	S	S	*	*			trans	-164.8	106.4	142.9	-96.6	144.5	0	0	0	105.5
430	D	30.1	Very low	32.6	Very low	130 Å²	130	128.7 Å²	128.7	70%	0.695	73%	0.725	S	S	*	*				81.4	118.1	59.7	-84.1	-44.9	0	0	0	116.5
431	N	28.4	Very low	32.4	Very low	138 Å²	138	129.4 Å²	129.4	74%	0.738	72%	0.721	S	S	*	*			trans	73.6	137.5	144.3	-74.6	-51.2	0	0	0	123.7
432	S	33	Very low	32.1	Very low	105 Å²	105	130.1 Å²	130.1	73%	0.734	72%	0.723	S	S	*	*			trans	77.8	137.2	145.1	-67.1	0	0	0	0	119
433	N	31.6	Very low	31.8	Very low	158 Å²	158	131.5 Å²	131.5	85%	0.845	72%	0.723	S	S	*	*			cis	-153.6	132	-0.9	-150.3	0.2	0	0	0	114.7
434	G	34	Very low	31.6	Very low	64 Å²	64	133.6 Å²	133.6	66%	0.66	72%	0.72	S	S	*	*			trans	72	158.3	150.8	0	0	0	0	0	119.8
435	N	34.8	Very low	31.3	Very low	140 Å²	140	131.6 Å²	131.6	75%	0.749	72%	0.719	S	S	*	*			cis	-160.3	164.5	-22.1	-153.8	0.2	0	0	0	111.4
436	N	39.5	Very low	31.2	Very low	120 Å²	120	129.6 Å²	129.6	64%	0.642	72%	0.724	S	S	*	*			trans	70	150.4	167.9	-53	-33.7	0	0	0	117.2
437	N	38.1	Very low	30.7	Very low	118 Å²	118	128.6 Å²	128.6	63%	0.631	72%	0.724	S	S	*	*			cis	-174.7	152	-28.4	-94.5	-25.6	0	0	0	105.1
438	N	36.1	Very low	30.6	Very low	107 Å²	107	129 Å²	129	57%	0.572	72%	0.722	S	S	*	*			cis	-153.4	147.5	-12.2	-116	-29.6	0	0	0	106
439	K	31.1	Very low	30.6	Very low	165 Å²	165	133.9 Å²	133.9	72%	0.717	73%	0.728	S	S	*	*				47.6	134	98	-65.2	-174.6	-172.3	159.3	0	114.4
440	Q	31.3	Very low	30.3	Very low	132 Å²	132	133 Å²	133	62%	0.617	72%	0.719	S	S	*	*			cis	-167.1	153.1	15.6	-128	175.2	13.6	0	0	115.6
441	K	29.5	Very low	30.2	Very low	158 Å²	158	131.6 Å²	131.6	69%	0.687	72%	0.719	S	S	*	*			trans	67.9	146	136.7	-90.1	168	-174.9	177.5	0	123.1
442	T	30	Very low	30.3	Very low	121 Å²	121	133.5 Å²	133.5	74%	0.742	72%	0.721	S	S	*	*			trans	57.9	119.3	147.3	50.8	0	0	0	0	119
443	N	25.9	Very low	30.3	Very low	140 Å²	140	136.3 Å²	136.3	75%	0.749	72%	0.72	S	S	*	*			cis	76.5	137.4	40.5	-162.5	19.9	0	0	0	113.9
444	Q	29	Very low	30.3	Very low	152 Å²	152	135.4 Å²	135.4	71%	0.71	71%	0.711	S	S	*	*			trans	77.9	126.2	176.9	-53.7	-174.1	2	0	0	118.3
445	N	25.3	Very low	30.1	Very low	157 Å²	157	137.6 Å²	137.6	84%	0.84	72%	0.716	S	S	*	*			trans	43.7	107.1	135.3	-50.4	-12.9	0	0	0	118.8
446	G	27.8	Very low	30	Very low	84 Å²	84	134.2 Å²	134.2	87%	0.866	71%	0.714	S	S	*	*			trans	-160.1	81.8	178.7	0	0	0	0	0	115.1
447	L	24.4	Very low	29.6	Very low	159 Å²	159	136.8 Å²	136.8	83%	0.832	72%	0.722	S	S	*	*			trans	-47.8	134.2	173.7	-75.8	154.6	0	0	0	116.6
448	T	23.8	Very low	29.2	Very low	98 Å²	98	137 Å²	137	60%	0.601	72%	0.723	S	S	*	*			trans	67.2	148.1	136.5	55.3	0	0	0	0	123.8
449	Y	24.9	Very low	29	Very low	196 Å²	196	137.1 Å²	137.1	77%	0.769	73%	0.733	S	S	*	*			trans	73	151.1	146.4	-67.9	-35.1	0	0	0	118.2
450	Q	27.9	Very low	29	Very low	150 Å²	150	134.8 Å²	134.8	70%	0.701	74%	0.737	S	S	*	*			cis	-157.1	146.1	1.7	-128.1	169.3	52.5	0	0	113.4
451	S	27.8	Very low	28.9	Very low	101 Å²	101	132 Å²	132	71%	0.706	74%	0.744	S	S	*	*			trans	66.1	164.1	147	-52.4	0	0	0	0	118.5
452	K	30.9	Very low	28.9	Very low	178 Å²	178	130.1 Å²	130.1	77%	0.774	75%	0.751	S	S	*	*			cis	-132.8	136	7.5	-81.1	-178.7	175.6	173.1	0	112.3
453	K	31.5	Very low	29	Very low	164 Å²	164	133.5 Å²	133.5	71%	0.713	76%	0.758	S	S	*	*				64.4	148.4	129.9	-65.3	175.8	156	-133	0	119.8
454	E	32.4	Very low	29.1	Very low	140 Å²	140	134.6 Å²	134.6	65%	0.654	76%	0.758	S	S	*	*			cis	-144.4	143.2	8.6	-142.3	123.6	-144.8	0	0	113.5
455	S	30.7	Very low	29	Very low	110 Å²	110	134 Å²	134	77%	0.769	76%	0.76	S	S	*	*			trans	2.2	145.6	159.5	53.7	0	0	0	0	123
456	G	32.2	Very low	29	Very low	68 Å²	68	130.1 Å²	130.1	70%	0.701	76%	0.758	S	S	*	*			cis	155.3	174.8	-6.9	0	0	0	0	0	116
457	Q	31.6	Very low	28.9	Very low	174 Å²	174	132 Å²	132	81%	0.813	75%	0.752	S	S	*	*			trans	69.4	144.4	158.4	-53.2	-165.9	-99.1	0	0	119.9
458	D	29.5	Very low	29	Very low	123 Å²	123	134.7 Å²	134.7	66%	0.658	75%	0.751	S	S	*	*			cis	-165.8	157.8	-19.9	-105.8	-27.9	0	0	0	112.9
459	S	31.5	Very low	29.1	Very low	110 Å²	110	141.9 Å²	141.9	77%	0.769	77%	0.767	S	S	*	*			trans	64.1	151.2	152.7	-68.6	0	0	0	0	121
460	S	30.9	Very low	29.2	Very low	115 Å²	115	139.6 Å²	139.6	80%	0.804	77%	0.767	S	S	*	*			cis	-169.4	157.8	-13.1	52.9	0	0	0	0	111.8
461	G	30.2	Very low	29.4	Very low	75 Å²	75	138.1 Å²	138.1	77%	0.773	77%	0.773	S	S	*	*			trans	85.3	106.7	166	0	0	0	0	0	115.3
462	S	29.2	Very low	29.4	Very low	118 Å²	118	136.6 Å²	136.6	83%	0.825	77%	0.773	S	S	*	*			cis	74.9	99.6	47.3	-164.6	0	0	0	0	115.4
463	Q	30.6	Very low	29.3	Very low	192 Å²	192	136 Å²	136	90%	0.897	78%	0.777	S	S	*	*				-171.1	165.1	120	-105	-176	6	0	0	115
464	H	29.2	Very low	29.1	Very low	162 Å²	162	133.1 Å²	133.1	75%	0.75	78%	0.777	S	S	*	*			trans	-57.1	153.5	-165.9	-93.4	-77.6	0	0	0	121.1
465	N	26.8	Very low	28.9	Very low	140 Å²	140	138.5 Å²	138.5	75%	0.749	79%	0.791	S	S	*	*			trans	45.9	96.5	135.6	-60.3	1.8	0	0	0	121.4
466	G	25.3	Very low	29	Very low	76 Å²	76	141.6 Å²	141.6	78%	0.784	80%	0.796	S	S	*	*				92.3	-163	117	0	0	0	0	0	119.4
467	V	26.1	Very low	29	Very low	124 Å²	124	144.3 Å²	144.3	75%	0.752	79%	0.788	S	S	*	*			trans	71.3	108	-179.6	-172.2	0	0	0	0	117.4
468	R	25.2	Very low	28.9	Very low	215 Å²	215	143.8 Å²	143.8	81%	0.811	79%	0.786	S	S	*	*			trans	30.1	128.6	135.9	-45.6	172.7	-161.7	-179.7	5.3	119.4	I470	R468-I470 HydrophobicContact CB-CG1 4.45Å; R468-I470 WeakPolarHBondContact O-CD1 3.49Å
469	R	26.5	Very low	29	Very low	249 Å²	249	143.5 Å²	143.5	94%	0.94	79%	0.793	S	S	*	*			trans	-120.6	101.2	146.2	-64	-177.3	-176	177	1.9	107.3
470	I	27.8	Very low	28.8	Very low	147 Å²	147	143 Å²	143	75%	0.754	80%	0.796	S	S	*	*				76.3	115.5	62.9	-60.7	168.5	0	0	0	112	R468	R468-I470 HydrophobicContact CB-CG1 4.45Å; R468-I470 WeakPolarHBondContact O-CD1 3.49Å
471	S	30.8	Very low	28.8	Very low	120 Å²	120	143.1 Å²	143.1	84%	0.839	80%	0.797	S	S	*	*			trans	-98.8	140.2	170.3	49.8	0	0	0	0	110.4
472	G	28	Very low	28.7	Very low	68 Å²	68	144.2 Å²	144.2	70%	0.701	80%	0.799	S	S	*	*			trans	-179.3	97.8	-179.9	0	0	0	0	0	118.4
473	I	29	Very low	28.8	Very low	167 Å²	167	142.2 Å²	142.2	86%	0.856	80%	0.796	S	S	*	*				56.5	115.8	123.6	-60.8	165.1	0	0	0	120.2
474	S	28.8	Very low	29.1	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	79%	0.788	S	S	*	*			trans	42.7	138.8	132.2	-156.9	0	0	0	0	122.8
475	W	28.3	Very low	29.1	Very low	253 Å²	253	136.8 Å²	136.8	96%	0.958	79%	0.79	S	S	*	*			trans	-132	124	164.5	27.1	-72.6	0	0	0	111.4
476	M	31.6	Very low	29.3	Very low	176 Å²	176	134.8 Å²	134.8	87%	0.867	79%	0.787	S	S	*	*			trans	-145.7	123.2	174.6	178.3	175.4	171.9	0	0	110.1
477	K	32.7	Very low	29.4	Very low	124 Å²	124	138.2 Å²	138.2	54%	0.539	79%	0.787	S	S	.	*			trans	-144	122.2	166.8	-86.6	-166	168.1	-178.5	0	107.6	N1182	K477-N1182 PolarHBondContact NZ-OD1 2.87Å
478	Q	28.3	Very low	29.4	Very low	163 Å²	163	141.7 Å²	141.7	76%	0.762	79%	0.787	S	S	*	*				80.8	98.9	68.5	-77.7	-177.4	-21.8	0	0	113.6
479	S	31.9	Very low	29.4	Very low	117 Å²	117	138 Å²	138	82%	0.818	78%	0.779	S	S	*	*			trans	-172.9	119.8	139.2	-88.6	0	0	0	0	105.2
480	A	28.7	Very low	29.5	Very low	100 Å²	100	133 Å²	133	83%	0.826	77%	0.766	S	S	*	*				68.8	129.3	72.2	0	0	0	0	0	112.2
481	S	28.9	Very low	29.4	Very low	118 Å²	118	133.3 Å²	133.3	83%	0.825	76%	0.762	S	S	*	*			cis	-133.9	172.7	4.7	68.7	0	0	0	0	113
482	A	29.4	Very low	29.1	Very low	98 Å²	98	134.4 Å²	134.4	81%	0.81	76%	0.758	S	S	*	*			trans	-79.2	167.7	162.7	0	0	0	0	0	111.3
483	G	30.8	Very low	29	Very low	75 Å²	75	135.9 Å²	135.9	77%	0.773	76%	0.758	S	S	*	*			trans	-166.6	112.2	172.3	0	0	0	0	0	111.3
484	P	37.4	Very low	29.1	Very low	111 Å²	111	133.5 Å²	133.5	72%	0.721	75%	0.751	S	S	*	*			trans	-105.4	167.1	-177.1	38.4	-33.3	0	0	0	114.4
485	T	29.8	Very low	29.2	Very low	130 Å²	130	135 Å²	135	80%	0.798	75%	0.75	S	S	*	*			trans	63.5	107.6	151.8	45.6	0	0	0	0	121.6
486	S	29.8	Very low	29.2	Very low	97 Å²	97	129.3 Å²	129.3	68%	0.678	74%	0.735	S	S	*	*				94.4	148.2	117.5	-154.1	0	0	0	0	121.1
487	N	26.8	Very low	29.1	Very low	148 Å²	148	128.4 Å²	128.4	79%	0.791	73%	0.726	S	S	*	*			trans	62.2	133.7	156.2	-76.9	-19.2	0	0	0	118.8
488	R	27	Very low	29.1	Very low	198 Å²	198	127.5 Å²	127.5	75%	0.747	74%	0.735	S	S	*	*			cis	175.3	125.9	14	167.5	-178.4	-169.3	-171.5	1.7	110.4
489	Q	25.2	Very low	29.2	Very low	138 Å²	138	131.4 Å²	131.4	65%	0.645	74%	0.743	S	S	*	*			trans	52.1	159.6	148.3	-55.5	176	-98	0	0	122.9
490	E	27.9	Very low	29.3	Very low	143 Å²	143	131.5 Å²	131.5	67%	0.668	74%	0.741	S	S	*	*			trans	70.3	141.6	160.5	-66.1	-167.4	-148.6	0	0	118
491	K	26.1	Very low	29.7	Very low	154 Å²	154	134.6 Å²	134.6	67%	0.67	74%	0.742	S	S	*	*			cis	-157.2	175.6	-13.2	-130.6	174.5	-163.5	146.3	0	111.6
492	L	25.2	Very low	29.9	Very low	142 Å²	142	134.3 Å²	134.3	74%	0.743	74%	0.738	S	S	*	*			trans	-11.8	147.4	143.5	-64.9	168.8	0	0	0	115.9
493	S	25.9	Very low	29.9	Very low	100 Å²	100	140.2 Å²	140.2	70%	0.699	74%	0.739	S	S	*	*			cis	-176.2	-161.2	11.7	34.8	0	0	0	0	111
494	V	29.8	Very low	29.8	Very low	117 Å²	117	143.1 Å²	143.1	71%	0.709	74%	0.736	S	S	*	*			trans	94.6	87.9	157	-167.9	0	0	0	0	117.8
495	D	30.8	Very low	29.3	Very low	132 Å²	132	148.3 Å²	148.3	71%	0.706	74%	0.741	S	S	*	*				83.3	110.7	119.6	-61	1.6	0	0	0	125.5
496	E	29.3	Very low	29.4	Very low	135 Å²	135	148.4 Å²	148.4	63%	0.631	74%	0.741	S	S	*	*				97.8	128.6	116.1	-74.1	-158	153.5	0	0	125.1
497	K	29.7	Very low	29.3	Very low	156 Å²	156	148.5 Å²	148.5	68%	0.678	74%	0.74	S	S	*	*			trans	43.6	125.4	138.9	-54	171.1	-177.7	145.2	0	118.5
498	S	32.9	Very low	29.3	Very low	106 Å²	106	147.3 Å²	147.3	74%	0.741	73%	0.734	S	S	*	*				-172.9	113.7	58.8	-69	0	0	0	0	116.3
499	R	29.6	Very low	29.3	Very low	244 Å²	244	143.3 Å²	143.3	92%	0.921	73%	0.727	S	S	*	*			trans	52.7	-163.9	139.5	-53.9	-170	165.7	-140.1	-1.2	118.2
500	P	34.2	Very low	29.6	Very low	119 Å²	119	147.5 Å²	147.5	77%	0.773	74%	0.737	S	S	*	*				-132.6	178.5	-101.8	42.5	-23.7	0	0	0	118.2
501	L	37.3	Very low	29.8	Very low	165 Å²	165	148.6 Å²	148.6	86%	0.864	74%	0.742	S	S	*	*			trans	-57.4	157.1	174	-53.5	167	0	0	0	114
502	P	32.1	Very low	29.9	Very low	112 Å²	112	153.4 Å²	153.4	73%	0.727	76%	0.756	S	S	*	*				-146.9	-159.6	95.8	40.9	-23.9	0	0	0	116.9	I699	P502-I699 HydrophobicContact CG-CD1 4.15Å
503	R	29.8	Very low	30.3	Very low	222 Å²	222	149.5 Å²	149.5	84%	0.838	75%	0.75	S	S	*	*			trans	-109.6	170	-158.2	-90	173.9	168.1	156.4	-4.3	114.7
504	I	28.6	Very low	30.5	Very low	137 Å²	137	151.6 Å²	151.6	70%	0.703	75%	0.753	S	S	*	*			trans	109.6	118.4	136.9	-87.5	151.2	0	0	0	121.4
505	R	26.8	Very low	30.7	Very low	220 Å²	220	152.1 Å²	152.1	83%	0.83	75%	0.752	S	S	*	*			trans	46.9	120.5	143.6	-61.7	-176	-176.6	-169.4	3.6	125.7
506	V	31.9	Very low	30.9	Very low	131 Å²	131	150.8 Å²	150.8	79%	0.794	75%	0.753	S	S	*	*				58.9	126.5	113.8	-177.5	0	0	0	0	122
507	C	28	Very low	31	Very low	99 Å²	99	150.7 Å²	150.7	67%	0.669	76%	0.757	S	S	*	*			trans	85.9	132.2	156.7	-87.9	0	0	0	0	120.6
508	D	27.3	Very low	31.3	Very low	123 Å²	123	149.4 Å²	149.4	66%	0.658	76%	0.757	S	S	*	*			trans	57.3	134.5	150.1	-44.7	-19.3	0	0	0	117.7
509	L	27.6	Very low	31.5	Very low	114 Å²	114	151 Å²	151	60%	0.597	76%	0.757	S	S	*	*			cis	-155.4	-153.7	45.5	-114	122	0	0	0	114.1	D694	L509-D694 WeakPolarHBondContact CB-OD1 3.36Å; L509-D694 WeakPolarHBondContact CD1-OD1 3.31Å; L509-D694 WeakPolarHBondContact CD2-OD1 3.44Å; L509-D694 WeakPolarHBondContact CG-OD1 3.1Å
510	R	29.9	Very low	31.7	Very low	226 Å²	226	145.9 Å²	145.9	85%	0.853	75%	0.748	S	S	*	*			trans	-124.7	130.3	-176	-77.4	167.2	147.1	-174.9	-5.2	112.4
511	E	32	Very low	31.7	Very low	167 Å²	167	144.7 Å²	144.7	78%	0.78	74%	0.742	S	S	*	*			trans	-140.4	143.1	149.4	-61.3	-166.6	118	0	0	107.4
512	R	30	Very low	31.4	Very low	255 Å²	255	142.9 Å²	142.9	96%	0.962	74%	0.743	S	S	*	*			cis	82.6	137.6	26.4	-88.4	-166.1	175.3	-152.8	-1	116.4
513	G	32.1	Very low	31.6	Very low	60 Å²	60	142 Å²	142	62%	0.619	75%	0.746	S	S	*	*			trans	109.1	113.9	-165	0	0	0	0	0	109.5
514	N	30.3	Very low	31.6	Very low	144 Å²	144	139 Å²	139	77%	0.77	74%	0.741	S	S	*	*				76.5	133.2	59.4	-72.6	56.3	0	0	0	111.7
515	D	33.5	Very low	31.8	Very low	127 Å²	127	140.5 Å²	140.5	68%	0.679	75%	0.745	S	S	*	*			cis	-154.9	157.9	4.1	-102.2	-36.3	0	0	0	112.7
516	S	35.6	Very low	31.9	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	74%	0.739	S	S	*	*			trans	68.6	161.5	153.7	84.3	0	0	0	0	118.1
517	N	32.2	Very low	32	Very low	133 Å²	133	139.1 Å²	139.1	71%	0.711	74%	0.74	S	S	*	*			cis	-161.3	160.8	-1.1	-137.5	6.4	0	0	0	112.7
518	L	36.3	Very low	32.4	Very low	129 Å²	129	140.6 Å²	140.6	68%	0.675	74%	0.742	S	S	*	*			trans	66.9	121.1	159.4	-53.1	169.8	0	0	0	117.3
519	D	35.4	Very low	32.8	Very low	139 Å²	139	141.1 Å²	141.1	74%	0.743	74%	0.74	S	S	*	*				90.4	149	62.8	-62.8	-2.6	0	0	0	111.3
520	D	35	Very low	33.2	Very low	138 Å²	138	139.2 Å²	139.2	74%	0.738	74%	0.737	S	S	*	*			cis	-153.3	136.3	6.9	-144.9	20.4	0	0	0	107.7
521	S	33.3	Very low	33.5	Very low	93 Å²	93	135 Å²	135	65%	0.65	73%	0.725	S	S	*	*				76.3	152.4	79.4	-52.5	0	0	0	0	118.6
522	S	32.5	Very low	33.6	Very low	127 Å²	127	133 Å²	133	89%	0.888	72%	0.719	S	S	*	*			trans	69.3	152	176.8	80.2	0	0	0	0	116.8
523	A	36.2	Very low	33.8	Very low	94 Å²	94	127.3 Å²	127.3	78%	0.777	71%	0.707	S	S	*	*			cis	-139.3	147.4	-8.6	0	0	0	0	0	107.6
524	Q	28.6	Very low	33.8	Very low	158 Å²	158	131.2 Å²	131.2	74%	0.738	71%	0.71	S	S	*	*			cis	98.5	145.2	31.7	-168.3	62.2	13.1	0	0	113
525	E	32.9	Very low	33.9	Very low	169 Å²	169	131.9 Å²	131.9	79%	0.79	71%	0.711	S	S	*	*			trans	82.9	148	179.5	-52.6	-154.2	124.9	0	0	117.4
526	K	30.2	Very low	33.6	Very low	162 Å²	162	133.2 Å²	133.2	70%	0.704	71%	0.713	S	S	*	*			cis	163.5	178.9	-33	-108.5	-172.1	171.3	-168.7	0	107.1
527	I	34	Very low	33.4	Very low	160 Å²	160	133.3 Å²	133.3	82%	0.821	71%	0.714	S	S	*	*			trans	77.8	131.8	170.5	-56.7	178.1	0	0	0	114.4
528	D	35.3	Very low	33.4	Very low	131 Å²	131	131.5 Å²	131.5	70%	0.701	71%	0.711	S	S	*	*			cis	-169.1	-173.8	-44.2	-112	-63.7	0	0	0	105.6
529	E	35.5	Very low	33.3	Very low	133 Å²	133	131.3 Å²	131.3	62%	0.621	72%	0.721	S	S	*	*			cis	-149.7	161.8	9.6	-142.6	-140.4	145.5	0	0	108.9	K531	E529-K531 IonicContact OE1-NZ 2.66Å; E529-K531 PolarHBondContact OE1-NZ 2.63Å; E529-K531 IonicContact OE2-NZ 3.54Å
530	S	36.3	Very low	33.2	Very low	75 Å²	75	128.2 Å²	128.2	52%	0.524	72%	0.721	S	S	.	*			trans	45.4	154.1	130.1	-74.9	0	0	0	0	123.8
531	K	36.3	Very low	33.2	Very low	138 Å²	138	125.1 Å²	125.1	60%	0.6	72%	0.722	S	S	*	*			cis	-169.7	165.1	10.3	-120.9	157.7	-157.9	140.3	0	110.9	E529	E529-K531 IonicContact OE1-NZ 2.66Å; E529-K531 PolarHBondContact OE1-NZ 2.63Å; E529-K531 IonicContact OE2-NZ 3.54Å
532	D	34.1	Very low	33.3	Very low	123 Å²	123	127.3 Å²	127.3	66%	0.658	73%	0.727	S	S	*	*			trans	62.1	161.7	143.2	-61.3	-19	0	0	0	119.4
533	I	34.6	Very low	33.5	Very low	137 Å²	137	127.8 Å²	127.8	70%	0.703	72%	0.715	S	S	*	*			cis	-160.8	156.5	-14.1	-113.6	165.9	0	0	0	106.2
534	M	31.4	Very low	33.4	Very low	141 Å²	141	130.4 Å²	130.4	70%	0.695	72%	0.715	S	S	*	*			cis	-168.9	167.2	-32.4	-109.7	-174	-161.9	0	0	107
535	M	33.1	Very low	33.5	Very low	159 Å²	159	127.7 Å²	127.7	78%	0.783	71%	0.713	S	S	*	*			trans	64.2	171	156.8	-77.3	171.3	171.7	0	0	118.8
536	E	27.8	Very low	33.5	Very low	155 Å²	155	126.2 Å²	126.2	72%	0.724	72%	0.716	S	S	*	*				-168.8	138.7	-51.9	-120	-174	154	0	0	109.7
537	S	30	Very low	33.6	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	72%	0.722	S	S	*	*			trans	65.6	176.4	149.7	89.5	0	0	0	0	117.9
538	S	33.2	Very low	33.4	Very low	94 Å²	94	132.3 Å²	132.3	66%	0.657	72%	0.724	S	S	*	*			cis	-151.9	152.7	-5.4	11.4	0	0	0	0	110.9
539	S	33.3	Very low	33	Very low	125 Å²	125	133.9 Å²	133.9	87%	0.874	73%	0.729	S	S	*	*			trans	48.6	144.8	153.6	56.3	0	0	0	0	121.9
540	G	34.2	Very low	32.6	Very low	74 Å²	74	134.2 Å²	134.2	76%	0.763	74%	0.735	S	S	*	*			cis	166.3	164.4	-1.9	0	0	0	0	0	113.1
541	G	34.1	Very low	32.2	Very low	73 Å²	73	136.3 Å²	136.3	75%	0.753	75%	0.745	S	S	*	*			trans	72.1	161.8	-178.5	0	0	0	0	0	114.8
542	D	35	Very low	31.9	Very low	139 Å²	139	138.5 Å²	138.5	74%	0.743	76%	0.755	S	S	*	*			cis	-174.1	155.6	-20.4	-121.5	24.7	0	0	0	106.2
543	Q	36.5	Very low	31.6	Very low	138 Å²	138	137.3 Å²	137.3	65%	0.645	76%	0.756	S	S	*	*			cis	-160.6	158.7	-5.9	-145.6	-170.4	102.3	0	0	109
544	L	35.5	Very low	31.5	Very low	149 Å²	149	138.3 Å²	138.3	78%	0.78	76%	0.759	S	S	*	*			trans	63.5	161.3	164.4	-52.9	168.1	0	0	0	118.1
545	S	30.7	Very low	31.5	Very low	100 Å²	100	136 Å²	136	70%	0.699	76%	0.757	S	S	*	*			cis	-153.6	150.3	-48.5	66.6	0	0	0	0	106.6
546	V	33.4	Very low	31.6	Very low	138 Å²	138	133.7 Å²	133.7	84%	0.836	75%	0.748	S	S	*	*				-152.6	151	65	164.3	0	0	0	0	111.1
547	R	30.7	Very low	31.7	Very low	224 Å²	224	134.9 Å²	134.9	85%	0.845	75%	0.751	S	S	*	*			trans	-93.7	166.5	-178.5	-79.5	177.8	179.2	172	0.2	112.2
548	R	29.6	Very low	31.9	Very low	226 Å²	226	137 Å²	137	85%	0.853	76%	0.759	S	S	*	*			cis	-172.4	171.4	-27.3	-157.3	178.5	-154.5	172.7	6	106.5
549	M	27.1	Very low	31.8	Very low	164 Å²	164	143.2 Å²	143.2	81%	0.808	77%	0.768	S	S	*	*			trans	-85	166.8	170.5	-67.6	-177.1	167.1	0	0	113.5
550	N	28	Very low	32.2	Very low	141 Å²	141	141.1 Å²	141.1	75%	0.754	75%	0.751	S	S	*	*			trans	89.6	156.3	132.1	-96	-1.7	0	0	0	123.2
551	T	27.9	Very low	32.2	Very low	118 Å²	118	144.1 Å²	144.1	72%	0.724	76%	0.755	S	S	*	*			trans	85.7	137.1	146.9	40.4	0	0	0	0	123.6
552	F	30.5	Very low	32.2	Very low	185 Å²	185	144 Å²	144	81%	0.811	75%	0.753	S	S	*	*			trans	70.1	111.4	145.1	-92.7	-119.3	0	0	0	122.6
553	S	27.6	Very low	32.4	Very low	98 Å²	98	142.2 Å²	142.2	69%	0.685	75%	0.752	S	S	*	*				50.5	153.6	104.9	-148.5	0	0	0	0	122.3
554	M	32.4	Very low	32.4	Very low	157 Å²	157	142.5 Å²	142.5	77%	0.773	76%	0.758	S	S	*	*			trans	84.5	102.1	165.1	-57.7	-158.2	70.4	0	0	119.6
555	S	30.3	Very low	32.4	Very low	93 Å²	93	140.2 Å²	140.2	65%	0.65	75%	0.754	S	S	*	*				87.7	143.2	119.8	-61.6	0	0	0	0	122.5
556	D	34.8	Very low	32.8	Very low	110 Å²	110	144.6 Å²	144.6	59%	0.588	76%	0.764	S	S	*	*			trans	51.1	109.8	156.8	-70.7	-71.7	0	0	0	123.1
557	K	30.2	Very low	33	Very low	181 Å²	181	143.4 Å²	143.4	79%	0.787	76%	0.762	S	S	*	*				33.2	119.7	120	-53	176.3	-164.6	113.6	0	117.8
558	V	34.9	Very low	33.4	Very low	149 Å²	149	138 Å²	138	90%	0.903	76%	0.756	S	S	*	*				-165	168.1	107	139.7	0	0	0	0	109.9
559	R	31.6	Very low	33.8	Very low	225 Å²	225	134.2 Å²	134.2	85%	0.849	75%	0.752	S	S	*	*			trans	-140.2	-177.4	-171.4	-139.8	-161	164.4	-143.2	0.2	106.6
560	P	40.7	Very low	34.3	Very low	81 Å²	81	134.9 Å²	134.9	53%	0.526	76%	0.758	S	S	.	*			cis	-129.6	-158.8	-20.5	28.2	-3.1	0	0	0	112.3
561	T	35.2	Very low	34.5	Very low	138 Å²	138	137.5 Å²	137.5	85%	0.847	76%	0.763	S	S	*	*			trans	69.2	147.7	164.4	65.4	0	0	0	0	116.7
562	G	33.9	Very low	34.7	Very low	69 Å²	69	138.2 Å²	138.2	71%	0.711	77%	0.771	S	S	*	*			cis	179.4	174	-0.7	0	0	0	0	0	109.5
563	S	38	Very low	35	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	76%	0.764	S	S	*	*			cis	-162.8	178	-8.5	-70.4	0	0	0	0	110.6
564	D	36.9	Very low	35.2	Very low	145 Å²	145	137.6 Å²	137.6	78%	0.775	77%	0.773	S	S	*	*			trans	58.9	93.3	147.5	-53.3	-26.7	0	0	0	123.7
565	S	36.1	Very low	35.4	Very low	100 Å²	100	136.1 Å²	136.1	70%	0.699	78%	0.778	S	S	*	*				55.8	125.3	122.7	70.7	0	0	0	0	123.1
566	Q	38.7	Very low	35.6	Very low	192 Å²	192	143.2 Å²	143.2	90%	0.897	79%	0.791	S	S	*	*				-167.1	179.9	103.9	-102.1	178.5	50.6	0	0	112.2
567	S	37.2	Very low	36.1	Very low	114 Å²	114	142.3 Å²	142.3	80%	0.797	80%	0.799	S	S	*	*			trans	-106.1	-166.7	-159.9	-59.8	0	0	0	0	113.5
568	P	39.9	Very low	36.5	Very low	110 Å²	110	139.2 Å²	139.2	71%	0.714	80%	0.797	S	S	*	*				-124	-161.2	-72.5	39.7	-25	0	0	0	112.5
569	N	37.4	Very low	36.5	Very low	146 Å²	146	137.6 Å²	137.6	78%	0.781	79%	0.79	S	S	*	*			trans	79.5	107.6	176.3	-61.3	-48.3	0	0	0	117.3
570	L	37.8	Very low	36.7	Very low	178 Å²	178	135.3 Å²	135.3	93%	0.932	79%	0.791	S	S	*	*				-173.1	141.2	110	-97.7	161.3	0	0	0	110.5
571	K	33.1	Very low	36.3	Very low	197 Å²	197	135.4 Å²	135.4	86%	0.857	79%	0.793	S	S	*	*			trans	-111.3	128.1	170.4	-84.9	178.9	176.1	171.3	0	109
572	C	30.5	Very low	36.1	Very low	132 Å²	132	135.5 Å²	135.5	89%	0.892	79%	0.788	S	S	*	*			trans	-162.7	127.2	139.4	-125.5	0	0	0	0	111.9
573	P	38	Very low	36	Very low	104 Å²	104	139.7 Å²	139.7	68%	0.675	79%	0.793	S	S	*	*			trans	-116.2	175.6	176.8	42	-33.6	0	0	0	113.4
574	L	30.7	Very low	35.8	Very low	167 Å²	167	140.5 Å²	140.5	87%	0.874	80%	0.796	S	S	*	*			trans	67.9	130.6	160.6	-67.8	160.2	0	0	0	118.5
575	S	38.1	Very low	35.6	Very low	125 Å²	125	140.7 Å²	140.7	87%	0.874	80%	0.797	S	S	*	*			trans	-126.2	119.3	149.9	65	0	0	0	0	110.7
576	R	33.3	Very low	35.3	Very low	243 Å²	243	140.9 Å²	140.9	92%	0.917	80%	0.798	S	S	*	*			trans	-148	119.6	167.8	179.4	-173.8	-178.3	-174.3	2.6	107.3
577	A	45.4	Very low	34.9	Very low	91 Å²	91	138.8 Å²	138.8	75%	0.752	79%	0.792	S	S	*	*			trans	-136.7	160.5	-170.9	0	0	0	0	0	111.9
578	P	40.1	Very low	34.7	Very low	116 Å²	116	138.6 Å²	138.6	75%	0.753	79%	0.787	S	S	*	*			cis	-137.2	164.2	-49.2	37.8	-25.2	0	0	0	113.1
579	P	33.8	Very low	34.3	Very low	115 Å²	115	139.5 Å²	139.5	75%	0.747	79%	0.79	S	S	*	*			trans	-112.1	-178.9	149.6	36.1	-25.3	0	0	0	111.5
580	M	36.5	Very low	34.2	Very low	176 Å²	176	137.6 Å²	137.6	87%	0.867	79%	0.786	S	S	*	*			trans	101.4	158.7	161.8	-59	-61.1	-66.5	0	0	118.8
581	S	32.5	Very low	34	Very low	83 Å²	83	134.7 Å²	134.7	58%	0.58	78%	0.776	S	S	*	*			trans	-129.2	151	-170.3	55.1	0	0	0	0	111.2
582	N	30.3	Very low	33.9	Very low	140 Å²	140	131.6 Å²	131.6	75%	0.749	77%	0.773	S	S	*	*			trans	69.1	136	153.2	-62.5	-1.8	0	0	0	120.6
583	I	32.2	Very low	34.2	Very low	157 Å²	157	130.3 Å²	130.3	81%	0.805	77%	0.766	S	S	*	*			trans	74.4	140.8	149.1	-67.7	161.1	0	0	0	114.5
584	P	33.1	Very low	34	Very low	119 Å²	119	129.8 Å²	129.8	77%	0.773	77%	0.765	S	S	*	*			cis	-135.4	-168	31.8	35.4	-12.2	0	0	0	117.8
585	N	32.8	Very low	34.3	Very low	149 Å²	149	126.8 Å²	126.8	80%	0.797	76%	0.758	S	S	*	*			trans	-96.7	158.9	-176.4	-73.7	-10	0	0	0	115.5
586	S	30.8	Very low	34.1	Very low	105 Å²	105	128.5 Å²	128.5	73%	0.734	75%	0.752	S	S	*	*			trans	63.1	135.6	145.7	67.6	0	0	0	0	119.1
587	L	30	Very low	34.2	Very low	147 Å²	147	122.7 Å²	122.7	77%	0.77	74%	0.739	S	S	*	*				-166	163.6	64	-92.6	158.4	0	0	0	113.7
588	T	33.6	Very low	33.6	Very low	111 Å²	111	122.8 Å²	122.8	68%	0.681	74%	0.735	S	S	*	*			trans	63.6	102.7	149.1	46.8	0	0	0	0	123.4
589	T	30.4	Very low	33.4	Very low	128 Å²	128	122.6 Å²	122.6	79%	0.785	73%	0.733	S	S	*	*				53.5	159.4	113.8	57.3	0	0	0	0	122
590	P	36.4	Very low	33.3	Very low	106 Å²	106	123.5 Å²	123.5	69%	0.688	73%	0.73	S	S	*	*			cis	-143.2	178.3	19.6	39.7	-18	0	0	0	119.8
591	T	32.5	Very low	33.2	Very low	117 Å²	117	123.3 Å²	123.3	72%	0.718	73%	0.725	S	S	*	*			trans	69.2	130.9	147	38.6	0	0	0	0	124.3
592	T	31.9	Very low	33.1	Very low	132 Å²	132	127.3 Å²	127.3	81%	0.81	73%	0.734	S	S	*	*			trans	57.5	139.3	146.8	52.4	0	0	0	0	120.1
