A0A087YGT7_POEFO Loading...

Regulator of nonsense transcripts 2

Involved in nonsense-mediated decay (NMD) of mRNAs containing premature stop codons by associating with the nuclear exon junction complex (EJC). Recruited by UPF3B associated with the EJC core at the cytoplasmic side of the nuclear envelope and the subsequent formation of an UPF1-UPF2-UPF3 surveillance complex (including UPF1 bound to release factors at the stalled ribosome) is believed to activate NMD. In cooperation with UPF3B stimulates both ATPase and RNA helicase activities of UPF1. Binds spliced mRNA.

AlphaFold DB , UniProt , Accession A0A087YGT7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,275 aa.

						>A0A087YGT7_POEFO|A0A087YGT7
MPAESKPSVNMDEKDVNSFSNKEKEKDKEDERRAASARDKAKEEAKASSKKDAGKEEKKKRLEEEKKKKEEKERKKKEEEKQKAEEDQKKKEEEEKKQQEELQKKLEEDEAKRQREEEAALLKEKEEGHQLHQEAWERHQGRKELRSRNQNAQEARPEEAFFSRLDSSLKKNTAFVKKLRTLTEQQRDALSNDFASLNLSKYIGEAVSSLVEAKLKISDVGCAVHLCSLFHQRYAEFAPLLLQAWKKHFEARKEDKAPNVSKLRTDLRFIAELTIVGLFTDREGLSLIYEQLKNIIGTDRETHTHVSVVISFCKHCGDDIAGLVPRRVKLAAEKFGLAFPPSEIISTEKQQPFQNLLREYFTSLTKHLKKDHRELQNIERQNRRILHSKGELSEDRHKQYEEFATSYQKLLANTQTLADLLDENMPELPQDKTVQEEHGPGIDIFTPGKPGEYELEGGIWEDEDARNFYENLIDLKAFVPAILFKDNEKSGLSKDKDDAKDGREGKDVSATEELELELEALDIADEPLELEGGDEVENEELAKKLLDEQEQEDEEASTGSHLKLIVDAFIQQLPNCVNRDLIDKAAMDFCMNMNTKSNRRKLVRALFTVPRQRLDLLPFYSRLVATLHPCMSDVAEDLCSMLKGDFRFHIRKKDQINIETKNKTVRFIGELSKFKMFSKTDTLHCLKMLLSDFTHHHIEMACTLLETCGRFLFRSPDSHLRTSVLLEQMMRKKQAQHLDARYVTMVENAYYYCNPPPIEKAVKKKRPPLQEYIRKLLYKDLSKVTTEKVLRQMRKLPWQEPEVKGYLICCMINIWNVKYNSIHCVANLLAGLVAYQEDVGIHVVDGVLEDIRLGMEVNQPKFNQRRISSAKFLGELYNYRMVESAVVFRTLFSFISFGVNPDGSPSPLDPPEHLFRIRLVCTLLDTCGQYFDRGSSKKKLDCFLIYFQRYIWWKKSVDVWTKDHPFPIDIDYMISDTLELLRPKMRLSCSLDDATRQVADLEREVLVKLGMAMEKDGRSSAMSEGEPLDEEDEDEDEEGAADTEEQSGNESEMNEQEEDEGSENEEEEREEEEEENTDYLTDSNKENETDEENNEVTIRGGGLKHVACAEDEDFIQALDKMMLENLQQRSGEAVKVHQLDVAIPLQLKSQLKKGSSGQQCMGEGDSDISDTMQFVMLTRKGNKQQYKILNVPLSSHLAANHFNQQQAEQEERMRMKKLTLDINERQEQEDYQEMMQSFAQRPAPANTNRERRPRYQHPKGAPNADLIFKTGGRRR
					

Structure Viewer

Loading PAE data...

(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	31.6	Very low	34	Very low	237 Å²	237	146.3 Å²	146.3	100%	1.167	83%	0.825	S	S	*	*				0	152.2	0	-72.4	-157.5	-60.4	0	0	108.6
2	P	55.9	Low	33.8	Very low	129 Å²	129	144.6 Å²	144.6	84%	0.838	81%	0.813	S	S	*	*			cis	-108.7	-171.5	-30.4	39.7	-27.1	0	0	0	108.8
3	A	31.7	Very low	33.6	Very low	81 Å²	81	144.4 Å²	144.4	67%	0.669	80%	0.801	S	S	*	*			cis	-129.7	-166.3	-6.6	0	0	0	0	0	107.2
4	E	32.6	Very low	33.4	Very low	189 Å²	189	144.7 Å²	144.7	88%	0.883	79%	0.79	S	S	*	*			cis	-152	-172	10	-152.4	145.2	-113.7	0	0	110.8
5	S	31	Very low	33.1	Very low	108 Å²	108	143.7 Å²	143.7	76%	0.755	78%	0.784	S	S	*	*			trans	-100.9	162.6	-162.2	53.6	0	0	0	0	116.9
6	K	35.8	Very low	32.8	Very low	192 Å²	192	141.9 Å²	141.9	84%	0.835	78%	0.778	S	S	*	*			trans	-56.3	164.8	165.5	-57.2	-177.8	177.8	-175.6	0	112.2
7	P	39.2	Very low	32.3	Very low	128 Å²	128	142.1 Å²	142.1	83%	0.831	78%	0.778	S	S	*	*				-137.1	-173.4	102.8	40.3	-31	0	0	0	114.5
8	S	29.3	Very low	32	Very low	104 Å²	104	140.9 Å²	140.9	73%	0.727	78%	0.782	S	S	*	*			trans	-141.6	172.1	176.5	52.1	0	0	0	0	109.3
9	V	31.6	Very low	31.6	Very low	129 Å²	129	144.2 Å²	144.2	78%	0.782	79%	0.788	S	S	*	*			trans	136.1	146.1	154.5	169.6	0	0	0	0	113.9
10	N	28.8	Very low	31.3	Very low	129 Å²	129	142 Å²	142	69%	0.69	78%	0.783	S	S	*	*			trans	-49.9	168.4	-179.8	-37.1	-0.2	0	0	0	117
11	M	27	Very low	31.2	Very low	183 Å²	183	141.5 Å²	141.5	90%	0.901	78%	0.779	S	S	*	*				-142.7	162.9	127.4	-98.6	-150.2	72	0	0	111.1
12	D	31.1	Very low	31.2	Very low	126 Å²	126	139.1 Å²	139.1	67%	0.674	76%	0.763	S	S	*	*			trans	-136.2	161.2	-169.1	-113.8	-50.5	0	0	0	111.8
13	E	31.8	Very low	29.9	Very low	142 Å²	142	141 Å²	141	66%	0.664	76%	0.76	S	S	*	*			trans	68.3	136.2	160.3	-71.5	-152.9	123.8	0	0	124
14	K	30.6	Very low	29.9	Very low	149 Å²	149	144.8 Å²	144.8	65%	0.648	76%	0.761	S	S	*	*			trans	75.6	148.4	143.7	-72.7	171.5	179.6	130.5	0	119.9
15	D	27.8	Very low	30	Very low	130 Å²	130	141.7 Å²	141.7	70%	0.695	75%	0.747	S	S	*	*			cis	-154.4	155	8.4	-119.8	-23.1	0	0	0	115.2
16	V	28.3	Very low	30.1	Very low	114 Å²	114	144.2 Å²	144.2	69%	0.691	75%	0.745	S	S	*	*			trans	53.5	123.4	145.6	178.1	0	0	0	0	124.6
17	N	25.4	Very low	29.7	Very low	145 Å²	145	139.9 Å²	139.9	78%	0.775	73%	0.73	S	S	*	*			trans	24.8	137.4	145.1	-60.7	-27.5	0	0	0	123.9
18	S	25.8	Very low	29.3	Very low	121 Å²	121	141 Å²	141	85%	0.846	72%	0.722	S	S	*	*				172.1	175.1	99.9	52.3	0	0	0	0	115.3
19	F	25.3	Very low	29.5	Very low	204 Å²	204	144.6 Å²	144.6	90%	0.895	73%	0.728	S	S	*	*			trans	-88	147.9	-172.5	-76.1	-116.6	0	0	0	114.6
20	S	26.1	Very low	29.7	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	72%	0.723	S	S	*	*				154.7	152.5	98.1	67.4	0	0	0	0	117.7
21	N	28	Very low	29.7	Very low	131 Å²	131	145.2 Å²	145.2	70%	0.701	72%	0.722	S	S	*	*			trans	60.5	119.2	144.3	-79	-45.2	0	0	0	124.9
22	K	32.2	Very low	29.9	Very low	188 Å²	188	144.6 Å²	144.6	82%	0.817	71%	0.71	S	S	*	*				54.9	135.8	125.1	-68.2	-178	175.2	-178.6	0	123
23	E	28.2	Very low	29.9	Very low	168 Å²	168	149.7 Å²	149.7	79%	0.785	72%	0.719	S	S	*	*				-160.7	137.7	115.1	-102.6	-170.6	158.2	0	0	109.8
24	K	31.6	Very low	29.8	Very low	160 Å²	160	147.1 Å²	147.1	70%	0.696	72%	0.722	S	S	*	*				61	146.1	93.5	-69.8	-175.9	164.6	-125.9	0	115.4
25	E	34.4	Very low	29.7	Very low	124 Å²	124	144.7 Å²	144.7	58%	0.579	73%	0.73	S	S	*	*			cis	-156.7	175	-10.9	-115.2	174.6	-112.1	0	0	106.1
26	K	33.3	Very low	29.8	Very low	162 Å²	162	144.4 Å²	144.4	70%	0.704	74%	0.738	S	S	*	*			cis	-149	-145.7	17.9	-140.4	179.1	174.3	74	0	108.2
27	D	28.9	Very low	29.9	Very low	100 Å²	100	143.2 Å²	143.2	54%	0.535	74%	0.74	S	S	.	*			cis	-155.6	-178.8	-0.2	-149.7	5.3	0	0	0	112.3
28	K	29.5	Very low	30.1	Very low	153 Å²	153	147.5 Å²	147.5	67%	0.665	75%	0.746	S	S	*	*			trans	13.1	122.8	164.4	-64.7	178.9	-170	82.2	0	120.8
29	E	33.2	Very low	30.2	Very low	179 Å²	179	148.6 Å²	148.6	84%	0.836	74%	0.742	S	S	*	*				87.4	138.3	50.6	-75.7	-176	154.2	0	0	114.9
30	D	36.2	Very low	30.4	Very low	129 Å²	129	147.7 Å²	147.7	69%	0.69	74%	0.738	S	S	*	*			cis	-167.7	154.3	-19	-177.9	30.3	0	0	0	110.2
31	E	28.6	Very low	30.5	Very low	141 Å²	141	147.6 Å²	147.6	66%	0.659	74%	0.743	S	S	*	*			trans	-178.7	97.8	135.9	-90.9	-123.6	105.7	0	0	114.3
32	R	32.1	Very low	30.5	Very low	171 Å²	171	150 Å²	150	65%	0.645	75%	0.747	S	S	*	*			trans	64.2	110.9	130.2	-58.7	-173.1	-178.4	148.5	-2.7	124.4
33	R	31.3	Very low	30.3	Very low	233 Å²	233	150.2 Å²	150.2	88%	0.879	75%	0.751	S	S	*	*				68.5	149.3	119.5	-65	176.4	-178.9	-173.7	-0.2	121.5
34	A	28.9	Very low	30.3	Very low	87 Å²	87	150.2 Å²	150.2	72%	0.719	75%	0.751	S	S	*	*			cis	-170.1	137.5	-19.4	0	0	0	0	0	114.4
35	A	29.3	Very low	30.1	Very low	99 Å²	99	146.1 Å²	146.1	82%	0.818	75%	0.747	S	S	*	*			trans	61.2	154	134.8	0	0	0	0	0	125.3
36	S	29.2	Very low	29.9	Very low	123 Å²	123	149.8 Å²	149.8	86%	0.86	76%	0.761	S	S	*	*			trans	79.2	145.3	156.4	-162.3	0	0	0	0	118.5
37	A	31.1	Very low	29.6	Very low	90 Å²	90	146.5 Å²	146.5	74%	0.744	76%	0.764	S	S	*	*			cis	-166.8	-176	-25.9	0	0	0	0	0	110.8
38	R	29.2	Very low	29.5	Very low	234 Å²	234	147.2 Å²	147.2	88%	0.883	78%	0.777	S	S	*	*			trans	-61	154.3	174.5	-77.6	177	170	158.2	-3.5	114.4
39	D	28	Very low	29.5	Very low	145 Å²	145	145.4 Å²	145.4	78%	0.775	78%	0.783	S	S	*	*				-168.8	-171.8	94.9	-130.9	-49	0	0	0	115.4
40	K	29.1	Very low	29.4	Very low	185 Å²	185	146.5 Å²	146.5	80%	0.804	79%	0.785	S	S	*	*			trans	-105.1	167	-163	-62.6	166.2	175.3	174.2	0	116
41	A	27.5	Very low	29.2	Very low	97 Å²	97	149.6 Å²	149.6	80%	0.802	79%	0.793	S	S	*	*			trans	72.6	168	141.6	0	0	0	0	0	118.8
42	K	29.6	Very low	29.5	Very low	183 Å²	183	149.9 Å²	149.9	80%	0.796	80%	0.799	S	S	*	*			cis	178.4	117.6	-36.5	176.2	-158.1	176.7	-159.2	0	107.9
43	E	27.2	Very low	29.5	Very low	192 Å²	192	146.8 Å²	146.8	90%	0.897	81%	0.81	S	S	*	*			trans	174	-176.9	162.8	-106.6	169.3	-159.1	0	0	110.3
44	E	27.8	Very low	29.8	Very low	168 Å²	168	138.3 Å²	138.3	79%	0.785	80%	0.795	S	S	*	*				-155.1	171.6	-83.3	-145.2	-179.2	-119.2	0	0	112.1
45	A	28.6	Very low	30.5	Very low	74 Å²	74	144.1 Å²	144.1	61%	0.612	80%	0.804	S	S	*	*			trans	52.8	111.8	150.7	0	0	0	0	0	124.8
46	K	28.7	Very low	31.5	Very low	201 Å²	201	147.4 Å²	147.4	87%	0.874	80%	0.802	S	S	*	*				59.7	105.1	122.6	-65.7	178	178.2	172.9	0	123.8
47	A	28.5	Very low	32.5	Very low	92 Å²	92	146.8 Å²	146.8	76%	0.76	79%	0.786	S	S	*	*				74.9	141.9	107.8	0	0	0	0	0	125.2
48	S	26.8	Very low	33.5	Very low	116 Å²	116	150.1 Å²	150.1	81%	0.811	78%	0.784	S	S	*	*			trans	77.5	152.3	166.5	92.3	0	0	0	0	116.2
49	S	28.7	Very low	34.8	Very low	114 Å²	114	146 Å²	146	80%	0.797	77%	0.772	S	S	*	*			cis	-142.2	174.2	14.6	-84.9	0	0	0	0	114.2
50	K	32.3	Very low	36.2	Very low	202 Å²	202	146.3 Å²	146.3	88%	0.878	77%	0.766	S	S	*	*			trans	-65.7	147.3	-174	-57.5	170.2	176.4	176.1	0	115.7
51	K	31.3	Very low	37.5	Very low	195 Å²	195	144.7 Å²	144.7	85%	0.848	76%	0.755	S	S	*	*				-171	174.2	105.5	-106.1	-170.7	172.9	-173.6	0	114.5
52	D	34.8	Very low	39	Very low	147 Å²	147	145 Å²	145	79%	0.786	74%	0.743	S	S	*	*			trans	-74.1	137.3	-156.2	-48.8	-91.5	0	0	0	117.5
53	A	32.3	Very low	40.6	Very low	106 Å²	106	141.5 Å²	141.5	88%	0.876	73%	0.729	S	S	*	*			trans	-176.6	166.2	140.7	0	0	0	0	0	111.9
54	G	37.8	Very low	42.3	Very low	55 Å²	55	137.9 Å²	137.9	57%	0.567	71%	0.712	S	S	*	*			trans	82.9	54.4	148.9	0	0	0	0	0	119.5	E56	G54-E56 PolarHBondContact O-N 3.46Å; G54-E56 VanDerWaalsContact O-N 3.14Å
55	K	43.8	Very low	44	Very low	209 Å²	209	136.3 Å²	136.3	91%	0.909	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-8.9	176.8	-153.4	175.6	-177.7	-177.8	0	114.7
56	E	50.1	Low	45.8	Very low	168 Å²	168	138.9 Å²	138.9	79%	0.785	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-37.2	-179.3	-65.5	-178.4	103.5	0	0	114.2	G54 K58 K59	G54-E56 PolarHBondContact O-N 3.46Å; G54-E56 VanDerWaalsContact O-N 3.14Å; E56-K58 VanDerWaalsContact C-N 3.26Å; E56-K58 PolarHBondContact O-N 3.17Å; E56-K59 WeakPolarHBondContact O-CB 3.34Å; E56-K59 PolarHBondContact O-N 2.6Å
57	E	49.9	Very low	47.7	Very low	110 Å²	110	136.5 Å²	136.5	51%	0.514	69%	0.692	S	S	.	*	H	α-helix	trans	-64	-34.5	-170	-151.9	-156.5	140.5	0	0	112.2	K59 K60 R61	E57-K59 PolarHBondContact O-N 3.41Å; E57-K60 PolarHBondContact O-N 3.07Å; E57-R61 PolarHBondContact O-N 3.46Å; E57-R61 IonicContact OE1-CZ 3.9Å; E57-R61 IonicContact OE1-NE 3.13Å; E57-R61 PolarHBondContact OE1-NE 2.89Å; E57-R61 IonicContact OE1-NH2 3.41Å; E57-R61 PolarHBondContact OE1-NH2 3.11Å
58	K	51.5	Low	49.7	Very low	160 Å²	160	139 Å²	139	70%	0.696	69%	0.686	S	S	*	*	H	α-helix	trans	-65	-23.9	176.9	-162.1	172.3	-174.8	178.9	0	113.1	E56 L62	E56-K58 VanDerWaalsContact C-N 3.26Å; E56-K58 PolarHBondContact O-N 3.17Å; K58-L62 WeakPolarHBondContact O-CD1 3.46Å; K58-L62 WeakPolarHBondContact O-CG 3.47Å; K58-L62 PolarHBondContact O-N 3.24Å
59	K	55.9	Low	51.8	Low	146 Å²	146	140.8 Å²	140.8	64%	0.635	68%	0.679	S	S	*	*	H	α-helix	trans	-74.7	-46.3	176.2	-166.1	-179	177.5	-171.1	0	111	E56 E57 R61 L62 E63	E56-K59 WeakPolarHBondContact O-CB 3.34Å; E56-K59 PolarHBondContact O-N 2.6Å; E57-K59 PolarHBondContact O-N 3.41Å; K59-R61 PolarHBondContact O-N 3.22Å; K59-L62 PolarHBondContact O-N 3.46Å; K59-E63 PolarHBondContact O-N 3.34Å; K59-E63 VanDerWaalsContact O-N 3.11Å