593	S	35.1	Very low	33.2	Very low	106 Å²	106	126 Å²	126	74%	0.741	74%	0.736	S	S	*	*			cis	-169.1	-176.4	-10	65.5	0	0	0	0	107.2
594	S	35.3	Very low	33.4	Very low	93 Å²	93	123.1 Å²	123.1	65%	0.65	74%	0.735	S	S	*	*			cis	-166.5	162.7	-3.3	16.6	0	0	0	0	108.5
595	S	35.6	Very low	33.5	Very low	103 Å²	103	123.1 Å²	123.1	72%	0.72	73%	0.729	S	S	*	*			trans	60.6	149.3	168.5	53.6	0	0	0	0	117.8
596	E	35.5	Very low	33.6	Very low	162 Å²	162	123.9 Å²	123.9	76%	0.757	73%	0.725	S	S	*	*			cis	-167.7	170.2	-16.7	-109.5	166	-106.1	0	0	105.8
597	N	34.3	Very low	33.7	Very low	120 Å²	120	123.5 Å²	123.5	64%	0.642	72%	0.723	S	S	*	*			cis	-147	167.8	1.3	-108.4	-41	0	0	0	105.5
598	S	33.3	Very low	33.6	Very low	94 Å²	94	121.2 Å²	121.2	66%	0.657	72%	0.719	S	S	*	*			cis	127.4	154.1	12.7	-67.5	0	0	0	0	109.4
599	P	36.6	Very low	33.4	Very low	112 Å²	112	120.8 Å²	120.8	73%	0.727	72%	0.72	S	S	*	*				-140.4	-152.5	-91.8	27	0.3	0	0	0	113.8
600	I	30.7	Very low	33.3	Very low	133 Å²	133	119 Å²	119	68%	0.682	72%	0.718	S	S	*	*			trans	113.5	135.7	143.4	-67.4	164.2	0	0	0	119.2
601	K	33.6	Very low	32.8	Very low	173 Å²	173	119.1 Å²	119.1	75%	0.752	72%	0.722	S	S	*	*			trans	71.7	146.3	163.1	-80.8	157.9	-170	177.4	0	119
602	Q	31	Very low	32.5	Very low	166 Å²	166	118.5 Å²	118.5	78%	0.776	72%	0.722	S	S	*	*			cis	174.1	137.6	-34.1	-113.5	171.8	2.4	0	0	107.5
603	S	33.4	Very low	32.3	Very low	114 Å²	114	115.4 Å²	115.4	80%	0.797	71%	0.706	S	S	*	*			trans	143.3	136.2	135.5	72	0	0	0	0	113.9
604	A	36.5	Very low	31.9	Very low	95 Å²	95	113.5 Å²	113.5	79%	0.785	69%	0.693	S	S	*	*			trans	61.3	137.4	159.6	0	0	0	0	0	119.1
605	D	34.7	Very low	31.6	Very low	119 Å²	119	113.4 Å²	113.4	64%	0.636	69%	0.692	S	S	*	*			cis	-157.4	171.4	-24.5	-147.4	-9.6	0	0	0	110.4
606	K	34.5	Very low	31.3	Very low	165 Å²	165	113.6 Å²	113.6	72%	0.717	69%	0.694	S	S	*	*			trans	-0.6	152.1	158.1	-69	147.8	-156.6	143.7	0	120.9
607	S	32.3	Very low	31.2	Very low	98 Å²	98	111.4 Å²	111.4	69%	0.685	69%	0.693	S	S	*	*			cis	-174.8	142.6	-10.5	51.2	0	0	0	0	112.4
608	S	29.3	Very low	30.9	Very low	99 Å²	99	110.1 Å²	110.1	69%	0.692	69%	0.694	S	S	*	*			trans	17.4	140.9	145.2	63.9	0	0	0	0	123.7
609	S	29.1	Very low	30.6	Very low	101 Å²	101	113.9 Å²	113.9	71%	0.706	70%	0.698	S	S	*	*				75.4	109	129.1	67.7	0	0	0	0	122.6
610	A	27.7	Very low	30.3	Very low	90 Å²	90	116.2 Å²	116.2	74%	0.744	70%	0.7	S	S	*	*				79.2	117.1	112.7	0	0	0	0	0	122.2
611	S	26	Very low	30.2	Very low	110 Å²	110	116.7 Å²	116.7	77%	0.769	70%	0.703	S	S	*	*				97.2	139.5	126.4	79.6	0	0	0	0	121.4
612	S	26.3	Very low	30.2	Very low	103 Å²	103	113.4 Å²	113.4	72%	0.72	70%	0.702	S	S	*	*			trans	87.9	149.2	149.9	85.4	0	0	0	0	121
613	S	27.2	Very low	30.1	Very low	68 Å²	68	111.8 Å²	111.8	48%	0.476	70%	0.699	S	S	.	*			trans	86.6	134.7	148.9	88.1	0	0	0	0	120.4	S739 N740	S613-S739 WeakPolarHBondContact O-CB 3.36Å; S613-N740 PolarHBondContact O-ND2 2.94Å
614	S	27.3	Very low	30.1	Very low	65 Å²	65	110.9 Å²	110.9	46%	0.455	69%	0.685	S	S	.	*			trans	32.2	152.1	137.1	45.9	0	0	0	0	122.7	N740	S614-N740 PolarHBondContact O-ND2 3.03Å
615	S	27.7	Very low	29.9	Very low	92 Å²	92	115.1 Å²	115.1	64%	0.643	69%	0.686	S	S	*	*			cis	-177.6	156.6	-14	54.3	0	0	0	0	109.7
616	S	30.2	Very low	29.5	Very low	107 Å²	107	119.2 Å²	119.2	75%	0.748	70%	0.698	S	S	*	*			trans	-69.1	143.3	174.5	54.8	0	0	0	0	114.1
617	P	33.6	Very low	29.3	Very low	115 Å²	115	118.1 Å²	118.1	75%	0.747	70%	0.696	S	S	*	*				-146.9	172.6	108.6	38.2	-23.3	0	0	0	114
618	S	26.9	Very low	29	Very low	94 Å²	94	119.6 Å²	119.6	66%	0.657	70%	0.696	S	S	*	*			cis	-175.2	171.5	-28.8	65.2	0	0	0	0	111.3
619	K	29	Very low	28.8	Very low	173 Å²	173	120.3 Å²	120.3	75%	0.752	70%	0.696	S	S	*	*			trans	82.1	128.5	156.7	-69.6	173.1	-178.7	176.9	0	121.8
620	Q	29.1	Very low	28.7	Very low	161 Å²	161	125.2 Å²	125.2	75%	0.752	71%	0.705	S	S	*	*			trans	61.7	145.7	148.2	-63.9	160.1	-55.7	0	0	117.6
621	N	29.3	Very low	28.7	Very low	142 Å²	142	127 Å²	127	76%	0.759	71%	0.706	S	S	*	*			cis	-166.7	164.2	-15.7	-103.5	-5.7	0	0	0	106.1
622	S	32.5	Very low	28.9	Very low	104 Å²	104	129.1 Å²	129.1	73%	0.727	70%	0.702	S	S	*	*			cis	-167.2	179.3	-23.5	63.7	0	0	0	0	105.8
623	N	30	Very low	29	Very low	132 Å²	132	133.9 Å²	133.9	71%	0.706	71%	0.71	S	S	*	*			cis	-155	-178.1	3.1	-164.3	19.5	0	0	0	111
624	D	32.5	Very low	29.1	Very low	96 Å²	96	139.4 Å²	139.4	51%	0.513	73%	0.728	S	S	.	*			trans	62.1	103.5	149.4	-87.1	-25.7	0	0	0	124.6
625	K	31.9	Very low	29.1	Very low	183 Å²	183	142.1 Å²	142.1	80%	0.796	73%	0.734	S	S	*	*			trans	73.8	106.1	130.6	-67.8	167.5	-174.3	115.6	0	120.4
626	K	27.6	Very low	29.1	Very low	205 Å²	205	146.5 Å²	146.5	89%	0.891	74%	0.744	S	S	*	*			trans	-99.9	141.2	164.1	-68.4	178.4	172.4	-179.1	0	112.4
627	E	29.5	Very low	28.9	Very low	143 Å²	143	146.5 Å²	146.5	67%	0.668	74%	0.74	S	S	*	*			trans	-168.2	141.4	145.1	-105.5	170	-146.2	0	0	108.1	K731	E627-K731 WeakPolarHBondContact OE1-CE 3.33Å; E627-K731 IonicContact OE1-NZ 3.55Å; E627-K731 PolarHBondContact OE1-NZ 3.07Å
628	N	26.5	Very low	28.8	Very low	129 Å²	129	148 Å²	148	69%	0.69	74%	0.74	S	S	*	*			cis	-158.6	148.3	-17.1	-143.9	-9.1	0	0	0	111.5
629	T	25.2	Very low	28.9	Very low	113 Å²	113	152.4 Å²	152.4	69%	0.693	75%	0.747	S	S	*	*			trans	51.1	123.2	160.9	52.3	0	0	0	0	122.6
630	K	26	Very low	28.9	Very low	205 Å²	205	152 Å²	152	89%	0.891	75%	0.753	S	S	*	*			trans	58.5	81.5	146.7	-67.2	-170.6	173.2	-173	0	118.7
631	T	27.5	Very low	29.1	Very low	126 Å²	126	151.3 Å²	151.3	77%	0.773	75%	0.754	S	S	*	*			trans	-140.6	153.4	158.7	51.4	0	0	0	0	108.4
632	F	30.4	Very low	29	Very low	156 Å²	156	154.1 Å²	154.1	68%	0.684	76%	0.763	S	S	*	*			cis	-147.1	143.1	-10	-137.8	-142.7	0	0	0	107.9	Q635	F632-Q635 HydrophobicContact CE1-CG 3.99Å; F632-Q635 VanDerWaalsContact CE1-NE2 3.26Å; F632-Q635 VanDerWaalsContact CZ-NE2 3.31Å
633	F	29.1	Very low	28.7	Very low	202 Å²	202	153.4 Å²	153.4	89%	0.886	76%	0.763	S	S	*	*			trans	-93.9	126.2	164.5	-153.6	-90.6	0	0	0	106.3
634	E	29.2	Very low	28.8	Very low	184 Å²	184	151.2 Å²	151.2	86%	0.86	75%	0.754	S	S	*	*			trans	-72.8	147.2	-158.8	-163.9	156.7	-170.9	0	0	113.7	Q636	E634-Q636 PolarHBondContact O-N 2.92Å
635	Q	26.7	Very low	28.5	Very low	122 Å²	122	152.7 Å²	152.7	57%	0.57	77%	0.769	S	S	*	*			trans	-90.1	106.3	-163.2	-65.6	-176.4	-8.1	0	0	112.6	F632 T637	F632-Q635 HydrophobicContact CE1-CG 3.99Å; F632-Q635 VanDerWaalsContact CE1-NE2 3.26Å; F632-Q635 VanDerWaalsContact CZ-NE2 3.31Å; Q635-T637 HydrophobicContact CB-CG2 4.41Å; Q635-T637 PolarHBondContact O-N 3.33Å
636	Q	28.2	Very low	28.4	Very low	184 Å²	184	152.4 Å²	152.4	86%	0.86	76%	0.764	S	S	*	*			trans	-90.9	79.6	149.3	-70.8	-160.2	12.9	0	0	110	E634 I638	E634-Q636 PolarHBondContact O-N 2.92Å; Q636-I638 PolarHBondContact O-N 3.42Å
637	T	25.9	Very low	28.6	Very low	108 Å²	108	146.9 Å²	146.9	66%	0.663	75%	0.751	S	S	*	*			trans	-72.2	79.9	166.6	35.2	0	0	0	0	109.9	Q635 K639	Q635-T637 HydrophobicContact CB-CG2 4.41Å; Q635-T637 PolarHBondContact O-N 3.33Å; T637-K639 PolarHBondContact O-N 3Å; T637-K639 VanDerWaalsContact O-N 3.14Å
638	I	31.9	Very low	28.8	Very low	146 Å²	146	150 Å²	150	75%	0.749	77%	0.766	S	S	*	*			trans	-52	122.7	166.1	-61.4	177.4	0	0	0	107.5	Q636 L640	Q636-I638 PolarHBondContact O-N 3.42Å; I638-L640 PolarHBondContact O-N 3.43Å
639	K	28.6	Very low	29.3	Very low	186 Å²	186	152.1 Å²	152.1	81%	0.809	77%	0.772	S	S	*	*			trans	-66.3	96.1	-175.5	-71.9	179.2	179.3	174.1	0	110.4	T637 N641	T637-K639 PolarHBondContact O-N 3Å; T637-K639 VanDerWaalsContact O-N 3.14Å; K639-N641 VanDerWaalsContact C-N 3.3Å; K639-N641 PolarHBondContact O-N 2.99Å
640	L	30.3	Very low	30	Very low	165 Å²	165	150 Å²	150	86%	0.864	76%	0.756	S	S	*	*			trans	-61.2	92.7	161.7	-96.6	146.2	0	0	0	108.7	I638 Q642	I638-L640 PolarHBondContact O-N 3.43Å; L640-Q642 PolarHBondContact O-N 3.29Å
641	N	32.2	Very low	30.8	Very low	147 Å²	147	145 Å²	145	79%	0.786	74%	0.744	S	S	*	*			trans	-59	125.3	171.5	-84	-18.1	0	0	0	109	K639 A643	K639-N641 VanDerWaalsContact C-N 3.3Å; K639-N641 PolarHBondContact O-N 2.99Å; N641-A643 PolarHBondContact O-N 2.89Å
642	Q	26.6	Very low	31.4	Very low	200 Å²	200	140.2 Å²	140.2	94%	0.935	71%	0.713	S	S	*	*			trans	-74.3	111.8	-165.9	-65.6	174.8	-9.5	0	0	111.7	L640	L640-Q642 PolarHBondContact O-N 3.29Å
643	A	25.9	Very low	32.1	Very low	89 Å²	89	135.8 Å²	135.8	74%	0.736	70%	0.696	S	S	*	*			trans	-149	145.2	164.1	0	0	0	0	0	110.4	N641	N641-A643 PolarHBondContact O-N 2.89Å
644	V	32.7	Very low	32.6	Very low	86 Å²	86	127.5 Å²	127.5	52%	0.521	67%	0.668	S	S	.	*			trans	70.4	90	180	-166.8	0	0	0	0	115.7
645	P	27.1	Very low	33.2	Very low	128 Å²	128	121.5 Å²	121.5	83%	0.831	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-72.6	125.6	153	31.1	-31.2	0	0	0	109.8
646	Y	30.2	Very low	33.8	Very low	177 Å²	177	116.2 Å²	116.2	69%	0.694	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-70.6	132.7	173.1	-104.4	-91	0	0	0	111.1
647	S	31.6	Very low	34.6	Very low	88 Å²	88	116 Å²	116	62%	0.615	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-89.5	155.9	160.8	60	0	0	0	0	110.4	E649	S647-E649 PolarHBondContact O-N 3.23Å; S647-E649 VanDerWaalsContact O-N 3.14Å
648	E	33.4	Very low	35.4	Very low	208 Å²	208	114.8 Å²	114.8	97%	0.972	59%	0.587	S	S	*	*	S	Bend	trans	-75.3	6.6	-179	-63.5	-167.1	122.7	0	0	114.3	N650	E648-N650 VanDerWaalsContact C-N 3.28Å; E648-N650 PolarHBondContact O-N 2.69Å
649	E	37.5	Very low	35.8	Very low	175 Å²	175	110.8 Å²	110.8	82%	0.818	57%	0.57	S	S	*	*			trans	-87.5	58	-176.6	-64	-163	-173.5	0	0	112.5	S647	S647-E649 PolarHBondContact O-N 3.23Å; S647-E649 VanDerWaalsContact O-N 3.14Å
650	N	39.8	Very low	36.1	Very low	69 Å²	69	108.1 Å²	108.1	37%	0.369	56%	0.564	S	S	.	*			trans	-107.5	106.3	171.1	-163	-9.1	0	0	0	111.6	E648 F652	E648-N650 VanDerWaalsContact C-N 3.28Å; E648-N650 PolarHBondContact O-N 2.69Å; N650-F652 PolarHBondContact O-N 3.23Å; N650-F652 WeakPolarHBondContact OD1-CB 3.45Å; N650-F652 PolarHBondContact OD1-N 3.16Å
651	P	42.4	Very low	36.2	Very low	98 Å²	98	105.8 Å²	105.8	64%	0.636	56%	0.559	S	S	*	*	H	α-helix	trans	-56.6	-33.1	180	-25.5	34.8	0	0	0	113.6	L653 G654 W655	P651-L653 PolarHBondContact O-N 3.45Å; P651-G654 CarbonylContact O-C 3.5Å; P651-G654 VanDerWaalsContact O-CA 3.31Å; P651-G654 WeakPolarHBondContact O-CA 3.49Å; P651-G654 PolarHBondContact O-N 2.92Å; P651-W655 PolarHBondContact O-N 2.94Å
652	F	39.6	Very low	36	Very low	26 Å²	26	108 Å²	108	11%	0.114	56%	0.558	C	S	.	*	H	α-helix	trans	-47.5	-57.7	-180	167.7	-103	0	0	0	114	P214 L248 D251 N650 G654 W655 L656	P214-F652 HydrophobicContact CG-CE1 4.48Å; P214-F652 HydrophobicContact CG-CZ 4.49Å; L248-F652 HydrophobicContact CD1-CE2 3.36Å; L248-F652 HydrophobicContact CD1-CZ 3.49Å; L248-F652 VanDerWaalsContact CD1-CZ 3.49Å; L248-F652 HydrophobicContact CG-CE2 3.99Å; L248-F652 HydrophobicContact CG-CZ 4.45Å; D251-F652 HydrophobicContact CB-CZ 4.31Å; D251-F652 WeakPolarHBondContact OD1-CE1 3.14Å; D251-F652 WeakPolarHBondContact OD1-CZ 3.37Å; N650-F652 PolarHBondContact O-N 3.23Å; N650-F652 WeakPolarHBondContact OD1-CB 3.45Å; N650-F652 PolarHBondContact OD1-N 3.16Å; F652-G654 PolarHBondContact O-N 3.39Å; F652-W655 PolarHBondContact O-N 2.9Å; F652-L656 HydrophobicContact CD2-CD1 3.96Å; F652-L656 HydrophobicContact CE1-CD1 4.3Å; F652-L656 HydrophobicContact CE2-CD1 3.21Å; F652-L656 HydrophobicContact CZ-CD1 3.39Å; F652-L656 PolarHBondContact O-N 2.89Å; F652-L656 VanDerWaalsContact O-N 3.12Å
653	L	45.3	Very low	36	Very low	64 Å²	64	106 Å²	106	34%	0.335	55%	0.548	S	S	.	.	H	α-helix	trans	-64.4	-26.7	178.3	-71.3	176	0	0	0	112.3	P651 W655 R657	P651-L653 PolarHBondContact O-N 3.45Å; L653-W655 VanDerWaalsContact C-N 3.34Å; L653-R657 WeakPolarHBondContact O-CG 3.46Å
654	G	38.9	Very low	36.1	Very low	28 Å²	28	108.2 Å²	108.2	29%	0.289	54%	0.541	S	S	.	.	H	α-helix	trans	-73.9	-22.1	173.1	0	0	0	0	0	113.7	P651 F652 R658	P651-G654 CarbonylContact O-C 3.5Å; P651-G654 VanDerWaalsContact O-CA 3.31Å; P651-G654 WeakPolarHBondContact O-CA 3.49Å; P651-G654 PolarHBondContact O-N 2.92Å; F652-G654 PolarHBondContact O-N 3.39Å; G654-R658 VanDerWaalsContact O-CZ 3.24Å; G654-R658 PolarHBondContact O-NE 3.27Å; G654-R658 PolarHBondContact O-NH2 3.01Å
655	W	42.5	Very low	35.9	Very low	57 Å²	57	112.9 Å²	112.9	22%	0.216	55%	0.554	C	S	.	*	H	α-helix	trans	-90.3	-47.6	-179.5	-177.7	96.7	0	0	0	111.6	G246 P651 F652 L653 R657 R658 T659	G246-W655 WeakPolarHBondContact O-CH2 3.21Å; G246-W655 WeakPolarHBondContact O-CZ3 3.45Å; P651-W655 PolarHBondContact O-N 2.94Å; F652-W655 PolarHBondContact O-N 2.9Å; L653-W655 VanDerWaalsContact C-N 3.34Å; W655-R657 VanDerWaalsContact C-N 3.27Å; W655-R657 PolarHBondContact O-N 3.17Å; W655-R658 WeakPolarHBondContact O-CB 3.5Å; W655-R658 PolarHBondContact O-N 3.07Å; W655-T659 HydrophobicContact CD2-CG2 4.19Å; W655-T659 HydrophobicContact CE3-CG2 4.4Å; W655-T659 HydrophobicContact CH2-CG2 3.8Å; W655-T659 HydrophobicContact CZ2-CG2 3.62Å; W655-T659 HydrophobicContact CZ3-CG2 4.21Å
656	L	39.9	Very low	35.9	Very low	12 Å²	12	113.2 Å²	113.2	6%	0.063	54%	0.544	C	S	.	.	H	α-helix	trans	-62.3	-30.3	178.8	-100	140.4	0	0	0	113.7	D251 F652 R658	D251-L656 HydrophobicContact CB-CD1 4.09Å; D251-L656 HydrophobicContact CB-CD2 4.29Å; F652-L656 HydrophobicContact CD2-CD1 3.96Å; F652-L656 HydrophobicContact CE1-CD1 4.3Å; F652-L656 HydrophobicContact CE2-CD1 3.21Å; F652-L656 HydrophobicContact CZ-CD1 3.39Å; F652-L656 PolarHBondContact O-N 2.89Å; F652-L656 VanDerWaalsContact O-N 3.12Å; L656-R658 PolarHBondContact O-N 2.93Å; L656-R658 VanDerWaalsContact O-N 3.11Å
657	R	44	Very low	35.9	Very low	179 Å²	179	113.7 Å²	113.7	68%	0.675	55%	0.55	S	S	*	*	H	α-helix	trans	-63.7	-8.1	170.1	-83.7	-174.5	172.4	-171.6	3.6	114.6	L653 W655	L653-R657 WeakPolarHBondContact O-CG 3.46Å; W655-R657 VanDerWaalsContact C-N 3.27Å; W655-R657 PolarHBondContact O-N 3.17Å
658	R	42.9	Very low	35.6	Very low	82 Å²	82	115.7 Å²	115.7	31%	0.309	55%	0.554	S	S	.	*	H	α-helix	trans	-114.3	-17.7	-177.1	-77.2	-179.7	-89.8	-156.9	-7.6	115.1	G654 W655 L656 E1344	G654-R658 VanDerWaalsContact O-CZ 3.24Å; G654-R658 PolarHBondContact O-NE 3.27Å; G654-R658 PolarHBondContact O-NH2 3.01Å; W655-R658 WeakPolarHBondContact O-CB 3.5Å; W655-R658 PolarHBondContact O-N 3.07Å; L656-R658 PolarHBondContact O-N 2.93Å; L656-R658 VanDerWaalsContact O-N 3.11Å; R658-E1344 WeakPolarHBondContact CD-OE1 3.36Å; R658-E1344 WeakPolarHBondContact CD-OE2 3.43Å; R658-E1344 IonicContact CZ-OE1 2.65Å; R658-E1344 IonicContact NE-OE1 3.78Å; R658-E1344 IonicContact NH1-OE1 2.73Å; R658-E1344 PolarHBondContact NH1-OE1 2.74Å; R658-E1344 IonicContact NH1-OE2 2.79Å; R658-E1344 PolarHBondContact NH1-OE2 2.73Å
659	T	40.2	Very low	35.3	Very low	62 Å²	62	111.2 Å²	111.2	38%	0.38	54%	0.541	S	S	.	.	H	α-helix	trans	-99.3	-3.6	-173.4	48.7	0	0	0	0	115	W655 P661	W655-T659 HydrophobicContact CD2-CG2 4.19Å; W655-T659 HydrophobicContact CE3-CG2 4.4Å; W655-T659 HydrophobicContact CH2-CG2 3.8Å; W655-T659 HydrophobicContact CZ2-CG2 3.62Å; W655-T659 HydrophobicContact CZ3-CG2 4.21Å; T659-P661 WeakPolarHBondContact O-CD 3.38Å
660	L	34.1	Very low	34.8	Very low	130 Å²	130	108 Å²	108	68%	0.681	54%	0.538	S	S	*	.	S	Bend	trans	-95.1	117	176.6	-70.1	172.7	0	0	0	112.3	Y662	L660-Y662 PolarHBondContact O-N 2.85Å; L660-Y662 VanDerWaalsContact O-N 3.12Å
661	P	33.1	Very low	34.2	Very low	117 Å²	117	111.6 Å²	111.6	76%	0.76	56%	0.555	S	S	*	*			trans	-71	106	170.3	-12.8	28.5	0	0	0	109.8	T659 Q663	T659-P661 WeakPolarHBondContact O-CD 3.38Å; P661-Q663 PolarHBondContact O-N 3.03Å
662	Y	27.3	Very low	33.6	Very low	194 Å²	194	114.5 Å²	114.5	76%	0.761	56%	0.56	S	S	*	*			trans	-76	73.2	179.2	-166.8	-101.9	0	0	0	111.2	L660 K664	L660-Y662 PolarHBondContact O-N 2.85Å; L660-Y662 VanDerWaalsContact O-N 3.12Å; Y662-K664 HydrophobicContact CD1-CB 3.94Å; Y662-K664 HydrophobicContact CE1-CB 3.7Å; Y662-K664 HydrophobicContact CE1-CD 3.92Å; Y662-K664 HydrophobicContact CE1-CG 3.87Å; Y662-K664 PolarHBondContact O-N 2.85Å
663	Q	28.2	Very low	33.1	Very low	157 Å²	157	117.6 Å²	117.6	73%	0.734	59%	0.585	S	S	*	*			trans	-69.7	72.6	174.9	-89.8	-73.7	-16.7	0	0	111.2	P661 K665	P661-Q663 PolarHBondContact O-N 3.03Å; Q663-K665 VanDerWaalsContact C-N 3.3Å; Q663-K665 PolarHBondContact O-N 2.86Å
664	K	27.8	Very low	32.4	Very low	135 Å²	135	124.1 Å²	124.1	59%	0.587	61%	0.611	S	S	*	*			trans	-73	84.6	171.2	-153.8	-168	-159.4	-175.8	0	108.9	Y662 H666	Y662-K664 HydrophobicContact CD1-CB 3.94Å; Y662-K664 HydrophobicContact CE1-CB 3.7Å; Y662-K664 HydrophobicContact CE1-CD 3.92Å; Y662-K664 HydrophobicContact CE1-CG 3.87Å; Y662-K664 PolarHBondContact O-N 2.85Å; K664-H666 PolarHBondContact O-N 3.35Å
665	K	27.6	Very low	32.1	Very low	185 Å²	185	128.4 Å²	128.4	80%	0.804	63%	0.634	S	S	*	*			trans	-58	104.8	171.3	-82.2	-167.1	173.1	-172.8	0	109.3	Q663 K667	Q663-K665 VanDerWaalsContact C-N 3.3Å; Q663-K665 PolarHBondContact O-N 2.86Å; K665-K667 PolarHBondContact O-N 2.86Å
666	H	28.6	Very low	31.6	Very low	134 Å²	134	134.5 Å²	134.5	62%	0.62	66%	0.662	S	S	*	*			trans	-62.8	112.4	166.8	-95.9	-105.5	0	0	0	108.8	K664 D668	K664-H666 PolarHBondContact O-N 3.35Å; H666-D668 IonicContact CE1-OD1 3.22Å; H666-D668 IonicContact CG-OD1 2.7Å; H666-D668 IonicContact CG-OD2 3.21Å; H666-D668 IonicContact ND1-OD1 2.83Å; H666-D668 PolarHBondContact ND1-OD1 3.33Å; H666-D668 IonicContact ND1-OD2 2.68Å; H666-D668 PolarHBondContact ND1-OD2 2.86Å
667	K	28.3	Very low	31.1	Very low	187 Å²	187	139.7 Å²	139.7	81%	0.813	69%	0.694	S	S	*	*			trans	-97.3	80	163.1	-104.2	-164.7	169.4	-166.5	0	107	K665 T669	K665-K667 PolarHBondContact O-N 2.86Å; K667-T669 PolarHBondContact O-N 3.25Å
668	D	27	Very low	30.4	Very low	130 Å²	130	135.4 Å²	135.4	70%	0.695	70%	0.697	S	S	*	*			trans	-78.8	75.4	178.6	-61.7	-28.4	0	0	0	109.3	H666	H666-D668 IonicContact CE1-OD1 3.22Å; H666-D668 IonicContact CG-OD1 2.7Å; H666-D668 IonicContact CG-OD2 3.21Å; H666-D668 IonicContact ND1-OD1 2.83Å; H666-D668 PolarHBondContact ND1-OD1 3.33Å; H666-D668 IonicContact ND1-OD2 2.68Å; H666-D668 PolarHBondContact ND1-OD2 2.86Å
669	T	26.4	Very low	29.6	Very low	115 Å²	115	137.1 Å²	137.1	71%	0.706	72%	0.717	S	S	*	*			trans	-138.2	79.3	-179.5	55.4	0	0	0	0	111.7	K667	K667-T669 PolarHBondContact O-N 3.25Å
670	S	27.1	Very low	28.9	Very low	107 Å²	107	141.2 Å²	141.2	75%	0.748	74%	0.736	S	S	*	*			trans	-163.6	87.2	164.7	-178.6	0	0	0	0	110.1
671	I	28	Very low	28.6	Very low	144 Å²	144	139.3 Å²	139.3	74%	0.738	73%	0.733	S	S	*	*				68.5	87.6	101	-59.7	160.2	0	0	0	113.8
672	H	28.9	Very low	28.2	Very low	160 Å²	160	140 Å²	140	74%	0.741	73%	0.73	S	S	*	*			trans	-174	145.1	141.8	-91.1	-33.5	0	0	0	107.8
673	S	28.9	Very low	28.2	Very low	91 Å²	91	136.3 Å²	136.3	64%	0.636	73%	0.728	S	S	*	*	S	Bend	cis	-164.3	122	-13.3	47.9	0	0	0	0	112.1
674	K	31.7	Very low	28.2	Very low	200 Å²	200	133.8 Å²	133.8	87%	0.87	72%	0.723	S	S	*	*			trans	155.2	142.4	136.2	-86.5	171.2	-180	-178.8	0	111
675	P	32.1	Very low	28.2	Very low	118 Å²	118	133.7 Å²	133.7	77%	0.766	73%	0.729	S	S	*	*			trans	-110.9	159.7	-171.6	40.4	-33.3	0	0	0	114.2
676	K	30.5	Very low	28.3	Very low	185 Å²	185	131.3 Å²	131.3	80%	0.804	73%	0.726	S	S	*	*				-175.4	116.1	121.9	-102.2	-179.2	178.9	-168.8	0	109
677	T	29.5	Very low	28.2	Very low	122 Å²	122	132.5 Å²	132.5	75%	0.748	74%	0.736	S	S	*	*				57.3	118.1	104	63.5	0	0	0	0	111.9
678	A	29.2	Very low	28.3	Very low	89 Å²	89	128.8 Å²	128.8	74%	0.736	73%	0.734	S	S	*	*				125.6	155.3	55.8	0	0	0	0	0	105.7
679	T	27.3	Very low	28.3	Very low	118 Å²	118	132 Å²	132	72%	0.724	74%	0.742	S	S	*	*			cis	-163.2	172.4	-26.3	-59.8	0	0	0	0	104.4
680	L	26.3	Very low	28.3	Very low	148 Å²	148	133.3 Å²	133.3	78%	0.775	75%	0.749	S	S	*	*			trans	70.1	122.1	168.8	-72.2	135	0	0	0	113.5
681	S	25.9	Very low	28.4	Very low	89 Å²	89	132.6 Å²	132.6	62%	0.622	74%	0.744	S	S	*	*				70.6	148	79.2	94.2	0	0	0	0	113
682	N	26.2	Very low	28.4	Very low	133 Å²	133	130.9 Å²	130.9	71%	0.711	74%	0.741	S	S	*	*			cis	-158.8	153.3	18.6	-151.5	11.3	0	0	0	111.3
683	T	26.8	Very low	28.4	Very low	116 Å²	116	128.6 Å²	128.6	71%	0.712	73%	0.734	S	S	*	*			trans	58.9	166.6	163.4	33.7	0	0	0	0	115.7
684	T	27.4	Very low	28.5	Very low	103 Å²	103	127.7 Å²	127.7	63%	0.632	72%	0.722	S	S	*	*			cis	-150.5	152	-1.7	-7.9	0	0	0	0	108.2
685	N	27.7	Very low	28.4	Very low	133 Å²	133	120.9 Å²	120.9	71%	0.711	70%	0.703	S	S	*	*			trans	65	156.9	150.7	-62.5	-10.2	0	0	0	117.9
686	N	30.4	Very low	28.3	Very low	136 Å²	136	122.5 Å²	122.5	73%	0.727	71%	0.705	S	S	*	*			cis	-148	173.3	-15.4	-122.7	-26.7	0	0	0	112.1
687	N	26.5	Very low	28.3	Very low	159 Å²	159	118.2 Å²	118.2	85%	0.85	70%	0.698	S	S	*	*			trans	-80.1	117.3	-177.4	-68.7	-77.7	0	0	0	114.8
688	S	30	Very low	28.2	Very low	108 Å²	108	119.2 Å²	119.2	76%	0.755	70%	0.698	S	S	*	*			trans	-162	120	146.7	49.3	0	0	0	0	107.9
689	K	26.7	Very low	28.3	Very low	198 Å²	198	120.4 Å²	120.4	86%	0.861	69%	0.69	S	S	*	*				70.1	137.3	50.4	-160.9	-172.5	-176.8	-166.4	0	111
690	V	27.9	Very low	28.3	Very low	142 Å²	142	121 Å²	121	86%	0.861	69%	0.689	S	S	*	*			trans	78.5	133.4	-165.7	-175.5	0	0	0	0	110.9
691	S	28.5	Very low	28.5	Very low	92 Å²	92	120.3 Å²	120.3	64%	0.643	69%	0.685	S	S	*	*			cis	-157.2	167.1	-20.9	-167.1	0	0	0	0	111.3
692	T	28.1	Very low	28.5	Very low	109 Å²	109	122.3 Å²	122.3	67%	0.669	69%	0.688	S	S	*	*			trans	16.4	129.6	148.9	50.6	0	0	0	0	121.5
693	N	29.8	Very low	28.6	Very low	112 Å²	112	123.5 Å²	123.5	60%	0.599	69%	0.689	S	S	*	*				93.8	134.5	125.8	-77.6	43.2	0	0	0	122.5
694	D	29.8	Very low	28.8	Very low	71 Å²	71	122.8 Å²	122.8	38%	0.38	68%	0.684	S	S	.	*			trans	66.9	130.4	140.4	-56	-39.1	0	0	0	123.6	L509	L509-D694 WeakPolarHBondContact CB-OD1 3.36Å; L509-D694 WeakPolarHBondContact CD1-OD1 3.31Å; L509-D694 WeakPolarHBondContact CD2-OD1 3.44Å; L509-D694 WeakPolarHBondContact CG-OD1 3.1Å
695	A	30	Very low	28.8	Very low	58 Å²	58	124.5 Å²	124.5	48%	0.479	69%	0.69	S	S	.	*			trans	-59.7	155	175.2	0	0	0	0	0	113.4
696	N	29.8	Very low	29	Very low	152 Å²	152	123.1 Å²	123.1	81%	0.813	68%	0.682	S	S	*	*				-168.9	169	99.7	-103.9	-67.3	0	0	0	113.8
697	S	30.8	Very low	29	Very low	94 Å²	94	125.2 Å²	125.2	66%	0.657	68%	0.68	S	S	*	*			trans	36	115.1	156.4	57	0	0	0	0	120.3
698	I	28.2	Very low	29.2	Very low	144 Å²	144	124.1 Å²	124.1	74%	0.738	67%	0.67	S	S	*	*				90.2	117.1	58.7	-75.9	171.9	0	0	0	114.1
699	I	30.6	Very low	29.4	Very low	113 Å²	113	125.6 Å²	125.6	58%	0.579	66%	0.663	S	S	*	*			trans	80.9	126	148.6	-86.7	171.7	0	0	0	120.5	P502	P502-I699 HydrophobicContact CG-CD1 4.15Å
700	D	28	Very low	29.7	Very low	131 Å²	131	122.7 Å²	122.7	70%	0.701	65%	0.652	S	S	*	*			trans	66.3	159.8	145.8	-71.2	10.1	0	0	0	119.4
701	I	29.2	Very low	29.9	Very low	133 Å²	133	122.2 Å²	122.2	68%	0.682	64%	0.641	S	S	*	*			cis	-151.3	159.9	-2.5	-127.6	167.6	0	0	0	112.7
702	L	26.2	Very low	30.3	Very low	132 Å²	132	124.3 Å²	124.3	69%	0.691	64%	0.64	S	S	*	*			trans	30.9	124.4	159.1	-56.7	170.1	0	0	0	122.6
703	H	29.1	Very low	30.6	Very low	158 Å²	158	125.4 Å²	125.4	73%	0.731	64%	0.641	S	S	*	*				91.5	143.6	121	-88.2	-138.2	0	0	0	124.4
704	T	29.8	Very low	30.9	Very low	100 Å²	100	126.8 Å²	126.8	61%	0.613	65%	0.649	S	S	*	*			trans	67.4	109.9	146.8	46.6	0	0	0	0	121.6
705	N	28.9	Very low	31.1	Very low	139 Å²	139	128.1 Å²	128.1	74%	0.743	66%	0.659	S	S	*	*				75.4	155	127.5	-55.5	-4.7	0	0	0	117.3
706	D	31.4	Very low	31.3	Very low	104 Å²	104	131.8 Å²	131.8	56%	0.556	67%	0.671	S	S	*	*			cis	-150.3	167.6	5.5	-141.1	-21.5	0	0	0	113.8
707	R	30.6	Very low	31.4	Very low	180 Å²	180	134.8 Å²	134.8	68%	0.679	67%	0.671	S	S	*	*			trans	47.6	115.3	144.6	-82.5	153	-147.9	-128.3	0	121.7
708	Q	31	Very low	31.5	Very low	136 Å²	136	134.7 Å²	134.7	64%	0.636	67%	0.67	S	S	*	*				89.6	152.4	85.4	-81.7	-179.4	24.2	0	0	113.3
709	K	32.2	Very low	31.7	Very low	139 Å²	139	133 Å²	133	60%	0.604	67%	0.671	S	S	*	*			cis	-165	154.9	13.4	-129.7	169.1	179.4	151	0	113.3
710	H	34.2	Very low	31.7	Very low	137 Å²	137	135.1 Å²	135.1	63%	0.634	68%	0.682	S	S	*	*			trans	63.1	162.8	145.1	-68.9	-21.5	0	0	0	120
711	Q	32.3	Very low	32	Very low	133 Å²	133	134.1 Å²	134.1	62%	0.621	68%	0.683	S	S	*	*			cis	-166.3	171.8	-14.9	-104.4	163.6	-46.2	0	0	106.7
712	H	36.4	Very low	31.9	Very low	135 Å²	135	136.3 Å²	136.3	63%	0.625	68%	0.684	S	S	*	*			cis	-158.9	157.4	-3.8	-127.5	-52.8	0	0	0	110
713	N	34.5	Very low	31.8	Very low	132 Å²	132	134.8 Å²	134.8	71%	0.706	68%	0.684	S	S	*	*			trans	61.3	152	148.1	-70.1	1.4	0	0	0	123.2
714	D	35.2	Very low	31.8	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	69%	0.69	S	S	*	*			cis	-163.4	-150.5	-34.3	-155.5	19	0	0	0	106.6
715	V	35.7	Very low	31.6	Very low	98 Å²	98	139 Å²	139	59%	0.594	70%	0.699	S	S	*	*			cis	-156.5	150.3	1	70.4	0	0	0	0	110.5
716	N	33.4	Very low	31.4	Very low	136 Å²	136	138.9 Å²	138.9	73%	0.727	70%	0.698	S	S	*	*			trans	60.5	147.9	161.8	-76.2	-31.3	0	0	0	120
717	R	30.9	Very low	31.1	Very low	214 Å²	214	138.4 Å²	138.4	81%	0.808	70%	0.703	S	S	*	*			cis	-146.9	127.8	-1.7	-115	-177.6	176.7	171.1	-2.8	107.1
718	S	32.7	Very low	31	Very low	92 Å²	92	137 Å²	137	64%	0.643	71%	0.709	S	S	*	*				66.8	129.6	90.4	89.1	0	0	0	0	114.6
719	S	32.9	Very low	30.8	Very low	109 Å²	109	139.8 Å²	139.8	76%	0.762	72%	0.719	S	S	*	*			cis	-161.7	174.8	15.5	-83.3	0	0	0	0	114.4
720	I	30.2	Very low	30.5	Very low	158 Å²	158	137.3 Å²	137.3	81%	0.81	72%	0.72	S	S	*	*			trans	-134.3	-168.6	166.6	-5.2	175.6	0	0	0	107.5
721	P	35.2	Very low	30.2	Very low	109 Å²	109	137.9 Å²	137.9	71%	0.708	72%	0.72	S	S	*	*			cis	-145	169.3	23.1	43.7	-22.4	0	0	0	119.7
722	Y	26.2	Very low	29.9	Very low	180 Å²	180	140.7 Å²	140.7	71%	0.706	73%	0.73	S	S	*	*			trans	33.3	142	141.5	-80.9	-91.6	0	0	0	125.6
723	S	25.9	Very low	29.3	Very low	99 Å²	99	140.1 Å²	140.1	69%	0.692	73%	0.731	S	S	*	*			trans	69.3	142	138.9	76	0	0	0	0	119.7
724	L	29	Very low	28.9	Very low	165 Å²	165	142.2 Å²	142.2	86%	0.864	73%	0.734	S	S	*	*				-164.3	-173.4	79.9	-111.6	169.6	0	0	0	115.2
725	F	24.1	Very low	28.5	Very low	181 Å²	181	144.3 Å²	144.3	79%	0.794	74%	0.736	S	S	*	*			trans	-83.4	177.1	-173.8	-116.8	-110.5	0	0	0	114.7
726	N	25.2	Very low	28.1	Very low	138 Å²	138	145.6 Å²	145.6	74%	0.738	74%	0.739	S	S	*	*			trans	82.8	110.9	147.7	-86	-17.8	0	0	0	122.1
727	S	26.2	Very low	27.9	Very low	93 Å²	93	143.9 Å²	143.9	65%	0.65	74%	0.738	S	S	*	*				84	166	111.4	-153.5	0	0	0	0	120.7
728	N	28.2	Very low	27.9	Very low	152 Å²	152	137.3 Å²	137.3	81%	0.813	73%	0.725	S	S	*	*			trans	69.9	112.4	166.1	-65.9	-32.1	0	0	0	119.7
729	K	27.2	Very low	27.9	Very low	193 Å²	193	135.8 Å²	135.8	84%	0.839	71%	0.714	S	S	*	*			trans	-55.6	166.3	156.4	-62.1	171.2	173.8	174.2	0	111.8
730	S	25.2	Very low	27.7	Very low	88 Å²	88	136 Å²	136	62%	0.615	71%	0.707	S	S	*	*			trans	87.6	114.5	141.2	-75.4	0	0	0	0	120.1
731	K	27.2	Very low	27.8	Very low	148 Å²	148	137 Å²	137	64%	0.643	71%	0.708	S	S	*	*				81.6	128.7	128.8	-66.3	172.6	-176.4	179	0	118.6	E627	E627-K731 WeakPolarHBondContact OE1-CE 3.33Å; E627-K731 IonicContact OE1-NZ 3.55Å; E627-K731 PolarHBondContact OE1-NZ 3.07Å
732	K	26.1	Very low	27.6	Very low	192 Å²	192	135.8 Å²	135.8	84%	0.835	70%	0.702	S	S	*	*			trans	72.4	140.1	147.5	-78	-167.7	173.2	-176.7	0	117
733	L	24.8	Very low	27.8	Very low	123 Å²	123	133.7 Å²	133.7	64%	0.644	70%	0.703	S	S	*	*			cis	171.7	135.9	0.5	-178.4	76.3	0	0	0	106.4
734	K	25.9	Very low	28	Very low	176 Å²	176	134.8 Å²	134.8	77%	0.765	70%	0.701	S	S	*	*			trans	67.9	152.4	153.2	-86.2	174.2	-177.2	-177.1	0	120.6
735	K	26.9	Very low	28.1	Very low	186 Å²	186	135.3 Å²	135.3	81%	0.809	70%	0.698	S	S	*	*			trans	71.8	141	166	-68.8	-170.5	170.5	-169.4	0	114.6
736	L	27.1	Very low	28.4	Very low	126 Å²	126	135.5 Å²	135.5	66%	0.66	70%	0.702	S	S	*	*			cis	-151.8	148.7	2.2	-128.6	165.1	0	0	0	110.6
737	S	28.8	Very low	28.4	Very low	100 Å²	100	137.9 Å²	137.9	70%	0.699	71%	0.706	S	S	*	*			trans	55.9	138.6	156.1	42.5	0	0	0	0	119.9
738	S	31.8	Very low	28.5	Very low	75 Å²	75	140 Å²	140	52%	0.524	71%	0.708	S	S	.	*			cis	-166.3	161.3	-7.1	47.1	0	0	0	0	111.2
739	S	31.7	Very low	28.6	Very low	60 Å²	60	139.5 Å²	139.5	42%	0.42	71%	0.706	S	S	.	*			trans	62	140	142.9	56.1	0	0	0	0	120	S613	S613-S739 WeakPolarHBondContact O-CB 3.36Å
740	N	29.4	Very low	28.7	Very low	114 Å²	114	136.3 Å²	136.3	61%	0.61	70%	0.698	S	S	*	*			cis	-175.8	139.3	-7.6	-104.2	-3.5	0	0	0	103.1	S613 S614	S613-N740 PolarHBondContact O-ND2 2.94Å; S614-N740 PolarHBondContact O-ND2 3.03Å
741	Q	32	Very low	29	Very low	180 Å²	180	139.3 Å²	139.3	84%	0.841	70%	0.704	S	S	*	*			cis	54	128.5	42.5	-89.4	-172.4	-32.2	0	0	113.7
742	S	30.2	Very low	29	Very low	82 Å²	82	138.4 Å²	138.4	57%	0.573	71%	0.706	S	S	*	*			cis	-157.5	-138.8	15.1	40.2	0	0	0	0	110.5
743	D	31.4	Very low	29.2	Very low	136 Å²	136	135.3 Å²	135.3	73%	0.727	70%	0.704	S	S	*	*			trans	85.3	82.2	157.7	-50.7	0.5	0	0	0	113.4
744	D	30.3	Very low	29.4	Very low	123 Å²	123	138.2 Å²	138.2	66%	0.658	71%	0.711	S	S	*	*				74.4	147	53.8	-67.7	-62.6	0	0	0	115.2
745	H	29.9	Very low	29.5	Very low	175 Å²	175	137.4 Å²	137.4	81%	0.81	71%	0.713	S	S	*	*			trans	75	152.3	173.5	-41.3	-43.7	0	0	0	114.7
746	Q	30.6	Very low	29.4	Very low	186 Å²	186	133.5 Å²	133.5	87%	0.869	71%	0.709	S	S	*	*			cis	-124.5	154.5	12.2	-73.1	178.9	6	0	0	115.5
747	K	25.8	Very low	29.7	Very low	187 Å²	187	135.2 Å²	135.2	81%	0.813	71%	0.714	S	S	*	*			trans	-51.5	176.2	165.7	-62.3	162.3	163.2	174.3	0	114.8
748	I	27.5	Very low	29.7	Very low	138 Å²	138	134.7 Å²	134.7	71%	0.708	71%	0.711	S	S	*	*			trans	88.3	87.3	157.5	-56.9	137.5	0	0	0	115.9
749	N	31.8	Very low	29.6	Very low	142 Å²	142	140.2 Å²	140.2	76%	0.759	73%	0.725	S	S	*	*				179.9	129.3	109	-87.8	-46.1	0	0	0	107.8
750	N	29	Very low	29.3	Very low	125 Å²	125	142.2 Å²	142.2	67%	0.668	74%	0.735	S	S	*	*			cis	100.6	123.4	34.4	-168.6	24.9	0	0	0	111.3
751	M	30.5	Very low	29.4	Very low	152 Å²	152	146.3 Å²	146.3	75%	0.749	75%	0.748	S	S	*	*			trans	62.6	160.4	-176.4	-49.6	-162.2	-167.7	0	0	115.4
752	N	26.9	Very low	29.3	Very low	128 Å²	128	141.2 Å²	141.2	68%	0.684	73%	0.729	S	S	*	*			cis	-169.6	159.2	-37.7	-99.9	-32.8	0	0	0	106
753	T	31	Very low	29.2	Very low	128 Å²	128	144.6 Å²	144.6	79%	0.785	74%	0.741	S	S	*	*			trans	64.5	159.1	177.9	73.1	0	0	0	0	115.4
754	K	29.8	Very low	29	Very low	184 Å²	184	143 Å²	143	80%	0.8	74%	0.74	S	S	*	*			cis	-154	109.8	-22.2	-107.9	164.2	-178.4	-178.3	0	103.8
755	I	27.4	Very low	29.1	Very low	158 Å²	158	145.8 Å²	145.8	81%	0.81	75%	0.749	S	S	*	*				61.3	114.9	90.2	-63.5	-179.6	0	0	0	115
756	S	25.5	Very low	29.1	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	74%	0.743	S	S	*	*			trans	80.6	98.6	156.7	-62.3	0	0	0	0	122.7
757	E	31.7	Very low	29	Very low	163 Å²	163	138 Å²	138	76%	0.762	73%	0.734	S	S	*	*			trans	-127.2	147.9	138.2	-73.9	179.6	-110.7	0	0	107.1	F759	E757-F759 WeakPolarHBondContact OE2-CE2 3.47Å
758	S	28.8	Very low	29.1	Very low	89 Å²	89	134.3 Å²	134.3	62%	0.622	73%	0.728	S	S	*	*			cis	69.6	84.2	-14	68.8	0	0	0	0	121.3	T760	S758-T760 PolarHBondContact O-N 3.49Å
759	F	30.1	Very low	29.2	Very low	191 Å²	191	132.7 Å²	132.7	84%	0.838	72%	0.72	S	S	*	*			trans	-89.5	83.5	154.4	-112.6	-87.7	0	0	0	111.6	E757	E757-F759 WeakPolarHBondContact OE2-CE2 3.47Å
760	T	26.9	Very low	29.1	Very low	101 Å²	101	132.2 Å²	132.2	62%	0.62	72%	0.718	S	S	*	*			trans	-107.2	157.9	158.7	40.9	0	0	0	0	109.1	S758	S758-T760 PolarHBondContact O-N 3.49Å
761	F	30.7	Very low	29.5	Very low	200 Å²	200	131.1 Å²	131.1	88%	0.877	72%	0.717	S	S	*	*			trans	-140.1	78.9	170.2	-157.1	-82.6	0	0	0	106.2
762	T	28.7	Very low	29.3	Very low	73 Å²	73	129.5 Å²	129.5	45%	0.448	72%	0.716	S	S	.	*				49.1	98	71.5	73.2	0	0	0	0	111.6
763	D	28.4	Very low	29.3	Very low	154 Å²	154	128.1 Å²	128.1	82%	0.824	72%	0.717	S	S	*	*				88.9	107.2	60.3	-74.8	-46.1	0	0	0	112.7
764	S	27.9	Very low	29.2	Very low	101 Å²	101	126.8 Å²	126.8	71%	0.706	71%	0.712	S	S	*	*			trans	176.9	132.4	166	33	0	0	0	0	108.1
765	H	31.5	Very low	29.1	Very low	182 Å²	182	123.6 Å²	123.6	84%	0.843	71%	0.713	S	S	*	*			cis	-153.5	162.7	-8	-93.9	-60.4	0	0	0	109.9
766	S	30.5	Very low	29.4	Very low	99 Å²	99	119.2 Å²	119.2	69%	0.692	71%	0.707	S	S	*	*			trans	58.1	126	158.6	-108.8	0	0	0	0	119.2
767	S	28.5	Very low	29.6	Very low	98 Å²	98	120.2 Å²	120.2	69%	0.685	71%	0.709	S	S	*	*			cis	67.8	133.1	24.3	108.6	0	0	0	0	113.6
768	T	27.6	Very low	29.6	Very low	111 Å²	111	119.7 Å²	119.7	68%	0.681	71%	0.708	S	S	*	*			cis	-161.3	-173.5	-10.7	-72.1	0	0	0	0	106.7
769	L	31	Very low	29.8	Very low	103 Å²	103	121.8 Å²	121.8	54%	0.539	71%	0.712	S	S	.	*			trans	103.3	97.1	152.5	-55.6	169.7	0	0	0	117.8
770	D	28.1	Very low	29.9	Very low	133 Å²	133	117.2 Å²	117.2	71%	0.711	70%	0.704	S	S	*	*				65.2	-177.7	115.1	-50.6	-8	0	0	0	118
771	P	37.5	Very low	30.3	Very low	102 Å²	102	116.4 Å²	116.4	66%	0.662	71%	0.708	S	S	*	*				-136.4	-167.3	-85.1	43.2	-26.3	0	0	0	114.1
772	T	27.4	Very low	30.4	Very low	117 Å²	117	114.6 Å²	114.6	72%	0.718	70%	0.702	S	S	*	*			trans	59.6	129.3	153.1	52.5	0	0	0	0	121.2
773	S	27.4	Very low	30.6	Very low	100 Å²	100	117.8 Å²	117.8	70%	0.699	72%	0.715	S	S	*	*			trans	69.6	130.8	133.7	65.6	0	0	0	0	122.6
774	S	28.6	Very low	30.8	Very low	99 Å²	99	118.3 Å²	118.3	69%	0.692	71%	0.71	S	S	*	*			trans	71.4	113.3	131.2	64.5	0	0	0	0	122
775	S	27.8	Very low	31.1	Very low	118 Å²	118	120.8 Å²	120.8	83%	0.825	71%	0.71	S	S	*	*				72.3	160.9	129.9	72.2	0	0	0	0	120
776	G	32.3	Very low	31.3	Very low	65 Å²	65	119 Å²	119	67%	0.67	70%	0.702	S	S	*	*			trans	87.2	76.9	-174.2	0	0	0	0	0	110.5
777	T	29.6	Very low	31.6	Very low	126 Å²	126	121.8 Å²	121.8	77%	0.773	70%	0.704	S	S	*	*				53.6	96.3	50.6	-35.1	0	0	0	0	111.7
778	M	32.5	Very low	31.9	Very low	151 Å²	151	123.5 Å²	123.5	74%	0.744	71%	0.706	S	S	*	*				168.4	138.4	118.2	-94	-155.2	145.1	0	0	113.8
779	N	32.3	Very low	32.3	Very low	133 Å²	133	124.7 Å²	124.7	71%	0.711	71%	0.708	S	S	*	*			trans	65.8	144.5	136.9	-65.8	-4.7	0	0	0	120.8
780	S	33.1	Very low	32.4	Very low	95 Å²	95	126.5 Å²	126.5	66%	0.664	72%	0.718	S	S	*	*			cis	-164.9	173.1	-16	-169.1	0	0	0	0	110.3
781	A	35.7	Very low	32.7	Very low	84 Å²	84	125.6 Å²	125.6	69%	0.694	72%	0.717	S	S	*	*			trans	81.5	137.1	147.7	0	0	0	0	0	119.1
782	Q	32.6	Very low	32.5	Very low	162 Å²	162	129 Å²	129	76%	0.757	72%	0.722	S	S	*	*			cis	-173.7	175.5	-24.5	-126.4	171	17.1	0	0	108.8
783	I	32.9	Very low	32.8	Very low	141 Å²	141	132.3 Å²	132.3	72%	0.723	73%	0.729	S	S	*	*			trans	71	140	157.7	-68.3	150.7	0	0	0	116.5
784	K	32.5	Very low	33	Very low	164 Å²	164	133.2 Å²	133.2	71%	0.713	74%	0.736	S	S	*	*			cis	-177.3	161.4	-34	-121.9	171.4	-177.3	176.3	0	108.1
785	Q	34.2	Very low	33.2	Very low	153 Å²	153	133.9 Å²	133.9	72%	0.715	74%	0.74	S	S	*	*			trans	68.7	150.3	158.1	-67.7	163.3	-38.8	0	0	116.8
786	Q	35	Very low	33.4	Very low	145 Å²	145	133.5 Å²	133.5	68%	0.678	74%	0.738	S	S	*	*			cis	-164	171.2	-13.2	-122.1	163.9	-17.5	0	0	112.4
787	H	37.6	Very low	33.5	Very low	157 Å²	157	135.2 Å²	135.2	73%	0.727	74%	0.737	S	S	*	*			trans	71.1	94.6	157.3	-74.9	-64.9	0	0	0	123
788	N	34.4	Very low	33.4	Very low	135 Å²	135	135 Å²	135	72%	0.722	74%	0.741	S	S	*	*				11	126.4	122.4	-69.2	8.4	0	0	0	119.9
789	N	35.5	Very low	33.4	Very low	136 Å²	136	137.8 Å²	137.8	73%	0.727	74%	0.743	S	S	*	*				176.8	142.4	90.4	-96.9	-36.6	0	0	0	114.4
790	N	33.6	Very low	33.1	Very low	141 Å²	141	143 Å²	143	75%	0.754	75%	0.753	S	S	*	*			trans	9.5	139.1	152.9	-52.1	-33.8	0	0	0	119.5
791	T	33.7	Very low	33.1	Very low	113 Å²	113	145.3 Å²	145.3	69%	0.693	76%	0.756	S	S	*	*				-171.1	135.3	61.1	-58.6	0	0	0	0	113.5
792	K	34.2	Very low	32.8	Very low	173 Å²	173	145.4 Å²	145.4	75%	0.752	76%	0.756	S	S	*	*			trans	50.3	108.2	159.4	-66	168.4	-172	175	0	118.4
793	Q	32.9	Very low	32.8	Very low	187 Å²	187	144.8 Å²	144.8	87%	0.874	76%	0.757	S	S	*	*				69.4	130.3	79.8	-71.7	175.4	-11.2	0	0	114.4
794	S	31.9	Very low	33	Very low	120 Å²	120	142.8 Å²	142.8	84%	0.839	75%	0.754	S	S	*	*			cis	-147.9	131.7	4	58.5	0	0	0	0	113.1
795	S	33	Very low	33	Very low	113 Å²	113	143.6 Å²	143.6	79%	0.79	77%	0.766	S	S	*	*			trans	-103.7	162.2	171.8	55	0	0	0	0	112.7
796	S	31.8	Very low	32.8	Very low	110 Å²	110	140.2 Å²	140.2	77%	0.769	76%	0.759	S	S	*	*			trans	-15.8	136.6	169.6	-48.7	0	0	0	0	118.9
797	P	34	Very low	32.7	Very low	101 Å²	101	138.7 Å²	138.7	66%	0.656	75%	0.754	S	S	*	*			trans	-113.2	122.8	134.3	33.2	-28.8	0	0	0	111.2	R799	P797-R799 HydrophobicContact CB-CG 4.42Å; P797-R799 HydrophobicContact CG-CG 4.49Å; P797-R799 PolarHBondContact O-N 3.38Å
798	S	28.8	Very low	32.4	Very low	122 Å²	122	141.4 Å²	141.4	85%	0.853	77%	0.765	S	S	*	*			trans	-69.1	77.4	167	-65.6	0	0	0	0	110.4	R800	S798-R800 PolarHBondContact O-N 2.86Å
799	R	31.2	Very low	32.2	Very low	208 Å²	208	145 Å²	145	79%	0.785	77%	0.774	S	S	*	*			trans	-69.1	96.2	175	-72.5	-166.7	177.7	-155.6	-1	110.1	P797 I801	P797-R799 HydrophobicContact CB-CG 4.42Å; P797-R799 HydrophobicContact CG-CG 4.49Å; P797-R799 PolarHBondContact O-N 3.38Å; R799-I801 HydrophobicContact CB-CG1 4.44Å; R799-I801 PolarHBondContact O-N 3.4Å
800	R	27.5	Very low	31.8	Very low	244 Å²	244	143.1 Å²	143.1	92%	0.921	78%	0.777	S	S	*	*			trans	-57.4	95.8	146.5	-73.6	-175.5	-178.4	176.1	2.2	106.8	S798 A802	S798-R800 PolarHBondContact O-N 2.86Å; R800-A802 PolarHBondContact O-N 2.87Å; R800-A802 VanDerWaalsContact O-N 3.15Å
801	I	31.8	Very low	31.6	Very low	143 Å²	143	144.2 Å²	144.2	73%	0.733	78%	0.782	S	S	*	*			trans	-73.2	102.1	159.1	-62.3	178.1	0	0	0	104.8	R799 L803	R799-I801 HydrophobicContact CB-CG1 4.44Å; R799-I801 PolarHBondContact O-N 3.4Å; I801-L803 PolarHBondContact O-N 3.35Å
802	A	30.1	Very low	31.3	Very low	85 Å²	85	146.2 Å²	146.2	70%	0.702	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-59.7	120.5	163.6	0	0	0	0	0	107.1	R800	R800-A802 PolarHBondContact O-N 2.87Å; R800-A802 VanDerWaalsContact O-N 3.15Å
803	L	32.9	Very low	31.2	Very low	149 Å²	149	143.6 Å²	143.6	78%	0.78	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-64.7	133.1	162.6	-78.4	165.5	0	0	0	106.8	I801 D805	I801-L803 PolarHBondContact O-N 3.35Å; L803-D805 PolarHBondContact O-N 2.78Å
804	P	36.6	Very low	31.2	Very low	99 Å²	99	143.1 Å²	143.1	64%	0.643	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-60.2	130.3	178.7	-25.1	34.9	0	0	0	111.2	S806	P804-S806 VanDerWaalsContact CB-OG 3.24Å; P804-S806 WeakPolarHBondContact CB-OG 3.37Å; P804-S806 PolarHBondContact O-N 2.8Å
805	D	31.5	Very low	31.3	Very low	181 Å²	181	144 Å²	144	97%	0.968	79%	0.785	S	S	*	*	S	Bend	trans	-73.2	56.6	168.7	-80.4	-49.6	0	0	0	110.6	L803	L803-D805 PolarHBondContact O-N 2.78Å
806	S	31.9	Very low	31.1	Very low	83 Å²	83	144.3 Å²	144.3	58%	0.58	78%	0.782	S	S	*	*			trans	-152.1	56.6	-170	71.7	0	0	0	0	113.4	P804	P804-S806 VanDerWaalsContact CB-OG 3.24Å; P804-S806 WeakPolarHBondContact CB-OG 3.37Å; P804-S806 PolarHBondContact O-N 2.8Å
807	I	32.6	Very low	31.3	Very low	112 Å²	112	142.5 Å²	142.5	57%	0.574	78%	0.782	S	S	*	*			trans	-153.3	62.4	155.1	-96.9	142.6	0	0	0	109	K348	K348-I807 HydrophobicContact CG-CD1 4.27Å
808	F	31.5	Very low	31.4	Very low	214 Å²	214	146.8 Å²	146.8	94%	0.939	79%	0.793	S	S	*	*			trans	-146.1	49	170.8	-113	-70.8	0	0	0	112.8
809	K	28.8	Very low	31.5	Very low	210 Å²	210	150.2 Å²	150.2	91%	0.913	79%	0.792	S	S	*	*			trans	-151	80	172.4	-105.2	178.5	179.5	177	0	110.6
810	A	28.5	Very low	31.7	Very low	97 Å²	97	146.8 Å²	146.8	80%	0.802	80%	0.795	S	S	*	*	S	Bend	trans	-162.7	47.2	176.8	0	0	0	0	0	113.7
811	L	28.5	Very low	32.1	Very low	164 Å²	164	138.1 Å²	138.1	86%	0.859	78%	0.781	S	S	*	*	S	Bend	trans	176.9	86	159.4	-101.5	162.2	0	0	0	108.9
812	D	28.1	Very low	32.3	Very low	156 Å²	156	138.1 Å²	138.1	83%	0.834	78%	0.782	S	S	*	*			trans	153.2	82.6	153.8	-82.1	-13.3	0	0	0	110.1
813	T	32.1	Very low	32.7	Very low	117 Å²	117	141.3 Å²	141.3	72%	0.718	79%	0.788	S	S	*	*			trans	-151.7	77.9	169	-47.6	0	0	0	0	111
814	L	32.2	Very low	32.9	Very low	178 Å²	178	140.4 Å²	140.4	93%	0.932	78%	0.784	S	S	*	*			trans	-136.3	72	155	-83.7	-175.4	0	0	0	109.9
815	N	33.5	Very low	32.9	Very low	139 Å²	139	142.6 Å²	142.6	74%	0.743	79%	0.79	S	S	*	*			trans	13.9	115.9	158.2	-56.7	-0.2	0	0	0	118.9
816	T	30.3	Very low	33.1	Very low	118 Å²	118	137.5 Å²	137.5	72%	0.724	78%	0.781	S	S	*	*			trans	-92.7	131.6	137.7	47.3	0	0	0	0	109.1
817	G	35.4	Very low	33.4	Very low	73 Å²	73	139.4 Å²	139.4	75%	0.753	78%	0.784	S	S	*	*			trans	-152.4	143.4	173.9	0	0	0	0	0	109.7
818	E	35.2	Very low	33.7	Very low	190 Å²	190	141.3 Å²	141.3	89%	0.888	79%	0.788	S	S	*	*			trans	-101	178.8	-164.2	-65.5	-170.4	98.1	0	0	114.5
819	K	32.3	Very low	33.8	Very low	194 Å²	194	139.6 Å²	139.6	84%	0.843	78%	0.78	S	S	*	*			trans	-78.2	151.8	-173.8	-53.6	169.8	177.6	178.3	0	113.1
820	T	35.2	Very low	34.2	Very low	137 Å²	137	139 Å²	139	84%	0.84	78%	0.778	S	S	*	*				173.9	123.2	106.9	37	0	0	0	0	106
821	G	34.3	Very low	34.6	Very low	61 Å²	61	138.8 Å²	138.8	63%	0.629	77%	0.77	S	S	*	*				105.4	145.4	74.5	0	0	0	0	0	108.1
822	D	36.5	Very low	35.1	Very low	143 Å²	143	138.3 Å²	138.3	77%	0.765	77%	0.769	S	S	*	*			cis	-154.5	164.8	-3.4	-70.3	-53.7	0	0	0	109.6
823	D	38.1	Very low	35.5	Very low	153 Å²	153	135.9 Å²	135.9	82%	0.818	76%	0.764	S	S	*	*			trans	50.9	145.6	157.1	-49.4	-22.5	0	0	0	120.6
824	D	38.1	Very low	35.6	Very low	130 Å²	130	140 Å²	140	70%	0.695	77%	0.772	S	S	*	*			cis	-169.8	149	19.8	-152.2	22.9	0	0	0	114.7
825	N	37.4	Very low	35.7	Very low	144 Å²	144	136.1 Å²	136.1	77%	0.77	76%	0.76	S	S	*	*			trans	47.2	122.9	146.8	-79	-41.3	0	0	0	127.8
826	G	34.8	Very low	36	Very low	75 Å²	75	138.8 Å²	138.8	77%	0.773	77%	0.768	S	S	*	*			trans	115.4	148	131.4	0	0	0	0	0	119.7
827	D	38.6	Very low	36.1	Very low	123 Å²	123	136.7 Å²	136.7	66%	0.658	77%	0.769	S	S	*	*			cis	-163.9	149.8	-20.9	-155.1	-2.5	0	0	0	114.4
828	K	37.6	Very low	36	Very low	151 Å²	151	139.3 Å²	139.3	66%	0.657	78%	0.776	S	S	*	*			trans	50	126	156.9	-80.2	147.3	-154.9	152	0	126.6
829	K	35.6	Very low	35.7	Very low	178 Å²	178	139.3 Å²	139.3	77%	0.774	77%	0.773	S	S	*	*			trans	78.6	121	133.1	-68.7	170.7	-177.7	177.8	0	119.5
830	K	35.4	Very low	35.6	Very low	198 Å²	198	138.5 Å²	138.5	86%	0.861	78%	0.777	S	S	*	*				87.7	142.3	68.9	-89.8	-166.5	174.7	-166.6	0	113.3
831	S	37.7	Very low	35.5	Very low	92 Å²	92	137 Å²	137	64%	0.643	77%	0.77	S	S	*	*			cis	-164.9	158.3	18.3	35.2	0	0	0	0	116.1
832	D	37.9	Very low	35.2	Very low	154 Å²	154	140 Å²	140	82%	0.824	78%	0.776	S	S	*	*			trans	62	132.9	145	-58.1	-9.8	0	0	0	121.9
833	S	36.9	Very low	34.9	Very low	106 Å²	106	139.3 Å²	139.3	74%	0.741	78%	0.777	S	S	*	*			cis	-180	160.5	28.7	49.3	0	0	0	0	114.8
834	K	35.3	Very low	34.5	Very low	202 Å²	202	137.8 Å²	137.8	88%	0.878	77%	0.774	S	S	*	*			trans	53.7	143.3	153.2	-71.9	175.2	-178.3	176.1	0	121
835	S	34.6	Very low	34.1	Very low	98 Å²	98	137.3 Å²	137.3	69%	0.685	78%	0.776	S	S	*	*			cis	-166.9	170.8	2.8	53.6	0	0	0	0	113.7
836	H	38.1	Very low	33.7	Very low	195 Å²	195	136.3 Å²	136.3	90%	0.903	78%	0.775	S	S	*	*			trans	60	147.2	164.2	-67.5	-72.7	0	0	0	122.3
837	G	32.4	Very low	33.3	Very low	73 Å²	73	138.1 Å²	138.1	75%	0.753	77%	0.771	S	S	*	*			trans	138.5	100.6	171.4	0	0	0	0	0	114.7
838	S	33.7	Very low	32.7	Very low	129 Å²	129	138.3 Å²	138.3	90%	0.902	78%	0.777	S	S	*	*			trans	-51	145.4	-174.3	40.2	0	0	0	0	117.6
839	K	29.8	Very low	32.3	Very low	190 Å²	190	135.8 Å²	135.8	83%	0.826	78%	0.784	S	S	*	*			trans	-138.5	149.6	172.2	-90.2	-171.9	174.3	-175.4	0	111.3
840	L	29.9	Very low	31.9	Very low	177 Å²	177	132.1 Å²	132.1	93%	0.927	78%	0.781	S	S	*	*			trans	-158.4	101.5	148.6	-142	126.6	0	0	0	114
841	P	33	Very low	31.6	Very low	106 Å²	106	128.9 Å²	128.9	69%	0.688	77%	0.772	S	S	*	*			trans	-123.4	172.3	163.5	38.6	-26.8	0	0	0	113.1
842	T	28.6	Very low	31.2	Very low	124 Å²	124	131.9 Å²	131.9	76%	0.761	77%	0.774	S	S	*	*			trans	-64	150.2	177.4	48.6	0	0	0	0	115.1
843	T	29.5	Very low	30.8	Very low	128 Å²	128	133.6 Å²	133.6	79%	0.785	77%	0.769	S	S	*	*				175.3	125.7	115	36.2	0	0	0	0	115.3
844	T	29.4	Very low	30.4	Very low	121 Å²	121	134.2 Å²	134.2	74%	0.742	76%	0.764	S	S	*	*			trans	62.8	157.5	130	-25	0	0	0	0	124.6
845	T	28.9	Very low	30.4	Very low	120 Å²	120	130.7 Å²	130.7	74%	0.736	76%	0.764	S	S	*	*			trans	92.9	94.9	149.3	34.5	0	0	0	0	123.4
846	T	28.8	Very low	29.9	Very low	122 Å²	122	132 Å²	132	75%	0.748	76%	0.762	S	S	*	*				75.9	140.3	122.1	-27.8	0	0	0	0	123.8
847	T	27.3	Very low	29.6	Very low	113 Å²	113	131 Å²	131	69%	0.693	76%	0.762	S	S	*	*			trans	108.7	107.2	139.9	-11.8	0	0	0	0	120.5
848	T	26.7	Very low	29.3	Very low	127 Å²	127	136.4 Å²	136.4	78%	0.779	76%	0.764	S	S	*	*			trans	63.2	134.8	146.6	45.2	0	0	0	0	124.1
849	A	29.2	Very low	28.8	Very low	98 Å²	98	141.4 Å²	141.4	81%	0.81	76%	0.764	S	S	*	*			trans	69.3	148.6	150.4	0	0	0	0	0	119
850	S	25.9	Very low	28.6	Very low	101 Å²	101	136.8 Å²	136.8	71%	0.706	76%	0.755	S	S	*	*			cis	-166.4	169.4	-26.4	-168	0	0	0	0	109.1
851	L	29.9	Very low	28.5	Very low	130 Å²	130	133.5 Å²	133.5	68%	0.681	74%	0.742	S	S	*	*			trans	70.5	112	169.6	-53.3	172.3	0	0	0	115
852	K	28.9	Very low	28.2	Very low	156 Å²	156	138.3 Å²	138.3	68%	0.678	75%	0.747	S	S	*	*				79.8	141.1	80.7	-80.4	-179.5	-160.4	164.8	0	113.3
853	R	29.3	Very low	28.2	Very low	190 Å²	190	140.6 Å²	140.6	72%	0.717	75%	0.749	S	S	*	*			cis	-153.2	153.6	15	-119.4	-176.7	-151.8	97.7	-11.4	112.7
854	D	28.3	Very low	28	Very low	119 Å²	119	145.4 Å²	145.4	64%	0.636	75%	0.752	S	S	*	*			trans	38.5	124.2	141.6	-47.4	-18.9	0	0	0	122.6
855	S	35.3	Very low	28	Very low	127 Å²	127	145.4 Å²	145.4	89%	0.888	75%	0.754	S	S	*	*				-136.7	139.8	124.5	58.9	0	0	0	0	109.8
856	I	25.5	Very low	27.9	Very low	126 Å²	126	146.9 Å²	146.9	65%	0.646	76%	0.758	S	S	*	*			trans	-123.1	129.3	-164.3	-63	168.2	0	0	0	110.5	K858	I856-K858 HydrophobicContact CG2-CG 4.47Å
857	I	30.8	Very low	28	Very low	175 Å²	175	148.9 Å²	148.9	90%	0.897	76%	0.764	S	S	*	*			trans	-123.3	136	156.4	-63.8	-174.6	0	0	0	109.5
858	K	25.6	Very low	27.9	Very low	185 Å²	185	149.3 Å²	149.3	80%	0.804	77%	0.766	S	S	*	*			trans	-83.2	148.7	-159.5	-68.7	169.7	176.7	168.7	0	113.8	I856	I856-K858 HydrophobicContact CG2-CG 4.47Å