60	K	57.1	Low	53.7	Low	152 Å²	152	139.9 Å²	139.9	66%	0.661	66%	0.662	S	S	*	*	H	α-helix	trans	-60	-46.2	176.5	-80.7	-171.6	173.4	-178.2	0	112.6	E57 L62 E63 E64	E57-K60 PolarHBondContact O-N 3.07Å; K60-L62 VanDerWaalsContact C-N 3.3Å; K60-L62 PolarHBondContact O-N 3.32Å; K60-E63 PolarHBondContact O-N 2.96Å; K60-E63 VanDerWaalsContact O-N 3.11Å; K60-E64 PolarHBondContact O-N 3.26Å
61	R	58.1	Low	55.6	Low	152 Å²	152	135.1 Å²	135.1	57%	0.574	64%	0.643	S	S	*	*	H	α-helix	trans	-61	-37.6	178.9	-66.7	-173.5	-174.6	-146	6.3	112.5	E57 K59 E64 E65	E57-R61 PolarHBondContact O-N 3.46Å; E57-R61 IonicContact OE1-CZ 3.9Å; E57-R61 IonicContact OE1-NE 3.13Å; E57-R61 PolarHBondContact OE1-NE 2.89Å; E57-R61 IonicContact OE1-NH2 3.41Å; E57-R61 PolarHBondContact OE1-NH2 3.11Å; K59-R61 PolarHBondContact O-N 3.22Å; R61-E64 PolarHBondContact O-N 3.2Å; R61-E65 PolarHBondContact O-N 3.15Å
62	L	59.2	Low	57.6	Low	103 Å²	103	133.7 Å²	133.7	54%	0.539	64%	0.637	S	S	.	*	H	α-helix	trans	-68.3	-33.9	174.8	-76.8	169.1	0	0	0	113	K58 K59 K60 K66	K58-L62 WeakPolarHBondContact O-CD1 3.46Å; K58-L62 WeakPolarHBondContact O-CG 3.47Å; K58-L62 PolarHBondContact O-N 3.24Å; K59-L62 PolarHBondContact O-N 3.46Å; K60-L62 VanDerWaalsContact C-N 3.3Å; K60-L62 PolarHBondContact O-N 3.32Å; L62-K66 VanDerWaalsContact O-CB 3.27Å; L62-K66 WeakPolarHBondContact O-CB 3.36Å; L62-K66 PolarHBondContact O-N 3.27Å
63	E	61.5	Low	59.4	Low	110 Å²	110	131.3 Å²	131.3	51%	0.514	62%	0.621	S	S	.	*	H	α-helix	trans	-70.7	-37.2	173	-73	179.8	127.7	0	0	112.3	K59 K60 K66 K67	K59-E63 PolarHBondContact O-N 3.34Å; K59-E63 VanDerWaalsContact O-N 3.11Å; K60-E63 PolarHBondContact O-N 2.96Å; K60-E63 VanDerWaalsContact O-N 3.11Å; E63-K66 PolarHBondContact O-N 3.18Å; E63-K67 WeakPolarHBondContact O-CB 3.31Å; E63-K67 WeakPolarHBondContact O-CG 3.19Å; E63-K67 PolarHBondContact O-N 3.05Å
64	E	62.9	Low	61.3	Low	116 Å²	116	135 Å²	135	54%	0.542	61%	0.612	S	S	.	*	H	α-helix	trans	-67.8	-42.8	173.6	-73.7	-168.6	107.3	0	0	112.9	K60 R61 K66 K67 K68	K60-E64 PolarHBondContact O-N 3.26Å; R61-E64 PolarHBondContact O-N 3.2Å; E64-K66 VanDerWaalsContact C-N 3.34Å; E64-K67 PolarHBondContact O-N 2.69Å; E64-K68 WeakPolarHBondContact O-CB 3.37Å; E64-K68 PolarHBondContact O-N 2.68Å
65	E	64.1	Low	63.2	Low	134 Å²	134	137.6 Å²	137.6	63%	0.626	61%	0.608	S	S	*	*	H	α-helix	trans	-63.8	-39.9	173.8	-76.1	-168.8	132.5	0	0	111.6	R61 K68 K69	R61-E65 PolarHBondContact O-N 3.15Å; E65-K68 PolarHBondContact O-N 2.73Å; E65-K69 VanDerWaalsContact O-CB 3.32Å; E65-K69 WeakPolarHBondContact O-CB 3.36Å; E65-K69 PolarHBondContact O-N 3.3Å
66	K	67.3	Low	64.7	Low	128 Å²	128	133 Å²	133	56%	0.557	59%	0.588	S	S	*	*	H	α-helix	trans	-61.8	-48.2	174.8	-171.6	171.5	-171.8	-80.1	0	111.3	L62 E63 E64 K68 K69 E70	L62-K66 VanDerWaalsContact O-CB 3.27Å; L62-K66 WeakPolarHBondContact O-CB 3.36Å; L62-K66 PolarHBondContact O-N 3.27Å; E63-K66 PolarHBondContact O-N 3.18Å; E64-K66 VanDerWaalsContact C-N 3.34Å; K66-K68 PolarHBondContact O-N 2.92Å; K66-K69 PolarHBondContact O-N 3.4Å; K66-E70 WeakPolarHBondContact CE-OE1 3.48Å; K66-E70 IonicContact NZ-OE1 3.73Å; K66-E70 PolarHBondContact NZ-OE1 3.1Å; K66-E70 WeakPolarHBondContact O-CB 3.49Å; K66-E70 WeakPolarHBondContact O-CG 3.45Å; K66-E70 PolarHBondContact O-N 2.9Å
67	K	68.9	Low	65.8	Low	152 Å²	152	129.9 Å²	129.9	66%	0.661	57%	0.572	S	S	*	*	H	α-helix	trans	-60.6	-44.9	176.2	-78	-176.9	175.3	-175.7	0	112.7	E63 E64 K69 E70 E71	E63-K67 WeakPolarHBondContact O-CB 3.31Å; E63-K67 WeakPolarHBondContact O-CG 3.19Å; E63-K67 PolarHBondContact O-N 3.05Å; E64-K67 PolarHBondContact O-N 2.69Å; K67-K69 VanDerWaalsContact C-N 3.3Å; K67-K69 PolarHBondContact O-N 3.27Å; K67-E70 PolarHBondContact O-N 2.91Å; K67-E71 WeakPolarHBondContact O-CB 3.19Å; K67-E71 PolarHBondContact O-N 3.5Å
68	K	70.1	Confident	66.9	Low	144 Å²	144	129.7 Å²	129.7	63%	0.626	57%	0.571	S	S	*	*	H	α-helix	trans	-64.6	-33.6	176.2	-79.1	178.5	176	170.1	0	112.8	E64 E65 K66 K72	E64-K68 WeakPolarHBondContact O-CB 3.37Å; E64-K68 PolarHBondContact O-N 2.68Å; E65-K68 PolarHBondContact O-N 2.73Å; K66-K68 PolarHBondContact O-N 2.92Å; K68-K72 WeakPolarHBondContact O-CB 3.38Å; K68-K72 PolarHBondContact O-N 3.32Å; K68-K72 VanDerWaalsContact O-N 3.08Å
69	K	71.2	Confident	68.1	Low	154 Å²	154	128.2 Å²	128.2	67%	0.67	57%	0.567	S	S	*	*	H	α-helix	trans	-70.2	-45.4	174.4	-167.6	177	-179.7	-175.8	0	111.4	E65 K66 K67 K72 E73	E65-K69 VanDerWaalsContact O-CB 3.32Å; E65-K69 WeakPolarHBondContact O-CB 3.36Å; E65-K69 PolarHBondContact O-N 3.3Å; K66-K69 PolarHBondContact O-N 3.4Å; K67-K69 VanDerWaalsContact C-N 3.3Å; K67-K69 PolarHBondContact O-N 3.27Å; K69-K72 PolarHBondContact O-N 3.06Å; K69-E73 WeakPolarHBondContact O-CB 3.31Å; K69-E73 PolarHBondContact O-N 3.41Å
70	E	68.1	Low	69	Low	94 Å²	94	126.4 Å²	126.4	44%	0.439	56%	0.56	S	S	.	*	H	α-helix	trans	-61.4	-42.6	175.4	-73.3	168.3	171.7	0	0	111.9	K66 K67 E73 R74	K66-E70 WeakPolarHBondContact CE-OE1 3.48Å; K66-E70 IonicContact NZ-OE1 3.73Å; K66-E70 PolarHBondContact NZ-OE1 3.1Å; K66-E70 WeakPolarHBondContact O-CB 3.49Å; K66-E70 WeakPolarHBondContact O-CG 3.45Å; K66-E70 PolarHBondContact O-N 2.9Å; K67-E70 PolarHBondContact O-N 2.91Å; E70-E73 PolarHBondContact O-N 2.85Å; E70-R74 VanDerWaalsContact O-CB 3.32Å; E70-R74 WeakPolarHBondContact O-CB 3.36Å; E70-R74 PolarHBondContact O-N 3.34Å
71	E	71.1	Confident	69.9	Low	103 Å²	103	122.8 Å²	122.8	48%	0.481	54%	0.544	S	S	.	.	H	α-helix	trans	-62.9	-44.7	174.9	-166.4	-158.2	141.9	0	0	112	K67 R74 K75	K67-E71 WeakPolarHBondContact O-CB 3.19Å; K67-E71 PolarHBondContact O-N 3.5Å; E71-R74 PolarHBondContact O-N 2.85Å; E71-K75 PolarHBondContact O-N 3.15Å; E71-K75 IonicContact OE1-NZ 2.84Å; E71-K75 PolarHBondContact OE1-NZ 2.8Å
72	K	73.9	Confident	70.7	Confident	165 Å²	165	121.6 Å²	121.6	72%	0.717	55%	0.546	S	S	*	.	H	α-helix	trans	-68.4	-34.7	179	-167.4	172.9	-174.3	177.9	0	112.4	K68 K69 K76	K68-K72 WeakPolarHBondContact O-CB 3.38Å; K68-K72 PolarHBondContact O-N 3.32Å; K68-K72 VanDerWaalsContact O-N 3.08Å; K69-K72 PolarHBondContact O-N 3.06Å; K72-K76 PolarHBondContact O-N 3.09Å; K72-K76 VanDerWaalsContact O-N 3.1Å
73	E	71.8	Confident	71.6	Confident	97 Å²	97	122.9 Å²	122.9	45%	0.453	55%	0.547	S	S	.	.	H	α-helix	trans	-71.7	-33.4	174.2	-156.6	-171.2	127.5	0	0	111.8	K69 E70 K77	K69-E73 WeakPolarHBondContact O-CB 3.31Å; K69-E73 PolarHBondContact O-N 3.41Å; E70-E73 PolarHBondContact O-N 2.85Å; E73-K77 WeakPolarHBondContact O-CG 3.28Å; E73-K77 PolarHBondContact O-N 3.08Å; E73-K77 VanDerWaalsContact O-N 3.13Å; E73-K77 IonicContact OE1-NZ 2.78Å; E73-K77 PolarHBondContact OE1-NZ 2.95Å
74	R	73.2	Confident	72.4	Confident	183 Å²	183	120.6 Å²	120.6	69%	0.691	55%	0.546	S	S	*	.	H	α-helix	trans	-65.3	-49.4	173	-169.2	172.9	-178.7	173.3	0.3	111.2	E70 E71 K76 K77 E78	E70-R74 VanDerWaalsContact O-CB 3.32Å; E70-R74 WeakPolarHBondContact O-CB 3.36Å; E70-R74 PolarHBondContact O-N 3.34Å; E71-R74 PolarHBondContact O-N 2.85Å; R74-K76 PolarHBondContact O-N 3.4Å; R74-K77 WeakPolarHBondContact O-CB 3.32Å; R74-K77 PolarHBondContact O-N 3.16Å; R74-K77 VanDerWaalsContact O-N 3.13Å; R74-E78 PolarHBondContact O-N 2.79Å
75	K	76.8	Confident	73.1	Confident	110 Å²	110	116.9 Å²	116.9	48%	0.478	53%	0.529	S	S	.	.	H	α-helix	trans	-58	-42.5	174.8	-80	173	173.1	161	0	112.7	E71 K77 E78 E79	E71-K75 PolarHBondContact O-N 3.15Å; E71-K75 IonicContact OE1-NZ 2.84Å; E71-K75 PolarHBondContact OE1-NZ 2.8Å; K75-K77 VanDerWaalsContact C-N 3.33Å; K75-K77 PolarHBondContact O-N 3.42Å; K75-E78 WeakPolarHBondContact O-CA 3.41Å; K75-E78 VanDerWaalsContact O-CB 3.27Å; K75-E78 WeakPolarHBondContact O-CB 3.34Å; K75-E78 PolarHBondContact O-N 2.85Å; K75-E78 VanDerWaalsContact O-N 3.09Å; K75-E79 PolarHBondContact O-N 3.08Å
76	K	76.4	Confident	73.8	Confident	111 Å²	111	115.8 Å²	115.8	48%	0.483	52%	0.524	S	S	.	.	H	α-helix	trans	-62.5	-37.5	175.8	-173.7	172.2	-176.2	-72	0	112.9	K72 R74 E78 E80	K72-K76 PolarHBondContact O-N 3.09Å; K72-K76 VanDerWaalsContact O-N 3.1Å; R74-K76 PolarHBondContact O-N 3.4Å; K76-E78 VanDerWaalsContact C-N 3.3Å; K76-E80 IonicContact NZ-OE1 3.56Å; K76-E80 PolarHBondContact NZ-OE1 3.22Å; K76-E80 IonicContact NZ-OE2 3.44Å; K76-E80 WeakPolarHBondContact O-CB 3.31Å; K76-E80 VanDerWaalsContact O-CG 3.31Å; K76-E80 WeakPolarHBondContact O-CG 3.41Å; K76-E80 PolarHBondContact O-N 2.84Å
77	K	72.3	Confident	74.2	Confident	104 Å²	104	113.2 Å²	113.2	45%	0.452	52%	0.516	S	S	.	.	H	α-helix	trans	-69.4	-29.1	174.3	-76.2	163.6	173.5	162.3	0	112.5	E73 R74 K75 K81	E73-K77 WeakPolarHBondContact O-CG 3.28Å; E73-K77 PolarHBondContact O-N 3.08Å; E73-K77 VanDerWaalsContact O-N 3.13Å; E73-K77 IonicContact OE1-NZ 2.78Å; E73-K77 PolarHBondContact OE1-NZ 2.95Å; R74-K77 WeakPolarHBondContact O-CB 3.32Å; R74-K77 PolarHBondContact O-N 3.16Å; R74-K77 VanDerWaalsContact O-N 3.13Å; K75-K77 VanDerWaalsContact C-N 3.33Å; K75-K77 PolarHBondContact O-N 3.42Å; K77-K81 WeakPolarHBondContact O-CB 3.28Å; K77-K81 PolarHBondContact O-N 2.82Å
78	E	73.3	Confident	74.5	Confident	106 Å²	106	111.6 Å²	111.6	50%	0.495	51%	0.511	S	S	.	.	H	α-helix	trans	-71.5	-46.3	175.4	-143.9	151.2	-135.1	0	0	110.7	R74 K75 K76 K81 Q82	R74-E78 PolarHBondContact O-N 2.79Å; K75-E78 WeakPolarHBondContact O-CA 3.41Å; K75-E78 VanDerWaalsContact O-CB 3.27Å; K75-E78 WeakPolarHBondContact O-CB 3.34Å; K75-E78 PolarHBondContact O-N 2.85Å; K75-E78 VanDerWaalsContact O-N 3.09Å; K76-E78 VanDerWaalsContact C-N 3.3Å; E78-K81 PolarHBondContact O-N 2.83Å; E78-Q82 WeakPolarHBondContact O-CG 3.39Å; E78-Q82 PolarHBondContact O-N 3.17Å
79	E	76.2	Confident	75.1	Confident	129 Å²	129	110.4 Å²	110.4	60%	0.603	51%	0.506	S	S	*	.	H	α-helix	trans	-61	-44.2	171.1	-68.8	174.2	142.8	0	0	112.2	K75 K81 Q82 K83	K75-E79 PolarHBondContact O-N 3.08Å; E79-K81 VanDerWaalsContact C-N 3.33Å; E79-K81 PolarHBondContact O-N 3.46Å; E79-Q82 PolarHBondContact O-N 3.36Å; E79-K83 WeakPolarHBondContact O-CB 3.35Å; E79-K83 PolarHBondContact O-N 3.04Å
80	E	75.9	Confident	75.5	Confident	107 Å²	107	107.5 Å²	107.5	50%	0.5	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-35.7	176.4	-78.1	174.2	163.3	0	0	112.5	K76 A84	K76-E80 IonicContact NZ-OE1 3.56Å; K76-E80 PolarHBondContact NZ-OE1 3.22Å; K76-E80 IonicContact NZ-OE2 3.44Å; K76-E80 WeakPolarHBondContact O-CB 3.31Å; K76-E80 VanDerWaalsContact O-CG 3.31Å; K76-E80 WeakPolarHBondContact O-CG 3.41Å; K76-E80 PolarHBondContact O-N 2.84Å; E80-A84 WeakPolarHBondContact O-CB 3.19Å; E80-A84 PolarHBondContact O-N 3.28Å; E80-A84 VanDerWaalsContact O-N 3.11Å
81	K	76.2	Confident	76	Confident	76 Å²	76	108.9 Å²	108.9	33%	0.33	50%	0.498	S	S	.	.	H	α-helix	trans	-70	-48.3	174.9	-179.5	-179.7	175	-71.5	0	111.9	K77 E78 E79 K83 A84 E85 E1095 V1096	K77-K81 WeakPolarHBondContact O-CB 3.28Å; K77-K81 PolarHBondContact O-N 2.82Å; E78-K81 PolarHBondContact O-N 2.83Å; E79-K81 VanDerWaalsContact C-N 3.33Å; E79-K81 PolarHBondContact O-N 3.46Å; K81-K83 PolarHBondContact O-N 3.34Å; K81-A84 WeakPolarHBondContact O-CB 3.19Å; K81-A84 PolarHBondContact O-N 2.9Å; K81-E85 IonicContact NZ-OE2 2.88Å; K81-E85 PolarHBondContact NZ-OE2 3.29Å; K81-E85 PolarHBondContact O-N 3.25Å; K81-E1095 WeakPolarHBondContact CE-OE1 3.19Å; K81-E1095 WeakPolarHBondContact CE-OE2 3.41Å; K81-E1095 IonicContact NZ-OE1 3.66Å; K81-E1095 IonicContact NZ-OE2 2.81Å; K81-E1095 PolarHBondContact NZ-OE2 3.05Å; K81-V1096 VanDerWaalsContact CE-CG2 3.47Å