859	W	23.2	Very low	28	Very low	235 Å²	235	151.1 Å²	151.1	89%	0.89	77%	0.77	S	S	*	*			trans	-59.3	148.3	155.7	-82	37.4	0	0	0	111.2	V861	W859-V861 HydrophobicContact CE3-CG2 3.96Å; W859-V861 HydrophobicContact CZ3-CG2 4.21Å
860	S	27.2	Very low	27.9	Very low	92 Å²	92	154 Å²	154	64%	0.643	77%	0.768	S	S	*	*			trans	-140.2	70.6	161.3	175.5	0	0	0	0	111.2	R862	S860-R862 PolarHBondContact O-N 3.18Å
861	V	27.4	Very low	27.9	Very low	109 Å²	109	154.7 Å²	154.7	66%	0.661	77%	0.769	S	S	*	*			trans	-63.9	116.1	153.5	175.4	0	0	0	0	107	W859	W859-V861 HydrophobicContact CE3-CG2 3.96Å; W859-V861 HydrophobicContact CZ3-CG2 4.21Å
862	R	25.6	Very low	27.8	Very low	207 Å²	207	157.9 Å²	157.9	78%	0.781	78%	0.777	S	S	*	*			trans	-128.3	96.6	172.6	-163.4	179.9	-66	-138.7	6.2	110.2	S860	S860-R862 PolarHBondContact O-N 3.18Å
863	H	28.5	Very low	27.7	Very low	172 Å²	172	156 Å²	156	80%	0.796	78%	0.778	S	S	*	*			trans	-53.6	141.7	161.5	-71.8	-87.7	0	0	0	109.6
864	R	26.5	Very low	27.6	Very low	228 Å²	228	152.8 Å²	152.8	86%	0.86	78%	0.776	S	S	*	*			trans	-123.1	132.9	148.4	-91.8	-170.6	166.5	-177.7	-2.8	108.5
865	P	29.9	Very low	27.6	Very low	121 Å²	121	152.5 Å²	152.5	79%	0.786	77%	0.774	S	S	*	*			trans	-78.5	172.5	-176.3	34	-36.9	0	0	0	111.6
866	N	26.8	Very low	27.4	Very low	151 Å²	151	152.2 Å²	152.2	81%	0.807	76%	0.763	S	S	*	*			trans	-51.8	143.9	160.2	-67.9	-37.2	0	0	0	110.6
867	N	29.4	Very low	27.5	Very low	164 Å²	164	151.9 Å²	151.9	88%	0.877	76%	0.762	S	S	*	*			trans	-149.9	116.2	135.1	-118	-12.5	0	0	0	111.1
868	T	26.5	Very low	27.5	Very low	122 Å²	122	150.4 Å²	150.4	75%	0.748	75%	0.754	S	S	*	*			trans	-95.8	128.6	163.2	-59.5	0	0	0	0	107.5
869	I	28.5	Very low	27.9	Very low	165 Å²	165	147 Å²	147	85%	0.846	75%	0.751	S	S	*	*			trans	-168.5	144.5	140.8	-101.5	150.9	0	0	0	108.1
870	M	25.9	Very low	28.1	Very low	158 Å²	158	140.9 Å²	140.9	78%	0.778	74%	0.744	S	S	*	*			trans	-91.7	146.7	177.9	-60.2	-175.5	84.4	0	0	110.9
871	T	26	Very low	28.2	Very low	117 Å²	117	142.3 Å²	142.3	72%	0.718	75%	0.749	S	S	*	*			trans	33.6	118.1	144.2	61.2	0	0	0	0	118.5
872	K	28.7	Very low	28.2	Very low	197 Å²	197	140.6 Å²	140.6	86%	0.857	75%	0.747	S	S	*	*				-159.1	147.2	103.7	-107.3	163.8	-175	177.7	0	113
873	T	26.5	Very low	28.3	Very low	115 Å²	115	139.2 Å²	139.2	71%	0.706	75%	0.749	S	S	*	*			trans	-28.3	152	147.7	48.2	0	0	0	0	113.9
874	N	28	Very low	28.3	Very low	124 Å²	124	135.5 Å²	135.5	66%	0.663	74%	0.742	S	S	*	*			cis	-162.5	161.7	36.8	-141.7	20.6	0	0	0	114.7
875	N	28.8	Very low	28.4	Very low	112 Å²	112	129.9 Å²	129.9	60%	0.599	73%	0.734	S	S	*	*			trans	58.6	127.7	143.8	-78.2	16.6	0	0	0	122.4
876	N	29.4	Very low	28.3	Very low	122 Å²	122	129.5 Å²	129.5	65%	0.652	73%	0.725	S	S	*	*			trans	76.6	142.5	132	-60.2	13.8	0	0	0	117.9
877	N	29.1	Very low	28.4	Very low	118 Å²	118	130.3 Å²	130.3	63%	0.631	72%	0.722	S	S	*	*			cis	-157.2	147.5	-1.2	-122.4	3	0	0	0	113.6
878	I	29	Very low	28.3	Very low	144 Å²	144	130.2 Å²	130.2	74%	0.738	71%	0.713	S	S	*	*			trans	71.9	150.5	143.7	-71.3	169.4	0	0	0	117.6
879	P	36	Very low	28.3	Very low	113 Å²	113	130.4 Å²	130.4	73%	0.734	71%	0.708	S	S	*	*			trans	-126.8	-129.8	-155.1	42.8	-23.2	0	0	0	112.1
880	S	27.3	Very low	28.2	Very low	107 Å²	107	128.1 Å²	128.1	75%	0.748	70%	0.702	S	S	*	*			trans	80.1	142.1	-176.3	98.7	0	0	0	0	113.9
881	T	27.8	Very low	28.4	Very low	122 Å²	122	126.2 Å²	126.2	75%	0.748	70%	0.695	S	S	*	*			cis	-144.9	159.9	-3	-12.8	0	0	0	0	109.1
882	A	27.1	Very low	28.6	Very low	73 Å²	73	128.5 Å²	128.5	60%	0.603	70%	0.702	S	S	*	*				37.8	140.7	108	0	0	0	0	0	116
883	E	29.5	Very low	28.4	Very low	178 Å²	178	125.2 Å²	125.2	83%	0.832	69%	0.694	S	S	*	*			cis	-157.9	169.1	32.3	-145.9	132.9	-127	0	0	113.3
884	S	27.8	Very low	28.5	Very low	94 Å²	94	128.6 Å²	128.6	66%	0.657	70%	0.701	S	S	*	*			trans	27.1	140.5	130.1	-156.2	0	0	0	0	120.2
885	T	28.7	Very low	28.5	Very low	110 Å²	110	128.2 Å²	128.2	68%	0.675	70%	0.704	S	S	*	*			cis	-161.7	139.9	6.3	6	0	0	0	0	108.3
886	D	26.9	Very low	28.4	Very low	114 Å²	114	130 Å²	130	61%	0.61	71%	0.711	S	S	*	*				46.6	107.6	100.1	-171.1	42.9	0	0	0	115.6
887	K	29.1	Very low	28.2	Very low	168 Å²	168	130.5 Å²	130.5	73%	0.73	71%	0.714	S	S	*	*				180	112.8	116.2	-94.4	150.7	-164	166.2	0	116.2
888	K	27.3	Very low	27.9	Very low	161 Å²	161	130 Å²	130	70%	0.7	72%	0.719	S	S	*	*				65.8	120.6	116.4	-74	-171.4	164.3	-169.4	0	124.1
889	I	26.6	Very low	27.7	Very low	126 Å²	126	128 Å²	128	65%	0.646	72%	0.718	S	S	*	*				86.5	158.9	116.7	-68.1	176.3	0	0	0	119.6
890	V	27.8	Very low	27.2	Very low	117 Å²	117	128.4 Å²	128.4	71%	0.709	72%	0.718	S	S	*	*			trans	72.5	90.8	-176.7	-146.7	0	0	0	0	111.6
891	D	28.8	Very low	27.1	Very low	118 Å²	118	131 Å²	131	63%	0.631	72%	0.719	S	S	*	*				63.5	121	59.2	-56.2	-71.3	0	0	0	113.7
892	L	29.9	Very low	27.2	Very low	165 Å²	165	131.6 Å²	131.6	86%	0.864	72%	0.717	S	S	*	*				-154.9	141.2	106	-133	74.5	0	0	0	110.8
893	N	25.5	Very low	27.3	Very low	129 Å²	129	135.3 Å²	135.3	69%	0.69	72%	0.719	S	S	*	*			trans	-87.5	154.9	171.6	-58	-81.9	0	0	0	109.4
894	Q	27.8	Very low	27.2	Very low	185 Å²	185	132.8 Å²	132.8	86%	0.864	71%	0.711	S	S	*	*				-154.7	141.8	127.9	-116.4	168	22.1	0	0	112.7
895	T	27.6	Very low	27.3	Very low	116 Å²	116	134.1 Å²	134.1	71%	0.712	72%	0.72	S	S	*	*			trans	-127.6	124.1	-178.4	-54.7	0	0	0	0	108.2
896	I	27.4	Very low	27.3	Very low	149 Å²	149	133.4 Å²	133.4	76%	0.764	72%	0.72	S	S	*	*			trans	-149.6	118	161.2	-80.4	113.8	0	0	0	103.7
897	N	24.5	Very low	27.4	Very low	133 Å²	133	134.3 Å²	134.3	71%	0.711	73%	0.725	S	S	*	*				70.4	118.5	56	-89.2	10	0	0	0	116.5
898	C	23.6	Very low	27.4	Very low	109 Å²	109	131.2 Å²	131.2	74%	0.736	73%	0.725	S	S	*	*			trans	64.3	132.9	144.9	-60.5	0	0	0	0	122.3
899	S	24.3	Very low	27.4	Very low	102 Å²	102	128.6 Å²	128.6	71%	0.713	73%	0.727	S	S	*	*			trans	81.1	108.2	137.2	-61	0	0	0	0	121.5
900	T	26.2	Very low	27.5	Very low	120 Å²	120	130.3 Å²	130.3	74%	0.736	73%	0.734	S	S	*	*				55.9	132.5	126.7	57.1	0	0	0	0	122.5
901	E	24.9	Very low	27.6	Very low	163 Å²	163	130.3 Å²	130.3	76%	0.762	73%	0.734	S	S	*	*			trans	70.8	157.6	146.6	-73.8	-162	-159.3	0	0	119
902	L	29.7	Very low	27.7	Very low	134 Å²	134	130.9 Å²	130.9	70%	0.702	74%	0.736	S	S	*	*			cis	-168.1	-173.2	-38.1	-117.7	-179.2	0	0	0	106.5
903	K	29	Very low	27.8	Very low	150 Å²	150	130.8 Å²	130.8	65%	0.652	73%	0.731	S	S	*	*			trans	74.4	152.8	159.1	-50.6	-162.3	-177.6	173.9	0	116.9
904	N	28.8	Very low	28.1	Very low	125 Å²	125	131.7 Å²	131.7	67%	0.668	74%	0.736	S	S	*	*			cis	-158.4	151.4	-20.2	-111.1	4.1	0	0	0	111.7
905	S	28.2	Very low	28.6	Very low	122 Å²	122	128.1 Å²	128.1	85%	0.853	73%	0.729	S	S	*	*	S	Bend	trans	178.8	130.2	134.1	31.7	0	0	0	0	108.1
906	S	30.2	Very low	28.5	Very low	95 Å²	95	127.5 Å²	127.5	66%	0.664	73%	0.729	S	S	*	*	S	Bend	cis	-134.9	166.4	-10.2	66.9	0	0	0	0	107.8
907	D	29.5	Very low	28.5	Very low	133 Å²	133	126 Å²	126	71%	0.711	73%	0.727	S	S	*	*			cis	-145.1	-177.5	23.6	-101.1	-62.6	0	0	0	112.9
908	S	28.4	Very low	28.6	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	73%	0.73	S	S	*	*			trans	81.7	95.2	165	-53	0	0	0	0	118.7
909	S	26.9	Very low	28.6	Very low	106 Å²	106	127.6 Å²	127.6	74%	0.741	73%	0.731	S	S	*	*			trans	62.7	119.5	146.4	59.9	0	0	0	0	122.1
910	M	29.1	Very low	28.7	Very low	161 Å²	161	127.1 Å²	127.1	79%	0.793	73%	0.728	S	S	*	*			trans	70.3	101.4	144.2	-68.6	178.1	174.5	0	0	118
911	T	29	Very low	28.7	Very low	117 Å²	117	130.3 Å²	130.3	72%	0.718	73%	0.731	S	S	*	*				77.4	135.5	72.7	60.8	0	0	0	0	113.1
912	I	31.6	Very low	28.8	Very low	130 Å²	130	128.3 Å²	128.3	67%	0.667	73%	0.726	S	S	*	*			cis	-158.5	145.7	6.4	-124.2	162.8	0	0	0	110.4
913	E	31.9	Very low	28.7	Very low	163 Å²	163	129.7 Å²	129.7	76%	0.762	73%	0.729	S	S	*	*			trans	41.7	166.4	146.9	-68	165.6	-148.8	0	0	123.3
914	N	31.5	Very low	28.8	Very low	148 Å²	148	127.3 Å²	127.3	79%	0.791	73%	0.731	S	S	*	*			cis	-161.7	169.7	-44.9	-120	-18.2	0	0	0	108
915	P	37.6	Very low	28.6	Very low	110 Å²	110	126.4 Å²	126.4	71%	0.714	73%	0.734	S	S	*	*			trans	-94.7	168.4	-169.8	37.9	-37.7	0	0	0	114.9
916	S	27.1	Very low	28.8	Very low	104 Å²	104	126.3 Å²	126.3	73%	0.727	73%	0.734	S	S	*	*			trans	175.2	151.9	130.7	45.5	0	0	0	0	117
917	T	26.3	Very low	28.5	Very low	117 Å²	117	133.7 Å²	133.7	72%	0.718	75%	0.747	S	S	*	*			trans	68.3	147.5	144.5	39.1	0	0	0	0	124.5
918	I	25.9	Very low	28.6	Very low	152 Å²	152	133 Å²	133	78%	0.779	75%	0.753	S	S	*	*			trans	71.8	142.1	143	-75.9	162.2	0	0	0	118.6
919	V	24.8	Very low	28.7	Very low	123 Å²	123	139.5 Å²	139.5	75%	0.745	76%	0.762	S	S	*	*			cis	-161.8	162.5	-35.6	95.8	0	0	0	0	109.2
920	S	26.4	Very low	29.2	Very low	93 Å²	93	140.5 Å²	140.5	65%	0.65	77%	0.765	S	S	*	*			trans	-23.5	139.6	168.9	-40	0	0	0	0	119.5
921	K	26.8	Very low	29.1	Very low	186 Å²	186	136 Å²	136	81%	0.809	76%	0.761	S	S	*	*				-167.5	141.7	107.2	-101.9	160.3	-173.3	177.8	0	110.6
922	N	26.3	Very low	29.2	Very low	122 Å²	122	141.6 Å²	141.6	65%	0.652	77%	0.769	S	S	*	*				52.1	139.4	97.8	-59.7	27.4	0	0	0	112.7
923	E	27.4	Very low	28.9	Very low	162 Å²	162	144.5 Å²	144.5	76%	0.757	78%	0.777	S	S	*	*			cis	-156.6	158.2	17.7	-129.3	143.9	-119.2	0	0	106.9
924	S	30.3	Very low	28.7	Very low	100 Å²	100	146.7 Å²	146.7	70%	0.699	78%	0.784	S	S	*	*				-177.3	167.6	54.1	47.7	0	0	0	0	112.4
925	S	26.1	Very low	28.5	Very low	106 Å²	106	150.5 Å²	150.5	74%	0.741	79%	0.787	S	S	*	*			trans	-16.5	142.6	158.1	51.8	0	0	0	0	118
926	S	31.5	Very low	27.9	Very low	121 Å²	121	149.3 Å²	149.3	85%	0.846	78%	0.782	S	S	*	*				-147.4	145.5	64.8	52	0	0	0	0	116.3
927	R	25.1	Very low	27.8	Very low	250 Å²	250	153 Å²	153	94%	0.943	79%	0.792	S	S	*	*			trans	-95.6	142.2	173.5	-65.2	168.5	170.1	159.2	-3.9	109.4
928	S	29.8	Very low	27.7	Very low	119 Å²	119	151.6 Å²	151.6	83%	0.832	78%	0.784	S	S	*	*			trans	-141.2	128.5	146.6	59.1	0	0	0	0	111.8
929	R	31.1	Very low	27.7	Very low	240 Å²	240	152 Å²	152	91%	0.906	79%	0.786	S	S	*	*			trans	-104	-163.7	157.9	-66.6	177.3	158.6	-169.8	-4.3	106.9
930	P	38.4	Very low	27.7	Very low	126 Å²	126	157.4 Å²	157.4	82%	0.818	79%	0.794	S	S	*	*				-122.9	136.2	-90.4	36	-19.7	0	0	0	113.8
931	G	25.9	Very low	27.7	Very low	68 Å²	68	160.6 Å²	160.6	70%	0.701	80%	0.802	S	S	*	*			trans	-134.6	152.5	167.2	0	0	0	0	0	110
932	R	31.6	Very low	27.9	Very low	234 Å²	234	156 Å²	156	88%	0.883	80%	0.798	S	S	*	*			cis	62	143.5	32	-66.7	-168.8	174.2	-173.6	1.1	113.7
933	F	24.2	Very low	27.8	Very low	191 Å²	191	161.6 Å²	161.6	84%	0.838	81%	0.81	S	S	*	*			trans	67.4	138.7	-158.4	-57.1	-92.1	0	0	0	112.6
934	F	28	Very low	27.7	Very low	209 Å²	209	158.5 Å²	158.5	92%	0.917	81%	0.807	S	S	*	*			cis	-83.5	147.8	0.8	-101.2	-99.8	0	0	0	114.9
935	R	27.1	Very low	27.5	Very low	227 Å²	227	161.9 Å²	161.9	86%	0.857	81%	0.811	S	S	*	*			trans	-123.6	146.9	166.7	-178.8	-179.3	-177.1	176.8	0.4	106.1
936	S	25.2	Very low	27.5	Very low	85 Å²	85	162.1 Å²	162.1	59%	0.594	81%	0.808	S	S	*	*			trans	75.2	92.2	170.3	-139	0	0	0	0	117.6	T938	S936-T938 WeakPolarHBondContact CB-OG1 3.31Å; S936-T938 PolarHBondContact O-OG1 2.9Å; S936-T938 WeakPolarHBondContact OG-CA 3.3Å; S936-T938 PolarHBondContact OG-N 3.49Å; S936-T938 PolarHBondContact OG-OG1 2.63Å
937	L	24.9	Very low	27.3	Very low	181 Å²	181	162.6 Å²	162.6	95%	0.948	80%	0.801	S	S	*	*				-108.2	77.3	111.8	-166.8	74.9	0	0	0	106
938	T	24.9	Very low	27.6	Very low	88 Å²	88	157.3 Å²	157.3	54%	0.54	79%	0.787	S	S	.	*				81.9	126.7	81.8	-62.1	0	0	0	0	111.3	S936	S936-T938 WeakPolarHBondContact CB-OG1 3.31Å; S936-T938 PolarHBondContact O-OG1 2.9Å; S936-T938 WeakPolarHBondContact OG-CA 3.3Å; S936-T938 PolarHBondContact OG-N 3.49Å; S936-T938 PolarHBondContact OG-OG1 2.63Å
939	L	26.8	Very low	27.5	Very low	160 Å²	160	156.9 Å²	156.9	84%	0.838	78%	0.775	S	S	*	*			trans	-54.9	165.4	-176.1	-70.5	150.8	0	0	0	114.4
940	R	23.5	Very low	27.5	Very low	238 Å²	238	151 Å²	151	90%	0.898	76%	0.762	S	S	*	*			trans	93.8	131.3	-172.7	-54.8	159.7	-167.3	-176.8	4.6	111
941	I	27.4	Very low	27.1	Very low	159 Å²	159	151.3 Å²	151.3	82%	0.815	76%	0.757	S	S	*	*			cis	-110.2	120	10.9	-61.4	167	0	0	0	111.2
942	A	29.6	Very low	27.3	Very low	90 Å²	90	158.2 Å²	158.2	74%	0.744	76%	0.762	S	S	*	*			trans	-121.6	141.3	153.6	0	0	0	0	0	106.9
943	R	25.8	Very low	27.6	Very low	239 Å²	239	154.3 Å²	154.3	90%	0.902	76%	0.757	S	S	*	*			trans	60.1	88.2	-179.2	-62.4	178	171.5	166.2	-4.5	117.2
944	S	24.3	Very low	27.9	Very low	97 Å²	97	152.3 Å²	152.3	68%	0.678	75%	0.753	S	S	*	*				-161.9	112.5	124.3	45.8	0	0	0	0	107.4
945	H	26.8	Very low	27.9	Very low	172 Å²	172	147.7 Å²	147.7	80%	0.796	75%	0.747	S	S	*	*				86.8	145.6	74.8	-93.5	-84	0	0	0	113
946	T	26.1	Very low	28	Very low	111 Å²	111	141.8 Å²	141.8	68%	0.681	74%	0.74	S	S	*	*			trans	58.5	107.3	169.6	49.3	0	0	0	0	115.9
947	N	26.4	Very low	28	Very low	130 Å²	130	146.1 Å²	146.1	70%	0.695	75%	0.753	S	S	*	*				81.3	138.8	94.4	-69.4	-8.8	0	0	0	112.2
948	H	30.9	Very low	28.3	Very low	139 Å²	139	146 Å²	146	64%	0.644	75%	0.748	S	S	*	*			cis	-154.5	169.7	6.5	-127.6	-16.2	0	0	0	110.6
949	N	29.5	Very low	28.5	Very low	110 Å²	110	150.9 Å²	150.9	59%	0.588	76%	0.761	S	S	*	*			trans	25.2	137.5	133.1	-60.2	2.1	0	0	0	118.8
950	N	30.2	Very low	28.6	Very low	117 Å²	117	148.7 Å²	148.7	63%	0.626	76%	0.76	S	S	*	*			cis	-171.2	147.8	14.1	-120.1	-19.4	0	0	0	111.9
951	N	30.4	Very low	28.8	Very low	132 Å²	132	142.8 Å²	142.8	71%	0.706	75%	0.745	S	S	*	*			trans	61.3	150.1	148.2	-62.2	-41.3	0	0	0	118.6
952	R	29.9	Very low	28.7	Very low	214 Å²	214	143.4 Å²	143.4	81%	0.808	74%	0.744	S	S	*	*			cis	-157.8	169	22.5	-142.1	163.1	-169.8	170.4	1.2	110.1
953	I	38.3	Very low	28.8	Very low	152 Å²	152	148.2 Å²	148.2	78%	0.779	75%	0.748	S	S	*	*			trans	71.8	84.6	176	-47.4	171.9	0	0	0	113.3
954	I	30.8	Very low	28.8	Very low	148 Å²	148	144.2 Å²	144.2	76%	0.759	74%	0.739	S	S	*	*			cis	80.3	131.4	45.4	-55.4	159.8	0	0	0	113
955	S	26.8	Very low	28.9	Very low	113 Å²	113	145.9 Å²	145.9	79%	0.79	73%	0.734	S	S	*	*			cis	-172	178.2	-24.3	-165	0	0	0	0	110.6
956	S	28.9	Very low	28.9	Very low	102 Å²	102	146.4 Å²	146.4	71%	0.713	73%	0.731	S	S	*	*			trans	90.7	82.6	159.2	-154.2	0	0	0	0	119.6
957	M	26.8	Very low	28.9	Very low	177 Å²	177	146 Å²	146	87%	0.872	73%	0.728	S	S	*	*	S	Bend		-96.8	146.1	124.5	-87.2	-169.5	168.5	0	0	108.8
958	Q	31.5	Very low	29	Very low	178 Å²	178	145.2 Å²	145.2	83%	0.832	73%	0.728	S	S	*	*			trans	55.4	114.4	162.2	-61.1	177.2	-55	0	0	119.7
959	K	27.3	Very low	28.7	Very low	190 Å²	190	144.5 Å²	144.5	83%	0.826	73%	0.729	S	S	*	*				165.3	120.1	118.5	-92.6	173.4	-178.9	178.9	0	113.3	I961	K959-I961 HydrophobicContact CD-CD1 4.47Å; K959-I961 HydrophobicContact CG-CD1 4.03Å
960	S	29.9	Very low	28.7	Very low	115 Å²	115	144 Å²	144	80%	0.804	73%	0.73	S	S	*	*			trans	-178.5	123.7	130.1	-150.8	0	0	0	0	107.5
961	I	27.4	Very low	28.5	Very low	114 Å²	114	145 Å²	145	59%	0.585	74%	0.735	S	S	*	*			cis	87	124.6	21.8	-51.6	-178.5	0	0	0	114.5	K959	K959-I961 HydrophobicContact CD-CD1 4.47Å; K959-I961 HydrophobicContact CG-CD1 4.03Å
962	H	26.4	Very low	28.4	Very low	171 Å²	171	143 Å²	143	79%	0.792	73%	0.732	S	S	*	*			trans	61.3	101	169.9	-66.5	-4.7	0	0	0	119.1
963	K	30.6	Very low	28.4	Very low	192 Å²	192	142 Å²	142	84%	0.835	73%	0.733	S	S	*	*				-158.6	137.7	87.8	-93.9	165.4	-177.5	178.4	0	107.6
964	H	26.4	Very low	28	Very low	154 Å²	154	138 Å²	138	71%	0.713	72%	0.719	S	S	*	*				51.2	131.1	82.7	-79.1	2.1	0	0	0	112.4
965	K	25.8	Very low	27.8	Very low	132 Å²	132	140.8 Å²	140.8	57%	0.574	72%	0.721	S	S	*	*			cis	-174.1	175.7	-4.9	-129.7	173.2	171.3	-167.4	0	105.5
966	Y	26.1	Very low	27.9	Very low	184 Å²	184	143.6 Å²	143.6	72%	0.722	72%	0.719	S	S	*	*			trans	66.4	141.7	163.1	-61.4	-55.4	0	0	0	117.1
967	T	27.3	Very low	27.8	Very low	101 Å²	101	143.6 Å²	143.6	62%	0.62	72%	0.715	S	S	*	*			cis	-167.2	163.4	-33.1	1.2	0	0	0	0	108.1
968	T	27.4	Very low	27.9	Very low	115 Å²	115	140.5 Å²	140.5	71%	0.706	71%	0.711	S	S	*	*			trans	60.7	173.6	150.9	54	0	0	0	0	116.2
969	N	26.2	Very low	27.7	Very low	123 Å²	123	138.3 Å²	138.3	66%	0.658	70%	0.704	S	S	*	*			cis	-133.3	121.4	-28.5	-119	-5.9	0	0	0	105.5
970	T	28.2	Very low	27.6	Very low	101 Å²	101	136.6 Å²	136.6	62%	0.62	70%	0.703	S	S	*	*				66.3	170.4	99	66.4	0	0	0	0	115.1
971	N	27	Very low	27.6	Very low	136 Å²	136	140.5 Å²	140.5	73%	0.727	71%	0.706	S	S	*	*			trans	65.9	92.6	166.1	-64.7	-32.2	0	0	0	116.5
972	S	27.3	Very low	28.1	Very low	90 Å²	90	139.9 Å²	139.9	63%	0.629	71%	0.711	S	S	*	*				79.8	154.6	66.3	79	0	0	0	0	113
973	K	30.5	Very low	28.4	Very low	194 Å²	194	135.8 Å²	135.8	84%	0.843	70%	0.7	S	S	*	*			trans	125.9	29.4	-170.2	50.7	166.8	178.1	170.4	0	112.2
974	S	28.9	Very low	28.4	Very low	68 Å²	68	131.9 Å²	131.9	48%	0.476	69%	0.688	S	S	.	*				56.1	138.8	65.6	-163	0	0	0	0	113.3
975	Y	27.1	Very low	28.6	Very low	207 Å²	207	131.2 Å²	131.2	81%	0.812	69%	0.69	S	S	*	*			trans	71.4	150.2	174.3	-53.7	-57	0	0	0	115.8
976	K	28.4	Very low	28.6	Very low	171 Å²	171	130.7 Å²	130.7	74%	0.743	69%	0.693	S	S	*	*			cis	-142.9	141.6	5	-134.6	164.8	-178.4	-174.7	0	110.9
977	T	28	Very low	28.7	Very low	103 Å²	103	125.5 Å²	125.5	63%	0.632	69%	0.689	S	S	*	*			trans	26.6	132.3	139.5	60.6	0	0	0	0	118.7
978	S	29.1	Very low	28.6	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	70%	0.697	S	S	*	*				-122.6	128.4	66	-28.8	0	0	0	0	113.5
979	L	26.3	Very low	28.6	Very low	131 Å²	131	129.2 Å²	129.2	69%	0.686	69%	0.694	S	S	*	*				56.6	106.7	104.1	-73.2	121.4	0	0	0	112.9
980	L	24.4	Very low	28.5	Very low	154 Å²	154	128.4 Å²	128.4	81%	0.806	69%	0.694	S	S	*	*				50.6	102.3	79.7	-73.4	85.7	0	0	0	111.8
981	K	30.4	Very low	28.4	Very low	197 Å²	197	130.8 Å²	130.8	86%	0.857	70%	0.698	S	S	*	*				-152.6	113.5	101.2	-99.3	-177.3	176.9	-171.7	0	110.6
982	S	39	Very low	28.2	Very low	101 Å²	101	132.1 Å²	132.1	71%	0.706	70%	0.7	S	S	*	*				-69.3	150.8	123.2	-123.1	0	0	0	0	106.5
983	P	32	Very low	28.1	Very low	85 Å²	85	133.5 Å²	133.5	55%	0.552	70%	0.699	S	S	*	*				-111.3	-165.6	73.1	12.3	10.1	0	0	0	109.7
984	N	31.4	Very low	27.9	Very low	110 Å²	110	132.6 Å²	132.6	59%	0.588	70%	0.698	S	S	*	*			cis	46.6	141.6	47.5	-61.5	40.7	0	0	0	109.1	D986	N984-D986 WeakPolarHBondContact CB-OD2 3.09Å; N984-D986 PolarHBondContact ND2-OD2 3.36Å
985	D	29.1	Very low	27.8	Very low	140 Å²	140	134.3 Å²	134.3	75%	0.749	71%	0.71	S	S	*	*			cis	-115.9	132.6	41	-54.4	-50.8	0	0	0	108.9
986	D	27.1	Very low	27.8	Very low	121 Å²	121	129.6 Å²	129.6	65%	0.647	71%	0.707	S	S	*	*				70.4	172.5	65	-74.1	-49.8	0	0	0	112.2	N984	N984-D986 WeakPolarHBondContact CB-OD2 3.09Å; N984-D986 PolarHBondContact ND2-OD2 3.36Å
987	A	26.8	Very low	27.7	Very low	75 Å²	75	128.2 Å²	128.2	62%	0.62	71%	0.707	S	S	*	*			trans	74.1	112.1	171.9	0	0	0	0	0	116.9
988	E	26.2	Very low	27.6	Very low	170 Å²	170	132.9 Å²	132.9	79%	0.794	71%	0.713	S	S	*	*				62.6	141	110.1	-68.6	174	145.5	0	0	120.4
989	L	26.5	Very low	27.5	Very low	124 Å²	124	133.1 Å²	133.1	65%	0.649	71%	0.705	S	S	*	*			cis	-117.8	150.4	-15.1	-72.1	104.3	0	0	0	106.6
990	T	24.9	Very low	27.6	Very low	106 Å²	106	133.9 Å²	133.9	65%	0.65	71%	0.705	S	S	*	*				46.6	149.9	61.3	57.4	0	0	0	0	113.5
991	E	25.1	Very low	27.7	Very low	151 Å²	151	131.5 Å²	131.5	71%	0.706	70%	0.697	S	S	*	*			trans	62	161.7	170.4	-81.5	148.4	-147.9	0	0	115.5
992	E	24.5	Very low	27.6	Very low	164 Å²	164	126.5 Å²	126.5	77%	0.766	69%	0.687	S	S	*	*			cis	-117.6	138.3	-20	-103.5	161.4	146.6	0	0	106.7
993	I	25.2	Very low	27	Very low	120 Å²	120	126.3 Å²	126.3	62%	0.615	69%	0.686	S	S	*	*				64.8	112.7	70.8	-70.1	169.4	0	0	0	112.1
994	H	26	Very low	26.7	Very low	175 Å²	175	129.4 Å²	129.4	81%	0.81	70%	0.697	S	S	*	*			trans	68.9	-171.3	152.4	-67.8	48	0	0	0	118.1
995	S	26.4	Very low	26.5	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	70%	0.697	S	S	*	*			trans	70.6	58.9	159.2	-56.6	0	0	0	0	116.6	N997	S995-N997 PolarHBondContact O-N 2.86Å
996	S	27.4	Very low	26.4	Very low	108 Å²	108	129.7 Å²	129.7	76%	0.755	70%	0.696	S	S	*	*				-1.3	105.6	104.2	-54.5	0	0	0	0	115
997	N	26.8	Very low	26.4	Very low	141 Å²	141	128 Å²	128	75%	0.754	69%	0.694	S	S	*	*				-141.3	114.5	128.6	-90.1	-43.1	0	0	0	107.1	S995	S995-N997 PolarHBondContact O-N 2.86Å
998	R	25.5	Very low	26.4	Very low	201 Å²	201	130.9 Å²	130.9	76%	0.758	70%	0.704	S	S	*	*				71.1	116.1	69.4	-86.3	-171.1	152.7	-134.6	-0.3	111.9
999	L	26	Very low	26.4	Very low	117 Å²	117	127.3 Å²	127.3	61%	0.613	70%	0.698	S	S	*	*			trans	67.7	165.8	147.9	-50.7	165.1	0	0	0	113.2
1000	H	29.1	Very low	26.7	Very low	147 Å²	147	126.1 Å²	126.1	68%	0.681	70%	0.7	S	S	*	*			cis	-115.4	139.2	2.5	-102	-84.2	0	0	0	109.9
1001	T	27.1	Very low	27	Very low	104 Å²	104	126.5 Å²	126.5	64%	0.638	71%	0.707	S	S	*	*				44.6	137.8	103.9	73.5	0	0	0	0	114.3
1002	S	27.4	Very low	27.5	Very low	93 Å²	93	124.5 Å²	124.5	65%	0.65	71%	0.707	S	S	*	*			cis	-145.8	142.1	29.4	-58.4	0	0	0	0	108
1003	S	25.7	Very low	27.7	Very low	97 Å²	97	122.3 Å²	122.3	68%	0.678	71%	0.705	S	S	*	*				49.5	153.1	73.9	84.6	0	0	0	0	114.9
1004	L	26.6	Very low	28.1	Very low	150 Å²	150	128 Å²	128	79%	0.785	72%	0.719	S	S	*	*			trans	75.1	133.9	175.9	-57.4	164.4	0	0	0	115.7
1005	T	26.4	Very low	28.3	Very low	97 Å²	97	124.4 Å²	124.4	60%	0.595	71%	0.713	S	S	*	*			cis	-165.1	178.6	-27.9	0.3	0	0	0	0	109.2
1006	H	28.6	Very low	28.6	Very low	158 Å²	158	124.4 Å²	124.4	73%	0.731	71%	0.713	S	S	*	*			trans	37.6	110.9	143.9	-65.8	-46.7	0	0	0	119
1007	S	25.7	Very low	29	Very low	86 Å²	86	127.6 Å²	127.6	60%	0.601	72%	0.716	S	S	*	*				103.4	153.5	74.6	-75.3	0	0	0	0	109.3
1008	T	26.9	Very low	29.5	Very low	136 Å²	136	126.5 Å²	126.5	83%	0.834	72%	0.717	S	S	*	*			trans	61.1	147.9	159.8	45.3	0	0	0	0	117.1
1009	S	27.8	Very low	29.6	Very low	94 Å²	94	121.3 Å²	121.3	66%	0.657	71%	0.711	S	S	*	*			cis	-168.4	178	-14.5	49	0	0	0	0	107.8
1010	S	31.1	Very low	29.7	Very low	100 Å²	100	122.4 Å²	122.4	70%	0.699	72%	0.723	S	S	*	*			trans	65.6	126.5	165.6	23.5	0	0	0	0	115.8
1011	S	30.8	Very low	29.5	Very low	114 Å²	114	118.8 Å²	118.8	80%	0.797	72%	0.719	S	S	*	*			cis	68.6	149.9	34.4	-43.6	0	0	0	0	113.5
1012	P	36.3	Very low	29.5	Very low	108 Å²	108	121.5 Å²	121.5	70%	0.701	72%	0.724	S	S	*	*			cis	-139.3	153.6	0.4	38.5	-19.1	0	0	0	118.1
1013	T	29.8	Very low	29.6	Very low	118 Å²	118	124 Å²	124	72%	0.724	73%	0.725	S	S	*	*			trans	36.5	147.1	135.8	71.7	0	0	0	0	126
1014	R	32.4	Very low	29.8	Very low	239 Å²	239	125.5 Å²	125.5	90%	0.902	72%	0.721	S	S	*	*			trans	76	155.2	137.4	-90.6	175.8	164.5	-161	-7.8	118.6
1015	S	31.3	Very low	30.1	Very low	100 Å²	100	125.1 Å²	125.1	70%	0.699	72%	0.715	S	S	*	*			cis	-145.8	-172.5	-0.1	51	0	0	0	0	109.8
1016	S	31.3	Very low	30.5	Very low	104 Å²	104	125.7 Å²	125.7	73%	0.727	72%	0.715	S	S	*	*			cis	-160.2	163.3	27.2	-45.9	0	0	0	0	114.9
1017	H	36.7	Very low	30.6	Very low	175 Å²	175	124 Å²	124	81%	0.81	71%	0.711	S	S	*	*			trans	-83.8	-172.7	156.5	-73.7	-82.3	0	0	0	109.8
1018	P	36.1	Very low	30.8	Very low	119 Å²	119	126.1 Å²	126.1	77%	0.773	72%	0.715	S	S	*	*			cis	-121.5	-172.4	11.9	18.1	10.3	0	0	0	113.7