82	Q	75.2	Confident	76.3	Confident	128 Å²	128	108.9 Å²	108.9	60%	0.598	50%	0.498	S	S	*	.	H	α-helix	trans	-57.8	-41	178	-76	179.3	-12.7	0	0	111.3	E78 E79 E85 E86	E78-Q82 WeakPolarHBondContact O-CG 3.39Å; E78-Q82 PolarHBondContact O-N 3.17Å; E79-Q82 PolarHBondContact O-N 3.36Å; Q82-E85 PolarHBondContact O-N 3.1Å; Q82-E86 WeakPolarHBondContact O-CB 3.32Å; Q82-E86 PolarHBondContact O-N 3.2Å
83	K	78.2	Confident	76.6	Confident	130 Å²	130	106 Å²	106	57%	0.565	49%	0.487	S	S	*	.	H	α-helix	trans	-65.4	-38.3	174.9	-170.1	175.4	179.6	-174.5	0	112.7	E79 K81 E86 D87	E79-K83 WeakPolarHBondContact O-CB 3.35Å; E79-K83 PolarHBondContact O-N 3.04Å; K81-K83 PolarHBondContact O-N 3.34Å; K83-E86 PolarHBondContact O-N 2.99Å; K83-D87 WeakPolarHBondContact CE-OD2 3.5Å; K83-D87 WeakPolarHBondContact O-CB 3.41Å; K83-D87 PolarHBondContact O-N 3.22Å
84	A	76.6	Confident	77	Confident	61 Å²	61	106.9 Å²	106.9	50%	0.504	49%	0.491	S	S	.	.	H	α-helix	trans	-64.6	-40.4	175.4	0	0	0	0	0	112.4	E80 K81 Q88	E80-A84 WeakPolarHBondContact O-CB 3.19Å; E80-A84 PolarHBondContact O-N 3.28Å; E80-A84 VanDerWaalsContact O-N 3.11Å; K81-A84 WeakPolarHBondContact O-CB 3.19Å; K81-A84 PolarHBondContact O-N 2.9Å; A84-Q88 VanDerWaalsContact O-CB 3.28Å; A84-Q88 WeakPolarHBondContact O-CB 3.44Å; A84-Q88 PolarHBondContact O-N 3.23Å
85	E	78.2	Confident	77.2	Confident	38 Å²	38	102.1 Å²	102.1	18%	0.178	48%	0.477	C	S	.	.	H	α-helix	trans	-63.4	-40.9	171.7	-76.7	-177.4	74.1	0	0	112.4	K81 Q82 Q88 K89 N1094	K81-E85 IonicContact NZ-OE2 2.88Å; K81-E85 PolarHBondContact NZ-OE2 3.29Å; K81-E85 PolarHBondContact O-N 3.25Å; Q82-E85 PolarHBondContact O-N 3.1Å; E85-Q88 PolarHBondContact O-N 3.01Å; E85-K89 WeakPolarHBondContact O-CB 3.34Å; E85-K89 WeakPolarHBondContact O-CG 3.42Å; E85-K89 PolarHBondContact O-N 3.47Å; E85-N1094 PolarHBondContact OE1-ND2 3.09Å
86	E	79.1	Confident	77.4	Confident	112 Å²	112	102.6 Å²	102.6	52%	0.523	48%	0.479	S	S	.	.	H	α-helix	trans	-67.8	-42.7	179.7	-157.3	-159.6	132.5	0	0	111.9	Q82 K83 K89 K90	Q82-E86 WeakPolarHBondContact O-CB 3.32Å; Q82-E86 PolarHBondContact O-N 3.2Å; K83-E86 PolarHBondContact O-N 2.99Å; E86-K89 PolarHBondContact O-N 2.8Å; E86-K90 WeakPolarHBondContact O-CG 3.43Å; E86-K90 PolarHBondContact O-N 3.03Å; E86-K90 VanDerWaalsContact O-N 3.09Å; E86-K90 WeakPolarHBondContact OE1-CE 3.31Å; E86-K90 IonicContact OE1-NZ 2.71Å; E86-K90 PolarHBondContact OE1-NZ 3.14Å
87	D	76.8	Confident	77.6	Confident	74 Å²	74	102.7 Å²	102.7	40%	0.396	48%	0.479	S	S	.	.	H	α-helix	trans	-72.7	-30.8	177.5	-69.5	-18.9	0	0	0	111.7	K83 K90 K91	K83-D87 WeakPolarHBondContact CE-OD2 3.5Å; K83-D87 WeakPolarHBondContact O-CB 3.41Å; K83-D87 PolarHBondContact O-N 3.22Å; D87-K90 IonicContact OD1-NZ 2.63Å; D87-K90 PolarHBondContact OD1-NZ 2.98Å; D87-K91 PolarHBondContact O-N 2.87Å
88	Q	75.1	Confident	77.9	Confident	118 Å²	118	103 Å²	103	55%	0.551	48%	0.482	S	S	*	.	H	α-helix	trans	-67.5	-46	169.9	-179	171.9	-27	0	0	111.8	A84 E85 K90 K91 E92	A84-Q88 VanDerWaalsContact O-CB 3.28Å; A84-Q88 WeakPolarHBondContact O-CB 3.44Å; A84-Q88 PolarHBondContact O-N 3.23Å; E85-Q88 PolarHBondContact O-N 3.01Å; Q88-K90 VanDerWaalsContact C-N 3.32Å; Q88-K90 PolarHBondContact O-N 3.46Å; Q88-K91 WeakPolarHBondContact O-CB 3.29Å; Q88-K91 PolarHBondContact O-N 2.83Å; Q88-E92 HydrophobicContact CG-CG 4.47Å; Q88-E92 WeakPolarHBondContact CG-OE1 3.48Å; Q88-E92 PolarHBondContact NE2-OE1 3.43Å; Q88-E92 PolarHBondContact O-N 3.38Å
89	K	81.3	Confident	78.1	Confident	119 Å²	119	104.3 Å²	104.3	52%	0.517	49%	0.488	S	S	.	.	H	α-helix	trans	-60.7	-39.2	177.8	-79.5	173.1	177.2	167.3	0	112.4	E85 E86 K91 E92 E93	E85-K89 WeakPolarHBondContact O-CB 3.34Å; E85-K89 WeakPolarHBondContact O-CG 3.42Å; E85-K89 PolarHBondContact O-N 3.47Å; E86-K89 PolarHBondContact O-N 2.8Å; K89-K91 VanDerWaalsContact C-N 3.33Å; K89-K91 PolarHBondContact O-N 3.13Å; K89-E92 PolarHBondContact O-N 2.99Å; K89-E93 WeakPolarHBondContact O-CB 3.28Å; K89-E93 PolarHBondContact O-N 2.92Å
90	K	81.1	Confident	78.4	Confident	93 Å²	93	103.1 Å²	103.1	40%	0.404	48%	0.483	S	S	.	.	H	α-helix	trans	-60.3	-41.7	171.9	-70.8	165.7	-159.1	154.5	0	112.1	E86 D87 Q88 E93 E94	E86-K90 WeakPolarHBondContact O-CG 3.43Å; E86-K90 PolarHBondContact O-N 3.03Å; E86-K90 VanDerWaalsContact O-N 3.09Å; E86-K90 WeakPolarHBondContact OE1-CE 3.31Å; E86-K90 IonicContact OE1-NZ 2.71Å; E86-K90 PolarHBondContact OE1-NZ 3.14Å; D87-K90 IonicContact OD1-NZ 2.63Å; D87-K90 PolarHBondContact OD1-NZ 2.98Å; Q88-K90 VanDerWaalsContact C-N 3.32Å; Q88-K90 PolarHBondContact O-N 3.46Å; K90-E93 PolarHBondContact O-N 2.62Å; K90-E94 WeakPolarHBondContact O-CB 3.46Å; K90-E94 PolarHBondContact O-N 3.1Å
91	K	77.9	Confident	78.7	Confident	122 Å²	122	103.1 Å²	103.1	53%	0.53	48%	0.483	S	S	.	.	H	α-helix	trans	-67.7	-40	179	-162.7	177.6	-175.7	-92.5	0	112.1	D87 Q88 K89 E94 E95	D87-K91 PolarHBondContact O-N 2.87Å; Q88-K91 WeakPolarHBondContact O-CB 3.29Å; Q88-K91 PolarHBondContact O-N 2.83Å; K89-K91 VanDerWaalsContact C-N 3.33Å; K89-K91 PolarHBondContact O-N 3.13Å; K91-E94 PolarHBondContact O-N 3.18Å; K91-E95 IonicContact NZ-OE1 3.35Å; K91-E95 PolarHBondContact NZ-OE1 3.28Å; K91-E95 WeakPolarHBondContact O-CB 3.36Å; K91-E95 WeakPolarHBondContact O-CG 3.13Å; K91-E95 PolarHBondContact O-N 3.47Å
92	E	77.2	Confident	78.8	Confident	103 Å²	103	104.9 Å²	104.9	48%	0.481	50%	0.495	S	S	.	.	H	α-helix	trans	-65.1	-38.4	173.8	-70.4	172.6	-169.3	0	0	111.7	Q88 K89 K96	Q88-E92 HydrophobicContact CG-CG 4.47Å; Q88-E92 WeakPolarHBondContact CG-OE1 3.48Å; Q88-E92 PolarHBondContact NE2-OE1 3.43Å; Q88-E92 PolarHBondContact O-N 3.38Å; K89-E92 PolarHBondContact O-N 2.99Å; E92-K96 VanDerWaalsContact O-CB 3.32Å; E92-K96 WeakPolarHBondContact O-CB 3.33Å; E92-K96 PolarHBondContact O-N 3.45Å
93	E	80.6	Confident	79.1	Confident	106 Å²	106	104.4 Å²	104.4	50%	0.495	49%	0.493	S	S	.	.	H	α-helix	trans	-67.8	-36.7	173.5	-162.4	-169.4	145.1	0	0	112.4	K89 K90 K97	K89-E93 WeakPolarHBondContact O-CB 3.28Å; K89-E93 PolarHBondContact O-N 2.92Å; K90-E93 PolarHBondContact O-N 2.62Å; E93-K97 WeakPolarHBondContact O-CG 3.08Å; E93-K97 PolarHBondContact O-N 2.97Å; E93-K97 VanDerWaalsContact OE1-CE 3.3Å; E93-K97 WeakPolarHBondContact OE1-CE 3.32Å; E93-K97 IonicContact OE1-NZ 2.63Å; E93-K97 PolarHBondContact OE1-NZ 3.37Å
94	E	78.9	Confident	79.5	Confident	114 Å²	114	103.8 Å²	103.8	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-71.3	-44.3	176.6	-172.3	171.2	-156.5	0	0	112.1	K90 K91 K96 K97 Q98	K90-E94 WeakPolarHBondContact O-CB 3.46Å; K90-E94 PolarHBondContact O-N 3.1Å; K91-E94 PolarHBondContact O-N 3.18Å; E94-K96 VanDerWaalsContact C-N 3.3Å; E94-K96 PolarHBondContact O-N 2.94Å; E94-K97 PolarHBondContact O-N 3.37Å; E94-Q98 WeakPolarHBondContact O-CG 3.12Å; E94-Q98 PolarHBondContact O-N 2.94Å
95	E	77.1	Confident	79.8	Confident	83 Å²	83	105.8 Å²	105.8	39%	0.388	49%	0.487	S	S	.	.	H	α-helix	trans	-61.5	-38.3	172.9	-74.6	179.3	-160.2	0	0	111.4	K91 Q98 Q99	K91-E95 IonicContact NZ-OE1 3.35Å; K91-E95 PolarHBondContact NZ-OE1 3.28Å; K91-E95 WeakPolarHBondContact O-CB 3.36Å; K91-E95 WeakPolarHBondContact O-CG 3.13Å; K91-E95 PolarHBondContact O-N 3.47Å; E95-Q98 PolarHBondContact O-N 3Å; E95-Q99 WeakPolarHBondContact O-CG 3.43Å; E95-Q99 PolarHBondContact O-N 3.15Å
96	K	81.5	Confident	79.9	Confident	121 Å²	121	109 Å²	109	53%	0.526	51%	0.505	S	S	.	.	H	α-helix	trans	-64.6	-44	174.2	-171.2	172.7	-172.5	-82.8	0	112.3	E92 E94 Q98 Q99 E100	E92-K96 VanDerWaalsContact O-CB 3.32Å; E92-K96 WeakPolarHBondContact O-CB 3.33Å; E92-K96 PolarHBondContact O-N 3.45Å; E94-K96 VanDerWaalsContact C-N 3.3Å; E94-K96 PolarHBondContact O-N 2.94Å; K96-Q98 VanDerWaalsContact C-N 3.33Å; K96-Q98 PolarHBondContact O-N 2.78Å; K96-Q99 PolarHBondContact O-N 3.36Å; K96-E100 IonicContact NZ-OE1 3.82Å; K96-E100 PolarHBondContact NZ-OE1 3.33Å; K96-E100 WeakPolarHBondContact O-CG 3.35Å; K96-E100 PolarHBondContact O-N 3.09Å
97	K	81.7	Confident	80.2	Confident	112 Å²	112	108.8 Å²	108.8	49%	0.487	50%	0.504	S	S	.	.	H	α-helix	trans	-62.4	-39	174.8	-76.1	168	-175.7	166.7	0	112.3	E93 E94 Q99 E100 E101	E93-K97 WeakPolarHBondContact O-CG 3.08Å; E93-K97 PolarHBondContact O-N 2.97Å; E93-K97 VanDerWaalsContact OE1-CE 3.3Å; E93-K97 WeakPolarHBondContact OE1-CE 3.32Å; E93-K97 IonicContact OE1-NZ 2.63Å; E93-K97 PolarHBondContact OE1-NZ 3.37Å; E94-K97 PolarHBondContact O-N 3.37Å; K97-Q99 VanDerWaalsContact C-N 3.35Å; K97-E100 PolarHBondContact O-N 3.45Å; K97-E101 WeakPolarHBondContact O-CB 3.34Å; K97-E101 PolarHBondContact O-N 2.95Å
98	Q	78.3	Confident	80.6	Confident	112 Å²	112	110.4 Å²	110.4	52%	0.523	51%	0.509	S	S	.	.	H	α-helix	trans	-64.5	-38.1	174.6	-71.2	176.6	25.1	0	0	112	E94 E95 K96 L102	E94-Q98 WeakPolarHBondContact O-CG 3.12Å; E94-Q98 PolarHBondContact O-N 2.94Å; E95-Q98 PolarHBondContact O-N 3Å; K96-Q98 VanDerWaalsContact C-N 3.33Å; K96-Q98 PolarHBondContact O-N 2.78Å; Q98-L102 VanDerWaalsContact O-CB 3.31Å; Q98-L102 WeakPolarHBondContact O-CB 3.22Å; Q98-L102 PolarHBondContact O-N 2.99Å
99	Q	76.5	Confident	80.8	Confident	133 Å²	133	108.6 Å²	108.6	62%	0.621	50%	0.504	S	S	*	.	H	α-helix	trans	-67.2	-44.2	174.1	-71.2	174.4	25.3	0	0	112.3	E95 K96 K97 E101 L102 Q103	E95-Q99 WeakPolarHBondContact O-CG 3.43Å; E95-Q99 PolarHBondContact O-N 3.15Å; K96-Q99 PolarHBondContact O-N 3.36Å; K97-Q99 VanDerWaalsContact C-N 3.35Å; Q99-E101 PolarHBondContact O-N 3.22Å; Q99-L102 PolarHBondContact O-N 3.32Å; Q99-Q103 WeakPolarHBondContact O-CB 3.36Å; Q99-Q103 PolarHBondContact O-N 3.01Å
100	E	82.5	Confident	80.8	Confident	103 Å²	103	108.3 Å²	108.3	48%	0.481	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-40.1	175.6	-71.8	172.7	-172.6	0	0	111.8	K96 K97 K104	K96-E100 IonicContact NZ-OE1 3.82Å; K96-E100 PolarHBondContact NZ-OE1 3.33Å; K96-E100 WeakPolarHBondContact O-CG 3.35Å; K96-E100 PolarHBondContact O-N 3.09Å; K97-E100 PolarHBondContact O-N 3.45Å; E100-K104 WeakPolarHBondContact O-CB 3.4Å; E100-K104 PolarHBondContact O-N 3.03Å
101	E	82.1	Confident	81.1	Confident	107 Å²	107	105.6 Å²	105.6	50%	0.5	50%	0.499	S	S	.	.	H	α-helix	trans	-69.1	-37.8	175.1	-164.4	-171.5	145.3	0	0	112.5	K97 Q99 K105	K97-E101 WeakPolarHBondContact O-CB 3.34Å; K97-E101 PolarHBondContact O-N 2.95Å; Q99-E101 PolarHBondContact O-N 3.22Å; E101-K105 WeakPolarHBondContact O-CG 3.44Å; E101-K105 PolarHBondContact O-N 3.28Å; E101-K105 WeakPolarHBondContact OE1-CE 3.4Å; E101-K105 IonicContact OE1-NZ 2.65Å; E101-K105 PolarHBondContact OE1-NZ 2.7Å
102	L	79.9	Confident	81.5	Confident	114 Å²	114	104.9 Å²	104.9	60%	0.597	50%	0.496	S	S	*	.	H	α-helix	trans	-67.1	-44.2	176.8	-162.6	89.8	0	0	0	111.5	Q98 Q99 K105 L106	Q98-L102 VanDerWaalsContact O-CB 3.31Å; Q98-L102 WeakPolarHBondContact O-CB 3.22Å; Q98-L102 PolarHBondContact O-N 2.99Å; Q99-L102 PolarHBondContact O-N 3.32Å; L102-K105 PolarHBondContact O-N 3.04Å; L102-L106 PolarHBondContact O-N 2.95Å; L102-L106 VanDerWaalsContact O-N 3.12Å
103	Q	80.3	Confident	81.8	Confident	117 Å²	117	106.6 Å²	106.6	55%	0.547	50%	0.498	S	S	.	.	H	α-helix	trans	-62.3	-45.5	176.1	-177.8	176.2	-28.9	0	0	110.8	Q99 K105 L106 E107	Q99-Q103 WeakPolarHBondContact O-CB 3.36Å; Q99-Q103 PolarHBondContact O-N 3.01Å; Q103-K105 VanDerWaalsContact C-N 3.27Å; Q103-K105 PolarHBondContact O-N 3.04Å; Q103-L106 WeakPolarHBondContact O-CB 3.47Å; Q103-L106 PolarHBondContact O-N 2.94Å; Q103-E107 WeakPolarHBondContact CG-OE1 3.41Å; Q103-E107 PolarHBondContact NE2-OE1 3.24Å; Q103-E107 PolarHBondContact O-N 2.86Å
104	K	86.4	Confident	81.9	Confident	117 Å²	117	106.4 Å²	106.4	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-59.8	-35.6	176.7	-173.2	169.8	-176	-75.2	0	112.9	E100 E107 E108	E100-K104 WeakPolarHBondContact O-CB 3.4Å; E100-K104 PolarHBondContact O-N 3.03Å; K104-E107 PolarHBondContact O-N 3.2Å; K104-E108 IonicContact NZ-OE1 3.41Å; K104-E108 PolarHBondContact NZ-OE1 2.91Å; K104-E108 WeakPolarHBondContact O-CB 3.3Å; K104-E108 WeakPolarHBondContact O-CG 3.39Å; K104-E108 PolarHBondContact O-N 3.32Å
105	K	83.9	Confident	82.3	Confident	103 Å²	103	109.4 Å²	109.4	45%	0.448	50%	0.503	S	S	.	.	H	α-helix	trans	-66.9	-38.4	173.5	-75.8	169	-174.3	165.4	0	112.8	E101 L102 Q103 E108 D109	E101-K105 WeakPolarHBondContact O-CG 3.44Å; E101-K105 PolarHBondContact O-N 3.28Å; E101-K105 WeakPolarHBondContact OE1-CE 3.4Å; E101-K105 IonicContact OE1-NZ 2.65Å; E101-K105 PolarHBondContact OE1-NZ 2.7Å; L102-K105 PolarHBondContact O-N 3.04Å; Q103-K105 VanDerWaalsContact C-N 3.27Å; Q103-K105 PolarHBondContact O-N 3.04Å; K105-E108 PolarHBondContact O-N 3.45Å; K105-D109 WeakPolarHBondContact O-CB 3.42Å; K105-D109 PolarHBondContact O-N 3.36Å
106	L	81	Confident	82.7	Confident	105 Å²	105	110.7 Å²	110.7	55%	0.55	51%	0.51	S	S	.	.	H	α-helix	trans	-64.4	-43.7	174.8	-68.7	168.2	0	0	0	111.3	L102 Q103 D109 E110	L102-L106 PolarHBondContact O-N 2.95Å; L102-L106 VanDerWaalsContact O-N 3.12Å; Q103-L106 WeakPolarHBondContact O-CB 3.47Å; Q103-L106 PolarHBondContact O-N 2.94Å; L106-D109 PolarHBondContact O-N 2.79Å; L106-E110 WeakPolarHBondContact O-CB 3.31Å; L106-E110 PolarHBondContact O-N 2.96Å
107	E	83.9	Confident	82.8	Confident	108 Å²	108	111.4 Å²	111.4	51%	0.505	52%	0.515	S	S	.	.	H	α-helix	trans	-63.4	-39.5	175.2	-68.3	170.7	-167.1	0	0	112	Q103 K104 A111	Q103-E107 WeakPolarHBondContact CG-OE1 3.41Å; Q103-E107 PolarHBondContact NE2-OE1 3.24Å; Q103-E107 PolarHBondContact O-N 2.86Å; K104-E107 PolarHBondContact O-N 3.2Å; E107-A111 VanDerWaalsContact O-CB 3.3Å; E107-A111 WeakPolarHBondContact O-CB 3.41Å; E107-A111 PolarHBondContact O-N 3.01Å
108	E	84.7	Confident	83	Confident	108 Å²	108	112.8 Å²	112.8	51%	0.505	52%	0.523	S	S	.	.	H	α-helix	trans	-67.4	-39.7	174.4	-76.8	176.7	-167.7	0	0	112.9	K104 K105 K112	K104-E108 IonicContact NZ-OE1 3.41Å; K104-E108 PolarHBondContact NZ-OE1 2.91Å; K104-E108 WeakPolarHBondContact O-CB 3.3Å; K104-E108 WeakPolarHBondContact O-CG 3.39Å; K104-E108 PolarHBondContact O-N 3.32Å; K105-E108 PolarHBondContact O-N 3.45Å; E108-K112 VanDerWaalsContact O-CB 3.24Å; E108-K112 WeakPolarHBondContact O-CB 3.39Å; E108-K112 PolarHBondContact O-N 3.33Å
109	D	80.6	Confident	83.5	Confident	81 Å²	81	110.3 Å²	110.3	43%	0.433	52%	0.522	S	S	.	.	H	α-helix	trans	-71.9	-28.6	176.1	-96.2	-17.6	0	0	0	113.5	K105 L106 R113	K105-D109 WeakPolarHBondContact O-CB 3.42Å; K105-D109 PolarHBondContact O-N 3.36Å; L106-D109 PolarHBondContact O-N 2.79Å; D109-R113 PolarHBondContact O-N 3.16Å; D109-R113 PolarHBondContact O-NE 2.91Å
110	E	81.6	Confident	84	Confident	113 Å²	113	106.8 Å²	106.8	53%	0.528	52%	0.515	S	S	.	.	H	α-helix	trans	-75.2	-47.8	173.3	-172.5	171.7	178.3	0	0	111	L106 K112 R113 Q114	L106-E110 WeakPolarHBondContact O-CB 3.31Å; L106-E110 PolarHBondContact O-N 2.96Å; E110-K112 PolarHBondContact O-N 3.28Å; E110-R113 PolarHBondContact O-N 3.2Å; E110-R113 VanDerWaalsContact O-N 3.1Å; E110-Q114 WeakPolarHBondContact O-CG 3.39Å; E110-Q114 PolarHBondContact O-N 2.92Å
111	A	86.8	Confident	84.2	Confident	35 Å²	35	106.6 Å²	106.6	29%	0.289	52%	0.517	S	S	.	.	H	α-helix	trans	-61.3	-29	173.9	0	0	0	0	0	112.7	E107 R115	E107-A111 VanDerWaalsContact O-CB 3.3Å; E107-A111 WeakPolarHBondContact O-CB 3.41Å; E107-A111 PolarHBondContact O-N 3.01Å; A111-R115 WeakPolarHBondContact O-CG 3.42Å; A111-R115 PolarHBondContact O-N 2.88Å
112	K	86.4	Confident	84.5	Confident	107 Å²	107	106.5 Å²	106.5	47%	0.465	52%	0.519	S	S	.	.	H	α-helix	trans	-68.3	-48.1	171.2	-179.4	-175.5	165.1	-165.1	0	111.8	E108 E110 Q114 R115 E116	E108-K112 VanDerWaalsContact O-CB 3.24Å; E108-K112 WeakPolarHBondContact O-CB 3.39Å; E108-K112 PolarHBondContact O-N 3.33Å; E110-K112 PolarHBondContact O-N 3.28Å; K112-Q114 PolarHBondContact O-N 3.13Å; K112-R115 PolarHBondContact O-N 3.15Å; K112-E116 WeakPolarHBondContact CE-OE1 3.43Å; K112-E116 IonicContact NZ-OE1 2.72Å; K112-E116 PolarHBondContact O-N 2.98Å
113	R	82.7	Confident	85	Confident	139 Å²	139	106.8 Å²	106.8	53%	0.525	52%	0.516	S	S	.	.	H	α-helix	trans	-58.3	-45.5	177.3	-83.9	177.2	-97.9	-173.4	-9	112.2	D109 E110 R115 E116 E117	D109-R113 PolarHBondContact O-N 3.16Å; D109-R113 PolarHBondContact O-NE 2.91Å; E110-R113 PolarHBondContact O-N 3.2Å; E110-R113 VanDerWaalsContact O-N 3.1Å; R113-R115 VanDerWaalsContact C-N 3.3Å; R113-R115 PolarHBondContact O-N 3.28Å; R113-E116 PolarHBondContact O-N 3.34Å; R113-E116 VanDerWaalsContact O-N 3.08Å; R113-E117 PolarHBondContact O-N 3Å
114	Q	84.2	Confident	85.5	Confident	103 Å²	103	105 Å²	105	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-56.9	-42.6	176.8	-68.7	172.9	6.1	0	0	112	E110 K112 E117 E118	E110-Q114 WeakPolarHBondContact O-CG 3.39Å; E110-Q114 PolarHBondContact O-N 2.92Å; K112-Q114 PolarHBondContact O-N 3.13Å; Q114-E117 PolarHBondContact O-N 3.36Å; Q114-E118 WeakPolarHBondContact O-CG 3.36Å; Q114-E118 PolarHBondContact O-N 3.29Å
115	R	86.9	Confident	85.6	Confident	176 Å²	176	104 Å²	104	66%	0.664	50%	0.503	S	S	*	.	H	α-helix	trans	-67.6	-35.1	175.4	-69.4	171.5	-172.9	166.2	6.7	113.5	A111 K112 R113 A119	A111-R115 WeakPolarHBondContact O-CG 3.42Å; A111-R115 PolarHBondContact O-N 2.88Å; K112-R115 PolarHBondContact O-N 3.15Å; R113-R115 VanDerWaalsContact C-N 3.3Å; R113-R115 PolarHBondContact O-N 3.28Å; R115-A119 VanDerWaalsContact O-CB 3.25Å; R115-A119 WeakPolarHBondContact O-CB 3.37Å; R115-A119 PolarHBondContact O-N 3.32Å
116	E	85.1	Confident	86	Confident	111 Å²	111	104.9 Å²	104.9	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-69.1	-37.1	176.3	-72.5	175.6	177.5	0	0	111.1	K112 R113 A120	K112-E116 WeakPolarHBondContact CE-OE1 3.43Å; K112-E116 IonicContact NZ-OE1 2.72Å; K112-E116 PolarHBondContact O-N 2.98Å; R113-E116 PolarHBondContact O-N 3.34Å; R113-E116 VanDerWaalsContact O-N 3.08Å; E116-A120 WeakPolarHBondContact O-CB 3.26Å; E116-A120 PolarHBondContact O-N 3.18Å
117	E	84.5	Confident	86.5	Confident	136 Å²	136	104 Å²	104	64%	0.636	50%	0.502	S	S	*	.	H	α-helix	trans	-68.8	-45.4	173	-71	177	-170.6	0	0	112.6	R113 Q114 A119 A120 L121	R113-E117 PolarHBondContact O-N 3Å; Q114-E117 PolarHBondContact O-N 3.36Å; E117-A119 VanDerWaalsContact C-N 3.35Å; E117-A119 PolarHBondContact O-N 2.75Å; E117-A120 PolarHBondContact O-N 3.17Å; E117-L121 WeakPolarHBondContact O-CB 3.21Å; E117-L121 PolarHBondContact O-N 2.91Å
118	E	85.7	Confident	86.9	Confident	141 Å²	141	99.1 Å²	99.1	66%	0.659	48%	0.48	S	S	*	.	H	α-helix	trans	-58.4	-45	173.7	-77	-175.5	155.3	0	0	111.8	Q114 L121 L122	Q114-E118 WeakPolarHBondContact O-CG 3.36Å; Q114-E118 PolarHBondContact O-N 3.29Å; E118-L121 PolarHBondContact O-N 3.01Å; E118-L122 WeakPolarHBondContact O-CB 3.33Å; E118-L122 PolarHBondContact O-N 3.3Å
119	A	88.4	Confident	87.2	Confident	60 Å²	60	98 Å²	98	50%	0.496	48%	0.475	S	S	.	.	H	α-helix	trans	-65.9	-37.5	178	0	0	0	0	0	112.4	R115 E117 K123	R115-A119 VanDerWaalsContact O-CB 3.25Å; R115-A119 WeakPolarHBondContact O-CB 3.37Å; R115-A119 PolarHBondContact O-N 3.32Å; E117-A119 VanDerWaalsContact C-N 3.35Å; E117-A119 PolarHBondContact O-N 2.75Å; A119-K123 WeakPolarHBondContact O-CB 3.48Å; A119-K123 PolarHBondContact O-N 3.49Å
120	A	86.2	Confident	87.9	Confident	58 Å²	58	99.5 Å²	99.5	48%	0.479	48%	0.479	S	S	.	.	H	α-helix	trans	-64.9	-43.7	174.8	0	0	0	0	0	111.8	E116 E117 K123 E124	E116-A120 WeakPolarHBondContact O-CB 3.26Å; E116-A120 PolarHBondContact O-N 3.18Å; E117-A120 PolarHBondContact O-N 3.17Å; A120-K123 PolarHBondContact O-N 3.03Å; A120-E124 WeakPolarHBondContact O-CB 3.37Å; A120-E124 PolarHBondContact O-N 3.37Å
121	L	86.9	Confident	88.4	Confident	100 Å²	100	96.8 Å²	96.8	52%	0.524	47%	0.468	S	S	.	.	H	α-helix	trans	-69	-38	179.4	-169	151.1	0	0	0	112.1	E117 E118 E124 K125	E117-L121 WeakPolarHBondContact O-CB 3.21Å; E117-L121 PolarHBondContact O-N 2.91Å; E118-L121 PolarHBondContact O-N 3.01Å; L121-E124 PolarHBondContact O-N 3.2Å; L121-K125 WeakPolarHBondContact O-CB 3.44Å; L121-K125 PolarHBondContact O-N 2.97Å; L121-K125 VanDerWaalsContact O-N 3.09Å
122	L	89.4	Confident	88.8	Confident	105 Å²	105	97.1 Å²	97.1	55%	0.55	46%	0.464	S	S	.	.	H	α-helix	trans	-59.1	-49	171.7	-172.3	75.6	0	0	0	110.8	E118 E124 K125 E126	E118-L122 WeakPolarHBondContact O-CB 3.33Å; E118-L122 PolarHBondContact O-N 3.3Å; L122-E124 PolarHBondContact O-N 3.16Å; L122-K125 WeakPolarHBondContact O-CB 3.48Å; L122-K125 PolarHBondContact O-N 3.48Å; L122-E126 PolarHBondContact O-N 2.86Å
123	K	90	Very high	89.2	Confident	119 Å²	119	97.4 Å²	97.4	52%	0.517	47%	0.467	S	S	.	.	H	α-helix	trans	-63.6	-40.7	179.5	-177.7	174.2	178.4	-75.9	0	112.8	A119 A120 K125 E126 E127	A119-K123 WeakPolarHBondContact O-CB 3.48Å; A119-K123 PolarHBondContact O-N 3.49Å; A120-K123 PolarHBondContact O-N 3.03Å; K123-K125 VanDerWaalsContact C-N 3.28Å; K123-K125 PolarHBondContact O-N 3.41Å; K123-E126 PolarHBondContact O-N 3.13Å; K123-E127 IonicContact NZ-OE1 2.62Å; K123-E127 PolarHBondContact NZ-OE1 3.34Å; K123-E127 WeakPolarHBondContact O-CG 3.26Å; K123-E127 PolarHBondContact O-N 2.93Å
124	E	89.7	Confident	89.7	Confident	81 Å²	81	95.2 Å²	95.2	38%	0.379	46%	0.462	S	S	.	.	H	α-helix	trans	-60.6	-39.6	174.9	-169.1	-167.1	171.5	0	0	111.5	A120 L121 L122 E127 G128 K334 F335	A120-E124 WeakPolarHBondContact O-CB 3.37Å; A120-E124 PolarHBondContact O-N 3.37Å; L121-E124 PolarHBondContact O-N 3.2Å; L122-E124 PolarHBondContact O-N 3.16Å; E124-E127 PolarHBondContact O-N 3.43Å; E124-G128 PolarHBondContact O-N 2.96Å; E124-K334 IonicContact OE1-NZ 2.71Å; E124-K334 PolarHBondContact OE1-NZ 2.91Å; E124-K334 IonicContact OE2-NZ 3.22Å; E124-K334 PolarHBondContact OE2-NZ 2.96Å; E124-F335 HydrophobicContact CB-CZ 4.47Å; E124-F335 HydrophobicContact CG-CE2 4.48Å; E124-F335 HydrophobicContact CG-CZ 4.09Å
125	K	89.8	Confident	90.2	Very high	95 Å²	95	90.8 Å²	90.8	41%	0.413	44%	0.443	S	S	.	.	H	α-helix	trans	-67.9	-40.3	175.8	-176.9	176.9	176.8	-178.3	0	112.3	L121 L122 K123 G128 H129 F335	L121-K125 WeakPolarHBondContact O-CB 3.44Å; L121-K125 PolarHBondContact O-N 2.97Å; L121-K125 VanDerWaalsContact O-N 3.09Å; L122-K125 WeakPolarHBondContact O-CB 3.48Å; L122-K125 PolarHBondContact O-N 3.48Å; K123-K125 VanDerWaalsContact C-N 3.28Å; K123-K125 PolarHBondContact O-N 3.41Å; K125-G128 PolarHBondContact O-N 3.32Å; K125-H129 WeakPolarHBondContact CE-NE2 3.41Å; K125-H129 PolarHBondContact O-CD2 3.17Å; K125-H129 PolarHBondContact O-N 3.25Å; K125-F335 HydrophobicContact CB-CD1 4.33Å; K125-F335 HydrophobicContact CB-CE1 3.78Å; K125-F335 HydrophobicContact CB-CZ 3.94Å; K125-F335 HydrophobicContact CG-CD1 4.08Å; K125-F335 HydrophobicContact CG-CE1 4.05Å
126	E	92.2	Very high	90.6	Very high	121 Å²	121	86.3 Å²	86.3	57%	0.565	43%	0.426	S	S	*	.	H	α-helix	trans	-62.1	-46.3	173.3	-71.7	179.7	166.8	0	0	111.7	L122 K123 G128 H129 Q130	L122-E126 PolarHBondContact O-N 2.86Å; K123-E126 PolarHBondContact O-N 3.13Å; E126-G128 VanDerWaalsContact C-N 3.31Å; E126-G128 PolarHBondContact O-N 3.17Å; E126-H129 PolarHBondContact O-N 2.97Å; E126-Q130 PolarHBondContact O-N 3.37Å