1019	S	28.8	Very low	31.2	Very low	92 Å²	92	125.4 Å²	125.4	64%	0.643	71%	0.707	S	S	*	*			cis	101.2	125.4	13.3	-41.9	0	0	0	0	118.1
1020	T	27.4	Very low	31.3	Very low	139 Å²	139	129 Å²	129	85%	0.853	71%	0.713	S	S	*	*			trans	90.8	138.9	148.7	-3.7	0	0	0	0	122.7
1021	A	26.5	Very low	31.4	Very low	72 Å²	72	129 Å²	129	60%	0.595	71%	0.708	S	S	*	*			trans	94.7	103.5	137.2	0	0	0	0	0	123.1
1022	Q	25.7	Very low	31.3	Very low	161 Å²	161	129.6 Å²	129.6	75%	0.752	70%	0.703	S	S	*	*				68.1	160.5	124.9	-64.8	175.6	-104	0	0	122.7
1023	H	29.7	Very low	31.2	Very low	144 Å²	144	130.7 Å²	130.7	67%	0.667	70%	0.703	S	S	*	*			trans	71.8	148.4	165	-58.5	-67.2	0	0	0	115.8
1024	H	31.1	Very low	31.5	Very low	129 Å²	129	131.9 Å²	131.9	60%	0.597	71%	0.705	S	S	*	*			cis	-159.6	161	-8.9	-130.3	-59.1	0	0	0	109.5
1025	H	32.4	Very low	31.6	Very low	142 Å²	142	126.8 Å²	126.8	66%	0.657	70%	0.695	S	S	*	*			trans	64.8	156.4	154.2	-64.4	-55.5	0	0	0	116.9
1026	D	33.3	Very low	31.6	Very low	109 Å²	109	127.8 Å²	127.8	58%	0.583	69%	0.693	S	S	*	*			cis	-151.7	144.5	-15.4	-113.7	-10.5	0	0	0	111.9
1027	N	30.7	Very low	31.6	Very low	122 Å²	122	127.3 Å²	127.3	65%	0.652	69%	0.69	S	S	*	*			trans	48.6	153.9	131.5	-56	-21.4	0	0	0	123.4
1028	N	31.4	Very low	31.4	Very low	131 Å²	131	127.4 Å²	127.4	70%	0.701	69%	0.69	S	S	*	*			trans	69.5	145.5	160.9	-63.8	28.3	0	0	0	117.8
1029	D	33.8	Very low	31.2	Very low	121 Å²	121	128.2 Å²	128.2	65%	0.647	69%	0.688	S	S	*	*			cis	-154.5	144.4	-16.1	-105.1	-23.3	0	0	0	111.5
1030	E	29.9	Very low	31.2	Very low	169 Å²	169	128.7 Å²	128.7	79%	0.79	69%	0.687	S	S	*	*			trans	41.6	152.7	137.4	-83.3	-160.2	150	0	0	126.3
1031	V	33.2	Very low	31.1	Very low	100 Å²	100	128.6 Å²	128.6	61%	0.606	68%	0.679	S	S	*	*			trans	76.5	86.2	139.7	170.2	0	0	0	0	119.2
1032	N	30.1	Very low	30.9	Very low	127 Å²	127	133.1 Å²	133.1	68%	0.679	69%	0.685	S	S	*	*				79.4	158.7	109.1	-66.8	6.2	0	0	0	124.3
1033	D	34.3	Very low	30.9	Very low	132 Å²	132	130.8 Å²	130.8	71%	0.706	69%	0.685	S	S	*	*			trans	77.3	132.3	145.3	-60.5	-19.7	0	0	0	123.7
1034	D	36.4	Very low	30.7	Very low	142 Å²	142	131.6 Å²	131.6	76%	0.759	69%	0.693	S	S	*	*			trans	69	86.6	140.5	-64.9	-1.6	0	0	0	122.8
1035	D	33.7	Very low	30.5	Very low	132 Å²	132	131.2 Å²	131.2	71%	0.706	70%	0.7	S	S	*	*				65.3	145.7	96.5	-156.9	33.9	0	0	0	121.9
1036	N	31.5	Very low	30.2	Very low	122 Å²	122	129.4 Å²	129.4	65%	0.652	70%	0.703	S	S	*	*			trans	51.4	103.7	156.5	-90.1	-48.6	0	0	0	122.5
1037	S	31	Very low	30	Very low	94 Å²	94	130 Å²	130	66%	0.657	71%	0.711	S	S	*	*				108.8	145.8	106.4	79.4	0	0	0	0	119.1
1038	H	32.5	Very low	30	Very low	176 Å²	176	131.3 Å²	131.3	82%	0.815	72%	0.717	S	S	*	*			trans	36	127.1	156.9	-76.3	-110.9	0	0	0	118.8
1039	D	31.6	Very low	30.3	Very low	137 Å²	137	129.9 Å²	129.9	73%	0.733	72%	0.715	S	S	*	*				-160.7	-169.6	69.9	-138.2	-41.6	0	0	0	116.4
1040	T	29.2	Very low	30.4	Very low	101 Å²	101	131.8 Å²	131.8	62%	0.62	73%	0.726	S	S	*	*			trans	-55.5	151.7	-168.5	32.8	0	0	0	0	120.9
1041	M	24.9	Very low	30.5	Very low	137 Å²	137	128.4 Å²	128.4	68%	0.675	72%	0.719	S	S	*	*			trans	74.7	123.1	138.1	-81.7	-168.2	-72.7	0	0	123.3
1042	K	23.7	Very low	30.5	Very low	168 Å²	168	132.9 Å²	132.9	73%	0.73	72%	0.724	S	S	*	*				82	125	129.1	-74.2	172	-179.7	161.6	0	121.5
1043	C	24.1	Very low	30.6	Very low	112 Å²	112	133.8 Å²	133.8	76%	0.757	73%	0.728	S	S	*	*			trans	80.9	160.7	135.4	-68.8	0	0	0	0	120.2
1044	L	26.8	Very low	30.2	Very low	160 Å²	160	133.4 Å²	133.4	84%	0.838	73%	0.73	S	S	*	*			trans	68.5	131.1	179.2	-53.6	174.9	0	0	0	114.8
1045	V	25.8	Very low	29.8	Very low	122 Å²	122	135.4 Å²	135.4	74%	0.739	74%	0.738	S	S	*	*			cis	114.6	129.8	16.4	165.2	0	0	0	0	111.2
1046	S	25.8	Very low	29.7	Very low	103 Å²	103	137 Å²	137	72%	0.72	74%	0.74	S	S	*	*			trans	70.2	108.4	164.6	-69.6	0	0	0	0	121
1047	V	29.2	Very low	29.8	Very low	123 Å²	123	137.7 Å²	137.7	75%	0.745	75%	0.752	S	S	*	*				44.7	109.9	109.4	179.8	0	0	0	0	118.1
1048	N	30.8	Very low	29.8	Very low	148 Å²	148	136.3 Å²	136.3	79%	0.791	75%	0.752	S	S	*	*				177.1	169.1	121	-101.3	-27.6	0	0	0	111.7
1049	P	37.6	Very low	29.5	Very low	101 Å²	101	137.3 Å²	137.3	66%	0.656	75%	0.754	S	S	*	*			cis	-130.7	172	-30.2	38	-23.5	0	0	0	113
1050	D	35.7	Very low	29.6	Very low	161 Å²	161	139.1 Å²	139.1	86%	0.861	76%	0.758	S	S	*	*			trans	-70.2	153.6	153.4	-72.8	-54.8	0	0	0	109.7
1051	P	32.4	Very low	29.5	Very low	99 Å²	99	140.5 Å²	140.5	64%	0.643	76%	0.758	S	S	*	*				-141.4	132.6	120.7	34.9	-22.3	0	0	0	114.2
1052	W	33.6	Very low	29.7	Very low	193 Å²	193	140.8 Å²	140.8	73%	0.731	76%	0.757	S	S	*	*				-167.7	124.7	111.8	-94.3	-36.5	0	0	0	114.1
1053	I	31.3	Very low	30.1	Very low	147 Å²	147	138.5 Å²	138.5	75%	0.754	75%	0.749	S	S	*	*			trans	64.7	92.2	144.8	-51.7	177.4	0	0	0	118.2
1054	T	27	Very low	30.7	Very low	123 Å²	123	141.7 Å²	141.7	76%	0.755	75%	0.753	S	S	*	*			trans	-34.6	140.2	150.2	-43.7	0	0	0	0	115.8
1055	M	28.8	Very low	30.9	Very low	185 Å²	185	141.5 Å²	141.5	91%	0.911	74%	0.741	S	S	*	*			trans	-135.3	140.9	144.1	-88.3	-150.8	74.2	0	0	110.3
1056	E	31.2	Very low	31.2	Very low	164 Å²	164	143.2 Å²	143.2	77%	0.766	74%	0.739	S	S	*	*			trans	-81.7	156.6	-164.8	-70	-157.4	128	0	0	116.3	G1058	E1056-G1058 VanDerWaalsContact C-N 3.29Å; E1056-G1058 PolarHBondContact O-N 3.43Å
1057	P	33.5	Very low	31.7	Very low	137 Å²	137	141.5 Å²	141.5	89%	0.89	72%	0.722	S	S	*	*			trans	-78.8	67.7	166.6	34.6	-35	0	0	0	112.7
1058	G	30.6	Very low	31.9	Very low	65 Å²	65	142.7 Å²	142.7	67%	0.67	72%	0.723	S	S	*	*			trans	-94.5	135.2	-176.8	0	0	0	0	0	116	E1056	E1056-G1058 VanDerWaalsContact C-N 3.29Å; E1056-G1058 PolarHBondContact O-N 3.43Å
1059	K	26.9	Very low	32.1	Very low	197 Å²	197	141.4 Å²	141.4	86%	0.857	72%	0.715	S	S	*	*			trans	-77.2	132.4	-174.6	-55.5	143.1	-176.6	161	0	113.2
1060	H	33.4	Very low	31.9	Very low	175 Å²	175	141.2 Å²	141.2	81%	0.81	72%	0.716	S	S	*	*			trans	175.4	162.5	133	-90.1	-67.8	0	0	0	109.3
1061	Q	27.5	Very low	31.9	Very low	131 Å²	131	142.5 Å²	142.5	61%	0.612	71%	0.714	S	S	*	*			cis	-179.1	118.5	-44.9	-174.5	-178.3	-24.5	0	0	107.4
1062	Q	28.9	Very low	32	Very low	142 Å²	142	143.1 Å²	143.1	66%	0.664	72%	0.72	S	S	*	*			trans	57.4	153.5	155.4	-68.7	160.8	-19.9	0	0	118.6
1063	Q	31	Very low	32	Very low	120 Å²	120	143 Å²	143	56%	0.561	73%	0.725	S	S	*	*			cis	-147	152	22.7	-159.3	82.8	-75.1	0	0	105.8
1064	Q	36.5	Very low	32.1	Very low	179 Å²	179	146.5 Å²	146.5	84%	0.836	73%	0.729	S	S	*	*			cis	-147.2	140.1	37.1	-58	154	7.5	0	0	108.8
1065	R	31.9	Very low	32.4	Very low	156 Å²	156	145.7 Å²	145.7	59%	0.589	73%	0.728	S	S	*	*			cis	72.5	141.9	48.5	-94.7	-174.3	145.3	169.7	-2.9	114.2	D1067	R1065-D1067 IonicContact NE-OD1 3.65Å; R1065-D1067 IonicContact NH2-OD1 3.54Å
1066	K	32.6	Very low	32.6	Very low	158 Å²	158	144.1 Å²	144.1	69%	0.687	72%	0.723	S	S	*	*			cis	-154.3	169.5	20.4	-117.5	-164.9	179.4	-162.9	0	111.5
1067	D	35.2	Very low	32.6	Very low	68 Å²	68	141.2 Å²	141.2	36%	0.364	72%	0.721	S	S	.	*			cis	-130.6	-143.5	-18.7	-135.5	-9	0	0	0	104.5	R1065 I1069	R1065-D1067 IonicContact NE-OD1 3.65Å; R1065-D1067 IonicContact NH2-OD1 3.54Å; D1067-I1069 VanDerWaalsContact OD2-CD1 3.29Å; D1067-I1069 WeakPolarHBondContact OD2-CD1 3.3Å
1068	L	34.5	Very low	32.5	Very low	148 Å²	148	139.4 Å²	139.4	78%	0.775	71%	0.711	S	S	*	*			cis	-123.9	164.1	0.5	-86.3	88.4	0	0	0	107.3
1069	I	33.3	Very low	32.5	Very low	121 Å²	121	144.7 Å²	144.7	62%	0.621	72%	0.718	S	S	*	*			cis	72.7	113.6	40.7	-58.7	177.1	0	0	0	111.1	D1067	D1067-I1069 VanDerWaalsContact OD2-CD1 3.29Å; D1067-I1069 WeakPolarHBondContact OD2-CD1 3.3Å
1070	S	33.7	Very low	32.6	Very low	97 Å²	97	142.3 Å²	142.3	68%	0.678	71%	0.714	S	S	*	*			cis	-149.8	-169.8	5.7	63.3	0	0	0	0	109.1
1071	K	36	Very low	32.5	Very low	187 Å²	187	140.2 Å²	140.2	81%	0.813	71%	0.709	S	S	*	*			cis	-157.2	174.2	19	-144	170.4	-169.5	-179.7	0	111.4
1072	S	35.7	Very low	32.5	Very low	112 Å²	112	139.1 Å²	139.1	78%	0.783	71%	0.711	S	S	*	*			trans	59.1	112.9	166.2	-60.7	0	0	0	0	120.2
1073	K	32.8	Very low	32.6	Very low	190 Å²	190	137.5 Å²	137.5	83%	0.826	71%	0.707	S	S	*	*			trans	-97	-159.6	159.3	-58.3	-178.9	175	-174.5	0	107.9
1074	R	32.6	Very low	32.6	Very low	221 Å²	221	139.1 Å²	139.1	83%	0.834	71%	0.713	S	S	*	*			cis	-170.1	-179.5	19.8	-151.3	-171.6	-74.8	-151.4	1.3	109.9
1075	S	34	Very low	32.3	Very low	106 Å²	106	137.2 Å²	137.2	74%	0.741	71%	0.707	S	S	*	*			trans	93.2	132.9	161.6	-138.6	0	0	0	0	115.9
1076	L	33	Very low	32.1	Very low	153 Å²	153	137.2 Å²	137.2	80%	0.801	71%	0.711	S	S	*	*			cis	-156.9	-171.9	-31	-122.1	164.9	0	0	0	109.2
1077	S	30.5	Very low	31.8	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	71%	0.709	S	S	*	*			trans	-100.6	-161.6	-167.7	-47.8	0	0	0	0	114
1078	S	31.4	Very low	31.4	Very low	99 Å²	99	141 Å²	141	69%	0.692	73%	0.73	S	S	*	*			trans	81.1	142.7	176.4	-55.7	0	0	0	0	115.2
1079	E	32.1	Very low	31.1	Very low	176 Å²	176	138.9 Å²	138.9	82%	0.822	73%	0.725	S	S	*	*			cis	-145.3	170.8	0.9	-142	114.8	-145.7	0	0	111.1
1080	L	28.7	Very low	31	Very low	147 Å²	147	138 Å²	138	77%	0.77	74%	0.735	S	S	*	*			trans	-74.7	164.4	162.2	-75.4	90.6	0	0	0	108
1081	D	30.3	Very low	30.8	Very low	130 Å²	130	137.8 Å²	137.8	70%	0.695	73%	0.732	S	S	*	*				-165.6	-175.7	54.8	-136.8	-61.5	0	0	0	114.4
1082	T	28.9	Very low	30.3	Very low	109 Å²	109	135.8 Å²	135.8	67%	0.669	73%	0.729	S	S	*	*			trans	-26.3	153	159	46.3	0	0	0	0	115.1
1083	D	29.7	Very low	29.8	Very low	108 Å²	108	136.3 Å²	136.3	58%	0.578	72%	0.719	S	S	*	*				-171.8	167.4	54.1	-151.2	-8.5	0	0	0	115
1084	K	31.2	Very low	29.5	Very low	154 Å²	154	134.5 Å²	134.5	67%	0.67	71%	0.713	S	S	*	*			trans	64.8	135.3	145.2	-90.1	156.6	-164.3	141.5	0	123.3
1085	L	30.1	Very low	29.3	Very low	139 Å²	139	133.9 Å²	133.9	73%	0.728	71%	0.712	S	S	*	*			trans	68.6	143.7	143.4	-59.6	164.1	0	0	0	118.2
1086	K	26.9	Very low	29.1	Very low	155 Å²	155	133.4 Å²	133.4	67%	0.674	71%	0.706	S	S	*	*			cis	-173.3	158.5	-29.3	-125.5	-172.9	-166.8	-177.3	0	106
1087	Q	27.1	Very low	28.9	Very low	136 Å²	136	133.3 Å²	133.3	64%	0.636	70%	0.702	S	S	*	*			trans	47.6	107	148.6	-69.9	168.9	-35.4	0	0	118.4
1088	Q	26.1	Very low	28.8	Very low	171 Å²	171	134.8 Å²	134.8	80%	0.799	70%	0.697	S	S	*	*				88.9	162.5	101.5	-79.9	175.1	-23.1	0	0	114.1
1089	P	28.4	Very low	28.7	Very low	103 Å²	103	137.1 Å²	137.1	67%	0.669	70%	0.697	S	S	*	*			cis	-117.1	-179	-21.3	37.6	-24.3	0	0	0	111.3	P1091	P1089-P1091 HydrophobicContact CG-CG 4.4Å
1090	A	32.8	Very low	28.4	Very low	101 Å²	101	131.7 Å²	131.7	84%	0.835	69%	0.687	S	S	*	*			trans	-80.6	134.9	149	0	0	0	0	0	108.4
1091	P	28.8	Very low	28.3	Very low	94 Å²	94	133.4 Å²	133.4	61%	0.61	69%	0.685	S	S	*	*			trans	-140.1	139.2	145.5	34.7	-19.6	0	0	0	113.9	P1089	P1089-P1091 HydrophobicContact CG-CG 4.4Å
1092	L	25.1	Very low	28.1	Very low	145 Å²	145	134.5 Å²	134.5	76%	0.759	69%	0.686	S	S	*	*				51.2	125.2	127.8	-56.3	171.8	0	0	0	119.7
1093	H	25.7	Very low	28	Very low	122 Å²	122	137.3 Å²	137.3	57%	0.565	69%	0.689	S	S	*	*				80	152.6	59.5	-148.6	-80.5	0	0	0	113.1
1094	H	26.6	Very low	27.8	Very low	152 Å²	152	136.1 Å²	136.1	70%	0.704	69%	0.689	S	S	*	*			trans	76.9	125	-170.2	-57.1	76.8	0	0	0	113.1
1095	Y	28.4	Very low	27.6	Very low	208 Å²	208	134 Å²	134	82%	0.816	69%	0.689	S	S	*	*				57.3	136.6	52.1	-78.1	-78	0	0	0	111.1
1096	P	30.3	Very low	27.7	Very low	96 Å²	96	133.2 Å²	133.2	62%	0.623	69%	0.686	S	S	*	*				-149.3	-175.6	62.3	43.9	-25.9	0	0	0	115.8
1097	H	28.4	Very low	27.7	Very low	152 Å²	152	131.7 Å²	131.7	70%	0.704	69%	0.685	S	S	*	*			trans	64.1	145.2	150.5	-69.2	-41.9	0	0	0	118.8
1098	H	27.3	Very low	27.7	Very low	133 Å²	133	131.2 Å²	131.2	62%	0.616	69%	0.692	S	S	*	*			cis	161.5	145.6	-17.6	-121.5	-135.6	0	0	0	104
1099	H	29.1	Very low	27.9	Very low	149 Å²	149	128.2 Å²	128.2	69%	0.69	69%	0.687	S	S	*	*			trans	62.2	161.3	170.5	-48.9	-57.5	0	0	0	114.7	Y1101	H1099-Y1101 HydrophobicContact CB-CD2 4.43Å; H1099-Y1101 AromaticContact ND1-CE2 3.87Å
1100	G	27.4	Very low	27.7	Very low	61 Å²	61	128.8 Å²	128.8	63%	0.629	69%	0.688	S	S	*	*			cis	-90.5	-173.7	-8.2	0	0	0	0	0	114.3
1101	Y	25.9	Very low	27.4	Very low	184 Å²	184	130.2 Å²	130.2	72%	0.722	68%	0.682	S	S	*	*			cis	55.7	126	41.3	-53.1	-67	0	0	0	110.3	H1099	H1099-Y1101 HydrophobicContact CB-CD2 4.43Å; H1099-Y1101 AromaticContact ND1-CE2 3.87Å
1102	E	26.3	Very low	27.2	Very low	153 Å²	153	131.5 Å²	131.5	72%	0.715	68%	0.684	S	S	*	*			cis	-162.1	160.2	15.4	-116.7	145.8	-146.8	0	0	107.9
1103	F	25.8	Very low	27.2	Very low	167 Å²	167	132.4 Å²	132.4	73%	0.732	68%	0.684	S	S	*	*			cis	-145.9	173.4	-8.3	-143.6	-161	0	0	0	107.7
1104	S	26.2	Very low	27.2	Very low	83 Å²	83	132.1 Å²	132.1	58%	0.58	70%	0.696	S	S	*	*				35	132.8	100.3	-142.4	0	0	0	0	114.1
1105	T	27.9	Very low	27.2	Very low	109 Å²	109	132.7 Å²	132.7	67%	0.669	70%	0.702	S	S	*	*				-156.5	152.2	59.1	48.6	0	0	0	0	116.1
1106	N	32.2	Very low	27.2	Very low	123 Å²	123	127.6 Å²	127.6	66%	0.658	70%	0.704	S	S	*	*			trans	72.1	115.6	145.4	-67.1	-22.2	0	0	0	117.8
1107	N	25.4	Very low	27.2	Very low	123 Å²	123	126.3 Å²	126.3	66%	0.658	71%	0.707	S	S	*	*				71.3	99.3	70.9	-70.7	-40.2	0	0	0	110.2
1108	T	28.2	Very low	27.4	Very low	127 Å²	127	127.6 Å²	127.6	78%	0.779	72%	0.719	S	S	*	*				70.6	165.4	90	62.1	0	0	0	0	112.1
1109	P	30.1	Very low	27.7	Very low	107 Å²	107	124.8 Å²	124.8	70%	0.695	73%	0.726	S	S	*	*			cis	-127.5	-172.1	5.8	47.8	-30.1	0	0	0	112.1
1110	V	24.7	Very low	27.8	Very low	115 Å²	115	123.1 Å²	123.1	70%	0.697	73%	0.73	S	S	*	*				43.2	134.8	99.8	-172.5	0	0	0	0	116.1
1111	N	25	Very low	28	Very low	132 Å²	132	127.3 Å²	127.3	71%	0.706	73%	0.733	S	S	*	*			trans	69.2	154.7	169.4	-70.9	-5.9	0	0	0	116.3
1112	N	25.8	Very low	28.4	Very low	121 Å²	121	126.3 Å²	126.3	65%	0.647	73%	0.733	S	S	*	*			cis	-150.7	174	-8.7	-125.3	-19	0	0	0	114.6
1113	Q	24.3	Very low	28.6	Very low	164 Å²	164	127.4 Å²	127.4	77%	0.766	74%	0.735	S	S	*	*			trans	-42.8	176.4	174	-60	160.1	-17.6	0	0	119.4
1114	S	25.9	Very low	28.6	Very low	115 Å²	115	127.3 Å²	127.3	80%	0.804	74%	0.741	S	S	*	*			trans	91.7	140.1	165.1	84.1	0	0	0	0	116.2
1115	I	27.7	Very low	28.7	Very low	164 Å²	164	126.6 Å²	126.6	84%	0.841	75%	0.746	S	S	*	*			cis	-123.4	159.4	4.4	-64.6	171.8	0	0	0	110.6
1116	A	28	Very low	28.6	Very low	102 Å²	102	127.2 Å²	127.2	84%	0.843	75%	0.75	S	S	*	*			trans	-49.9	159.9	-174.9	0	0	0	0	0	117.9
1117	G	30.5	Very low	28.3	Very low	68 Å²	68	129.8 Å²	129.8	70%	0.701	76%	0.758	S	S	*	*			cis	176	178.4	-0.8	0	0	0	0	0	115.5
1118	D	31.3	Very low	28.5	Very low	179 Å²	179	128.9 Å²	128.9	96%	0.957	76%	0.758	S	S	*	*			trans	52.9	130.2	166.8	-59.9	-23.4	0	0	0	122
1119	G	33.1	Very low	28.3	Very low	74 Å²	74	128.3 Å²	128.3	76%	0.763	76%	0.758	S	S	*	*			trans	168.1	23.2	174.2	0	0	0	0	0	122.8
1120	C	32.6	Very low	28.1	Very low	114 Å²	114	128.4 Å²	128.4	77%	0.77	76%	0.76	S	S	*	*			trans	62.2	122.5	173.4	-72.4	0	0	0	0	118.3
1121	Q	32.1	Very low	28.1	Very low	149 Å²	149	129.9 Å²	129.9	70%	0.696	76%	0.764	S	S	*	*				60.6	132.3	79.4	-64	-169.8	46.9	0	0	114.7
1122	K	32.6	Very low	28.2	Very low	163 Å²	163	130 Å²	130	71%	0.709	76%	0.764	S	S	*	*			cis	-164.6	154.4	6.7	-119.1	167.1	-176.9	153.8	0	111.7
1123	K	30.6	Very low	28.2	Very low	177 Å²	177	131.8 Å²	131.8	77%	0.77	77%	0.773	S	S	*	*			trans	31.7	134	149	-63.2	-176.9	176.2	-169.5	0	120.7
1124	I	26.5	Very low	28.6	Very low	165 Å²	165	128.6 Å²	128.6	85%	0.846	77%	0.767	S	S	*	*			cis	75.4	123.6	47	-58.3	168.7	0	0	0	114
1125	G	28	Very low	28.6	Very low	68 Å²	68	129.1 Å²	129.1	70%	0.701	77%	0.765	S	S	*	*			trans	137	103.8	-178.2	0	0	0	0	0	108.8
1126	V	26.7	Very low	28.4	Very low	122 Å²	122	125.4 Å²	125.4	74%	0.739	75%	0.753	S	S	*	*			cis	79.2	100.6	33.8	-169.5	0	0	0	0	113.2
1127	E	24.2	Very low	28.3	Very low	177 Å²	177	129.3 Å²	129.3	83%	0.827	75%	0.751	S	S	*	*			trans	62.4	172.6	160.3	-67.2	-164.5	151.6	0	0	117.9
1128	P	31.1	Very low	28.1	Very low	103 Å²	103	132.2 Å²	132.2	67%	0.669	76%	0.756	S	S	*	*				-134.4	-175.7	-57.3	40.2	-26.5	0	0	0	113.4
1129	C	23.9	Very low	27.8	Very low	115 Å²	115	129.4 Å²	129.4	78%	0.777	75%	0.745	S	S	*	*			trans	69.5	141.2	152.5	-72.5	0	0	0	0	122
1130	C	24.6	Very low	27.5	Very low	109 Å²	109	131.8 Å²	131.8	74%	0.736	74%	0.744	S	S	*	*			trans	62.1	116	142.1	-65.5	0	0	0	0	122.7
1131	L	25.2	Very low	27.1	Very low	146 Å²	146	133.2 Å²	133.2	76%	0.764	74%	0.743	S	S	*	*			trans	70.9	119.3	130.7	-60.7	170.1	0	0	0	120.7
1132	D	26.8	Very low	26.9	Very low	134 Å²	134	131.9 Å²	131.9	72%	0.717	75%	0.745	S	S	*	*			trans	66.9	120.9	138.9	-55.2	-27.2	0	0	0	122.9
1133	L	26	Very low	26.8	Very low	159 Å²	159	128.9 Å²	128.9	83%	0.832	75%	0.745	S	S	*	*			trans	9.8	159.1	132.1	-90.4	70.6	0	0	0	121
1134	P	32.9	Very low	26.8	Very low	98 Å²	98	127 Å²	127	64%	0.636	74%	0.743	S	S	*	*			cis	-144.3	161.9	4	33.5	-10.8	0	0	0	118.9
1135	T	25.6	Very low	26.9	Very low	126 Å²	126	126.2 Å²	126.2	77%	0.773	74%	0.737	S	S	*	*			trans	61.6	139.7	141.1	59.4	0	0	0	0	124.7
1136	S	25.2	Very low	27.1	Very low	85 Å²	85	128.5 Å²	128.5	59%	0.594	73%	0.73	S	S	*	*				122.9	113.5	124.8	-80.3	0	0	0	0	120.6
1137	K	25.5	Very low	27.2	Very low	184 Å²	184	130.1 Å²	130.1	80%	0.8	73%	0.727	S	S	*	*			trans	69.7	131.5	130.9	-58.8	169.2	-172	174.1	0	121.6
1138	T	26.2	Very low	27.3	Very low	129 Å²	129	128.3 Å²	128.3	79%	0.791	72%	0.722	S	S	*	*				160.6	96.6	114.6	-65.6	0	0	0	0	108.3
1139	V	24.6	Very low	27	Very low	120 Å²	120	132.2 Å²	132.2	73%	0.727	73%	0.729	S	S	*	*				76.1	122.9	83.6	171.1	0	0	0	0	114.9
1140	V	25.9	Very low	27.1	Very low	125 Å²	125	131.4 Å²	131.4	76%	0.758	73%	0.73	S	S	*	*			trans	-174.1	102.4	131.6	145	0	0	0	0	107.6
1141	I	24.8	Very low	27.3	Very low	144 Å²	144	132.5 Å²	132.5	74%	0.738	73%	0.733	S	S	*	*				41.2	136.7	109.6	14.8	177.5	0	0	0	115.9
1142	T	27.9	Very low	27.4	Very low	121 Å²	121	130.9 Å²	130.9	74%	0.742	73%	0.73	S	S	*	*			cis	-134.6	-170.4	14.1	74.5	0	0	0	0	110.1
1143	S	31.6	Very low	27.6	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	74%	0.736	S	S	*	*			cis	-178.9	164.6	-20.2	37	0	0	0	0	107
1144	D	29.3	Very low	27.7	Very low	137 Å²	137	132.5 Å²	132.5	73%	0.733	73%	0.729	S	S	*	*				-145.7	-131.9	-53.4	-149.9	-110.6	0	0	0	104.1	H1146	D1144-H1146 IonicContact OD1-CD2 2.78Å; D1144-H1146 PolarHBondContact OD1-N 3.45Å; D1144-H1146 VanDerWaalsContact OD1-N 3.17Å
1145	M	30	Very low	27.4	Very low	148 Å²	148	134.2 Å²	134.2	73%	0.729	74%	0.738	S	S	*	*			cis	-128.3	124.7	-2.9	-77.3	-173.5	74.4	0	0	110.9
1146	H	31	Very low	27.5	Very low	116 Å²	116	136 Å²	136	54%	0.537	74%	0.742	S	S	.	*			trans	64.7	156.3	144.5	-69.1	-173.7	0	0	0	121.4	D1144	D1144-H1146 IonicContact OD1-CD2 2.78Å; D1144-H1146 PolarHBondContact OD1-N 3.45Å; D1144-H1146 VanDerWaalsContact OD1-N 3.17Å
1147	K	28.2	Very low	27.5	Very low	156 Å²	156	137.1 Å²	137.1	68%	0.678	75%	0.75	S	S	*	*			cis	179.8	140.1	-27.1	-101.7	170.4	-179.4	156	0	103.8
1148	L	27.3	Very low	27.5	Very low	139 Å²	139	134.8 Å²	134.8	73%	0.728	76%	0.755	S	S	*	*			cis	-149.4	150.5	-9.1	-87.2	158.8	0	0	0	106.4
1149	K	25.1	Very low	27.4	Very low	186 Å²	186	135.5 Å²	135.5	81%	0.809	76%	0.759	S	S	*	*				39.2	114.8	87.4	-59	-175.3	178.6	-179.9	0	114.3
1150	A	26.2	Very low	27.7	Very low	98 Å²	98	134.9 Å²	134.9	81%	0.81	77%	0.767	S	S	*	*			cis	88.2	125.9	43.3	0	0	0	0	0	114.4
1151	T	29.2	Very low	27.6	Very low	131 Å²	131	134.7 Å²	134.7	80%	0.804	77%	0.771	S	S	*	*			trans	-146.3	145.1	171.9	-47.9	0	0	0	0	110.3	Y1153	T1151-Y1153 HydrophobicContact CG2-CE2 4.44Å
1152	T	26.1	Very low	28	Very low	113 Å²	113	132.9 Å²	132.9	69%	0.693	77%	0.771	S	S	*	*			trans	-107.2	137.5	-174	-52.5	0	0	0	0	111.9
1153	Y	30.3	Very low	28.1	Very low	214 Å²	214	132.4 Å²	132.4	84%	0.839	77%	0.773	S	S	*	*			trans	-139.1	118.2	148.5	-73.3	-78.5	0	0	0	107.1	T1151	T1151-Y1153 HydrophobicContact CG2-CE2 4.44Å
1154	T	29.6	Very low	28.1	Very low	112 Å²	112	132.6 Å²	132.6	69%	0.687	77%	0.774	S	S	*	*				78.7	116	56.5	-57.2	0	0	0	0	111.7
1155	T	25.7	Very low	28.2	Very low	134 Å²	134	131.3 Å²	131.3	82%	0.822	77%	0.771	S	S	*	*			trans	-72	138.4	178.7	47.5	0	0	0	0	112.3
1156	L	28.3	Very low	28.3	Very low	164 Å²	164	130.3 Å²	130.3	86%	0.859	77%	0.774	S	S	*	*			trans	-147.9	127.9	157.4	-113.2	163.8	0	0	0	110.3
1157	S	24	Very low	28.1	Very low	109 Å²	109	130.3 Å²	130.3	76%	0.762	79%	0.787	S	S	*	*			trans	-86.9	137.8	172.7	52.2	0	0	0	0	110.5
1158	C	26.4	Very low	28.2	Very low	134 Å²	134	128.6 Å²	128.6	91%	0.905	79%	0.794	S	S	*	*			trans	-142.2	131.3	157.7	-98.6	0	0	0	0	110.7
1159	T	24.1	Very low	28.1	Very low	145 Å²	145	128.1 Å²	128.1	89%	0.89	80%	0.797	S	S	*	*			trans	-85.8	145.1	171.8	43.4	0	0	0	0	110.6
1160	A	30.6	Very low	28.3	Very low	106 Å²	106	127.1 Å²	127.1	88%	0.876	80%	0.8	S	S	*	*			trans	-148.8	137.1	162.4	0	0	0	0	0	109.1
1161	S	24.8	Very low	28.3	Very low	121 Å²	121	127.8 Å²	127.8	85%	0.846	79%	0.794	S	S	*	*			trans	-134.2	128.1	-165.2	55.8	0	0	0	0	113.4
1162	S	33	Very low	28.3	Very low	106 Å²	106	127.7 Å²	127.7	74%	0.741	79%	0.793	S	S	*	*			trans	-166	114.1	160	53.1	0	0	0	0	107.8
1163	S	29.4	Very low	28.3	Very low	112 Å²	112	128.1 Å²	128.1	78%	0.783	80%	0.795	S	S	*	*				47.9	116.9	80.2	70.5	0	0	0	0	113.2
1164	S	31.8	Very low	28.3	Very low	104 Å²	104	124.6 Å²	124.6	73%	0.727	80%	0.796	S	S	*	*			cis	-153.7	-149.8	0.1	47.5	0	0	0	0	109
1165	T	31.4	Very low	28.1	Very low	110 Å²	110	123 Å²	123	68%	0.675	80%	0.795	S	S	*	*			cis	-162	164.9	13.7	-24.7	0	0	0	0	110.8
1166	T	31.6	Very low	28.2	Very low	126 Å²	126	127.3 Å²	127.3	77%	0.773	80%	0.797	S	S	*	*			trans	42.4	100.1	155.6	45.9	0	0	0	0	121.1
1167	S	26.7	Very low	28.2	Very low	117 Å²	117	124.9 Å²	124.9	82%	0.818	79%	0.79	S	S	*	*				24.8	125.4	122.8	-166.7	0	0	0	0	120.7
1168	S	30.4	Very low	28.5	Very low	119 Å²	119	125 Å²	125	83%	0.832	79%	0.786	S	S	*	*				-170.8	155.7	108.8	37.8	0	0	0	0	112.3
1169	V	26	Very low	28.6	Very low	130 Å²	130	130.1 Å²	130.1	79%	0.788	79%	0.786	S	S	*	*			trans	-106.1	138.6	-179.7	173.3	0	0	0	0	109.5
1170	L	29.2	Very low	28.7	Very low	164 Å²	164	129.4 Å²	129.4	86%	0.859	78%	0.776	S	S	*	*			trans	-158.5	136.4	151.9	-114.2	164.1	0	0	0	112.8
1171	T	26.4	Very low	28.6	Very low	112 Å²	112	129 Å²	129	69%	0.687	76%	0.762	S	S	*	*			trans	-105.4	129.3	179.2	-60.5	0	0	0	0	109.8
1172	V	28.4	Very low	28.6	Very low	129 Å²	129	128.8 Å²	128.8	78%	0.782	75%	0.752	S	S	*	*			trans	-134	137.9	166	-177.1	0	0	0	0	109.4
1173	T	25.7	Very low	28.2	Very low	122 Å²	122	128.5 Å²	128.5	75%	0.748	75%	0.749	S	S	*	*			trans	-135.5	118.1	-176	-50	0	0	0	0	110.5
1174	T	29.8	Very low	28.1	Very low	140 Å²	140	131.9 Å²	131.9	86%	0.859	75%	0.749	S	S	*	*			trans	-154.2	159.1	165.9	0.6	0	0	0	0	112
1175	A	27.4	Very low	27.8	Very low	80 Å²	80	132.9 Å²	132.9	66%	0.661	75%	0.751	S	S	*	*			trans	-95.3	172.7	-172.3	0	0	0	0	0	113.3
1176	Y	26.8	Very low	27.6	Very low	223 Å²	223	134.6 Å²	134.6	88%	0.875	76%	0.762	S	S	*	*				-171.4	-174.6	110.3	-113.3	-87.2	0	0	0	112.2
1177	T	28.1	Very low	27.5	Very low	113 Å²	113	135 Å²	135	69%	0.693	76%	0.764	S	S	*	*			trans	-133.5	139.4	-153.7	27.7	0	0	0	0	116.8