127	E	91.4	Very high	91	Very high	88 Å²	88	86.6 Å²	86.6	41%	0.411	43%	0.428	S	S	.	.	H	α-helix	trans	-60	-39.6	174.1	-74.4	-177.4	-152.4	0	0	112.1	K123 E124 Q130 L131	K123-E127 IonicContact NZ-OE1 2.62Å; K123-E127 PolarHBondContact NZ-OE1 3.34Å; K123-E127 WeakPolarHBondContact O-CG 3.26Å; K123-E127 PolarHBondContact O-N 2.93Å; E124-E127 PolarHBondContact O-N 3.43Å; E127-Q130 PolarHBondContact O-N 3.01Å; E127-L131 WeakPolarHBondContact O-CB 3.45Å; E127-L131 PolarHBondContact O-N 3.49Å
128	G	91.6	Very high	91.4	Very high	5 Å²	5	83.9 Å²	83.9	5%	0.052	41%	0.412	C	S	.	.	H	α-helix	trans	-64	-43.6	175.1	0	0	0	0	0	113.6	E124 K125 E126 L131 H132	E124-G128 PolarHBondContact O-N 2.96Å; K125-G128 PolarHBondContact O-N 3.32Å; E126-G128 VanDerWaalsContact C-N 3.31Å; E126-G128 PolarHBondContact O-N 3.17Å; G128-L131 PolarHBondContact O-N 2.88Å; G128-H132 PolarHBondContact O-N 3.45Å; G128-H132 VanDerWaalsContact O-N 3.12Å
129	H	92.1	Very high	91.8	Very high	85 Å²	85	77.7 Å²	77.7	39%	0.394	38%	0.383	S	S	.	.	H	α-helix	trans	-67.4	-39.4	174.9	-78.2	-65.6	0	0	0	112.4	K125 E126 H132 Q133	K125-H129 WeakPolarHBondContact CE-NE2 3.41Å; K125-H129 PolarHBondContact O-CD2 3.17Å; K125-H129 PolarHBondContact O-N 3.25Å; E126-H129 PolarHBondContact O-N 2.97Å; H129-H132 WeakPolarHBondContact O-CB 3.48Å; H129-H132 PolarHBondContact O-N 3.42Å; H129-Q133 PolarHBondContact O-N 2.85Å
130	Q	94	Very high	92.1	Very high	111 Å²	111	79.4 Å²	79.4	52%	0.519	38%	0.381	S	S	.	.	H	α-helix	trans	-62.4	-45.3	174.8	-177.8	-179.7	-17.8	0	0	111.2	E126 E127 H132 Q133 E134	E126-Q130 PolarHBondContact O-N 3.37Å; E127-Q130 PolarHBondContact O-N 3.01Å; Q130-H132 VanDerWaalsContact C-N 3.25Å; Q130-H132 PolarHBondContact O-N 2.86Å; Q130-Q133 PolarHBondContact O-N 3.21Å; Q130-E134 HydrophobicContact CG-CG 4.4Å; Q130-E134 PolarHBondContact NE2-OE1 3.07Å; Q130-E134 PolarHBondContact O-N 3.49Å
131	L	93.3	Very high	92.4	Very high	56 Å²	56	78.2 Å²	78.2	29%	0.293	37%	0.374	S	S	.	.	H	α-helix	trans	-60	-36.4	177.5	-176.3	63.4	0	0	0	112.2	E127 G128 A135 R327 V328 F339	E127-L131 WeakPolarHBondContact O-CB 3.45Å; E127-L131 PolarHBondContact O-N 3.49Å; G128-L131 PolarHBondContact O-N 2.88Å; L131-A135 WeakPolarHBondContact O-CB 3.36Å; L131-A135 PolarHBondContact O-N 2.91Å; L131-A135 VanDerWaalsContact O-N 3.16Å; L131-R327 HydrophobicContact CD2-CB 4.16Å; L131-V328 HydrophobicContact CD2-CG2 4Å; L131-V328 HydrophobicContact CG-CG2 4.43Å; L131-F339 HydrophobicContact CD2-CZ 4.49Å; L131-F339 HydrophobicContact CG-CE1 4.11Å; L131-F339 HydrophobicContact CG-CZ 4.34Å
132	H	94.9	Very high	92.8	Very high	43 Å²	43	74 Å²	74	20%	0.199	35%	0.351	C	S	.	.	H	α-helix	trans	-66.4	-45.9	174.7	178.4	-95.9	0	0	0	112.6	G128 H129 Q130 A135 W136 L337 A338 F339	G128-H132 PolarHBondContact O-N 3.45Å; G128-H132 VanDerWaalsContact O-N 3.12Å; H129-H132 WeakPolarHBondContact O-CB 3.48Å; H129-H132 PolarHBondContact O-N 3.42Å; Q130-H132 VanDerWaalsContact C-N 3.25Å; Q130-H132 PolarHBondContact O-N 2.86Å; H132-A135 PolarHBondContact O-N 3.15Å; H132-W136 AromaticContact CD2-CD1 3.98Å; H132-W136 AromaticContact CE1-CD1 3.5Å; H132-W136 AromaticContact CE1-NE1 3.73Å; H132-W136 AromaticContact NE2-CD1 3.48Å; H132-W136 AromaticContact NE2-NE1 3.36Å; H132-W136 PolarHBondContact NE2-NE1 3.22Å; H132-W136 PolarHBondContact O-N 2.97Å; H132-W136 VanDerWaalsContact O-N 3.12Å; H132-L337 HydrophobicContact CB-CD1 4.18Å; H132-A338 PolarHBondContact CD2-O 3.07Å; H132-A338 PolarHBondContact NE2-O 3Å; H132-F339 VanDerWaalsContact CA-CE1 3.46Å; H132-F339 HydrophobicContact CB-CE1 4.01Å; H132-F339 HydrophobicContact CB-CE2 4.45Å; H132-F339 HydrophobicContact CB-CZ 3.88Å
133	Q	94.9	Very high	93.1	Very high	113 Å²	113	73 Å²	73	53%	0.528	34%	0.343	S	S	.	.	H	α-helix	trans	-62.1	-50.2	175.6	-178.9	176.5	-13.8	0	0	111.7	H129 Q130 A135 W136 E137	H129-Q133 PolarHBondContact O-N 2.85Å; Q130-Q133 PolarHBondContact O-N 3.21Å; Q133-A135 PolarHBondContact O-N 2.9Å; Q133-W136 PolarHBondContact O-N 2.95Å; Q133-W136 VanDerWaalsContact O-N 3.12Å; Q133-E137 HydrophobicContact CG-CG 4.29Å; Q133-E137 WeakPolarHBondContact CG-OE1 3.42Å; Q133-E137 PolarHBondContact NE2-OE1 3.13Å; Q133-E137 WeakPolarHBondContact O-CG 3.46Å; Q133-E137 PolarHBondContact O-N 3.36Å
134	E	93.3	Very high	93.3	Very high	93 Å²	93	72.4 Å²	72.4	44%	0.435	34%	0.342	S	S	.	.	H	α-helix	trans	-60.4	-29.4	179.1	-74.7	-174.6	-159.3	0	0	112.9	Q130 R138	Q130-E134 HydrophobicContact CG-CG 4.4Å; Q130-E134 PolarHBondContact NE2-OE1 3.07Å; Q130-E134 PolarHBondContact O-N 3.49Å; E134-R138 WeakPolarHBondContact O-CB 3.18Å; E134-R138 PolarHBondContact O-N 3.12Å; E134-R138 PolarHBondContact O-NH1 3.21Å
135	A	93.6	Very high	93.6	Very high	10 Å²	10	69.8 Å²	69.8	8%	0.083	33%	0.33	C	S	.	.	H	α-helix	trans	-71.2	-47.8	173.3	0	0	0	0	0	111.9	L131 H132 Q133 R138 H139 F339 P340	L131-A135 WeakPolarHBondContact O-CB 3.36Å; L131-A135 PolarHBondContact O-N 2.91Å; L131-A135 VanDerWaalsContact O-N 3.16Å; H132-A135 PolarHBondContact O-N 3.15Å; Q133-A135 PolarHBondContact O-N 2.9Å; A135-R138 PolarHBondContact O-N 2.93Å; A135-H139 WeakPolarHBondContact O-CB 3.4Å; A135-H139 PolarHBondContact O-N 2.9Å; A135-F339 HydrophobicContact CB-CD1 3.86Å; A135-F339 HydrophobicContact CB-CE1 4.23Å; A135-P340 HydrophobicContact CB-CG 4Å
136	W	94.7	Very high	93.9	Very high	81 Å²	81	66.4 Å²	66.4	31%	0.307	32%	0.315	S	S	.	.	H	α-helix	trans	-66.7	-43	-179.9	-88.7	105.8	0	0	0	113.3	H132 Q133 R138 H139 Q140 A338 P340	H132-W136 AromaticContact CD2-CD1 3.98Å; H132-W136 AromaticContact CE1-CD1 3.5Å; H132-W136 AromaticContact CE1-NE1 3.73Å; H132-W136 AromaticContact NE2-CD1 3.48Å; H132-W136 AromaticContact NE2-NE1 3.36Å; H132-W136 PolarHBondContact NE2-NE1 3.22Å; H132-W136 PolarHBondContact O-N 2.97Å; H132-W136 VanDerWaalsContact O-N 3.12Å; Q133-W136 PolarHBondContact O-N 2.95Å; Q133-W136 VanDerWaalsContact O-N 3.12Å; W136-R138 VanDerWaalsContact C-N 3.33Å; W136-R138 PolarHBondContact O-N 3.39Å; W136-H139 PolarHBondContact O-N 3.1Å; W136-Q140 HydrophobicContact CE3-CG 4.27Å; W136-Q140 WeakPolarHBondContact O-CG 3.45Å; W136-Q140 PolarHBondContact O-N 3.35Å; W136-A338 PolarHBondContact NE1-O 3.38Å; W136-P340 HydrophobicContact CB-CG 4.45Å; W136-P340 HydrophobicContact CD2-CB 4.31Å; W136-P340 HydrophobicContact CD2-CG 3.72Å; W136-P340 HydrophobicContact CE3-CB 4.33Å; W136-P340 HydrophobicContact CE3-CG 4.12Å; W136-P340 HydrophobicContact CG-CG 3.86Å; W136-P340 HydrophobicContact CH2-CB 4.4Å; W136-P340 HydrophobicContact CZ2-CB 4.36Å; W136-P340 HydrophobicContact CZ2-CG 4.41Å; W136-P340 HydrophobicContact CZ3-CB 4.37Å
137	E	93.9	Very high	94	Very high	118 Å²	118	63.7 Å²	63.7	55%	0.551	31%	0.309	S	S	*	.	H	α-helix	trans	-59.6	-44.2	175.3	-71.3	-179.1	-175.4	0	0	111.5	Q133 G141	Q133-E137 HydrophobicContact CG-CG 4.29Å; Q133-E137 WeakPolarHBondContact CG-OE1 3.42Å; Q133-E137 PolarHBondContact NE2-OE1 3.13Å; Q133-E137 WeakPolarHBondContact O-CG 3.46Å; Q133-E137 PolarHBondContact O-N 3.36Å; E137-G141 PolarHBondContact O-N 3.35Å
138	R	93.3	Very high	94.2	Very high	78 Å²	78	64 Å²	64	29%	0.294	31%	0.306	S	S	.	.	H	α-helix	trans	-63.5	-47.5	177.1	-177.3	170	71.8	-102.7	9.9	112.1	E134 A135 W136 R142 D318	E134-R138 WeakPolarHBondContact O-CB 3.18Å; E134-R138 PolarHBondContact O-N 3.12Å; E134-R138 PolarHBondContact O-NH1 3.21Å; A135-R138 PolarHBondContact O-N 2.93Å; W136-R138 VanDerWaalsContact C-N 3.33Å; W136-R138 PolarHBondContact O-N 3.39Å; R138-R142 WeakPolarHBondContact O-CB 3.23Å; R138-R142 WeakPolarHBondContact O-CD 3.25Å; R138-R142 WeakPolarHBondContact O-CG 3.44Å; R138-R142 PolarHBondContact O-N 3.12Å; R138-R142 VanDerWaalsContact O-N 3.09Å; R138-D318 IonicContact CZ-OD2 2.72Å; R138-D318 IonicContact NE-OD2 3.66Å; R138-D318 PolarHBondContact NE-OD2 3.17Å; R138-D318 IonicContact NH2-OD2 3.73Å; R138-D318 PolarHBondContact NH2-OD2 3.27Å
139	H	94.4	Very high	94.5	Very high	11 Å²	11	63.9 Å²	63.9	5%	0.051	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-49.4	178.5	175.8	98.5	0	0	0	111.6	A135 W136 R142 K143 P340 P341	A135-H139 WeakPolarHBondContact O-CB 3.4Å; A135-H139 PolarHBondContact O-N 2.9Å; W136-H139 PolarHBondContact O-N 3.1Å; H139-R142 PolarHBondContact O-N 3.18Å; H139-K143 VanDerWaalsContact O-CB 3.32Å; H139-K143 WeakPolarHBondContact O-CB 3.47Å; H139-K143 PolarHBondContact O-N 2.88Å; H139-P340 HydrophobicContact CB-CB 3.74Å; H139-P340 HydrophobicContact CB-CG 3.95Å; H139-P341 PolarHBondContact CE1-O 2.71Å; H139-P341 VanDerWaalsContact CE1-O 3.27Å; H139-P341 PolarHBondContact ND1-O 3.33Å
140	Q	93.8	Very high	94.6	Very high	97 Å²	97	64.9 Å²	64.9	45%	0.453	31%	0.309	S	S	.	.	H	α-helix	trans	-65.3	-46.2	-178	-66.1	-66.2	-1.9	0	0	112	W136 R142 K143 E144	W136-Q140 HydrophobicContact CE3-CG 4.27Å; W136-Q140 WeakPolarHBondContact O-CG 3.45Å; W136-Q140 PolarHBondContact O-N 3.35Å; Q140-R142 VanDerWaalsContact C-N 3.29Å; Q140-R142 PolarHBondContact O-N 2.95Å; Q140-K143 PolarHBondContact O-N 3.44Å; Q140-E144 WeakPolarHBondContact O-CB 3.44Å; Q140-E144 PolarHBondContact O-N 2.82Å
141	G	93.8	Very high	94.6	Very high	33 Å²	33	64.1 Å²	64.1	34%	0.34	31%	0.309	S	S	.	.	H	α-helix	trans	-60.8	-36.4	177.7	0	0	0	0	0	113.2	E137 L145	E137-G141 PolarHBondContact O-N 3.35Å; G141-L145 WeakPolarHBondContact O-CB 3.27Å; G141-L145 WeakPolarHBondContact O-CG 3.24Å; G141-L145 PolarHBondContact O-N 3.32Å; G141-L145 VanDerWaalsContact O-N 3.16Å
142	R	95.8	Very high	94.6	Very high	10 Å²	10	61.5 Å²	61.5	4%	0.038	30%	0.295	C	S	.	.	H	α-helix	trans	-66.8	-48.1	173.2	-76.9	169	162.9	175.8	6.1	112.5	R138 H139 Q140 E144 L145 R146 E272 I275 H315 D318 D319 I344	R138-R142 WeakPolarHBondContact O-CB 3.23Å; R138-R142 WeakPolarHBondContact O-CD 3.25Å; R138-R142 WeakPolarHBondContact O-CG 3.44Å; R138-R142 PolarHBondContact O-N 3.12Å; R138-R142 VanDerWaalsContact O-N 3.09Å; H139-R142 PolarHBondContact O-N 3.18Å; Q140-R142 VanDerWaalsContact C-N 3.29Å; Q140-R142 PolarHBondContact O-N 2.95Å; R142-E144 PolarHBondContact O-N 2.85Å; R142-L145 PolarHBondContact O-N 3.07Å; R142-R146 VanDerWaalsContact O-CB 3.31Å; R142-R146 WeakPolarHBondContact O-CB 3.18Å; R142-R146 PolarHBondContact O-N 3.31Å; R142-E272 IonicContact CZ-OE2 3.78Å; R142-E272 IonicContact NE-OE2 3.89Å; R142-E272 PolarHBondContact NE-OE2 2.65Å; R142-E272 VanDerWaalsContact NE-OE2 3.07Å; R142-E272 VanDerWaalsContact NH2-CD 3.32Å; R142-E272 IonicContact NH2-OE1 3.85Å; R142-E272 PolarHBondContact NH2-OE1 2.9Å; R142-E272 IonicContact NH2-OE2 2.8Å; R142-E272 PolarHBondContact NH2-OE2 2.71Å; R142-I275 HydrophobicContact CB-CG2 3.93Å; R142-I275 HydrophobicContact CG-CG2 3.7Å; R142-H315 PolarHBondContact NH2-O 2.73Å; R142-D318 IonicContact CZ-OD1 3.8Å; R142-D318 IonicContact NH1-OD1 2.68Å; R142-D318 PolarHBondContact NH1-OD1 3.1Å; R142-D318 IonicContact NH1-OD2 2.7Å; R142-D318 PolarHBondContact NH1-OD2 2.97Å; R142-D319 VanDerWaalsContact CD-OD2 3.3Å; R142-D319 WeakPolarHBondContact CD-OD2 3.44Å; R142-D319 IonicContact CZ-OD2 2.68Å; R142-D319 IonicContact NE-OD2 3.59Å; R142-D319 IonicContact NH1-OD2 3.26Å; R142-D319 PolarHBondContact NH1-OD2 3Å; R142-I344 HydrophobicContact CB-CD1 3.71Å