1178	T	29.7	Very low	27.5	Very low	113 Å²	113	134 Å²	134	69%	0.693	76%	0.757	S	S	*	*			trans	63.2	118.6	137.8	-51.5	0	0	0	0	121.8	I1180	T1178-I1180 HydrophobicContact CG2-CD1 4.41Å
1179	R	29.2	Very low	27.5	Very low	240 Å²	240	133.2 Å²	133.2	91%	0.906	75%	0.752	S	S	*	*			trans	-178.6	165.9	136.6	-98.7	164.3	-168.5	-163.5	5.5	109.8
1180	I	26.5	Very low	27.6	Very low	131 Å²	131	131.6 Å²	131.6	67%	0.672	75%	0.746	S	S	*	*				-162.2	140.7	-61.5	-115.2	168.1	0	0	0	109.8	T1178	T1178-I1180 HydrophobicContact CG2-CD1 4.41Å
1181	T	27.8	Very low	27.6	Very low	96 Å²	96	131 Å²	131	59%	0.589	74%	0.744	S	S	*	*			trans	59.1	126.7	162.6	52.4	0	0	0	0	124.2
1182	N	26.1	Very low	27.6	Very low	117 Å²	117	133.7 Å²	133.7	63%	0.626	75%	0.749	S	S	*	*				120.6	133.5	110.5	-98.4	13.3	0	0	0	121	K477	K477-N1182 PolarHBondContact NZ-OD1 2.87Å
1183	C	24.8	Very low	27.8	Very low	100 Å²	100	136.9 Å²	136.9	68%	0.676	75%	0.754	S	S	*	*			trans	77.7	97.8	142.8	-68.4	0	0	0	0	123.1
1184	K	25.3	Very low	27.9	Very low	184 Å²	184	139.5 Å²	139.5	80%	0.8	76%	0.758	S	S	*	*				69.6	103.4	117.3	-76.8	-170.9	173.5	-173.2	0	121.3
1185	T	26.7	Very low	28	Very low	125 Å²	125	142 Å²	142	77%	0.767	76%	0.759	S	S	*	*				51.3	117.7	123.8	59.2	0	0	0	0	120.9
1186	T	27.3	Very low	28.1	Very low	145 Å²	145	146.5 Å²	146.5	89%	0.89	77%	0.766	S	S	*	*				-146.8	152	109.7	9	0	0	0	0	111.5
1187	T	28.4	Very low	28.3	Very low	135 Å²	135	143.3 Å²	143.3	83%	0.828	76%	0.764	S	S	*	*			trans	-91.5	175.9	166.6	51.6	0	0	0	0	108.8
1188	S	28.2	Very low	28.3	Very low	95 Å²	95	146.1 Å²	146.1	66%	0.664	77%	0.769	S	S	*	*			cis	-158.6	157.7	24.1	59.8	0	0	0	0	111.4
1189	S	29.3	Very low	28.2	Very low	104 Å²	104	148.2 Å²	148.2	73%	0.727	77%	0.771	S	S	*	*				58.1	138.5	111.6	78.1	0	0	0	0	117.2
1190	S	28	Very low	28.1	Very low	95 Å²	95	144.6 Å²	144.6	66%	0.664	76%	0.764	S	S	*	*			cis	-158.9	168.5	0.6	46.3	0	0	0	0	110
1191	D	29.7	Very low	28	Very low	151 Å²	151	146.6 Å²	146.6	81%	0.807	77%	0.768	S	S	*	*				-171.9	174.8	111	-92	0.2	0	0	0	112.3
1192	Q	26	Very low	27.9	Very low	170 Å²	170	150.3 Å²	150.3	79%	0.794	78%	0.777	S	S	*	*			trans	-104.3	149.3	-157.7	-52.7	179.6	13.6	0	0	112.9
1193	H	32.2	Very low	27.9	Very low	195 Å²	195	155.4 Å²	155.4	90%	0.903	79%	0.788	S	S	*	*				-166.9	160	123.1	-101.5	-68.5	0	0	0	110.6
1194	H	28.4	Very low	27.9	Very low	178 Å²	178	161.2 Å²	161.2	82%	0.824	80%	0.798	S	S	*	*			trans	-88.6	150.2	-169.5	-77	-42.6	0	0	0	114.8
1195	H	33.1	Very low	28	Very low	192 Å²	192	156 Å²	156	89%	0.889	80%	0.797	S	S	*	*				-152.1	162.7	127.5	-107.4	-68.6	0	0	0	111.5
1196	H	29.6	Very low	28	Very low	174 Å²	174	158.3 Å²	158.3	81%	0.806	80%	0.799	S	S	*	*			trans	-75.3	148.3	-167.7	-77.9	-61	0	0	0	115.4
1197	N	31	Very low	28.2	Very low	156 Å²	156	159.2 Å²	159.2	83%	0.834	80%	0.798	S	S	*	*			trans	-145.7	139	147.8	-111.3	-43.1	0	0	0	109.8	H1199	N1197-H1199 PolarHBondContact O-N 2.94Å
1198	H	26.6	Very low	28.1	Very low	172 Å²	172	161.3 Å²	161.3	80%	0.796	80%	0.798	S	S	*	*			trans	-79.9	112	-174.7	-88.9	-87.8	0	0	0	112.5
1199	H	27.9	Very low	28.2	Very low	158 Å²	158	163.8 Å²	163.8	73%	0.731	80%	0.804	S	S	*	*			trans	-120	116.4	163.1	-91.4	-86.3	0	0	0	110.8	N1197 F1201	N1197-H1199 PolarHBondContact O-N 2.94Å; H1199-F1201 HydrophobicContact CB-CD2 4.26Å; H1199-F1201 HydrophobicContact CB-CE2 4.42Å; H1199-F1201 PolarHBondContact O-N 2.84Å; H1199-F1201 VanDerWaalsContact O-N 3.08Å
1200	H	26.9	Very low	28.4	Very low	164 Å²	164	168.2 Å²	168.2	76%	0.759	81%	0.813	S	S	*	*			trans	-75.6	91.6	172.2	-96.7	-89.2	0	0	0	111.1
1201	F	24.6	Very low	28.5	Very low	173 Å²	173	172.7 Å²	172.7	76%	0.759	82%	0.821	S	S	*	*			trans	-91.3	121.1	160.9	-86.3	-88.9	0	0	0	110.1	H1199	H1199-F1201 HydrophobicContact CB-CD2 4.26Å; H1199-F1201 HydrophobicContact CB-CE2 4.42Å; H1199-F1201 PolarHBondContact O-N 2.84Å; H1199-F1201 VanDerWaalsContact O-N 3.08Å
1202	F	26.9	Very low	28.6	Very low	174 Å²	174	173.6 Å²	173.6	76%	0.763	83%	0.825	S	S	*	*			trans	-88.5	112.7	170.1	-85	-81.5	0	0	0	110.5
1203	Y	24.8	Very low	28.8	Very low	223 Å²	223	174.2 Å²	174.2	88%	0.875	82%	0.82	S	S	*	*			trans	-68.1	134.5	167.8	-87	-103.4	0	0	0	110.9
1204	Y	26	Very low	29	Very low	223 Å²	223	171 Å²	171	88%	0.875	80%	0.803	S	S	*	*			trans	-87.4	109.9	161.2	-86.1	-94	0	0	0	108.7
1205	G	26.3	Very low	29.4	Very low	75 Å²	75	165.8 Å²	165.8	77%	0.773	79%	0.785	S	S	*	*			trans	-74.3	124.2	166.8	0	0	0	0	0	110.3
1206	E	26.1	Very low	29.8	Very low	173 Å²	173	165.5 Å²	165.5	81%	0.808	78%	0.776	S	S	*	*			trans	-70.8	144.1	172.7	-64.7	-169.3	129.4	0	0	110.8
1207	N	31.9	Very low	30.4	Very low	163 Å²	163	161.7 Å²	161.7	87%	0.872	76%	0.755	S	S	*	*			trans	-151.5	101.5	164.9	-113.1	-60	0	0	0	107.8	N1209	N1207-N1209 PolarHBondContact O-N 3.42Å
1208	E	27.7	Very low	30.9	Very low	179 Å²	179	157.3 Å²	157.3	84%	0.836	73%	0.731	S	S	*	*			trans	-68.5	111.6	176.1	-63.6	-163.1	109.5	0	0	109.9
1209	N	28.8	Very low	31.6	Very low	148 Å²	148	156.4 Å²	156.4	79%	0.791	72%	0.722	S	S	*	*			trans	171.1	82.8	139.8	-95.2	-58.3	0	0	0	113.6	N1207	N1207-N1209 PolarHBondContact O-N 3.42Å
1210	Q	33.8	Very low	32.5	Very low	197 Å²	197	150.9 Å²	150.9	92%	0.921	70%	0.696	S	S	*	*			trans	-173.6	116.4	142.1	-106.8	153.3	84.5	0	0	112.2
1211	K	29.5	Very low	33.2	Very low	188 Å²	188	147.8 Å²	147.8	82%	0.817	69%	0.688	S	S	*	*			trans	-94.8	106.5	178.3	-74.2	174	176.9	169.5	0	110.9
1212	L	31.7	Very low	34.3	Very low	170 Å²	170	141.6 Å²	141.6	89%	0.89	66%	0.663	S	S	*	*			trans	-140.1	108.8	169.4	-156.4	79.3	0	0	0	111
1213	W	31.7	Very low	35.1	Very low	184 Å²	184	139.5 Å²	139.5	70%	0.697	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-85.2	132.3	-178.5	-59.7	88.1	0	0	0	111.1	Q1347	W1213-Q1347 VanDerWaalsContact CD1-OE1 3.29Å
1214	K	36.9	Very low	36.1	Very low	126 Å²	126	129.8 Å²	129.8	55%	0.548	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-92.2	144	169.3	-69.3	-173	-172.8	176.3	0	110.8	H144	H144-K1214 PolarHBondContact O-NZ 3.46Å
1215	P	35.3	Very low	36.7	Very low	70 Å²	70	122.9 Å²	122.9	46%	0.455	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-68.7	150.6	174	30.4	-35.7	0	0	0	111.9	E1344 I1345 F1346	P1215-E1344 HydrophobicContact CB-CG 4.28Å; P1215-I1345 WeakPolarHBondContact CA-O 3.04Å; P1215-I1345 WeakPolarHBondContact CB-O 3.49Å; P1215-F1346 HydrophobicContact CB-CB 4.18Å
1216	R	41	Very low	37.3	Very low	185 Å²	185	123.4 Å²	123.4	70%	0.698	59%	0.589	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.7	145.9	167.2	-75.4	-175.5	166.4	-158.2	-5.6	109.7
1217	R	43	Very low	37.8	Very low	95 Å²	95	123.3 Å²	123.3	36%	0.358	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.9	147.2	175.2	-69.3	169.3	89	-175.7	8.9	110.4	D1342 M1343 E1344	R1217-D1342 IonicContact CZ-OD1 3.83Å; R1217-D1342 IonicContact CZ-OD2 2.66Å; R1217-D1342 IonicContact NE-OD1 3.68Å; R1217-D1342 PolarHBondContact NE-OD1 2.81Å; R1217-D1342 IonicContact NE-OD2 2.72Å; R1217-D1342 VanDerWaalsContact NH2-CG 3.3Å; R1217-D1342 IonicContact NH2-OD1 3.86Å; R1217-D1342 PolarHBondContact NH2-OD1 3.07Å; R1217-D1342 IonicContact NH2-OD2 2.88Å; R1217-D1342 PolarHBondContact NH2-OD2 3.33Å; R1217-M1343 WeakPolarHBondContact CA-O 3.4Å; R1217-E1344 HydrophobicContact CG-CB 4.27Å
1218	L	42.4	Very low	38.3	Very low	64 Å²	64	120 Å²	120	34%	0.335	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.3	132.2	170.9	-72.1	166.6	0	0	0	109.1	F1220 M1343	L1218-F1220 HydrophobicContact CB-CD2 4.45Å; L1218-F1220 HydrophobicContact CB-CE2 3.6Å; L1218-F1220 HydrophobicContact CB-CZ 3.74Å; L1218-F1220 HydrophobicContact CD1-CZ 4.11Å; L1218-F1220 HydrophobicContact CG-CZ 4.49Å; L1218-M1343 HydrophobicContact CB-CE 4.43Å; L1218-M1343 HydrophobicContact CD1-CE 3.84Å; L1218-M1343 PolarHBondContact N-O 2.82Å; L1218-M1343 PolarHBondContact O-N 3.4Å
1219	Y	39.5	Very low	39.3	Very low	152 Å²	152	114.1 Å²	114.1	60%	0.596	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-101.1	135.6	174.9	-67.1	-91.7	0	0	0	108.8	I1361	Y1219-I1361 HydrophobicContact CD1-CD1 3.97Å; Y1219-I1361 HydrophobicContact CE1-CD1 4.1Å
1220	F	47.1	Very low	40.5	Very low	43 Å²	43	110.8 Å²	110.8	19%	0.189	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.6	141.7	174.8	-51.2	-93.9	0	0	0	110.3	L1218 L1241 W1341 M1343	L1218-F1220 HydrophobicContact CB-CD2 4.45Å; L1218-F1220 HydrophobicContact CB-CE2 3.6Å; L1218-F1220 HydrophobicContact CB-CZ 3.74Å; L1218-F1220 HydrophobicContact CD1-CZ 4.11Å; L1218-F1220 HydrophobicContact CG-CZ 4.49Å; F1220-L1241 HydrophobicContact CD1-CD2 4.21Å; F1220-L1241 HydrophobicContact CE1-CD2 4.02Å; F1220-W1341 AromaticContact CD2-CD1 3.81Å; F1220-W1341 AromaticContact CD2-NE1 3.61Å; F1220-W1341 AromaticContact CG-NE1 3.85Å; F1220-W1341 PolarHBondContact N-O 2.82Å; F1220-W1341 PolarHBondContact O-N 3.02Å; F1220-M1343 HydrophobicContact CD2-CB 4.49Å; F1220-M1343 HydrophobicContact CE2-CB 3.93Å; F1220-M1343 HydrophobicContact CE2-CE 4.01Å; F1220-M1343 HydrophobicContact CE2-SD 4.32Å; F1220-M1343 HydrophobicContact CZ-CE 4.11Å
1221	V	42.5	Very low	41.2	Very low	99 Å²	99	104.2 Å²	104.2	60%	0.6	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	117.8	169.9	179.9	0	0	0	0	106.7	L1338 I1340	V1221-L1338 HydrophobicContact CG1-CD1 3.9Å; V1221-L1338 HydrophobicContact CG1-CD2 4.48Å; V1221-L1338 HydrophobicContact CG1-CG 4.3Å; V1221-I1340 HydrophobicContact CG2-CG2 4.4Å
1222	L	47.4	Very low	42.1	Very low	43 Å²	43	99.2 Å²	99.2	23%	0.225	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117.5	175.2	-88.9	158.9	0	0	0	109	L1224 M1238 L1339 W1341	L1222-L1224 HydrophobicContact CB-CG 4.33Å; L1222-L1224 PolarHBondContact O-N 3.33Å; L1222-M1238 HydrophobicContact CD1-CG 4.46Å; L1222-M1238 HydrophobicContact CD1-SD 4.06Å; L1222-L1339 PolarHBondContact N-O 2.89Å; L1222-L1339 PolarHBondContact O-N 2.81Å; L1222-L1339 VanDerWaalsContact O-N 3.14Å; L1222-W1341 HydrophobicContact CD1-CH2 3.84Å; L1222-W1341 HydrophobicContact CD1-CZ2 3.37Å
1223	N	43.4	Very low	43.3	Very low	130 Å²	130	95.3 Å²	95.3	70%	0.695	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	99.8	172	-161.8	21.5	0	0	0	107.7	L1338	N1223-L1338 HydrophobicContact CB-CD1 4.4Å
1224	L	45.9	Very low	44.3	Very low	19 Å²	19	88.2 Å²	88.2	10%	0.099	46%	0.459	C	S	.	.			trans	-96.6	117.9	-170.6	-75.1	164	0	0	0	110.8	L1222 I1226 L1234 L1339 I1371	L1222-L1224 HydrophobicContact CB-CG 4.33Å; L1222-L1224 PolarHBondContact O-N 3.33Å; L1224-I1226 PolarHBondContact O-N 3.39Å; L1224-L1234 HydrophobicContact CD2-CD1 3.54Å; L1224-L1234 HydrophobicContact CD2-CD2 3.61Å; L1224-L1234 HydrophobicContact CD2-CG 4.21Å; L1224-L1339 HydrophobicContact CD1-CB 3.95Å; L1224-L1339 HydrophobicContact CD1-CD2 4.13Å; L1224-I1371 HydrophobicContact CD1-CD1 4.32Å
1225	P	38	Very low	44.9	Very low	78 Å²	78	83.1 Å²	83.1	51%	0.506	44%	0.438	S	S	.	.			trans	-66	114.5	163.4	-9.8	25.9	0	0	0	107.9	H1227	P1225-H1227 PolarHBondContact O-N 2.98Å
1226	I	40.4	Very low	46	Very low	85 Å²	85	84.4 Å²	84.4	44%	0.436	44%	0.44	S	S	.	.	S	Bend	trans	-81.1	0.6	-177.4	-65.3	-171.4	0	0	0	111.9	L1224 H1337	L1224-I1226 PolarHBondContact O-N 3.39Å; I1226-H1337 HydrophobicContact CD1-CB 4.45Å; I1226-H1337 WeakPolarHBondContact CD1-ND1 3.33Å; I1226-H1337 WeakPolarHBondContact CG1-ND1 3.22Å
1227	H	36.6	Very low	46.7	Very low	172 Å²	172	81.3 Å²	81.3	80%	0.796	43%	0.434	S	S	*	.	S	Bend	trans	-119.6	133.7	170.3	-77.3	-96.2	0	0	0	111.3	P1225 T1229	P1225-H1227 PolarHBondContact O-N 2.98Å; H1227-T1229 PolarHBondContact O-N 3.42Å
1228	G	42.5	Very low	47	Very low	92 Å²	92	78.5 Å²	78.5	95%	0.948	43%	0.425	S	S	*	.	S	Bend	trans	84	-22	164.2	0	0	0	0	0	117.8
1229	T	47.6	Very low	47.6	Very low	57 Å²	57	77.7 Å²	77.7	35%	0.35	42%	0.421	S	S	.	.			trans	-81.3	124.3	-177.3	-35.1	0	0	0	0	112.4	H1227 L1234	H1227-T1229 PolarHBondContact O-N 3.42Å; T1229-L1234 HydrophobicContact CG2-CD1 4.1Å; T1229-L1234 HydrophobicContact CG2-CG 4.12Å
1230	D	54	Low	48.4	Very low	77 Å²	77	74.9 Å²	74.9	41%	0.412	41%	0.413	S	S	.	.			trans	-65.5	127.4	175.2	-176.8	-13	0	0	0	110.9	H1232 I1233 L1234	D1230-H1232 PolarHBondContact O-N 2.86Å; D1230-H1232 VanDerWaalsContact O-N 3.16Å; D1230-H1232 WeakPolarHBondContact OD1-CB 3.3Å; D1230-H1232 IonicContact OD1-CD2 3.86Å; D1230-H1232 PolarHBondContact OD1-N 3.22Å; D1230-I1233 HydrophobicContact CB-CD1 4.09Å; D1230-I1233 HydrophobicContact CB-CG1 4.12Å; D1230-I1233 PolarHBondContact O-N 3.02Å; D1230-L1234 PolarHBondContact O-N 3.36Å
1231	P	49.1	Very low	48.6	Very low	59 Å²	59	77 Å²	77	38%	0.383	43%	0.426	S	S	.	.	H	α-helix	trans	-56.4	-24.7	173.5	23.7	-34.9	0	0	0	114.3	L1235	P1231-L1235 WeakPolarHBondContact O-CB 3.12Å; P1231-L1235 PolarHBondContact O-N 3Å
1232	H	47.5	Very low	49	Very low	83 Å²	83	75 Å²	75	38%	0.384	41%	0.411	S	S	.	.	H	α-helix	trans	-66.4	-39	171.9	-85.9	-82.5	0	0	0	112.8	D1230 L1235 I1236 H1378	D1230-H1232 PolarHBondContact O-N 2.86Å; D1230-H1232 VanDerWaalsContact O-N 3.16Å; D1230-H1232 WeakPolarHBondContact OD1-CB 3.3Å; D1230-H1232 IonicContact OD1-CD2 3.86Å; D1230-H1232 PolarHBondContact OD1-N 3.22Å; H1232-L1235 PolarHBondContact O-N 3.02Å; H1232-I1236 VanDerWaalsContact O-CG1 3.27Å; H1232-I1236 WeakPolarHBondContact O-CG1 3.17Å; H1232-I1236 PolarHBondContact O-N 3.42Å; H1232-H1378 AromaticContact CE1-NE2 3.82Å
1233	I	57.3	Low	49.1	Very low	88 Å²	88	77.6 Å²	77.6	45%	0.451	42%	0.42	S	S	.	.	H	α-helix	trans	-66.7	-42.2	178.9	-65.1	175	0	0	0	110.1	D1230 L1235 I1236 Q1237	D1230-I1233 HydrophobicContact CB-CD1 4.09Å; D1230-I1233 HydrophobicContact CB-CG1 4.12Å; D1230-I1233 PolarHBondContact O-N 3.02Å; I1233-L1235 VanDerWaalsContact C-N 3.34Å; I1233-L1235 PolarHBondContact O-N 3.07Å; I1233-I1236 PolarHBondContact O-N 3.06Å; I1233-Q1237 WeakPolarHBondContact O-CG 3.42Å; I1233-Q1237 PolarHBondContact O-N 3.13Å
1234	L	53.2	Low	49.4	Very low	35 Å²	35	77.6 Å²	77.6	18%	0.183	42%	0.416	C	S	.	.	H	α-helix	trans	-63	-39.2	173.6	-77.3	161.1	0	0	0	112.3	L1224 T1229 D1230 Q1237 M1238	L1224-L1234 HydrophobicContact CD2-CD1 3.54Å; L1224-L1234 HydrophobicContact CD2-CD2 3.61Å; L1224-L1234 HydrophobicContact CD2-CG 4.21Å; T1229-L1234 HydrophobicContact CG2-CD1 4.1Å; T1229-L1234 HydrophobicContact CG2-CG 4.12Å; D1230-L1234 PolarHBondContact O-N 3.36Å; L1234-Q1237 PolarHBondContact O-N 2.85Å; L1234-M1238 WeakPolarHBondContact O-CG 3.23Å; L1234-M1238 PolarHBondContact O-N 3.39Å
1235	L	49.5	Very low	49.3	Very low	20 Å²	20	82.8 Å²	82.8	11%	0.105	44%	0.435	C	S	.	.	H	α-helix	trans	-66.5	-40.8	175.3	-176.9	60.9	0	0	0	111.8	P1231 H1232 I1233 M1238 I1239 H1378	P1231-L1235 WeakPolarHBondContact O-CB 3.12Å; P1231-L1235 PolarHBondContact O-N 3Å; H1232-L1235 PolarHBondContact O-N 3.02Å; I1233-L1235 VanDerWaalsContact C-N 3.34Å; I1233-L1235 PolarHBondContact O-N 3.07Å; L1235-M1238 PolarHBondContact O-N 2.97Å; L1235-I1239 HydrophobicContact CD1-CD1 4.07Å; L1235-I1239 HydrophobicContact CD1-CG1 4.35Å; L1235-I1239 HydrophobicContact CG-CD1 3.86Å; L1235-I1239 WeakPolarHBondContact O-CB 3.4Å; L1235-I1239 VanDerWaalsContact O-CG1 3.26Å; L1235-I1239 WeakPolarHBondContact O-CG1 3.42Å; L1235-I1239 PolarHBondContact O-N 2.65Å; L1235-H1378 HydrophobicContact CD2-CB 4.45Å
1236	I	58.3	Low	49.7	Very low	96 Å²	96	84.7 Å²	84.7	49%	0.492	44%	0.438	S	S	.	.	H	α-helix	trans	-62.4	-47.4	174.7	-70.1	162.4	0	0	0	110.4	H1232 I1233 M1238 I1239 E1240	H1232-I1236 VanDerWaalsContact O-CG1 3.27Å; H1232-I1236 WeakPolarHBondContact O-CG1 3.17Å; H1232-I1236 PolarHBondContact O-N 3.42Å; I1233-I1236 PolarHBondContact O-N 3.06Å; I1236-M1238 VanDerWaalsContact C-N 3.32Å; I1236-M1238 PolarHBondContact O-N 3.35Å; I1236-I1239 PolarHBondContact O-N 2.87Å; I1236-I1239 VanDerWaalsContact O-N 3.13Å; I1236-E1240 HydrophobicContact CG2-CG 4.47Å; I1236-E1240 PolarHBondContact O-N 3.15Å
1237	Q	55.1	Low	49.3	Very low	121 Å²	121	84.6 Å²	84.6	57%	0.565	44%	0.443	S	S	*	.	H	α-helix	trans	-59.3	-41.8	176	-73.6	178.6	-11.3	0	0	112.1	I1233 L1234 L1241	I1233-Q1237 WeakPolarHBondContact O-CG 3.42Å; I1233-Q1237 PolarHBondContact O-N 3.13Å; L1234-Q1237 PolarHBondContact O-N 2.85Å; Q1237-L1241 WeakPolarHBondContact O-CB 3.29Å; Q1237-L1241 PolarHBondContact O-N 2.9Å
1238	M	50.7	Low	49.4	Very low	36 Å²	36	78.5 Å²	78.5	18%	0.177	42%	0.42	C	S	.	.	H	α-helix	trans	-64.4	-41.1	173.5	-76.7	-175.8	60	0	0	112.7	L1222 L1234 L1235 I1236 L1241 I1242 W1341	L1222-M1238 HydrophobicContact CD1-CG 4.46Å; L1222-M1238 HydrophobicContact CD1-SD 4.06Å; L1234-M1238 WeakPolarHBondContact O-CG 3.23Å; L1234-M1238 PolarHBondContact O-N 3.39Å; L1235-M1238 PolarHBondContact O-N 2.97Å; I1236-M1238 VanDerWaalsContact C-N 3.32Å; I1236-M1238 PolarHBondContact O-N 3.35Å; M1238-L1241 PolarHBondContact O-N 3.31Å; M1238-I1242 WeakPolarHBondContact O-CB 3.36Å; M1238-I1242 WeakPolarHBondContact O-CD1 3.41Å; M1238-I1242 WeakPolarHBondContact O-CG1 3.44Å; M1238-I1242 PolarHBondContact O-N 3.17Å; M1238-W1341 HydrophobicContact CE-CH2 3.83Å; M1238-W1341 HydrophobicContact CE-CZ2 3.46Å; M1238-W1341 VanDerWaalsContact CE-CZ2 3.46Å; M1238-W1341 HydrophobicContact SD-CH2 3.86Å; M1238-W1341 HydrophobicContact SD-CZ2 3.79Å
1239	I	54.5	Low	48.9	Very low	46 Å²	46	80.3 Å²	80.3	24%	0.236	40%	0.399	C	S	.	.	H	α-helix	trans	-66.5	-44.4	179.4	-75.1	169.1	0	0	0	111.2	L1235 I1236 L1241 I1242 K1243	L1235-I1239 HydrophobicContact CD1-CD1 4.07Å; L1235-I1239 HydrophobicContact CD1-CG1 4.35Å; L1235-I1239 HydrophobicContact CG-CD1 3.86Å; L1235-I1239 WeakPolarHBondContact O-CB 3.4Å; L1235-I1239 VanDerWaalsContact O-CG1 3.26Å; L1235-I1239 WeakPolarHBondContact O-CG1 3.42Å; L1235-I1239 PolarHBondContact O-N 2.65Å; I1236-I1239 PolarHBondContact O-N 2.87Å; I1236-I1239 VanDerWaalsContact O-N 3.13Å; I1239-L1241 VanDerWaalsContact C-N 3.35Å; I1239-I1242 PolarHBondContact O-N 2.97Å; I1239-K1243 HydrophobicContact CG2-CD 4.1Å; I1239-K1243 HydrophobicContact CG2-CG 4.43Å; I1239-K1243 WeakPolarHBondContact O-CB 3.41Å; I1239-K1243 WeakPolarHBondContact O-CG 3.37Å; I1239-K1243 PolarHBondContact O-N 2.86Å
1240	E	56.6	Low	48.3	Very low	94 Å²	94	83.9 Å²	83.9	44%	0.439	41%	0.412	S	S	.	.	H	α-helix	trans	-65.3	-37.8	175.7	-65.2	-45.7	130	0	0	111.9	I1236 K1243 H1244	I1236-E1240 HydrophobicContact CG2-CG 4.47Å; I1236-E1240 PolarHBondContact O-N 3.15Å; E1240-K1243 PolarHBondContact O-N 2.94Å; E1240-K1243 IonicContact OE1-NZ 2.65Å; E1240-K1243 PolarHBondContact OE1-NZ 3.22Å; E1240-K1243 VanDerWaalsContact OE2-CD 3.26Å; E1240-K1243 WeakPolarHBondContact OE2-CD 3.34Å; E1240-K1243 IonicContact OE2-NZ 3.51Å; E1240-H1244 WeakPolarHBondContact O-CB 3.5Å; E1240-H1244 PolarHBondContact O-N 3.27Å
1241	L	51.6	Low	47.2	Very low	88 Å²	88	86.8 Å²	86.8	46%	0.461	42%	0.421	S	S	.	.	H	α-helix	trans	-62.9	-44.1	173.5	-152.7	82	0	0	0	111.5	F1220 Q1237 M1238 I1239 H1244 Y1245	F1220-L1241 HydrophobicContact CD1-CD2 4.21Å; F1220-L1241 HydrophobicContact CE1-CD2 4.02Å; Q1237-L1241 WeakPolarHBondContact O-CB 3.29Å; Q1237-L1241 PolarHBondContact O-N 2.9Å; M1238-L1241 PolarHBondContact O-N 3.31Å; I1239-L1241 VanDerWaalsContact C-N 3.35Å; L1241-H1244 PolarHBondContact O-N 2.66Å; L1241-Y1245 HydrophobicContact CG-CD2 4.38Å; L1241-Y1245 HydrophobicContact CG-CE2 4.27Å; L1241-Y1245 VanDerWaalsContact O-CD2 3.32Å; L1241-Y1245 WeakPolarHBondContact O-CD2 3.4Å; L1241-Y1245 PolarHBondContact O-N 3.08Å; L1241-Y1245 VanDerWaalsContact O-N 3.13Å
1242	I	50.3	Low	46.4	Very low	56 Å²	56	89.5 Å²	89.5	29%	0.287	43%	0.432	S	S	.	.	H	α-helix	trans	-62.8	-48.2	176.8	-71.5	164	0	0	0	110.5	M1238 I1239 H1244 Y1245 Q1246	M1238-I1242 WeakPolarHBondContact O-CB 3.36Å; M1238-I1242 WeakPolarHBondContact O-CD1 3.41Å; M1238-I1242 WeakPolarHBondContact O-CG1 3.44Å; M1238-I1242 PolarHBondContact O-N 3.17Å; I1239-I1242 PolarHBondContact O-N 2.97Å; I1242-H1244 VanDerWaalsContact C-N 3.33Å; I1242-H1244 PolarHBondContact O-N 2.82Å; I1242-Y1245 PolarHBondContact O-N 2.9Å; I1242-Q1246 VanDerWaalsContact O-CB 3.29Å; I1242-Q1246 WeakPolarHBondContact O-CB 3.26Å; I1242-Q1246 PolarHBondContact O-N 2.88Å
1243	K	49.1	Very low	45.7	Very low	97 Å²	97	88.5 Å²	88.5	42%	0.422	43%	0.434	S	S	.	.	H	α-helix	trans	-54.9	-46.6	174.2	-76	168.8	173.1	-179.9	0	111.7	I1239 E1240 Y1245 Q1246 C1247	I1239-K1243 HydrophobicContact CG2-CD 4.1Å; I1239-K1243 HydrophobicContact CG2-CG 4.43Å; I1239-K1243 WeakPolarHBondContact O-CB 3.41Å; I1239-K1243 WeakPolarHBondContact O-CG 3.37Å; I1239-K1243 PolarHBondContact O-N 2.86Å; E1240-K1243 PolarHBondContact O-N 2.94Å; E1240-K1243 IonicContact OE1-NZ 2.65Å; E1240-K1243 PolarHBondContact OE1-NZ 3.22Å; E1240-K1243 VanDerWaalsContact OE2-CD 3.26Å; E1240-K1243 WeakPolarHBondContact OE2-CD 3.34Å; E1240-K1243 IonicContact OE2-NZ 3.51Å; K1243-Y1245 PolarHBondContact O-N 2.82Å; K1243-Q1246 PolarHBondContact O-N 3.2Å; K1243-Q1246 VanDerWaalsContact O-N 3.08Å; K1243-C1247 WeakPolarHBondContact O-CB 3.4Å; K1243-C1247 PolarHBondContact O-N 3.44Å; K1243-C1247 PolarHBondContact O-SG 3.41Å
1244	H	48.8	Very low	44.6	Very low	130 Å²	130	87.7 Å²	87.7	60%	0.602	44%	0.436	S	S	*	.	H	α-helix	trans	-59.9	-44	-179.6	-169.2	-73.9	0	0	0	111.8	E1240 L1241 I1242 S1248	E1240-H1244 WeakPolarHBondContact O-CB 3.5Å; E1240-H1244 PolarHBondContact O-N 3.27Å; L1241-H1244 PolarHBondContact O-N 2.66Å; I1242-H1244 VanDerWaalsContact C-N 3.33Å; I1242-H1244 PolarHBondContact O-N 2.82Å; H1244-S1248 WeakPolarHBondContact O-CB 3.5Å; H1244-S1248 PolarHBondContact O-N 3.31Å; H1244-S1248 PolarHBondContact O-OG 2.73Å
1245	Y	45.4	Very low	43.3	Very low	128 Å²	128	92.9 Å²	92.9	50%	0.502	45%	0.454	S	S	.	.	H	α-helix	trans	-71	-28.9	173.9	-81.1	-73.4	0	0	0	113.5	L1241 I1242 K1243 S1248 Y1249	L1241-Y1245 HydrophobicContact CG-CD2 4.38Å; L1241-Y1245 HydrophobicContact CG-CE2 4.27Å; L1241-Y1245 VanDerWaalsContact O-CD2 3.32Å; L1241-Y1245 WeakPolarHBondContact O-CD2 3.4Å; L1241-Y1245 PolarHBondContact O-N 3.08Å; L1241-Y1245 VanDerWaalsContact O-N 3.13Å; I1242-Y1245 PolarHBondContact O-N 2.9Å; K1243-Y1245 PolarHBondContact O-N 2.82Å; Y1245-S1248 WeakPolarHBondContact O-CB 3.48Å; Y1245-S1248 PolarHBondContact O-N 3.31Å; Y1245-Y1249 PolarHBondContact O-N 3.11Å
1246	Q	45.7	Very low	42.5	Very low	119 Å²	119	102.3 Å²	102.3	56%	0.556	49%	0.489	S	S	*	.	H	α-helix	trans	-73.5	-44.8	177.6	-165.4	164.9	-7.7	0	0	111.6	I1242 K1243 S1248 Y1249 E1250	I1242-Q1246 VanDerWaalsContact O-CB 3.29Å; I1242-Q1246 WeakPolarHBondContact O-CB 3.26Å; I1242-Q1246 PolarHBondContact O-N 2.88Å; K1243-Q1246 PolarHBondContact O-N 3.2Å; K1243-Q1246 VanDerWaalsContact O-N 3.08Å; Q1246-S1248 VanDerWaalsContact C-N 3.31Å; Q1246-S1248 PolarHBondContact O-N 2.84Å; Q1246-Y1249 WeakPolarHBondContact O-CA 3.4Å; Q1246-Y1249 VanDerWaalsContact O-CB 3.27Å; Q1246-Y1249 WeakPolarHBondContact O-CB 3.48Å; Q1246-Y1249 PolarHBondContact O-N 2.78Å; Q1246-E1250 PolarHBondContact O-N 3.19Å
1247	C	32.1	Very low	41.3	Very low	83 Å²	83	104.5 Å²	104.5	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-60.3	-39.2	168.3	-68	0	0	0	0	111.8	K1243 Y1249 E1250 F1251	K1243-C1247 WeakPolarHBondContact O-CB 3.4Å; K1243-C1247 PolarHBondContact O-N 3.44Å; K1243-C1247 PolarHBondContact O-SG 3.41Å; C1247-Y1249 PolarHBondContact O-N 3.3Å; C1247-E1250 PolarHBondContact O-N 3.04Å; C1247-F1251 VanDerWaalsContact O-CB 3.27Å; C1247-F1251 WeakPolarHBondContact O-CB 3.49Å; C1247-F1251 PolarHBondContact O-N 3.14Å
1248	S	38.6	Very low	40.1	Very low	44 Å²	44	108.6 Å²	108.6	31%	0.308	51%	0.511	S	S	.	.	H	α-helix	trans	-60.3	-34.6	173	-59	0	0	0	0	112	H1244 Y1245 Q1246 L1252	H1244-S1248 WeakPolarHBondContact O-CB 3.5Å; H1244-S1248 PolarHBondContact O-N 3.31Å; H1244-S1248 PolarHBondContact O-OG 2.73Å; Y1245-S1248 WeakPolarHBondContact O-CB 3.48Å; Y1245-S1248 PolarHBondContact O-N 3.31Å; Q1246-S1248 VanDerWaalsContact C-N 3.31Å; Q1246-S1248 PolarHBondContact O-N 2.84Å; S1248-L1252 WeakPolarHBondContact O-CB 3.2Å; S1248-L1252 WeakPolarHBondContact O-CD1 3.41Å; S1248-L1252 VanDerWaalsContact O-CG 3.22Å; S1248-L1252 WeakPolarHBondContact O-CG 3.5Å; S1248-L1252 PolarHBondContact O-N 3.37Å
1249	Y	33	Very low	39	Very low	129 Å²	129	111.2 Å²	111.2	51%	0.506	53%	0.532	S	S	.	.	H	α-helix	trans	-69.7	-46.5	176.7	-142.3	-90.4	0	0	0	111.7	Y1245 Q1246 C1247 L1252 S1253	Y1245-Y1249 PolarHBondContact O-N 3.11Å; Q1246-Y1249 WeakPolarHBondContact O-CA 3.4Å; Q1246-Y1249 VanDerWaalsContact O-CB 3.27Å; Q1246-Y1249 WeakPolarHBondContact O-CB 3.48Å; Q1246-Y1249 PolarHBondContact O-N 2.78Å; C1247-Y1249 PolarHBondContact O-N 3.3Å; Y1249-L1252 PolarHBondContact O-N 2.9Å; Y1249-S1253 PolarHBondContact O-N 3.04Å; Y1249-S1253 PolarHBondContact O-OG 3.09Å
1250	E	34.9	Very low	37.8	Very low	132 Å²	132	114 Å²	114	62%	0.617	55%	0.551	S	S	*	*	H	α-helix	trans	-66.5	-37.7	177.7	-68.1	-160.4	166.6	0	0	112.7	Q1246 C1247 S1253 S1254	Q1246-E1250 PolarHBondContact O-N 3.19Å; C1247-E1250 PolarHBondContact O-N 3.04Å; E1250-S1253 VanDerWaalsContact CA-OG 3.31Å; E1250-S1253 WeakPolarHBondContact CA-OG 3.32Å; E1250-S1253 PolarHBondContact O-N 3.33Å; E1250-S1253 PolarHBondContact O-OG 2.99Å; E1250-S1254 WeakPolarHBondContact O-CB 3.4Å; E1250-S1254 PolarHBondContact O-N 3.4Å; E1250-S1254 PolarHBondContact O-OG 3.47Å
1251	F	30.3	Very low	36.4	Very low	139 Å²	139	118 Å²	118	61%	0.61	57%	0.567	S	S	*	*	H	α-helix	trans	-63.1	-44.9	173.8	-167	-91.8	0	0	0	111.2	C1247 S1254 Y1255	C1247-F1251 VanDerWaalsContact O-CB 3.27Å; C1247-F1251 WeakPolarHBondContact O-CB 3.49Å; C1247-F1251 PolarHBondContact O-N 3.14Å; F1251-S1254 PolarHBondContact O-N 3.19Å; F1251-Y1255 HydrophobicContact CD1-CD2 4.36Å; F1251-Y1255 AromaticContact CE1-CD2 3.79Å; F1251-Y1255 HydrophobicContact CE1-CD2 3.79Å; F1251-Y1255 HydrophobicContact CE1-CE2 4.06Å; F1251-Y1255 HydrophobicContact CZ-CD2 4.22Å; F1251-Y1255 HydrophobicContact CZ-CE2 4.22Å; F1251-Y1255 PolarHBondContact O-N 3.22Å
1252	L	32.5	Very low	35.3	Very low	116 Å²	116	120.8 Å²	120.8	61%	0.607	58%	0.581	S	S	*	*	H	α-helix	trans	-66.9	-36.7	176.2	-75.6	169.7	0	0	0	113	S1248 Y1249 R1256	S1248-L1252 WeakPolarHBondContact O-CB 3.2Å; S1248-L1252 WeakPolarHBondContact O-CD1 3.41Å; S1248-L1252 VanDerWaalsContact O-CG 3.22Å; S1248-L1252 WeakPolarHBondContact O-CG 3.5Å; S1248-L1252 PolarHBondContact O-N 3.37Å; Y1249-L1252 PolarHBondContact O-N 2.9Å; L1252-R1256 WeakPolarHBondContact O-CB 3.29Å; L1252-R1256 PolarHBondContact O-N 2.88Å
1253	S	33.2	Very low	34.2	Very low	61 Å²	61	125.3 Å²	125.3	43%	0.427	61%	0.605	S	S	.	*	H	α-helix	trans	-68.9	-35.2	172	50.8	0	0	0	0	112.6	Y1249 E1250 R1256 L1257	Y1249-S1253 PolarHBondContact O-N 3.04Å; Y1249-S1253 PolarHBondContact O-OG 3.09Å; E1250-S1253 VanDerWaalsContact CA-OG 3.31Å; E1250-S1253 WeakPolarHBondContact CA-OG 3.32Å; E1250-S1253 PolarHBondContact O-N 3.33Å; E1250-S1253 PolarHBondContact O-OG 2.99Å; S1253-R1256 PolarHBondContact O-N 3.49Å; S1253-L1257 PolarHBondContact O-N 3.32Å
1254	S	33.1	Very low	33.2	Very low	71 Å²	71	129.5 Å²	129.5	50%	0.497	63%	0.625	S	S	.	*	H	α-helix	trans	-66.9	-42.4	175	-60.7	0	0	0	0	111.4	E1250 F1251 R1256 L1257 R1258	E1250-S1254 WeakPolarHBondContact O-CB 3.4Å; E1250-S1254 PolarHBondContact O-N 3.4Å; E1250-S1254 PolarHBondContact O-OG 3.47Å; F1251-S1254 PolarHBondContact O-N 3.19Å; S1254-R1256 PolarHBondContact O-N 2.94Å; S1254-L1257 PolarHBondContact O-N 2.86Å; S1254-R1258 WeakPolarHBondContact O-CB 3.45Å; S1254-R1258 PolarHBondContact O-N 2.97Å
1255	Y	27.1	Very low	32.1	Very low	145 Å²	145	128.7 Å²	128.7	57%	0.569	64%	0.635	S	S	*	*	H	α-helix	trans	-62.1	-42.9	174.9	-126.6	-88.6	0	0	0	111.5	F1251 L1257 R1258 C1259	F1251-Y1255 HydrophobicContact CD1-CD2 4.36Å; F1251-Y1255 AromaticContact CE1-CD2 3.79Å; F1251-Y1255 HydrophobicContact CE1-CD2 3.79Å; F1251-Y1255 HydrophobicContact CE1-CE2 4.06Å; F1251-Y1255 HydrophobicContact CZ-CD2 4.22Å; F1251-Y1255 HydrophobicContact CZ-CE2 4.22Å; F1251-Y1255 PolarHBondContact O-N 3.22Å; Y1255-L1257 PolarHBondContact O-N 3.49Å; Y1255-R1258 PolarHBondContact O-N 3.27Å; Y1255-R1258 VanDerWaalsContact O-N 3.15Å; Y1255-C1259 PolarHBondContact O-N 3.37Å
1256	R	32.5	Very low	31.4	Very low	218 Å²	218	128.2 Å²	128.2	82%	0.823	65%	0.65	S	S	*	*	H	α-helix	trans	-64.2	-16.8	175.8	-105.8	-176.3	171.4	-171.2	-4.6	115	L1252 S1253 S1254	L1252-R1256 WeakPolarHBondContact O-CB 3.29Å; L1252-R1256 PolarHBondContact O-N 2.88Å; S1253-R1256 PolarHBondContact O-N 3.49Å; S1254-R1256 PolarHBondContact O-N 2.94Å
1257	L	32.5	Very low	30.6	Very low	142 Å²	142	128.9 Å²	128.9	74%	0.743	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-3.3	175.9	-115.3	69.7	0	0	0	114	S1253 S1254 Y1255	S1253-L1257 PolarHBondContact O-N 3.32Å; S1254-L1257 PolarHBondContact O-N 2.86Å; Y1255-L1257 PolarHBondContact O-N 3.49Å
1258	R	28.9	Very low	30.5	Very low	206 Å²	206	131.1 Å²	131.1	78%	0.777	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	-9.8	-175.3	-135.5	169.9	-169.3	165.4	3.1	114.6	S1254 Y1255	S1254-R1258 WeakPolarHBondContact O-CB 3.45Å; S1254-R1258 PolarHBondContact O-N 2.97Å; Y1255-R1258 PolarHBondContact O-N 3.27Å; Y1255-R1258 VanDerWaalsContact O-N 3.15Å
1259	C	28.3	Very low	30.1	Very low	91 Å²	91	133.8 Å²	133.8	62%	0.615	69%	0.692	S	S	*	*	S	Bend	trans	-92.2	4.7	176.5	-62.4	0	0	0	0	114.5	Y1255	Y1255-C1259 PolarHBondContact O-N 3.37Å
1260	T	29.9	Very low	29.9	Very low	105 Å²	105	133.7 Å²	133.7	64%	0.644	71%	0.705	S	S	*	*	S	Bend	trans	-126.1	20	178.9	48.4	0	0	0	0	113.2
1261	K	27.8	Very low	29.8	Very low	179 Å²	179	132.1 Å²	132.1	78%	0.778	71%	0.709	S	S	*	*	S	Bend	trans	-133.7	31.1	173.8	-80.1	-159.9	169.9	-167.1	0	113.6
1262	L	26.9	Very low	29.9	Very low	145 Å²	145	131 Å²	131	76%	0.759	72%	0.718	S	S	*	*	S	Bend	trans	-131	145.5	161.3	-70.8	171.5	0	0	0	106.4
1263	I	27.9	Very low	30.1	Very low	151 Å²	151	131.2 Å²	131.2	77%	0.774	73%	0.727	S	S	*	*	S	Bend	trans	72.2	127.1	-158.8	-41	167.2	0	0	0	111
1264	H	27.1	Very low	30.3	Very low	185 Å²	185	134.1 Å²	134.1	86%	0.856	74%	0.744	S	S	*	*	S	Bend	trans	77.5	47.1	-177.8	-51.6	109.9	0	0	0	119.1
1265	S	27.1	Very low	30.2	Very low	114 Å²	114	136.7 Å²	136.7	80%	0.797	76%	0.76	S	S	*	*			trans	-164.8	132.2	147.1	56.9	0	0	0	0	108.4
1266	S	30.7	Very low	30.3	Very low	117 Å²	117	133.9 Å²	133.9	82%	0.818	76%	0.762	S	S	*	*			cis	-147.5	147.4	5.3	48.1	0	0	0	0	111
1267	T	27.7	Very low	30.2	Very low	134 Å²	134	129.8 Å²	129.8	82%	0.822	76%	0.762	S	S	*	*			trans	-86	127.4	173.3	45.1	0	0	0	0	112.2
1268	T	30.6	Very low	30.2	Very low	130 Å²	130	127.4 Å²	127.4	80%	0.798	76%	0.756	S	S	*	*			trans	-179.4	137.3	147.4	24.2	0	0	0	0	112
1269	S	29.2	Very low	30.4	Very low	100 Å²	100	124.1 Å²	124.1	70%	0.699	75%	0.754	S	S	*	*			trans	40.4	140.6	144.1	62.7	0	0	0	0	122.1
1270	T	30.3	Very low	30.8	Very low	126 Å²	126	125.9 Å²	125.9	77%	0.773	76%	0.758	S	S	*	*			cis	-167.9	155.9	4.2	11	0	0	0	0	111.8
1271	S	31.5	Very low	31	Very low	99 Å²	99	126.9 Å²	126.9	69%	0.692	76%	0.764	S	S	*	*			trans	43.1	115.6	150.6	62.7	0	0	0	0	122.7
1272	S	33.9	Very low	31.2	Very low	115 Å²	115	122.1 Å²	122.1	80%	0.804	77%	0.766	S	S	*	*				28.3	157.1	104.4	-44.1	0	0	0	0	120.8
1273	P	35.4	Very low	31.5	Very low	122 Å²	122	122 Å²	122	79%	0.792	77%	0.766	S	S	*	*			cis	-136	-177	19.2	38.2	-17	0	0	0	116.6
1274	P	38.3	Very low	31.8	Very low	121 Å²	121	121 Å²	121	79%	0.786	76%	0.762	S	S	*	*			trans	-118.4	173.8	-170.6	42.9	-32.9	0	0	0	116.1
1275	C	29.9	Very low	32.2	Very low	125 Å²	125	119.9 Å²	119.9	85%	0.845	76%	0.762	S	S	*	*			trans	174.2	163.8	150	-98.9	0	0	0	0	109.3
1276	S	30.2	Very low	32.9	Very low	87 Å²	87	119.5 Å²	119.5	61%	0.608	76%	0.757	S	S	*	*			cis	-175.7	153.8	-31.2	54.4	0	0	0	0	108.8
1277	T	30.9	Very low	32.9	Very low	132 Å²	132	121 Å²	121	81%	0.81	76%	0.755	S	S	*	*			trans	60.3	156.9	160.2	44.7	0	0	0	0	118.4
1278	S	32.5	Very low	33.1	Very low	91 Å²	91	122 Å²	122	64%	0.636	75%	0.75	S	S	*	*			cis	-170.8	146.9	-14.7	46	0	0	0	0	110.3
1279	N	33.2	Very low	33.3	Very low	137 Å²	137	121.6 Å²	121.6	73%	0.733	74%	0.743	S	S	*	*			trans	63.6	166.9	149.8	-68.5	30.4	0	0	0	118.7
1280	D	35.3	Very low	33.5	Very low	129 Å²	129	122 Å²	122	69%	0.69	74%	0.741	S	S	*	*			cis	-149.6	173.8	8.5	-130.8	-33.9	0	0	0	116.2
1281	T	33.8	Very low	33.8	Very low	126 Å²	126	122.1 Å²	122.1	77%	0.773	74%	0.737	S	S	*	*			trans	-11.5	141.6	173.3	55.2	0	0	0	0	125.5
1282	G	32.9	Very low	33.9	Very low	79 Å²	79	122.4 Å²	122.4	81%	0.814	73%	0.734	S	S	*	*				95.3	161.3	121.4	0	0	0	0	0	120.2
1283	N	32.6	Very low	34	Very low	141 Å²	141	123.4 Å²	123.4	75%	0.754	73%	0.726	S	S	*	*			cis	-168.8	174.9	-21.6	-164.2	8.8	0	0	0	109.8
1284	N	35.5	Very low	33.9	Very low	131 Å²	131	123.5 Å²	123.5	70%	0.701	72%	0.716	S	S	*	*			trans	73	119.2	167.7	-47	-37.1	0	0	0	116.8
1285	N	34.4	Very low	33.7	Very low	161 Å²	161	126 Å²	126	86%	0.861	71%	0.71	S	S	*	*			cis	103.4	151.5	44.9	-93.2	-1.4	0	0	0	114.5
1286	P	41.5	Very low	33.9	Very low	107 Å²	107	126.3 Å²	126.3	70%	0.695	70%	0.699	S	S	*	*			trans	-111	-172.6	-157.3	43.7	-36.6	0	0	0	114.2
1287	I	30.8	Very low	34	Very low	149 Å²	149	128.1 Å²	128.1	76%	0.764	70%	0.698	S	S	*	*			trans	176	135.3	143.8	-97.4	156.5	0	0	0	113.7
1288	H	33.4	Very low	34	Very low	154 Å²	154	128.6 Å²	128.6	71%	0.713	69%	0.691	S	S	*	*			trans	54	165	150.7	-75.5	-119.2	0	0	0	121.5
1289	D	33.4	Very low	34	Very low	122 Å²	122	131.3 Å²	131.3	65%	0.652	69%	0.693	S	S	*	*			cis	-148.7	-172.5	0.7	-132.5	-28.6	0	0	0	115.8
1290	T	34.1	Very low	33.7	Very low	108 Å²	108	131.6 Å²	131.6	66%	0.663	69%	0.694	S	S	*	*			trans	-44.8	178.1	171.8	50.7	0	0	0	0	119
1291	D	36.4	Very low	33.3	Very low	128 Å²	128	133.1 Å²	133.1	68%	0.684	70%	0.697	S	S	*	*			cis	-160.8	147.4	31.9	-127.7	-1.2	0	0	0	111.5
1292	V	33.2	Very low	33.1	Very low	106 Å²	106	135.3 Å²	135.3	64%	0.642	70%	0.698	S	S	*	*				69.3	137	94.6	154.2	0	0	0	0	115.2
1293	H	36.1	Very low	32.6	Very low	136 Å²	136	136 Å²	136	63%	0.63	69%	0.689	S	S	*	*			cis	-163.1	156.2	10	-129.1	17.4	0	0	0	114.2
1294	Q	33.9	Very low	32.2	Very low	124 Å²	124	135 Å²	135	58%	0.579	69%	0.688	S	S	*	*			trans	59.4	162.2	138.6	-69.5	-175.8	10.7	0	0	121.7
1295	R	34.9	Very low	31.7	Very low	173 Å²	173	135.5 Å²	135.5	65%	0.653	69%	0.69	S	S	*	*			cis	-161.2	145.3	-7.2	-117.9	170.5	-164.5	-110.2	8.1	111.7
1296	Q	33.2	Very low	31.3	Very low	132 Å²	132	133.6 Å²	133.6	62%	0.617	69%	0.685	S	S	*	*			trans	57	162.4	138.6	-69.6	179.8	-76.7	0	0	122.9
1297	Q	32.1	Very low	30.6	Very low	125 Å²	125	133.2 Å²	133.2	58%	0.584	69%	0.685	S	S	*	*			cis	-176.8	145	-29.8	174.5	163.8	-6.8	0	0	111.4
1298	Q	31	Very low	30.6	Very low	142 Å²	142	134.3 Å²	134.3	66%	0.664	69%	0.686	S	S	*	*			trans	64.3	168.5	164.4	-81.3	164.7	11.3	0	0	116.7
1299	Q	32.7	Very low	30.4	Very low	148 Å²	148	135.4 Å²	135.4	69%	0.692	69%	0.692	S	S	*	*			cis	-141.8	132.7	2	-123.4	151	63.2	0	0	107.2
1300	L	27.2	Very low	30.1	Very low	143 Å²	143	137.5 Å²	137.5	75%	0.749	70%	0.697	S	S	*	*				66.8	136.4	105.1	-85.6	152.3	0	0	0	118.9
1301	E	27.1	Very low	29.8	Very low	160 Å²	160	139 Å²	139	75%	0.748	70%	0.697	S	S	*	*			trans	76.8	105.1	149.2	-81.1	168.1	-146.9	0	0	124.8
1302	H	28.9	Very low	29.4	Very low	172 Å²	172	139.5 Å²	139.5	80%	0.796	70%	0.695	S	S	*	*				82.5	149.4	118.6	-107.8	-100.1	0	0	0	124.6
1303	C	23.4	Very low	29.2	Very low	94 Å²	94	141.7 Å²	141.7	64%	0.635	70%	0.699	S	S	*	*			trans	71.2	98.1	149.2	-84.8	0	0	0	0	123.5
1304	T	24.4	Very low	28.8	Very low	120 Å²	120	142.6 Å²	142.6	74%	0.736	70%	0.703	S	S	*	*				67.7	140.2	119.1	47.4	0	0	0	0	124.5
1305	L	25	Very low	28.5	Very low	142 Å²	142	142.4 Å²	142.4	74%	0.743	71%	0.706	S	S	*	*			trans	81.3	104.9	137.5	-77	168	0	0	0	122.1
1306	T	25.8	Very low	28	Very low	120 Å²	120	142.1 Å²	142.1	74%	0.736	71%	0.712	S	S	*	*				77.8	152.5	128.5	43.1	0	0	0	0	124.7
1307	S	26.1	Very low	27.7	Very low	100 Å²	100	143.5 Å²	143.5	70%	0.699	72%	0.718	S	S	*	*			trans	81.2	114.5	148.7	38.1	0	0	0	0	121.9
1308	H	30.3	Very low	27.3	Very low	172 Å²	172	145.4 Å²	145.4	80%	0.796	73%	0.727	S	S	*	*			trans	31.3	125.4	136.2	-58.7	-46.2	0	0	0	121.7
1309	Q	29.7	Very low	27.1	Very low	176 Å²	176	146.9 Å²	146.9	82%	0.822	73%	0.734	S	S	*	*				-149.4	154.8	90.5	-89	151	13.8	0	0	106.8
1310	Q	27.4	Very low	26.7	Very low	166 Å²	166	145.6 Å²	145.6	78%	0.776	74%	0.741	S	S	*	*				56.1	135.1	59.4	-78.8	174	-38	0	0	111.7
1311	E	26.6	Very low	26.5	Very low	141 Å²	141	147.1 Å²	147.1	66%	0.659	75%	0.745	S	S	*	*			cis	-159.8	168.6	19.4	-137.8	-170.1	123.4	0	0	111.8
1312	Q	29.1	Very low	26.5	Very low	138 Å²	138	145.9 Å²	145.9	65%	0.645	74%	0.743	S	S	*	*			trans	64.2	152.9	155.7	-63	177.6	27.4	0	0	118.9
1313	Q	29.1	Very low	26.3	Very low	152 Å²	152	143.8 Å²	143.8	71%	0.71	74%	0.742	S	S	*	*			cis	-152.4	-170.5	-19.4	-122	173.3	38.6	0	0	110.9
1314	Q	27.2	Very low	26.5	Very low	155 Å²	155	144 Å²	144	72%	0.724	74%	0.742	S	S	*	*			trans	-59.4	169.6	177.4	-63.5	147.4	-102.9	0	0	113.3
1315	D	27.2	Very low	26.5	Very low	120 Å²	120	143.5 Å²	143.5	64%	0.642	73%	0.732	S	S	*	*			cis	-159.8	-169.7	23.7	-144.4	-43.7	0	0	0	112.9
1316	Q	25.8	Very low	26.6	Very low	167 Å²	167	143.7 Å²	143.7	78%	0.78	73%	0.733	S	S	*	*			trans	76.7	81.8	162.6	-69.5	178.8	59.8	0	0	118.9
1317	Q	25.9	Very low	26.6	Very low	160 Å²	160	140.3 Å²	140.3	75%	0.748	71%	0.713	S	S	*	*				25.7	111.1	114.1	-49.2	177.9	22.5	0	0	118
1318	Q	24.5	Very low	26.5	Very low	165 Å²	165	141.7 Å²	141.7	77%	0.771	71%	0.711	S	S	*	*				172.7	151.2	102.7	-91.4	173.5	41.8	0	0	113
1319	H	26.3	Very low	26.3	Very low	174 Å²	174	142.4 Å²	142.4	81%	0.806	72%	0.72	S	S	*	*	S	Bend	trans	68.9	148.8	166	-93.7	45.9	0	0	0	119.9
1320	S	24.2	Very low	26	Very low	120 Å²	120	140.1 Å²	140.1	84%	0.839	71%	0.713	S	S	*	*			trans	77.5	27.5	155.1	69.3	0	0	0	0	121.6
1321	Q	23.6	Very low	25.8	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	72%	0.717	S	S	*	*			trans	-130.9	145	157.6	-74.3	-179.4	-15.1	0	0	109.6
1322	D	25.8	Very low	25.8	Very low	133 Å²	133	140.5 Å²	140.5	71%	0.711	72%	0.717	S	S	*	*			cis	-133	163.6	3.9	-93.2	-48.9	0	0	0	112.5	P1324	D1322-P1324 WeakPolarHBondContact O-CD 3.44Å
1323	V	24.6	Very low	25.9	Very low	129 Å²	129	142.9 Å²	142.9	78%	0.782	73%	0.725	S	S	*	*			trans	-106.1	103.1	163.2	177.5	0	0	0	0	109.2	Q1325	V1323-Q1325 PolarHBondContact O-N 2.81Å
1324	P	27.5	Very low	26.1	Very low	98 Å²	98	141.6 Å²	141.6	64%	0.636	72%	0.723	S	S	*	*			trans	-69.9	98.4	176.5	-18.1	32.5	0	0	0	110.7	D1322 L1326	D1322-P1324 WeakPolarHBondContact O-CD 3.44Å; P1324-L1326 HydrophobicContact CB-CD1 4.26Å; P1324-L1326 HydrophobicContact CB-CG 4.42Å; P1324-L1326 PolarHBondContact O-N 3.16Å
1325	Q	25.7	Very low	26.7	Very low	110 Å²	110	143.2 Å²	143.2	51%	0.514	73%	0.728	S	S	.	*			trans	-60.8	98	163.3	-66.3	-177.7	-5.2	0	0	108.3	H37 P39 V1323 P1327	H37-Q1325 PolarHBondContact O-NE2 2.77Å; P39-Q1325 HydrophobicContact CB-CB 4.28Å; P39-Q1325 HydrophobicContact CG-CB 4.16Å; P39-Q1325 HydrophobicContact CG-CG 4.23Å; V1323-Q1325 PolarHBondContact O-N 2.81Å; Q1325-P1327 VanDerWaalsContact C-CD 3.43Å; Q1325-P1327 WeakPolarHBondContact O-CD 3.47Å
1326	L	25.8	Very low	27.5	Very low	146 Å²	146	141.4 Å²	141.4	76%	0.764	72%	0.721	S	S	*	*			trans	-110.7	85.4	-173.6	-103.9	170.9	0	0	0	113.1	P1324	P1324-L1326 HydrophobicContact CB-CD1 4.26Å; P1324-L1326 HydrophobicContact CB-CG 4.42Å; P1324-L1326 PolarHBondContact O-N 3.16Å
1327	P	26.8	Very low	28.6	Very low	49 Å²	49	137.4 Å²	137.4	32%	0.318	70%	0.702	S	S	.	*			trans	-70.7	-173.9	152.9	32.8	-31.9	0	0	0	110.6	Q1325	Q1325-P1327 VanDerWaalsContact C-CD 3.43Å; Q1325-P1327 WeakPolarHBondContact O-CD 3.47Å
1328	L	24.4	Very low	29.7	Very low	128 Å²	128	133.1 Å²	133.1	67%	0.67	68%	0.684	S	S	*	*			trans	78.6	114.6	-174	-65.6	80.6	0	0	0	115.9	L1330	L1328-L1330 HydrophobicContact CB-CB 4.45Å; L1328-L1330 HydrophobicContact CB-CD1 4.48Å; L1328-L1330 HydrophobicContact CB-CG 4.02Å; L1328-L1330 HydrophobicContact CD2-CD1 4.28Å; L1328-L1330 HydrophobicContact CD2-CD2 4.41Å; L1328-L1330 HydrophobicContact CD2-CG 3.9Å; L1328-L1330 PolarHBondContact O-N 3.03Å
1329	L	25.4	Very low	31.1	Very low	187 Å²	187	125.5 Å²	125.5	98%	0.979	65%	0.649	S	S	*	*			trans	-67.7	74.5	148.3	-108.1	163.1	0	0	0	108.9
1330	L	23	Very low	32.8	Very low	129 Å²	129	119.1 Å²	119.1	68%	0.675	62%	0.62	S	S	*	*			trans	-69.1	141.3	179.5	-108.1	169.1	0	0	0	111.4	L1328 S1332	L1328-L1330 HydrophobicContact CB-CB 4.45Å; L1328-L1330 HydrophobicContact CB-CD1 4.48Å; L1328-L1330 HydrophobicContact CB-CG 4.02Å; L1328-L1330 HydrophobicContact CD2-CD1 4.28Å; L1328-L1330 HydrophobicContact CD2-CD2 4.41Å; L1328-L1330 HydrophobicContact CD2-CG 3.9Å; L1328-L1330 PolarHBondContact O-N 3.03Å; L1330-S1332 PolarHBondContact O-N 3.18Å
1331	Y	24.1	Very low	34.8	Very low	222 Å²	222	113.8 Å²	113.8	87%	0.871	58%	0.582	S	S	*	*			trans	-81.5	55.6	-169.6	-150.1	-96.7	0	0	0	112.1
1332	S	25.5	Very low	36.4	Very low	92 Å²	92	105.8 Å²	105.8	64%	0.643	54%	0.544	S	S	*	.			trans	-63.5	136.3	179.8	-175.2	0	0	0	0	111.5	L1330	L1330-S1332 PolarHBondContact O-N 3.18Å
1333	K	31.7	Very low	37.9	Very low	189 Å²	189	100.2 Å²	100.2	82%	0.822	51%	0.514	S	S	*	.	S	Bend	trans	-77.8	-22.5	-177.1	-72.8	177.8	176.7	172.7	0	112.9	K1335	K1333-K1335 PolarHBondContact O-N 3.24Å
1334	D	32.9	Very low	39.4	Very low	124 Å²	124	94.5 Å²	94.5	66%	0.663	48%	0.479	S	S	*	.			trans	-96.4	90.2	-167.7	-61.3	-55.8	0	0	0	113.2	T1336	D1334-T1336 PolarHBondContact O-N 2.77Å
1335	K	38.8	Very low	40.8	Very low	190 Å²	190	93.4 Å²	93.4	83%	0.826	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	20.1	-175.3	-61.9	-175.4	177.7	-179.5	0	115.1	K1333	K1333-K1335 PolarHBondContact O-N 3.24Å
1336	T	45.4	Very low	42	Very low	81 Å²	81	90.8 Å²	90.8	50%	0.497	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-21.6	-168.3	36.9	0	0	0	0	115.4	D1334	D1334-T1336 PolarHBondContact O-N 2.77Å
1337	H	49.2	Very low	43.1	Very low	83 Å²	83	88 Å²	88	38%	0.384	44%	0.437	S	S	.	.	S	Bend	trans	-108.4	-18	-166.5	-61.5	-80.2	0	0	0	115.9	I1226	I1226-H1337 HydrophobicContact CD1-CB 4.45Å; I1226-H1337 WeakPolarHBondContact CD1-ND1 3.33Å; I1226-H1337 WeakPolarHBondContact CG1-ND1 3.22Å
1338	L	47.9	Very low	44	Very low	71 Å²	71	89.7 Å²	89.7	37%	0.372	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	130.4	-174.8	-159.2	74.9	0	0	0	111.6	V1221 N1223 I1340 G1363	V1221-L1338 HydrophobicContact CG1-CD1 3.9Å; V1221-L1338 HydrophobicContact CG1-CD2 4.48Å; V1221-L1338 HydrophobicContact CG1-CG 4.3Å; N1223-L1338 HydrophobicContact CB-CD1 4.4Å; L1338-I1340 HydrophobicContact CD2-CD1 3.98Å; L1338-I1340 HydrophobicContact CD2-CG1 4.17Å; L1338-I1340 HydrophobicContact CG-CG1 4.35Å; L1338-G1363 WeakPolarHBondContact O-CA 3.02Å
1339	L	54.6	Low	44.9	Very low	5 Å²	5	87.9 Å²	87.9	3%	0.026	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.2	172.7	-158.4	76.2	0	0	0	110.2	L1222 L1224 W1341 N1364 A1367 F1368 I1371	L1222-L1339 PolarHBondContact N-O 2.89Å; L1222-L1339 PolarHBondContact O-N 2.81Å; L1222-L1339 VanDerWaalsContact O-N 3.14Å; L1224-L1339 HydrophobicContact CD1-CB 3.95Å; L1224-L1339 HydrophobicContact CD1-CD2 4.13Å; L1339-W1341 HydrophobicContact CD2-CE3 3.81Å; L1339-W1341 HydrophobicContact CD2-CH2 4.37Å; L1339-W1341 HydrophobicContact CD2-CZ3 3.6Å; L1339-N1364 WeakPolarHBondContact CD1-O 3.29Å; L1339-A1367 HydrophobicContact CD1-CB 4.45Å; L1339-F1368 HydrophobicContact CD1-CB 4.38Å; L1339-I1371 HydrophobicContact CD2-CD1 3.75Å
1340	I	62.8	Low	46.4	Very low	40 Å²	40	87.6 Å²	87.6	21%	0.205	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.7	179.6	-47.5	180	0	0	0	109	V1221 L1338 I1361 S1362	V1221-I1340 HydrophobicContact CG2-CG2 4.4Å; L1338-I1340 HydrophobicContact CD2-CD1 3.98Å; L1338-I1340 HydrophobicContact CD2-CG1 4.17Å; L1338-I1340 HydrophobicContact CG-CG1 4.35Å; I1340-I1361 HydrophobicContact CB-CB 4.12Å; I1340-I1361 HydrophobicContact CB-CG2 4.45Å; I1340-I1361 HydrophobicContact CG2-CB 3.91Å; I1340-I1361 HydrophobicContact CG2-CD1 3.99Å; I1340-I1361 HydrophobicContact CG2-CG2 4.14Å; I1340-I1361 PolarHBondContact O-N 3.03Å; I1340-S1362 PolarHBondContact N-O 3.12Å; I1340-S1362 PolarHBondContact O-N 3.35Å; I1340-S1362 VanDerWaalsContact O-N 3.11Å
1341	W	65.5	Low	47.3	Very low	8 Å²	8	86.3 Å²	86.3	3%	0.03	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	161.5	176.9	57.6	35.8	0	0	0	113.5	F1220 L1222 M1238 L1339 K1359 F1368 I1371	F1220-W1341 AromaticContact CD2-CD1 3.81Å; F1220-W1341 AromaticContact CD2-NE1 3.61Å; F1220-W1341 AromaticContact CG-NE1 3.85Å; F1220-W1341 PolarHBondContact N-O 2.82Å; F1220-W1341 PolarHBondContact O-N 3.02Å; L1222-W1341 HydrophobicContact CD1-CH2 3.84Å; L1222-W1341 HydrophobicContact CD1-CZ2 3.37Å; M1238-W1341 HydrophobicContact CE-CH2 3.83Å; M1238-W1341 HydrophobicContact CE-CZ2 3.46Å; M1238-W1341 VanDerWaalsContact CE-CZ2 3.46Å; M1238-W1341 HydrophobicContact SD-CH2 3.86Å; M1238-W1341 HydrophobicContact SD-CZ2 3.79Å; L1339-W1341 HydrophobicContact CD2-CE3 3.81Å; L1339-W1341 HydrophobicContact CD2-CH2 4.37Å; L1339-W1341 HydrophobicContact CD2-CZ3 3.6Å; W1341-K1359 CarbonylContact C-O 3.34Å; W1341-K1359 VanDerWaalsContact CA-O 3.26Å; W1341-K1359 WeakPolarHBondContact CA-O 3.33Å; W1341-K1359 WeakPolarHBondContact CB-O 3.27Å; W1341-F1368 HydrophobicContact CB-CE2 4.49Å; W1341-F1368 AromaticContact CE3-CD2 3.9Å; W1341-F1368 HydrophobicContact CE3-CD2 3.9Å; W1341-F1368 AromaticContact CE3-CE2 4Å; W1341-F1368 HydrophobicContact CE3-CE2 4Å; W1341-I1371 HydrophobicContact CH2-CB 4.48Å; W1341-I1371 HydrophobicContact CH2-CD1 3.96Å; W1341-I1371 HydrophobicContact CH2-CG2 3.77Å; W1341-I1371 HydrophobicContact CZ3-CB 4.24Å; W1341-I1371 HydrophobicContact CZ3-CD1 3.84Å; W1341-I1371 HydrophobicContact CZ3-CG2 3.93Å
1342	D	57.4	Low	48.3	Very low	7 Å²	7	82.4 Å²	82.4	4%	0.037	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.7	176	154.2	50.3	0	0	0	107.8	R1217 F1358 K1359 I1361	R1217-D1342 IonicContact CZ-OD1 3.83Å; R1217-D1342 IonicContact CZ-OD2 2.66Å; R1217-D1342 IonicContact NE-OD1 3.68Å; R1217-D1342 PolarHBondContact NE-OD1 2.81Å; R1217-D1342 IonicContact NE-OD2 2.72Å; R1217-D1342 VanDerWaalsContact NH2-CG 3.3Å; R1217-D1342 IonicContact NH2-OD1 3.86Å; R1217-D1342 PolarHBondContact NH2-OD1 3.07Å; R1217-D1342 IonicContact NH2-OD2 2.88Å; R1217-D1342 PolarHBondContact NH2-OD2 3.33Å; D1342-F1358 WeakPolarHBondContact O-CA 3.12Å; D1342-K1359 HydrophobicContact CB-CB 4.27Å; D1342-K1359 PolarHBondContact N-O 2.61Å; D1342-K1359 PolarHBondContact O-N 3.07Å; D1342-I1361 HydrophobicContact CB-CD1 3.88Å; D1342-I1361 HydrophobicContact CB-CG1 4.23Å