143	K	94.6	Very high	94.3	Very high	86 Å²	86	67 Å²	67	37%	0.374	32%	0.321	S	S	.	.	H	α-helix	trans	-62.7	-41.5	-178.8	-171	166	177.8	170.9	0	111.8	H139 Q140 S147 E343	H139-K143 VanDerWaalsContact O-CB 3.32Å; H139-K143 WeakPolarHBondContact O-CB 3.47Å; H139-K143 PolarHBondContact O-N 2.88Å; Q140-K143 PolarHBondContact O-N 3.44Å; K143-S147 PolarHBondContact O-N 3.3Å; K143-S147 VanDerWaalsContact O-N 3.1Å; K143-E343 WeakPolarHBondContact CE-OE2 3.33Å; K143-E343 IonicContact NZ-OE1 3.71Å; K143-E343 IonicContact NZ-OE2 2.71Å; K143-E343 PolarHBondContact NZ-OE2 3.16Å
144	E	95	Very high	93.9	Very high	106 Å²	106	70.3 Å²	70.3	50%	0.495	34%	0.336	S	S	.	.	H	α-helix	trans	-65.9	-47.7	176	-160.1	-139.4	125.3	0	0	112.1	Q140 R142 S147 R148	Q140-E144 WeakPolarHBondContact O-CB 3.44Å; Q140-E144 PolarHBondContact O-N 2.82Å; R142-E144 PolarHBondContact O-N 2.85Å; E144-S147 PolarHBondContact O-N 3.46Å; E144-R148 PolarHBondContact O-N 2.89Å; E144-R148 IonicContact OE1-CZ 3.5Å; E144-R148 IonicContact OE1-NE 3.77Å; E144-R148 PolarHBondContact OE1-NE 2.69Å; E144-R148 IonicContact OE1-NH2 3.88Å; E144-R148 PolarHBondContact OE1-NH2 2.77Å
145	L	95.3	Very high	93.6	Very high	26 Å²	26	69.5 Å²	69.5	14%	0.136	35%	0.346	C	S	.	.	H	α-helix	trans	-64.8	-39	176.5	-76.5	171	0	0	0	112.5	G141 R142 R148 N149 V276	G141-L145 WeakPolarHBondContact O-CB 3.27Å; G141-L145 WeakPolarHBondContact O-CG 3.24Å; G141-L145 PolarHBondContact O-N 3.32Å; G141-L145 VanDerWaalsContact O-N 3.16Å; R142-L145 PolarHBondContact O-N 3.07Å; L145-R148 PolarHBondContact O-N 3.47Å; L145-N149 VanDerWaalsContact O-CB 3.28Å; L145-N149 WeakPolarHBondContact O-CB 3.49Å; L145-N149 VanDerWaalsContact O-CG 3.29Å; L145-N149 PolarHBondContact O-N 3.41Å; L145-N149 PolarHBondContact O-ND2 2.94Å; L145-V276 HydrophobicContact CB-CB 3.93Å; L145-V276 HydrophobicContact CB-CG1 3.87Å; L145-V276 HydrophobicContact CD1-CG1 4.12Å
146	R	96.1	Very high	93.5	Very high	24 Å²	24	72 Å²	72	9%	0.091	35%	0.353	C	S	.	.	H	α-helix	trans	-60.2	-46.6	176	-171.2	176.6	-174.5	76.1	-7.3	111.3	R142 N149 Q150 T274 I275 V276 D281 I344	R142-R146 VanDerWaalsContact O-CB 3.31Å; R142-R146 WeakPolarHBondContact O-CB 3.18Å; R142-R146 PolarHBondContact O-N 3.31Å; R146-N149 PolarHBondContact O-N 2.77Å; R146-Q150 HydrophobicContact CG-CG 4.38Å; R146-Q150 WeakPolarHBondContact O-CB 3.44Å; R146-Q150 VanDerWaalsContact O-CG 3.31Å; R146-Q150 WeakPolarHBondContact O-CG 3.33Å; R146-Q150 PolarHBondContact O-N 2.78Å; R146-T274 PolarHBondContact NH1-O 2.86Å; R146-I275 VanDerWaalsContact CD-O 3.28Å; R146-I275 WeakPolarHBondContact CD-O 3.49Å; R146-I275 PolarHBondContact NH1-O 2.98Å; R146-V276 WeakPolarHBondContact CA-O 3.36Å; R146-D281 IonicContact CZ-OD1 2.6Å; R146-D281 IonicContact NH1-OD1 3.12Å; R146-D281 IonicContact NH2-OD1 2.69Å; R146-D281 PolarHBondContact NH2-OD1 2.67Å; R146-D281 IonicContact NH2-OD2 2.68Å; R146-I344 PolarHBondContact NH2-O 3.32Å; R146-I344 VanDerWaalsContact NH2-O 3.08Å
147	S	95	Very high	93.3	Very high	63 Å²	63	70.2 Å²	70.2	44%	0.441	35%	0.352	S	S	.	.	H	α-helix	trans	-57.9	-49.7	174.5	-178.5	0	0	0	0	111.9	K143 E144 N149 Q150 N151	K143-S147 PolarHBondContact O-N 3.3Å; K143-S147 VanDerWaalsContact O-N 3.1Å; E144-S147 PolarHBondContact O-N 3.46Å; S147-N149 PolarHBondContact O-N 2.89Å; S147-Q150 PolarHBondContact O-N 3.31Å; S147-N151 WeakPolarHBondContact O-CB 3.49Å; S147-N151 PolarHBondContact O-N 3.5Å
148	R	95.6	Very high	93.1	Very high	96 Å²	96	72.1 Å²	72.1	36%	0.362	36%	0.361	S	S	.	.	H	α-helix	trans	-64.7	-34.3	178.5	-70.9	-163.7	-83.6	122.3	-9	113.8	E144 L145 A152	E144-R148 PolarHBondContact O-N 2.89Å; E144-R148 IonicContact OE1-CZ 3.5Å; E144-R148 IonicContact OE1-NE 3.77Å; E144-R148 PolarHBondContact OE1-NE 2.69Å; E144-R148 IonicContact OE1-NH2 3.88Å; E144-R148 PolarHBondContact OE1-NH2 2.77Å; L145-R148 PolarHBondContact O-N 3.47Å; R148-A152 PolarHBondContact O-N 3.09Å
149	N	96.4	Very high	92.7	Very high	2 Å²	2	76.7 Å²	76.7	1%	0.011	39%	0.386	C	S	.	.	H	α-helix	trans	-80.5	-31.9	179.5	-75.3	-24.4	0	0	0	113.2	L145 R146 S147 A152 S228 H231 Q232 V276	L145-N149 VanDerWaalsContact O-CB 3.28Å; L145-N149 WeakPolarHBondContact O-CB 3.49Å; L145-N149 VanDerWaalsContact O-CG 3.29Å; L145-N149 PolarHBondContact O-N 3.41Å; L145-N149 PolarHBondContact O-ND2 2.94Å; R146-N149 PolarHBondContact O-N 2.77Å; S147-N149 PolarHBondContact O-N 2.89Å; N149-A152 WeakPolarHBondContact O-CB 3.38Å; N149-S228 PolarHBondContact ND2-OG 3.44Å; N149-S228 WeakPolarHBondContact OD1-CB 3.46Å; N149-H231 PolarHBondContact O-CD2 3.19Å; N149-H231 PolarHBondContact O-NE2 3.1Å; N149-Q232 PolarHBondContact OD1-NE2 2.95Å; N149-V276 WeakPolarHBondContact CB-O 3.3Å; N149-V276 PolarHBondContact ND2-O 2.92Å
150	Q	94.1	Very high	92.4	Very high	106 Å²	106	78.8 Å²	78.8	50%	0.495	41%	0.405	S	S	.	.	H	α-helix	trans	-72.8	-42.6	174.8	-72.9	177.4	-25.5	0	0	111.1	R146 S147 A152	R146-Q150 HydrophobicContact CG-CG 4.38Å; R146-Q150 WeakPolarHBondContact O-CB 3.44Å; R146-Q150 VanDerWaalsContact O-CG 3.31Å; R146-Q150 WeakPolarHBondContact O-CG 3.33Å; R146-Q150 PolarHBondContact O-N 2.78Å; S147-Q150 PolarHBondContact O-N 3.31Å; Q150-A152 PolarHBondContact O-N 3.45Å
151	N	94.4	Very high	92.4	Very high	95 Å²	95	77.8 Å²	77.8	51%	0.508	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	1.4	176.6	-63.6	-1.2	0	0	0	113.4	S147 Q153 E154 A155	S147-N151 WeakPolarHBondContact O-CB 3.49Å; S147-N151 PolarHBondContact O-N 3.5Å; N151-Q153 PolarHBondContact O-N 2.97Å; N151-Q153 VanDerWaalsContact O-N 3.11Å; N151-E154 PolarHBondContact O-N 3.43Å; N151-A155 PolarHBondContact O-N 3.43Å
152	A	93.3	Very high	92.3	Very high	1 Å²	1	77.6 Å²	77.6	1%	0.008	39%	0.389	C	S	.	.	H	α-helix	trans	-57	-28.5	-177.6	0	0	0	0	0	113.9	R148 N149 Q150 E154 A155 R156 Q232	R148-A152 PolarHBondContact O-N 3.09Å; N149-A152 WeakPolarHBondContact O-CB 3.38Å; Q150-A152 PolarHBondContact O-N 3.45Å; A152-E154 VanDerWaalsContact C-N 3.33Å; A152-E154 PolarHBondContact O-N 3.48Å; A152-A155 PolarHBondContact O-N 3.2Å; A152-R156 WeakPolarHBondContact O-CD 3.33Å; A152-R156 WeakPolarHBondContact O-CG 3.43Å; A152-R156 PolarHBondContact O-N 2.84Å; A152-Q232 HydrophobicContact CB-CG 4.2Å
153	Q	89	Confident	92.1	Very high	159 Å²	159	81.7 Å²	81.7	74%	0.743	42%	0.419	S	S	*	.	H	α-helix	trans	-66.1	-34.2	-179.5	-178.2	164.6	-36	0	0	112.9	N151	N151-Q153 PolarHBondContact O-N 2.97Å; N151-Q153 VanDerWaalsContact O-N 3.11Å
154	E	86.8	Confident	91.9	Very high	181 Å²	181	87.5 Å²	87.5	85%	0.846	44%	0.439	S	S	*	.	H	α-helix	trans	-86.4	-25.9	179	-59.1	-175.8	164.5	0	0	112.2	N151 A152	N151-E154 PolarHBondContact O-N 3.43Å; A152-E154 VanDerWaalsContact C-N 3.33Å; A152-E154 PolarHBondContact O-N 3.48Å
155	A	86.2	Confident	91.9	Very high	77 Å²	77	83.7 Å²	83.7	64%	0.636	42%	0.422	S	S	*	.	H	α-helix	trans	-92.1	0.9	-177.2	0	0	0	0	0	114.9	N151 A152	N151-A155 PolarHBondContact O-N 3.43Å; A152-A155 PolarHBondContact O-N 3.2Å
156	R	92.3	Very high	91.8	Very high	63 Å²	63	84.9 Å²	84.9	24%	0.238	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-70	135.7	-178.7	-91	157.8	-170.5	159.8	3.7	111.7	A152 H231 Q232	A152-R156 WeakPolarHBondContact O-CD 3.33Å; A152-R156 WeakPolarHBondContact O-CG 3.43Å; A152-R156 PolarHBondContact O-N 2.84Å; R156-H231 PolarHBondContact NE-O 2.92Å; R156-H231 VanDerWaalsContact NE-O 3.15Å; R156-H231 PolarHBondContact NH2-ND1 3.26Å; R156-H231 PolarHBondContact NH2-O 2.97Å; R156-Q232 VanDerWaalsContact CG-O 3.31Å; R156-Q232 WeakPolarHBondContact CG-O 3.45Å
157	P	91.3	Very high	91.7	Very high	43 Å²	43	87.1 Å²	87.1	28%	0.279	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-78.2	150.1	-177.5	32	-35.4	0	0	0	113	F161 F162 R233	P157-F161 HydrophobicContact CB-CB 3.78Å; P157-F161 HydrophobicContact CB-CD1 3.55Å; P157-F161 HydrophobicContact CB-CD2 4.37Å; P157-F161 HydrophobicContact CB-CE1 4.16Å; P157-F161 HydrophobicContact CB-CG 3.66Å; P157-F161 HydrophobicContact CG-CD1 3.48Å; P157-F161 VanDerWaalsContact CG-CD1 3.48Å; P157-F161 HydrophobicContact CG-CE1 3.75Å; P157-F161 HydrophobicContact CG-CG 4.15Å; P157-F162 HydrophobicContact CG-CE2 3.99Å; P157-F162 HydrophobicContact CG-CZ 3.89Å; P157-F162 WeakPolarHBondContact O-CE2 3.42Å; P157-R233 HydrophobicContact CG-CG 4.42Å
158	E	88.4	Confident	91.6	Very high	158 Å²	158	86.2 Å²	86.2	74%	0.738	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-76.5	168.8	177	-59.4	-179	166.2	0	0	113.5	A160 F161 F162	E158-A160 PolarHBondContact O-N 2.94Å; E158-F161 VanDerWaalsContact O-CB 3.31Å; E158-F161 WeakPolarHBondContact O-CB 3.21Å; E158-F161 PolarHBondContact O-N 2.96Å; E158-F162 WeakPolarHBondContact O-CD2 3.29Å
159	E	85.2	Confident	91.5	Very high	174 Å²	174	87.1 Å²	87.1	81%	0.813	45%	0.453	S	S	*	.	H	α-helix	trans	-52.5	-32.5	179.6	-63.4	-163.7	143.9	0	0	114.2	F161 F162 S163	E159-F161 PolarHBondContact O-N 3.28Å; E159-F162 PolarHBondContact O-N 2.67Å; E159-F162 VanDerWaalsContact O-N 3.1Å; E159-S163 PolarHBondContact O-N 2.84Å
160	A	88.2	Confident	91.4	Very high	55 Å²	55	96 Å²	96	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-65	-15.2	178.6	0	0	0	0	0	114.5	E158 S163 R164	E158-A160 PolarHBondContact O-N 2.94Å; A160-S163 PolarHBondContact O-OG 3.4Å; A160-R164 PolarHBondContact O-NE 3.01Å; A160-R164 VanDerWaalsContact O-NE 3.15Å
161	F	93.2	Very high	91.3	Very high	75 Å²	75	96.2 Å²	96.2	33%	0.329	49%	0.49	S	S	.	.	H	α-helix	trans	-81.8	-48	169.2	172.7	-101.9	0	0	0	111	P157 E158 E159 S163 R164 L165	P157-F161 HydrophobicContact CB-CB 3.78Å; P157-F161 HydrophobicContact CB-CD1 3.55Å; P157-F161 HydrophobicContact CB-CD2 4.37Å; P157-F161 HydrophobicContact CB-CE1 4.16Å; P157-F161 HydrophobicContact CB-CG 3.66Å; P157-F161 HydrophobicContact CG-CD1 3.48Å; P157-F161 VanDerWaalsContact CG-CD1 3.48Å; P157-F161 HydrophobicContact CG-CE1 3.75Å; P157-F161 HydrophobicContact CG-CG 4.15Å; E158-F161 VanDerWaalsContact O-CB 3.31Å; E158-F161 WeakPolarHBondContact O-CB 3.21Å; E158-F161 PolarHBondContact O-N 2.96Å; E159-F161 PolarHBondContact O-N 3.28Å; F161-S163 VanDerWaalsContact C-N 3.27Å; F161-S163 PolarHBondContact O-N 3.23Å; F161-R164 WeakPolarHBondContact O-CB 3.43Å; F161-R164 PolarHBondContact O-N 3.41Å; F161-L165 HydrophobicContact CD1-CD1 4.06Å; F161-L165 HydrophobicContact CE1-CD1 3.59Å; F161-L165 HydrophobicContact CZ-CD1 4.07Å
162	F	93	Very high	91.3	Very high	29 Å²	29	91.7 Å²	91.7	13%	0.127	47%	0.466	C	S	.	.	H	α-helix	trans	-64.2	-28.1	-176.1	-69.7	-72	0	0	0	114	P157 E158 E159 R164 L165 N198 R233 Y234	P157-F162 HydrophobicContact CG-CE2 3.99Å; P157-F162 HydrophobicContact CG-CZ 3.89Å; P157-F162 WeakPolarHBondContact O-CE2 3.42Å; E158-F162 WeakPolarHBondContact O-CD2 3.29Å; E159-F162 PolarHBondContact O-N 2.67Å; E159-F162 VanDerWaalsContact O-N 3.1Å; F162-R164 PolarHBondContact O-N 2.71Å; F162-L165 HydrophobicContact CD1-CD1 4.3Å; F162-L165 PolarHBondContact O-N 3.28Å; F162-N198 PolarHBondContact O-ND2 2.59Å; F162-R233 HydrophobicContact CE1-CG 3.74Å; F162-R233 HydrophobicContact CZ-CG 3.84Å; F162-Y234 HydrophobicContact CD1-CE1 4.24Å; F162-Y234 HydrophobicContact CE1-CD1 4.06Å; F162-Y234 AromaticContact CE1-CE1 3.42Å; F162-Y234 HydrophobicContact CE1-CE1 3.42Å; F162-Y234 VanDerWaalsContact CE1-CE1 3.42Å; F162-Y234 HydrophobicContact CZ-CD1 4.28Å; F162-Y234 HydrophobicContact CZ-CE1 4.09Å
163	S	90.1	Very high	91.4	Very high	96 Å²	96	94 Å²	94	67%	0.671	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-16.7	173.9	63.3	0	0	0	0	114.2	E159 A160 F161	E159-S163 PolarHBondContact O-N 2.84Å; A160-S163 PolarHBondContact O-OG 3.4Å; F161-S163 VanDerWaalsContact C-N 3.27Å; F161-S163 PolarHBondContact O-N 3.23Å
164	R	91.6	Very high	91.6	Very high	209 Å²	209	88.7 Å²	88.7	79%	0.789	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-4.9	178.6	-51.8	179.7	-169.7	-169.2	-2.2	113.3	A160 F161 F162	A160-R164 PolarHBondContact O-NE 3.01Å; A160-R164 VanDerWaalsContact O-NE 3.15Å; F161-R164 WeakPolarHBondContact O-CB 3.43Å; F161-R164 PolarHBondContact O-N 3.41Å; F162-R164 PolarHBondContact O-N 2.71Å
165	L	94.7	Very high	92.1	Very high	26 Å²	26	80.2 Å²	80.2	14%	0.136	42%	0.424	C	S	.	.	S	Bend	trans	-104.2	149.8	-172.8	-62.1	-178.3	0	0	0	112.4	F161 F162 S167 A195 N198	F161-L165 HydrophobicContact CD1-CD1 4.06Å; F161-L165 HydrophobicContact CE1-CD1 3.59Å; F161-L165 HydrophobicContact CZ-CD1 4.07Å; F162-L165 HydrophobicContact CD1-CD1 4.3Å; F162-L165 PolarHBondContact O-N 3.28Å; L165-S167 PolarHBondContact O-N 3.4Å; L165-S167 VanDerWaalsContact O-N 3.13Å; L165-S167 PolarHBondContact O-OG 2.95Å; L165-A195 WeakPolarHBondContact CD2-O 3.23Å; L165-N198 HydrophobicContact CB-CB 3.91Å
166	D	92.9	Very high	92.6	Very high	50 Å²	50	77 Å²	77	27%	0.267	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-72.3	111.2	-173.5	-169	-39.9	0	0	0	111.3	S168 K171 N172 S196 L197 N198	D166-S168 WeakPolarHBondContact OD1-CB 3.36Å; D166-S168 PolarHBondContact OD1-N 3.35Å; D166-S168 PolarHBondContact OD1-OG 3.19Å; D166-K171 WeakPolarHBondContact OD2-CD 3.47Å; D166-K171 WeakPolarHBondContact OD2-CE 3.22Å; D166-K171 IonicContact OD2-NZ 3.99Å; D166-K171 PolarHBondContact OD2-NZ 3.4Å; D166-N172 PolarHBondContact O-ND2 3.47Å; D166-S196 PolarHBondContact N-O 3.26Å; D166-L197 HydrophobicContact CB-CD2 4.22Å; D166-N198 PolarHBondContact O-N 3.33Å
167	S	94	Very high	92.6	Very high	71 Å²	71	81.3 Å²	81.3	50%	0.497	42%	0.417	S	S	.	.			trans	-94.8	10.3	-178.7	-55.5	0	0	0	0	113.2	L165 L169 N198	L165-S167 PolarHBondContact O-N 3.4Å; L165-S167 VanDerWaalsContact O-N 3.13Å; L165-S167 PolarHBondContact O-OG 2.95Å; S167-L169 PolarHBondContact O-N 3.18Å; S167-N198 WeakPolarHBondContact OG-CB 3.22Å; S167-N198 PolarHBondContact OG-ND2 2.91Å
168	S	93.9	Very high	92.8	Very high	45 Å²	45	83.4 Å²	83.4	32%	0.315	42%	0.421	S	S	.	.			trans	-69	131.7	-174.1	65.8	0	0	0	0	112.3	D166 K170 K171 N172	D166-S168 WeakPolarHBondContact OD1-CB 3.36Å; D166-S168 PolarHBondContact OD1-N 3.35Å; D166-S168 PolarHBondContact OD1-OG 3.19Å; S168-K170 VanDerWaalsContact C-N 3.26Å; S168-K170 PolarHBondContact O-N 2.99Å; S168-K171 PolarHBondContact O-N 3.4Å; S168-N172 PolarHBondContact N-ND2 3.38Å; S168-N172 PolarHBondContact O-N 3Å; S168-N172 PolarHBondContact O-ND2 2.95Å
169	L	92.8	Very high	93.1	Very high	115 Å²	115	75.9 Å²	75.9	60%	0.602	39%	0.386	S	S	*	.	H	α-helix	trans	-52.1	-44.3	178.1	179.4	65.4	0	0	0	111.8	S167 K171 N172 T173 Y202	S167-L169 PolarHBondContact O-N 3.18Å; L169-K171 PolarHBondContact O-N 2.9Å; L169-N172 PolarHBondContact O-N 2.9Å; L169-T173 WeakPolarHBondContact CD1-OG1 3.36Å; L169-T173 VanDerWaalsContact O-CB 3.3Å; L169-T173 WeakPolarHBondContact O-CB 3.33Å; L169-T173 PolarHBondContact O-N 3.4Å; L169-T173 PolarHBondContact O-OG1 2.98Å; L169-T173 VanDerWaalsContact O-OG1 3.08Å; L169-Y202 HydrophobicContact CD1-CE1 3.95Å; L169-Y202 WeakPolarHBondContact CD1-OH 3.3Å
170	K	93.5	Very high	93.5	Very high	188 Å²	188	74.2 Å²	74.2	82%	0.817	37%	0.372	S	S	*	.	H	α-helix	trans	-60	-43.1	-177.8	-172.4	176.9	179.8	-179.5	0	112.8	S168 A174	S168-K170 VanDerWaalsContact C-N 3.26Å; S168-K170 PolarHBondContact O-N 2.99Å; K170-A174 WeakPolarHBondContact O-CB 3.45Å; K170-A174 PolarHBondContact O-N 2.92Å
171	K	93.9	Very high	93.7	Very high	110 Å²	110	76.3 Å²	76.3	48%	0.478	38%	0.38	S	S	.	.	H	α-helix	trans	-77.5	-44.5	179.3	-67.2	-171.5	-173.3	170.6	0	112	D166 S168 L169 A174 F175 L197	D166-K171 WeakPolarHBondContact OD2-CD 3.47Å; D166-K171 WeakPolarHBondContact OD2-CE 3.22Å; D166-K171 IonicContact OD2-NZ 3.99Å; D166-K171 PolarHBondContact OD2-NZ 3.4Å; S168-K171 PolarHBondContact O-N 3.4Å; L169-K171 PolarHBondContact O-N 2.9Å; K171-A174 WeakPolarHBondContact O-CB 3.45Å; K171-A174 PolarHBondContact O-N 2.98Å; K171-F175 PolarHBondContact O-N 3.33Å; K171-L197 HydrophobicContact CB-CD2 3.65Å; K171-L197 HydrophobicContact CD-CD2 4.22Å
172	N	94.2	Very high	93.7	Very high	0 Å²	0	73 Å²	73	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-65.1	-46.4	-177.5	-74	-81.9	0	0	0	111.9	D166 S168 L169 A174 F175 V176 N198 L199 Y202	D166-N172 PolarHBondContact O-ND2 3.47Å; S168-N172 PolarHBondContact N-ND2 3.38Å; S168-N172 PolarHBondContact O-N 3Å; S168-N172 PolarHBondContact O-ND2 2.95Å; L169-N172 PolarHBondContact O-N 2.9Å; N172-A174 VanDerWaalsContact C-N 3.29Å; N172-A174 PolarHBondContact O-N 3.47Å; N172-F175 PolarHBondContact O-N 2.97Å; N172-V176 WeakPolarHBondContact O-CG2 3.4Å; N172-V176 PolarHBondContact O-N 2.95Å; N172-N198 PolarHBondContact OD1-O 3.16Å; N172-L199 HydrophobicContact CB-CD2 4.26Å; N172-L199 VanDerWaalsContact OD1-CD2 3.22Å; N172-L199 WeakPolarHBondContact OD1-CD2 3.4Å; N172-Y202 HydrophobicContact CB-CD2 3.52Å; N172-Y202 HydrophobicContact CB-CE1 4.42Å; N172-Y202 HydrophobicContact CB-CE2 3.38Å; N172-Y202 HydrophobicContact CB-CG 4.12Å
173	T	93.7	Very high	93.8	Very high	51 Å²	51	73.4 Å²	73.4	31%	0.313	37%	0.371	S	S	.	.	H	α-helix	trans	-65.4	-30.4	173.6	-54.1	0	0	0	0	112.7	L169 K177	L169-T173 WeakPolarHBondContact CD1-OG1 3.36Å; L169-T173 VanDerWaalsContact O-CB 3.3Å; L169-T173 WeakPolarHBondContact O-CB 3.33Å; L169-T173 PolarHBondContact O-N 3.4Å; L169-T173 PolarHBondContact O-OG1 2.98Å; L169-T173 VanDerWaalsContact O-OG1 3.08Å; T173-K177 WeakPolarHBondContact O-CG 3.31Å; T173-K177 PolarHBondContact O-N 2.87Å; T173-K177 VanDerWaalsContact O-N 3.14Å
174	A	94.9	Very high	94	Very high	47 Å²	47	71.6 Å²	71.6	39%	0.388	35%	0.352	S	S	.	.	H	α-helix	trans	-68.9	-41.3	172.9	0	0	0	0	0	111.9	K170 K171 N172 K177 K178	K170-A174 WeakPolarHBondContact O-CB 3.45Å; K170-A174 PolarHBondContact O-N 2.92Å; K171-A174 WeakPolarHBondContact O-CB 3.45Å; K171-A174 PolarHBondContact O-N 2.98Å; N172-A174 VanDerWaalsContact C-N 3.29Å; N172-A174 PolarHBondContact O-N 3.47Å; A174-K177 PolarHBondContact O-N 3.5Å; A174-K178 PolarHBondContact O-N 3.44Å; A174-K178 VanDerWaalsContact O-N 3.13Å
175	F	96.6	Very high	94.2	Very high	2 Å²	2	70.9 Å²	70.9	1%	0.009	36%	0.357	C	S	.	.	H	α-helix	trans	-62.6	-49.3	175.6	-177.8	-101.8	0	0	0	111.7	K171 N172 K177 K178 L179 L190 D193 F194 L197 L199 F230	K171-F175 PolarHBondContact O-N 3.33Å; N172-F175 PolarHBondContact O-N 2.97Å; F175-K177 VanDerWaalsContact C-N 3.26Å; F175-K177 PolarHBondContact O-N 3.36Å; F175-K178 WeakPolarHBondContact O-CB 3.38Å; F175-K178 PolarHBondContact O-N 2.91Å; F175-L179 HydrophobicContact CD1-CD1 4.44Å; F175-L179 HydrophobicContact CE1-CD1 4.09Å; F175-L179 HydrophobicContact CE1-CD2 4.03Å; F175-L179 HydrophobicContact CE1-CG 4.26Å; F175-L179 HydrophobicContact CZ-CD2 3.97Å; F175-L179 PolarHBondContact O-N 3.48Å; F175-L190 HydrophobicContact CD2-CD2 4.2Å; F175-L190 HydrophobicContact CE2-CB 4.23Å; F175-L190 HydrophobicContact CE2-CD2 3.79Å; F175-L190 WeakPolarHBondContact CE2-O 3.32Å; F175-D193 HydrophobicContact CD2-CB 3.59Å; F175-D193 HydrophobicContact CE2-CB 3.72Å; F175-F194 HydrophobicContact CE1-CD2 4.15Å; F175-F194 HydrophobicContact CE2-CB 4.23Å; F175-F194 HydrophobicContact CZ-CB 3.81Å; F175-F194 HydrophobicContact CZ-CD2 4.15Å; F175-F194 HydrophobicContact CZ-CG 4.49Å; F175-L197 HydrophobicContact CB-CD1 3.64Å; F175-L197 HydrophobicContact CD1-CD1 4.37Å; F175-L197 HydrophobicContact CD2-CD1 4.1Å; F175-L197 HydrophobicContact CG-CD1 3.78Å; F175-L199 HydrophobicContact CD1-CD1 3.79Å; F175-L199 HydrophobicContact CD1-CD2 3.89Å; F175-L199 HydrophobicContact CE1-CD1 3.7Å; F175-F230 HydrophobicContact CE1-CE2 4.06Å; F175-F230 AromaticContact CE1-CZ 3.96Å; F175-F230 HydrophobicContact CE1-CZ 3.96Å
176	V	95.5	Very high	94.2	Very high	10 Å²	10	72.9 Å²	72.9	6%	0.061	37%	0.366	C	S	.	.	H	α-helix	trans	-54	-43	174.7	171	0	0	0	0	111.4	N172 K178 L179 E205 A206 S209	N172-V176 WeakPolarHBondContact O-CG2 3.4Å; N172-V176 PolarHBondContact O-N 2.95Å; V176-K178 VanDerWaalsContact C-N 3.34Å; V176-K178 PolarHBondContact O-N 3.44Å; V176-L179 WeakPolarHBondContact O-CB 3.32Å; V176-L179 PolarHBondContact O-N 3.42Å; V176-E205 HydrophobicContact CG1-CB 3.84Å; V176-A206 HydrophobicContact CG2-CB 4.27Å; V176-S209 VanDerWaalsContact CG1-OG 3.32Å; V176-S209 WeakPolarHBondContact CG1-OG 3.46Å
177	K	93.7	Very high	94.3	Very high	153 Å²	153	74.5 Å²	74.5	67%	0.665	37%	0.368	S	S	*	.	H	α-helix	trans	-63.3	-33	175.5	-77.4	179.4	178.7	-174.2	0	113.9	T173 A174 F175 L179	T173-K177 WeakPolarHBondContact O-CG 3.31Å; T173-K177 PolarHBondContact O-N 2.87Å; T173-K177 VanDerWaalsContact O-N 3.14Å; A174-K177 PolarHBondContact O-N 3.5Å; F175-K177 VanDerWaalsContact C-N 3.26Å; F175-K177 PolarHBondContact O-N 3.36Å; K177-L179 VanDerWaalsContact C-N 3.35Å
178	K	95	Very high	94.4	Very high	87 Å²	87	76.6 Å²	76.6	38%	0.378	37%	0.374	S	S	.	.	H	α-helix	trans	-64.8	-37.8	174.4	-66.1	-179.7	-177.4	-177.3	0	111.7	A174 F175 V176 R180 T181 L182 L190 D193	A174-K178 PolarHBondContact O-N 3.44Å; A174-K178 VanDerWaalsContact O-N 3.13Å; F175-K178 WeakPolarHBondContact O-CB 3.38Å; F175-K178 PolarHBondContact O-N 2.91Å; V176-K178 VanDerWaalsContact C-N 3.34Å; V176-K178 PolarHBondContact O-N 3.44Å; K178-R180 VanDerWaalsContact C-N 3.25Å; K178-R180 PolarHBondContact O-N 3.35Å; K178-T181 CarbonylContact O-C 3.5Å; K178-T181 VanDerWaalsContact O-C 3.31Å; K178-T181 PolarHBondContact O-N 3.46Å; K178-L182 PolarHBondContact O-N 3.19Å; K178-L182 VanDerWaalsContact O-N 3.13Å; K178-L190 HydrophobicContact CB-CD2 3.78Å; K178-L190 HydrophobicContact CD-CD2 3.63Å; K178-L190 HydrophobicContact CG-CD2 4.37Å; K178-D193 IonicContact NZ-OD2 2.64Å; K178-D193 PolarHBondContact NZ-OD2 3.34Å
179	L	94.8	Very high	94.5	Very high	0 Å²	0	77.2 Å²	77.2	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-58	-35.3	-177.4	-60.3	178.3	0	0	0	112.9	F175 V176 K177 T181 L182 A206 L210 L226 F230	F175-L179 HydrophobicContact CD1-CD1 4.44Å; F175-L179 HydrophobicContact CE1-CD1 4.09Å; F175-L179 HydrophobicContact CE1-CD2 4.03Å; F175-L179 HydrophobicContact CE1-CG 4.26Å; F175-L179 HydrophobicContact CZ-CD2 3.97Å; F175-L179 PolarHBondContact O-N 3.48Å; V176-L179 WeakPolarHBondContact O-CB 3.32Å; V176-L179 PolarHBondContact O-N 3.42Å; K177-L179 VanDerWaalsContact C-N 3.35Å; L179-T181 PolarHBondContact O-N 3.18Å; L179-T181 VanDerWaalsContact O-N 3.12Å; L179-L182 WeakPolarHBondContact O-CD2 3.49Å; L179-L182 PolarHBondContact O-N 3.48Å; L179-A206 HydrophobicContact CD1-CB 3.9Å; L179-L210 HydrophobicContact CB-CD2 4.23Å; L179-L210 HydrophobicContact CB-CG 4.35Å; L179-L210 HydrophobicContact CD1-CD1 4.41Å; L179-L210 HydrophobicContact CD1-CG 4.25Å; L179-L210 HydrophobicContact CD2-CD2 4.4Å; L179-L226 HydrophobicContact CD2-CD1 4.1Å; L179-F230 HydrophobicContact CD1-CE2 4.04Å; L179-F230 HydrophobicContact CD1-CZ 4.11Å
180	R	93	Very high	94.7	Very high	139 Å²	139	71.8 Å²	71.8	53%	0.525	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-15.2	179.3	-153	179.5	-171.1	-142.5	10.2	113.6	K178 S209 E212	K178-R180 VanDerWaalsContact C-N 3.25Å; K178-R180 PolarHBondContact O-N 3.35Å; R180-S209 WeakPolarHBondContact CA-O 3.24Å; R180-E212 HydrophobicContact CG-CB 4.5Å; R180-E212 IonicContact CZ-OE2 3.65Å; R180-E212 IonicContact NE-OE2 3.3Å; R180-E212 PolarHBondContact NE-OE2 2.92Å; R180-E212 IonicContact NH2-OE2 3.71Å; R180-E212 PolarHBondContact NH2-OE2 3.01Å