1343	M	55.9	Low	49.4	Very low	17 Å²	17	84 Å²	84	8%	0.084	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	128.2	177.5	-170.4	-177.1	74.3	0	0	109.9	R1217 L1218 F1220 I1345 V1356 R1357 F1358	R1217-M1343 WeakPolarHBondContact CA-O 3.4Å; L1218-M1343 HydrophobicContact CB-CE 4.43Å; L1218-M1343 HydrophobicContact CD1-CE 3.84Å; L1218-M1343 PolarHBondContact N-O 2.82Å; L1218-M1343 PolarHBondContact O-N 3.4Å; F1220-M1343 HydrophobicContact CD2-CB 4.49Å; F1220-M1343 HydrophobicContact CE2-CB 3.93Å; F1220-M1343 HydrophobicContact CE2-CE 4.01Å; F1220-M1343 HydrophobicContact CE2-SD 4.32Å; F1220-M1343 HydrophobicContact CZ-CE 4.11Å; M1343-I1345 HydrophobicContact CE-CD1 4.04Å; M1343-I1345 HydrophobicContact CE-CG1 4.25Å; M1343-V1356 HydrophobicContact CG-CG1 3.7Å; M1343-V1356 HydrophobicContact SD-CG1 4.07Å; M1343-R1357 WeakPolarHBondContact CA-O 3.49Å; M1343-F1358 HydrophobicContact CB-CD1 4.41Å; M1343-F1358 HydrophobicContact CB-CE1 4.42Å; M1343-F1358 HydrophobicContact CG-CD1 4.12Å; M1343-F1358 HydrophobicContact CG-CE1 3.79Å; M1343-F1358 HydrophobicContact CG-CZ 4.31Å; M1343-F1358 HydrophobicContact SD-CE1 3.79Å; M1343-F1358 HydrophobicContact SD-CZ 4.14Å
1344	E	56	Low	50.2	Low	8 Å²	8	81.5 Å²	81.5	4%	0.037	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	119	-180	172.3	173.9	-116.9	0	0	110	R658 P1215 R1217 V1356 R1357	R658-E1344 WeakPolarHBondContact CD-OE1 3.36Å; R658-E1344 WeakPolarHBondContact CD-OE2 3.43Å; R658-E1344 IonicContact CZ-OE1 2.65Å; R658-E1344 IonicContact NE-OE1 3.78Å; R658-E1344 IonicContact NH1-OE1 2.73Å; R658-E1344 PolarHBondContact NH1-OE1 2.74Å; R658-E1344 IonicContact NH1-OE2 2.79Å; R658-E1344 PolarHBondContact NH1-OE2 2.73Å; P1215-E1344 HydrophobicContact CB-CG 4.28Å; R1217-E1344 HydrophobicContact CG-CB 4.27Å; E1344-V1356 WeakPolarHBondContact O-CA 3.28Å; E1344-R1357 HydrophobicContact CB-CB 4.3Å; E1344-R1357 PolarHBondContact N-O 2.89Å; E1344-R1357 PolarHBondContact O-N 3.31Å; E1344-R1357 WeakPolarHBondContact OE2-CD 3.42Å; E1344-R1357 IonicContact OE2-CZ 3.37Å; E1344-R1357 IonicContact OE2-NE 3.66Å; E1344-R1357 IonicContact OE2-NH1 3.18Å; E1344-R1357 PolarHBondContact OE2-NH1 3.24Å
1345	I	57	Low	51.1	Low	75 Å²	75	76 Å²	76	39%	0.385	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.3	174.3	-56.8	174.2	0	0	0	108.1	P1215 M1343 V1356	P1215-I1345 WeakPolarHBondContact CA-O 3.04Å; P1215-I1345 WeakPolarHBondContact CB-O 3.49Å; M1343-I1345 HydrophobicContact CE-CD1 4.04Å; M1343-I1345 HydrophobicContact CE-CG1 4.25Å; I1345-V1356 HydrophobicContact CG1-CG2 4.46Å
1346	F	51.7	Low	52	Low	56 Å²	56	69 Å²	69	25%	0.246	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	146.8	-178.5	60.4	-83.6	0	0	0	111.3	P1215 L1348 Y1354 G1355 R1357	P1215-F1346 HydrophobicContact CB-CB 4.18Å; F1346-L1348 HydrophobicContact CD2-CD2 4.43Å; F1346-L1348 HydrophobicContact CD2-CG 4.46Å; F1346-L1348 HydrophobicContact CE2-CD2 3.9Å; F1346-L1348 HydrophobicContact CE2-CG 4.09Å; F1346-Y1354 CarbonylContact O-C 3.45Å; F1346-Y1354 WeakPolarHBondContact O-CA 3.49Å; F1346-G1355 WeakPolarHBondContact CD1-O 3.29Å; F1346-G1355 WeakPolarHBondContact CE1-O 3.37Å; F1346-G1355 PolarHBondContact N-O 3.4Å; F1346-G1355 PolarHBondContact O-N 2.82Å; F1346-R1357 HydrophobicContact CD1-CB 4.46Å; F1346-R1357 HydrophobicContact CE1-CB 3.9Å
1347	Q	49.5	Very low	52.9	Low	87 Å²	87	70.9 Å²	70.9	41%	0.407	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	125.5	178	-177	162.2	66.3	0	0	110.3	W1213 Y1354	W1213-Q1347 VanDerWaalsContact CD1-OE1 3.29Å; Q1347-Y1354 HydrophobicContact CB-CD1 4.38Å; Q1347-Y1354 HydrophobicContact CB-CE1 4.45Å
1348	L	45.9	Very low	53.8	Low	85 Å²	85	68.9 Å²	68.9	45%	0.445	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	161.5	163.3	-70.8	167.9	0	0	0	108.7	F1346 H1353	F1346-L1348 HydrophobicContact CD2-CD2 4.43Å; F1346-L1348 HydrophobicContact CD2-CG 4.46Å; F1346-L1348 HydrophobicContact CE2-CD2 3.9Å; F1346-L1348 HydrophobicContact CE2-CG 4.09Å; L1348-H1353 HydrophobicContact CB-CB 3.82Å; L1348-H1353 HydrophobicContact CD1-CB 4.46Å; L1348-H1353 PolarHBondContact N-O 2.99Å
1349	A	43.1	Very low	54.8	Low	89 Å²	89	71.4 Å²	71.4	74%	0.736	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	149.7	-168.3	0	0	0	0	0	113.4
1350	K	56.1	Low	55.7	Low	181 Å²	181	76.1 Å²	76.1	79%	0.787	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	141.6	178.1	-70.3	-177.4	179.3	178.8	0	111
1351	P	42.1	Very low	55.9	Low	102 Å²	102	77.8 Å²	77.8	66%	0.662	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	cis	-93.5	139	2.8	34.8	-32.4	0	0	0	113.9	H1353	P1351-H1353 PolarHBondContact O-CD2 3.22Å; P1351-H1353 PolarHBondContact O-N 2.99Å; P1351-H1353 VanDerWaalsContact O-N 3.09Å
1352	I	45.4	Very low	56	Low	140 Å²	140	80 Å²	80	72%	0.718	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.6	47.6	157.7	-30.2	178.4	0	0	0	117.1	Y1354	I1352-Y1354 HydrophobicContact CG2-CE2 4.31Å
1353	H	48.6	Very low	56.5	Low	126 Å²	126	80.5 Å²	80.5	58%	0.583	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	135.9	162.1	-78.5	-83.6	0	0	0	111.2	L1348 P1351	L1348-H1353 HydrophobicContact CB-CB 3.82Å; L1348-H1353 HydrophobicContact CD1-CB 4.46Å; L1348-H1353 PolarHBondContact N-O 2.99Å; P1351-H1353 PolarHBondContact O-CD2 3.22Å; P1351-H1353 PolarHBondContact O-N 2.99Å; P1351-H1353 VanDerWaalsContact O-N 3.09Å
1354	Y	49.1	Very low	57.3	Low	137 Å²	137	82.9 Å²	82.9	54%	0.537	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.1	171.1	-61.6	-78.5	0	0	0	108.8	F1346 Q1347 I1352	F1346-Y1354 CarbonylContact O-C 3.45Å; F1346-Y1354 WeakPolarHBondContact O-CA 3.49Å; Q1347-Y1354 HydrophobicContact CB-CD1 4.38Å; Q1347-Y1354 HydrophobicContact CB-CE1 4.45Å; I1352-Y1354 HydrophobicContact CG2-CE2 4.31Å
1355	G	50.7	Low	57.9	Low	7 Å²	7	87.7 Å²	87.7	7%	0.072	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	146.5	167.2	0	0	0	0	0	110.5	F1346	F1346-G1355 WeakPolarHBondContact CD1-O 3.29Å; F1346-G1355 WeakPolarHBondContact CE1-O 3.37Å; F1346-G1355 PolarHBondContact N-O 3.4Å; F1346-G1355 PolarHBondContact O-N 2.82Å
1356	V	58.9	Low	58.4	Low	45 Å²	45	88.9 Å²	88.9	27%	0.273	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	128	171.8	-170.2	0	0	0	0	108.7	M1343 E1344 I1345 F1358	M1343-V1356 HydrophobicContact CG-CG1 3.7Å; M1343-V1356 HydrophobicContact SD-CG1 4.07Å; E1344-V1356 WeakPolarHBondContact O-CA 3.28Å; I1345-V1356 HydrophobicContact CG1-CG2 4.46Å; V1356-F1358 HydrophobicContact CB-CE2 4.11Å; V1356-F1358 HydrophobicContact CG1-CD2 4.16Å; V1356-F1358 HydrophobicContact CG1-CE1 4.35Å; V1356-F1358 HydrophobicContact CG1-CE2 3.52Å; V1356-F1358 HydrophobicContact CG1-CZ 3.63Å
1357	R	63.7	Low	58.9	Low	119 Å²	119	87.1 Å²	87.1	45%	0.449	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124	176.1	176.9	-177.3	-66.4	140.1	-3.4	109.3	M1343 E1344 F1346	M1343-R1357 WeakPolarHBondContact CA-O 3.49Å; E1344-R1357 HydrophobicContact CB-CB 4.3Å; E1344-R1357 PolarHBondContact N-O 2.89Å; E1344-R1357 PolarHBondContact O-N 3.31Å; E1344-R1357 WeakPolarHBondContact OE2-CD 3.42Å; E1344-R1357 IonicContact OE2-CZ 3.37Å; E1344-R1357 IonicContact OE2-NE 3.66Å; E1344-R1357 IonicContact OE2-NH1 3.18Å; E1344-R1357 PolarHBondContact OE2-NH1 3.24Å; F1346-R1357 HydrophobicContact CD1-CB 4.46Å; F1346-R1357 HydrophobicContact CE1-CB 3.9Å
1358	F	67.6	Low	59.9	Low	42 Å²	42	84.7 Å²	84.7	18%	0.184	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	132.9	173.1	-62.3	-89.4	0	0	0	110.4	D1342 M1343 V1356 F1368 M1372 F1375	D1342-F1358 WeakPolarHBondContact O-CA 3.12Å; M1343-F1358 HydrophobicContact CB-CD1 4.41Å; M1343-F1358 HydrophobicContact CB-CE1 4.42Å; M1343-F1358 HydrophobicContact CG-CD1 4.12Å; M1343-F1358 HydrophobicContact CG-CE1 3.79Å; M1343-F1358 HydrophobicContact CG-CZ 4.31Å; M1343-F1358 HydrophobicContact SD-CE1 3.79Å; M1343-F1358 HydrophobicContact SD-CZ 4.14Å; V1356-F1358 HydrophobicContact CB-CE2 4.11Å; V1356-F1358 HydrophobicContact CG1-CD2 4.16Å; V1356-F1358 HydrophobicContact CG1-CE1 4.35Å; V1356-F1358 HydrophobicContact CG1-CE2 3.52Å; V1356-F1358 HydrophobicContact CG1-CZ 3.63Å; F1358-F1368 HydrophobicContact CB-CZ 4.34Å; F1358-M1372 HydrophobicContact CB-CE 4.42Å; F1358-M1372 HydrophobicContact CB-SD 3.86Å; F1358-M1372 HydrophobicContact CD1-SD 4.38Å; F1358-M1372 HydrophobicContact CD2-CE 3.72Å; F1358-M1372 HydrophobicContact CD2-SD 3.86Å; F1358-M1372 HydrophobicContact CE2-CE 4.29Å; F1358-M1372 HydrophobicContact CG-CE 4.24Å; F1358-M1372 HydrophobicContact CG-SD 3.78Å; F1358-F1375 AromaticContact CE2-CD1 3.96Å; F1358-F1375 HydrophobicContact CE2-CD1 3.96Å; F1358-F1375 AromaticContact CE2-CE1 3.56Å; F1358-F1375 HydrophobicContact CE2-CE1 3.56Å; F1358-F1375 AromaticContact CE2-CZ 3.94Å; F1358-F1375 HydrophobicContact CE2-CZ 3.94Å; F1358-F1375 HydrophobicContact CZ-CD1 4.21Å; F1358-F1375 HydrophobicContact CZ-CD2 4.42Å; F1358-F1375 AromaticContact CZ-CE1 3.77Å; F1358-F1375 HydrophobicContact CZ-CE1 3.77Å; F1358-F1375 HydrophobicContact CZ-CE2 4Å; F1358-F1375 AromaticContact CZ-CZ 3.67Å; F1358-F1375 HydrophobicContact CZ-CZ 3.67Å
1359	K	70	Confident	61.1	Low	124 Å²	124	86.1 Å²	86.1	54%	0.539	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	119.6	170.5	-176.8	-171.8	176.5	-169.7	0	109.6	W1341 D1342 I1361	W1341-K1359 CarbonylContact C-O 3.34Å; W1341-K1359 VanDerWaalsContact CA-O 3.26Å; W1341-K1359 WeakPolarHBondContact CA-O 3.33Å; W1341-K1359 WeakPolarHBondContact CB-O 3.27Å; D1342-K1359 HydrophobicContact CB-CB 4.27Å; D1342-K1359 PolarHBondContact N-O 2.61Å; D1342-K1359 PolarHBondContact O-N 3.07Å; K1359-I1361 PolarHBondContact O-N 2.84Å
1360	R	73.6	Confident	62.3	Low	104 Å²	104	86.2 Å²	86.2	39%	0.392	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	123.7	166	-171.9	-169	65.7	129	4.7	109.1	S1362 G1363 F1368	R1360-S1362 WeakPolarHBondContact CG-O 3.1Å; R1360-G1363 PolarHBondContact NH1-O 3.49Å; R1360-F1368 HydrophobicContact CB-CD1 4.41Å; R1360-F1368 HydrophobicContact CB-CD2 3.78Å; R1360-F1368 HydrophobicContact CB-CE1 4.43Å; R1360-F1368 HydrophobicContact CB-CE2 3.8Å; R1360-F1368 HydrophobicContact CB-CG 4.11Å; R1360-F1368 HydrophobicContact CB-CZ 4.14Å; R1360-F1368 HydrophobicContact CG-CD2 4.11Å; R1360-F1368 HydrophobicContact CG-CG 4.34Å
1361	I	67.2	Low	62.8	Low	74 Å²	74	79.6 Å²	79.6	38%	0.379	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-50	170	-64.8	169.2	0	0	0	108.9	Y1219 I1340 D1342 K1359	Y1219-I1361 HydrophobicContact CD1-CD1 3.97Å; Y1219-I1361 HydrophobicContact CE1-CD1 4.1Å; I1340-I1361 HydrophobicContact CB-CB 4.12Å; I1340-I1361 HydrophobicContact CB-CG2 4.45Å; I1340-I1361 HydrophobicContact CG2-CB 3.91Å; I1340-I1361 HydrophobicContact CG2-CD1 3.99Å; I1340-I1361 HydrophobicContact CG2-CG2 4.14Å; I1340-I1361 PolarHBondContact O-N 3.03Å; D1342-I1361 HydrophobicContact CB-CD1 3.88Å; D1342-I1361 HydrophobicContact CB-CG1 4.23Å; K1359-I1361 PolarHBondContact O-N 2.84Å
1362	S	66.6	Low	64.1	Low	56 Å²	56	76.6 Å²	76.6	39%	0.392	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	169.4	-177.4	-167.9	0	0	0	0	112	I1340 R1360	I1340-S1362 PolarHBondContact N-O 3.12Å; I1340-S1362 PolarHBondContact O-N 3.35Å; I1340-S1362 VanDerWaalsContact O-N 3.11Å; R1360-S1362 WeakPolarHBondContact CG-O 3.1Å
1363	G	67.6	Low	65.2	Low	17 Å²	17	77.9 Å²	77.9	18%	0.175	37%	0.371	C	S	.	.	S	Bend	trans	94.6	-177.8	170.8	0	0	0	0	0	116.6	L1338 R1360 Q1365	L1338-G1363 WeakPolarHBondContact O-CA 3.02Å; R1360-G1363 PolarHBondContact NH1-O 3.49Å; G1363-Q1365 PolarHBondContact O-N 3.04Å
1364	N	72.2	Confident	65.7	Low	66 Å²	66	76.5 Å²	76.5	35%	0.353	36%	0.361	S	S	.	.			trans	-61.1	119.2	-169.9	-174.2	-31.1	0	0	0	112.7	L1339 N1366 A1367 F1368	L1339-N1364 WeakPolarHBondContact CD1-O 3.29Å; N1364-N1366 VanDerWaalsContact C-N 3.3Å; N1364-N1366 PolarHBondContact O-N 3.24Å; N1364-N1366 WeakPolarHBondContact OD1-CB 3.49Å; N1364-N1366 PolarHBondContact OD1-N 2.88Å; N1364-A1367 HydrophobicContact CB-CB 4.02Å; N1364-A1367 PolarHBondContact O-N 3.03Å; N1364-A1367 PolarHBondContact OD1-N 3.02Å; N1364-F1368 PolarHBondContact O-N 3.49Å; N1364-F1368 VanDerWaalsContact O-N 3.09Å
1365	Q	70.2	Confident	66.4	Low	110 Å²	110	71.3 Å²	71.3	51%	0.514	34%	0.342	S	S	.	.	H	α-helix	trans	-68.1	-27.3	-177	-163.1	-174.6	19.5	0	0	113.1	G1363 K1369	G1363-Q1365 PolarHBondContact O-N 3.04Å; Q1365-K1369 WeakPolarHBondContact O-CB 3.5Å; Q1365-K1369 VanDerWaalsContact O-CG 3.29Å; Q1365-K1369 WeakPolarHBondContact O-CG 3.33Å; Q1365-K1369 PolarHBondContact O-N 2.77Å
1366	N	67.5	Low	67.2	Low	100 Å²	100	76.8 Å²	76.8	54%	0.535	37%	0.368	S	S	.	.	H	α-helix	trans	-75	-40.7	175.8	-72.1	-14.5	0	0	0	111	N1364 F1368 K1369 I1370	N1364-N1366 VanDerWaalsContact C-N 3.3Å; N1364-N1366 PolarHBondContact O-N 3.24Å; N1364-N1366 WeakPolarHBondContact OD1-CB 3.49Å; N1364-N1366 PolarHBondContact OD1-N 2.88Å; N1366-F1368 PolarHBondContact O-N 3.36Å; N1366-K1369 PolarHBondContact O-N 3.05Å; N1366-I1370 VanDerWaalsContact O-CG1 3.28Å; N1366-I1370 WeakPolarHBondContact O-CG1 3.38Å; N1366-I1370 PolarHBondContact O-N 2.57Å
1367	A	62.2	Low	67.4	Low	19 Å²	19	84 Å²	84	16%	0.157	39%	0.392	C	S	.	.	H	α-helix	trans	-58.4	-46.9	172.2	0	0	0	0	0	111.2	L1339 N1364 K1369 I1370 I1371	L1339-A1367 HydrophobicContact CD1-CB 4.45Å; N1364-A1367 HydrophobicContact CB-CB 4.02Å; N1364-A1367 PolarHBondContact O-N 3.03Å; N1364-A1367 PolarHBondContact OD1-N 3.02Å; A1367-K1369 PolarHBondContact O-N 2.91Å; A1367-I1370 PolarHBondContact O-N 2.87Å; A1367-I1371 WeakPolarHBondContact O-CG1 3.47Å; A1367-I1371 PolarHBondContact O-N 2.99Å
1368	F	69.4	Low	67.1	Low	36 Å²	36	82.8 Å²	82.8	16%	0.158	39%	0.391	C	S	.	.	H	α-helix	trans	-57.1	-45	173.7	-174	-95.2	0	0	0	112.6	L1339 W1341 F1358 R1360 N1364 N1366 M1372	L1339-F1368 HydrophobicContact CD1-CB 4.38Å; W1341-F1368 HydrophobicContact CB-CE2 4.49Å; W1341-F1368 AromaticContact CE3-CD2 3.9Å; W1341-F1368 HydrophobicContact CE3-CD2 3.9Å; W1341-F1368 AromaticContact CE3-CE2 4Å; W1341-F1368 HydrophobicContact CE3-CE2 4Å; F1358-F1368 HydrophobicContact CB-CZ 4.34Å; R1360-F1368 HydrophobicContact CB-CD1 4.41Å; R1360-F1368 HydrophobicContact CB-CD2 3.78Å; R1360-F1368 HydrophobicContact CB-CE1 4.43Å; R1360-F1368 HydrophobicContact CB-CE2 3.8Å; R1360-F1368 HydrophobicContact CB-CG 4.11Å; R1360-F1368 HydrophobicContact CB-CZ 4.14Å; R1360-F1368 HydrophobicContact CG-CD2 4.11Å; R1360-F1368 HydrophobicContact CG-CG 4.34Å; N1364-F1368 PolarHBondContact O-N 3.49Å; N1364-F1368 VanDerWaalsContact O-N 3.09Å; N1366-F1368 PolarHBondContact O-N 3.36Å; F1368-M1372 HydrophobicContact CD1-CG 4.07Å; F1368-M1372 HydrophobicContact CE1-CG 3.67Å; F1368-M1372 HydrophobicContact CE2-CG 4.28Å; F1368-M1372 HydrophobicContact CZ-CG 3.77Å; F1368-M1372 HydrophobicContact CZ-SD 4.13Å; F1368-M1372 WeakPolarHBondContact O-CB 3.13Å; F1368-M1372 VanDerWaalsContact O-CG 3.29Å; F1368-M1372 WeakPolarHBondContact O-CG 3.29Å; F1368-M1372 PolarHBondContact O-N 3.25Å
1369	K	70.8	Confident	66.5	Low	114 Å²	114	84.4 Å²	84.4	50%	0.496	40%	0.399	S	S	.	.	H	α-helix	trans	-63.7	-38.9	176.9	-77.8	171.1	-180	172.4	0	113	Q1365 N1366 A1367 K1373	Q1365-K1369 WeakPolarHBondContact O-CB 3.5Å; Q1365-K1369 VanDerWaalsContact O-CG 3.29Å; Q1365-K1369 WeakPolarHBondContact O-CG 3.33Å; Q1365-K1369 PolarHBondContact O-N 2.77Å; N1366-K1369 PolarHBondContact O-N 3.05Å; A1367-K1369 PolarHBondContact O-N 2.91Å; K1369-K1373 WeakPolarHBondContact O-CB 3.46Å; K1369-K1373 PolarHBondContact O-N 3.18Å
1370	I	69.2	Low	65.1	Low	92 Å²	92	89.2 Å²	89.2	47%	0.472	42%	0.42	S	S	.	.	H	α-helix	trans	-65.3	-52	178.2	-70.1	162.7	0	0	0	109.5	N1366 A1367 M1372 K1373 Y1374	N1366-I1370 VanDerWaalsContact O-CG1 3.28Å; N1366-I1370 WeakPolarHBondContact O-CG1 3.38Å; N1366-I1370 PolarHBondContact O-N 2.57Å; A1367-I1370 PolarHBondContact O-N 2.87Å; I1370-M1372 PolarHBondContact O-N 3.32Å; I1370-K1373 WeakPolarHBondContact O-CA 3.04Å; I1370-K1373 WeakPolarHBondContact O-CB 3.44Å; I1370-K1373 PolarHBondContact O-N 3.46Å; I1370-Y1374 HydrophobicContact CG2-CD2 4.08Å; I1370-Y1374 HydrophobicContact CG2-CE2 4.23Å; I1370-Y1374 WeakPolarHBondContact O-CD2 3.29Å; I1370-Y1374 PolarHBondContact O-N 2.8Å
1371	I	66.6	Low	63.5	Low	42 Å²	42	90.3 Å²	90.3	22%	0.215	44%	0.438	C	S	.	.	H	α-helix	trans	-63.2	-43	-178.3	-59.4	160.3	0	0	0	110.9	L1224 L1339 W1341 A1367 K1373 Y1374 F1375	L1224-I1371 HydrophobicContact CD1-CD1 4.32Å; L1339-I1371 HydrophobicContact CD2-CD1 3.75Å; W1341-I1371 HydrophobicContact CH2-CB 4.48Å; W1341-I1371 HydrophobicContact CH2-CD1 3.96Å; W1341-I1371 HydrophobicContact CH2-CG2 3.77Å; W1341-I1371 HydrophobicContact CZ3-CB 4.24Å; W1341-I1371 HydrophobicContact CZ3-CD1 3.84Å; W1341-I1371 HydrophobicContact CZ3-CG2 3.93Å; A1367-I1371 WeakPolarHBondContact O-CG1 3.47Å; A1367-I1371 PolarHBondContact O-N 2.99Å; I1371-K1373 VanDerWaalsContact C-N 3.3Å; I1371-K1373 PolarHBondContact O-N 2.93Å; I1371-Y1374 PolarHBondContact O-N 2.94Å; I1371-F1375 WeakPolarHBondContact O-CB 3.48Å; I1371-F1375 PolarHBondContact O-N 2.87Å
1372	M	68.6	Low	63.4	Low	38 Å²	38	91.2 Å²	91.2	19%	0.187	44%	0.441	C	S	.	.	H	α-helix	trans	-61	-36.3	174.1	-73.6	-56.5	-48.7	0	0	112.7	F1358 F1368 I1370 I1376	F1358-M1372 HydrophobicContact CB-CE 4.42Å; F1358-M1372 HydrophobicContact CB-SD 3.86Å; F1358-M1372 HydrophobicContact CD1-SD 4.38Å; F1358-M1372 HydrophobicContact CD2-CE 3.72Å; F1358-M1372 HydrophobicContact CD2-SD 3.86Å; F1358-M1372 HydrophobicContact CE2-CE 4.29Å; F1358-M1372 HydrophobicContact CG-CE 4.24Å; F1358-M1372 HydrophobicContact CG-SD 3.78Å; F1368-M1372 HydrophobicContact CD1-CG 4.07Å; F1368-M1372 HydrophobicContact CE1-CG 3.67Å; F1368-M1372 HydrophobicContact CE2-CG 4.28Å; F1368-M1372 HydrophobicContact CZ-CG 3.77Å; F1368-M1372 HydrophobicContact CZ-SD 4.13Å; F1368-M1372 WeakPolarHBondContact O-CB 3.13Å; F1368-M1372 VanDerWaalsContact O-CG 3.29Å; F1368-M1372 WeakPolarHBondContact O-CG 3.29Å; F1368-M1372 PolarHBondContact O-N 3.25Å; I1370-M1372 PolarHBondContact O-N 3.32Å; M1372-I1376 HydrophobicContact CE-CD1 4.38Å; M1372-I1376 WeakPolarHBondContact O-CB 3.39Å; M1372-I1376 WeakPolarHBondContact O-CD1 3.5Å; M1372-I1376 WeakPolarHBondContact O-CG1 3.35Å; M1372-I1376 PolarHBondContact O-N 3.35Å; M1372-I1376 VanDerWaalsContact O-N 3.08Å
1373	K	69	Low	63.2	Low	167 Å²	167	93 Å²	93	73%	0.726	44%	0.443	S	S	*	.	H	α-helix	trans	-62.9	-47.2	173.6	-109.2	-169.3	170.9	-166.6	0	111.9	K1369 I1370 I1371 I1376 Y1377	K1369-K1373 WeakPolarHBondContact O-CB 3.46Å; K1369-K1373 PolarHBondContact O-N 3.18Å; I1370-K1373 WeakPolarHBondContact O-CA 3.04Å; I1370-K1373 WeakPolarHBondContact O-CB 3.44Å; I1370-K1373 PolarHBondContact O-N 3.46Å; I1371-K1373 VanDerWaalsContact C-N 3.3Å; I1371-K1373 PolarHBondContact O-N 2.93Å; K1373-I1376 PolarHBondContact O-N 2.79Å; K1373-Y1377 WeakPolarHBondContact O-CB 3.45Å; K1373-Y1377 PolarHBondContact O-N 3.3Å
1374	Y	58.8	Low	62.9	Low	98 Å²	98	97.2 Å²	97.2	38%	0.384	46%	0.458	S	S	.	.	H	α-helix	trans	-66.7	-38.8	178.9	-88.8	-95	0	0	0	112.3	I1370 I1371 Y1377 H1378	I1370-Y1374 HydrophobicContact CG2-CD2 4.08Å; I1370-Y1374 HydrophobicContact CG2-CE2 4.23Å; I1370-Y1374 WeakPolarHBondContact O-CD2 3.29Å; I1370-Y1374 PolarHBondContact O-N 2.8Å; I1371-Y1374 PolarHBondContact O-N 2.94Å; Y1374-Y1377 PolarHBondContact O-N 2.89Å; Y1374-H1378 PolarHBondContact O-N 3.47Å
1375	F	64.4	Low	62.4	Low	28 Å²	28	99.1 Å²	99.1	12%	0.123	46%	0.464	C	S	.	.	H	α-helix	trans	-61	-46.9	175.3	-173.4	-92.7	0	0	0	112	F1358 I1371 Y1377 H1378 H1379 V1381	F1358-F1375 AromaticContact CE2-CD1 3.96Å; F1358-F1375 HydrophobicContact CE2-CD1 3.96Å; F1358-F1375 AromaticContact CE2-CE1 3.56Å; F1358-F1375 HydrophobicContact CE2-CE1 3.56Å; F1358-F1375 AromaticContact CE2-CZ 3.94Å; F1358-F1375 HydrophobicContact CE2-CZ 3.94Å; F1358-F1375 HydrophobicContact CZ-CD1 4.21Å; F1358-F1375 HydrophobicContact CZ-CD2 4.42Å; F1358-F1375 AromaticContact CZ-CE1 3.77Å; F1358-F1375 HydrophobicContact CZ-CE1 3.77Å; F1358-F1375 HydrophobicContact CZ-CE2 4Å; F1358-F1375 AromaticContact CZ-CZ 3.67Å; F1358-F1375 HydrophobicContact CZ-CZ 3.67Å; I1371-F1375 WeakPolarHBondContact O-CB 3.48Å; I1371-F1375 PolarHBondContact O-N 2.87Å; F1375-Y1377 VanDerWaalsContact C-N 3.26Å; F1375-Y1377 PolarHBondContact O-N 3.16Å; F1375-H1378 PolarHBondContact O-N 2.97Å; F1375-H1379 AromaticContact CE2-CD2 3.94Å; F1375-H1379 PolarHBondContact O-N 2.71Å; F1375-V1381 HydrophobicContact CE1-CG2 3.91Å; F1375-V1381 HydrophobicContact CZ-CG2 4.34Å
1376	I	66.7	Low	61.9	Low	121 Å²	121	98.4 Å²	98.4	62%	0.621	46%	0.461	S	S	*	.	H	α-helix	trans	-65.8	-27.4	175.6	-67.4	166	0	0	0	112	M1372 K1373	M1372-I1376 HydrophobicContact CE-CD1 4.38Å; M1372-I1376 WeakPolarHBondContact O-CB 3.39Å; M1372-I1376 WeakPolarHBondContact O-CD1 3.5Å; M1372-I1376 WeakPolarHBondContact O-CG1 3.35Å; M1372-I1376 PolarHBondContact O-N 3.35Å; M1372-I1376 VanDerWaalsContact O-N 3.08Å; K1373-I1376 PolarHBondContact O-N 2.79Å
1377	Y	63.9	Low	61.5	Low	198 Å²	198	98.3 Å²	98.3	78%	0.776	46%	0.456	S	S	*	.	H	α-helix	trans	-79	-38	178.2	-167	-98.7	0	0	0	112.9	K1373 Y1374 F1375	K1373-Y1377 WeakPolarHBondContact O-CB 3.45Å; K1373-Y1377 PolarHBondContact O-N 3.3Å; Y1374-Y1377 PolarHBondContact O-N 2.89Å; F1375-Y1377 VanDerWaalsContact C-N 3.26Å; F1375-Y1377 PolarHBondContact O-N 3.16Å
1378	H	56.3	Low	61.5	Low	93 Å²	93	103.9 Å²	103.9	43%	0.431	48%	0.478	S	S	.	.	H	α-helix	trans	-89.3	-26.1	-177.9	-84.1	-82.5	0	0	0	114.8	H1232 L1235 Y1374 F1375	H1232-H1378 AromaticContact CE1-NE2 3.82Å; L1235-H1378 HydrophobicContact CD2-CB 4.45Å; Y1374-H1378 PolarHBondContact O-N 3.47Å; F1375-H1378 PolarHBondContact O-N 2.97Å
1379	H	55	Low	60.9	Low	76 Å²	76	109.2 Å²	109.2	35%	0.352	50%	0.502	S	S	.	.	S	Bend	trans	-116.5	127.6	177.4	-66.7	-84.6	0	0	0	111.8	F1375 V1381	F1375-H1379 AromaticContact CE2-CD2 3.94Å; F1375-H1379 PolarHBondContact O-N 2.71Å; H1379-V1381 VanDerWaalsContact C-N 3.35Å; H1379-V1381 HydrophobicContact CB-CG2 3.62Å; H1379-V1381 PolarHBondContact O-N 3.25Å
1380	K	42.2	Very low	60	Low	224 Å²	224	108.8 Å²	108.8	97%	0.974	50%	0.503	S	S	*	.			trans	-73	87.3	165.8	-66.1	-178.7	179.7	176.2	0	109.2
1381	V	40	Very low	59.2	Low	128 Å²	128	110.3 Å²	110.3	78%	0.776	51%	0.506	S	S	*	.			trans	-110.7	0	177	-170.4	0	0	0	0	110.4	F1375 H1379	F1375-V1381 HydrophobicContact CE1-CG2 3.91Å; F1375-V1381 HydrophobicContact CZ-CG2 4.34Å; H1379-V1381 VanDerWaalsContact C-N 3.35Å; H1379-V1381 HydrophobicContact CB-CG2 3.62Å; H1379-V1381 PolarHBondContact O-N 3.25Å

Retrieved 1,381 of 1,381 residues in 194 ms (Link to these results)

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