181	T	92.3	Very high	94.8	Very high	100 Å²	100	63.9 Å²	63.9	61%	0.613	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.2	35.4	177.7	63.2	0	0	0	0	111.7	K178 L179	K178-T181 CarbonylContact O-C 3.5Å; K178-T181 VanDerWaalsContact O-C 3.31Å; K178-T181 PolarHBondContact O-N 3.46Å; L179-T181 PolarHBondContact O-N 3.18Å; L179-T181 VanDerWaalsContact O-N 3.12Å
182	L	94.1	Very high	94.9	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.021	33%	0.328	C	S	.	.			trans	-64.7	147.8	178.2	76.6	89.6	0	0	0	111	K178 L179 L190 L210 L215 D219 C222 A223 L226	K178-L182 PolarHBondContact O-N 3.19Å; K178-L182 VanDerWaalsContact O-N 3.13Å; L179-L182 WeakPolarHBondContact O-CD2 3.49Å; L179-L182 PolarHBondContact O-N 3.48Å; L182-L190 HydrophobicContact CB-CD1 3.91Å; L182-L210 HydrophobicContact CD2-CD2 3.7Å; L182-L215 HydrophobicContact CD1-CD2 3.69Å; L182-L215 HydrophobicContact CD2-CD2 4.13Å; L182-L215 HydrophobicContact CG-CD2 3.64Å; L182-D219 HydrophobicContact CD1-CB 4.43Å; L182-C222 HydrophobicContact CD1-CB 4.1Å; L182-A223 HydrophobicContact CD1-CB 4.03Å; L182-A223 HydrophobicContact CD2-CB 4.11Å; L182-L226 HydrophobicContact CD2-CD1 4.31Å
183	T	95.2	Very high	95	Very high	39 Å²	39	66.6 Å²	66.6	24%	0.239	34%	0.341	C	S	.	.			trans	-134.6	163.3	173	63.3	0	0	0	0	111.4	Q185 Q186 D219 C222	T183-Q185 VanDerWaalsContact C-N 3.28Å; T183-Q185 PolarHBondContact O-N 2.95Å; T183-Q186 WeakPolarHBondContact O-CB 3.36Å; T183-Q186 PolarHBondContact O-N 3.19Å; T183-Q186 WeakPolarHBondContact OG1-CG 3.37Å; T183-D219 WeakPolarHBondContact CA-OD1 3.23Å; T183-C222 PolarHBondContact O-SG 2.9Å; T183-C222 VanDerWaalsContact O-SG 3.32Å
184	E	94.5	Very high	95.1	Very high	58 Å²	58	64.3 Å²	64.3	27%	0.271	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-57.6	-40.5	-179.4	-167.7	52.3	-121.5	0	0	112.7	Q186 R187 D219 C222	E184-Q186 PolarHBondContact O-N 3.41Å; E184-R187 WeakPolarHBondContact O-CB 3.22Å; E184-R187 PolarHBondContact O-N 2.91Å; E184-R187 VanDerWaalsContact O-N 3.11Å; E184-R187 IonicContact OE1-CZ 2.65Å; E184-R187 IonicContact OE1-NE 2.61Å; E184-R187 PolarHBondContact OE1-NE 3.43Å; E184-R187 IonicContact OE1-NH2 2.9Å; E184-R187 PolarHBondContact OE1-NH2 3.37Å; E184-R187 IonicContact OE2-NH2 3.23Å; E184-R187 PolarHBondContact OE2-NH2 2.76Å; E184-D219 PolarHBondContact N-OD1 3.04Å; E184-C222 VanDerWaalsContact OE2-CB 3.3Å; E184-C222 WeakPolarHBondContact OE2-CB 3.46Å; E184-C222 PolarHBondContact OE2-N 2.87Å
185	Q	94.8	Very high	95.2	Very high	194 Å²	194	64.3 Å²	64.3	91%	0.907	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-62.1	-12.8	175.8	-66.3	176.9	-12.2	0	0	114.5	T183	T183-Q185 VanDerWaalsContact C-N 3.28Å; T183-Q185 PolarHBondContact O-N 2.95Å
186	Q	95.4	Very high	95.1	Very high	68 Å²	68	66.9 Å²	66.9	32%	0.318	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-97.9	-1.1	179.9	-64.7	173.9	-4.5	0	0	113.2	T183 E184 D188 A189 L190	T183-Q186 WeakPolarHBondContact O-CB 3.36Å; T183-Q186 PolarHBondContact O-N 3.19Å; T183-Q186 WeakPolarHBondContact OG1-CG 3.37Å; E184-Q186 PolarHBondContact O-N 3.41Å; Q186-D188 PolarHBondContact O-N 2.73Å; Q186-A189 PolarHBondContact O-N 2.69Å; Q186-L190 HydrophobicContact CB-CD1 3.71Å; Q186-L190 HydrophobicContact CB-CG 4.04Å; Q186-L190 WeakPolarHBondContact O-CB 3.5Å; Q186-L190 WeakPolarHBondContact O-CG 3.3Å; Q186-L190 PolarHBondContact O-N 2.98Å
187	R	95.3	Very high	95.2	Very high	83 Å²	83	66.6 Å²	66.6	31%	0.313	34%	0.343	S	S	.	.	H	α-helix	trans	-47.1	-54.8	-174.6	-175.3	-172	-70.5	-134.6	3.5	112.8	E184 S191 C222	E184-R187 WeakPolarHBondContact O-CB 3.22Å; E184-R187 PolarHBondContact O-N 2.91Å; E184-R187 VanDerWaalsContact O-N 3.11Å; E184-R187 IonicContact OE1-CZ 2.65Å; E184-R187 IonicContact OE1-NE 2.61Å; E184-R187 PolarHBondContact OE1-NE 3.43Å; E184-R187 IonicContact OE1-NH2 2.9Å; E184-R187 PolarHBondContact OE1-NH2 3.37Å; E184-R187 IonicContact OE2-NH2 3.23Å; E184-R187 PolarHBondContact OE2-NH2 2.76Å; R187-S191 WeakPolarHBondContact O-CB 3.44Å; R187-S191 PolarHBondContact O-N 3.15Å; R187-S191 PolarHBondContact O-OG 3.24Å; R187-C222 VanDerWaalsContact CA-SG 3.59Å; R187-C222 HydrophobicContact CB-CB 4.33Å
188	D	95.9	Very high	95.3	Very high	115 Å²	115	60.5 Å²	60.5	62%	0.615	32%	0.318	S	S	*	.	H	α-helix	trans	-73.3	-38.9	-175.3	-54.8	-37.8	0	0	0	112.1	Q186 L190 S191 N192	Q186-D188 PolarHBondContact O-N 2.73Å; D188-L190 PolarHBondContact O-N 3.45Å; D188-S191 PolarHBondContact O-N 3.16Å; D188-N192 WeakPolarHBondContact O-CB 3.26Å; D188-N192 VanDerWaalsContact O-CG 3.3Å; D188-N192 PolarHBondContact O-N 3.39Å; D188-N192 PolarHBondContact O-ND2 3.18Å
189	A	95.7	Very high	95.3	Very high	58 Å²	58	56.3 Å²	56.3	48%	0.479	30%	0.3	S	S	.	.	H	α-helix	trans	-63.1	-42.5	177.4	0	0	0	0	0	111.8	Q186 D193	Q186-A189 PolarHBondContact O-N 2.69Å; A189-D193 PolarHBondContact O-N 2.95Å
190	L	96.4	Very high	95.3	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-72.6	-33	175.9	-67.6	171.8	0	0	0	112.1	F175 K178 L182 Q186 D188 F194 L226	F175-L190 HydrophobicContact CD2-CD2 4.2Å; F175-L190 HydrophobicContact CE2-CB 4.23Å; F175-L190 HydrophobicContact CE2-CD2 3.79Å; F175-L190 WeakPolarHBondContact CE2-O 3.32Å; K178-L190 HydrophobicContact CB-CD2 3.78Å; K178-L190 HydrophobicContact CD-CD2 3.63Å; K178-L190 HydrophobicContact CG-CD2 4.37Å; L182-L190 HydrophobicContact CB-CD1 3.91Å; Q186-L190 HydrophobicContact CB-CD1 3.71Å; Q186-L190 HydrophobicContact CB-CG 4.04Å; Q186-L190 WeakPolarHBondContact O-CB 3.5Å; Q186-L190 WeakPolarHBondContact O-CG 3.3Å; Q186-L190 PolarHBondContact O-N 2.98Å; D188-L190 PolarHBondContact O-N 3.45Å; L190-F194 WeakPolarHBondContact O-CB 3.1Å; L190-F194 PolarHBondContact O-N 3.04Å; L190-L226 HydrophobicContact CB-CD1 3.93Å; L190-L226 HydrophobicContact CB-CD2 3.85Å; L190-L226 HydrophobicContact CD1-CD1 3.72Å; L190-L226 HydrophobicContact CG-CD1 4.45Å
191	S	97.1	Very high	95.3	Very high	21 Å²	21	61.1 Å²	61.1	15%	0.147	33%	0.332	C	S	.	.	H	α-helix	trans	-65.1	-42	173.1	-59.1	0	0	0	0	111.8	R187 D188 F194 A195 H225	R187-S191 WeakPolarHBondContact O-CB 3.44Å; R187-S191 PolarHBondContact O-N 3.15Å; R187-S191 PolarHBondContact O-OG 3.24Å; D188-S191 PolarHBondContact O-N 3.16Å; S191-F194 PolarHBondContact O-N 3.17Å; S191-A195 WeakPolarHBondContact O-CB 3.43Å; S191-A195 PolarHBondContact O-N 3.48Å; S191-H225 PolarHBondContact OG-NE2 2.63Å
192	N	95.8	Very high	95.5	Very high	116 Å²	116	58 Å²	58	62%	0.62	31%	0.309	S	S	*	.	H	α-helix	trans	-69.2	-42.9	177.3	-74	-43.6	0	0	0	112.4	D188 A195 S196	D188-N192 WeakPolarHBondContact O-CB 3.26Å; D188-N192 VanDerWaalsContact O-CG 3.3Å; D188-N192 PolarHBondContact O-N 3.39Å; D188-N192 PolarHBondContact O-ND2 3.18Å; N192-A195 PolarHBondContact O-N 3.3Å; N192-S196 PolarHBondContact O-N 2.9Å
193	D	95.4	Very high	95.6	Very high	51 Å²	51	58.3 Å²	58.3	27%	0.273	31%	0.311	S	S	.	.	H	α-helix	trans	-55.7	-55.2	169.8	-85	-10.1	0	0	0	110.2	F175 K178 A189 A195 S196 L197	F175-D193 HydrophobicContact CD2-CB 3.59Å; F175-D193 HydrophobicContact CE2-CB 3.72Å; K178-D193 IonicContact NZ-OD2 2.64Å; K178-D193 PolarHBondContact NZ-OD2 3.34Å; A189-D193 PolarHBondContact O-N 2.95Å; D193-A195 VanDerWaalsContact C-N 3.3Å; D193-A195 PolarHBondContact O-N 3.01Å; D193-S196 PolarHBondContact O-N 2.98Å; D193-S196 VanDerWaalsContact O-N 3.1Å; D193-S196 PolarHBondContact O-OG 3.49Å; D193-L197 HydrophobicContact CB-CD1 4.44Å; D193-L197 WeakPolarHBondContact O-CD1 3.42Å; D193-L197 VanDerWaalsContact O-CG 3.3Å; D193-L197 WeakPolarHBondContact O-CG 3.38Å; D193-L197 PolarHBondContact O-N 3.29Å
194	F	97.1	Very high	95.5	Very high	4 Å²	4	58 Å²	58	2%	0.018	32%	0.315	C	S	.	.	H	α-helix	trans	-55.4	-43.1	-179.1	177.3	-88.9	0	0	0	112.5	F175 L190 S191 S196 L197 L199 L229 F230 R233 Y234	F175-F194 HydrophobicContact CE1-CD2 4.15Å; F175-F194 HydrophobicContact CE2-CB 4.23Å; F175-F194 HydrophobicContact CZ-CB 3.81Å; F175-F194 HydrophobicContact CZ-CD2 4.15Å; F175-F194 HydrophobicContact CZ-CG 4.49Å; L190-F194 WeakPolarHBondContact O-CB 3.1Å; L190-F194 PolarHBondContact O-N 3.04Å; S191-F194 PolarHBondContact O-N 3.17Å; F194-S196 PolarHBondContact O-N 3.12Å; F194-L197 PolarHBondContact O-N 2.91Å; F194-L199 HydrophobicContact CD2-CD1 3.58Å; F194-L199 HydrophobicContact CE2-CD1 3.85Å; F194-L229 HydrophobicContact CD1-CB 3.97Å; F194-L229 HydrophobicContact CD1-CD1 4.16Å; F194-L229 HydrophobicContact CE1-CB 3.66Å; F194-L229 VanDerWaalsContact CZ-C 3.49Å; F194-L229 HydrophobicContact CZ-CB 4.03Å; F194-L229 VanDerWaalsContact CZ-O 3.26Å; F194-L229 WeakPolarHBondContact CZ-O 3.41Å; F194-F230 HydrophobicContact CD2-CD2 4.19Å; F194-F230 AromaticContact CD2-CE2 4Å; F194-F230 HydrophobicContact CD2-CE2 4Å; F194-F230 HydrophobicContact CD2-CZ 4.21Å; F194-F230 HydrophobicContact CE2-CB 4.41Å; F194-F230 AromaticContact CE2-CD1 3.81Å; F194-F230 HydrophobicContact CE2-CD1 3.81Å; F194-F230 AromaticContact CE2-CD2 3.73Å; F194-F230 HydrophobicContact CE2-CD2 3.73Å; F194-F230 AromaticContact CE2-CE1 3.96Å; F194-F230 HydrophobicContact CE2-CE1 3.96Å; F194-F230 AromaticContact CE2-CE2 3.89Å; F194-F230 HydrophobicContact CE2-CE2 3.89Å; F194-F230 AromaticContact CE2-CG 3.68Å; F194-F230 HydrophobicContact CE2-CG 3.68Å; F194-F230 HydrophobicContact CE2-CZ 4.01Å; F194-F230 HydrophobicContact CZ-CG 4.35Å; F194-R233 HydrophobicContact CE1-CB 4.44Å; F194-R233 HydrophobicContact CZ-CB 4.1Å; F194-R233 PolarHBondContact O-NH1 2.93Å; F194-Y234 AromaticContact CE2-CE2 3.81Å; F194-Y234 HydrophobicContact CE2-CE2 3.81Å; F194-Y234 HydrophobicContact CZ-CD2 4.37Å; F194-Y234 AromaticContact CZ-CE2 3.72Å; F194-Y234 HydrophobicContact CZ-CE2 3.72Å
195	A	95.7	Very high	95.6	Very high	46 Å²	46	59.6 Å²	59.6	38%	0.38	32%	0.323	S	S	.	.	H	α-helix	trans	-55.2	-38.6	-179.8	0	0	0	0	0	111.8	L165 S191 N192 D193 R233	L165-A195 WeakPolarHBondContact CD2-O 3.23Å; S191-A195 WeakPolarHBondContact O-CB 3.43Å; S191-A195 PolarHBondContact O-N 3.48Å; N192-A195 PolarHBondContact O-N 3.3Å; D193-A195 VanDerWaalsContact C-N 3.3Å; D193-A195 PolarHBondContact O-N 3.01Å; A195-R233 PolarHBondContact O-NH1 2.76Å
196	S	95.3	Very high	95.7	Very high	56 Å²	56	50.4 Å²	50.4	39%	0.392	28%	0.279	S	S	.	.	H	α-helix	trans	-84.6	-12.4	-176.1	75.9	0	0	0	0	116.2	D166 N192 D193 F194	D166-S196 PolarHBondContact N-O 3.26Å; N192-S196 PolarHBondContact O-N 2.9Å; D193-S196 PolarHBondContact O-N 2.98Å; D193-S196 VanDerWaalsContact O-N 3.1Å; D193-S196 PolarHBondContact O-OG 3.49Å; F194-S196 PolarHBondContact O-N 3.12Å
197	L	96.5	Very high	95.8	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-105.8	142.8	-167.7	-69.5	169.4	0	0	0	113.7	D166 K171 F175 D193 F194 L199 Y234	D166-L197 HydrophobicContact CB-CD2 4.22Å; K171-L197 HydrophobicContact CB-CD2 3.65Å; K171-L197 HydrophobicContact CD-CD2 4.22Å; F175-L197 HydrophobicContact CB-CD1 3.64Å; F175-L197 HydrophobicContact CD1-CD1 4.37Å; F175-L197 HydrophobicContact CD2-CD1 4.1Å; F175-L197 HydrophobicContact CG-CD1 3.78Å; D193-L197 HydrophobicContact CB-CD1 4.44Å; D193-L197 WeakPolarHBondContact O-CD1 3.42Å; D193-L197 VanDerWaalsContact O-CG 3.3Å; D193-L197 WeakPolarHBondContact O-CG 3.38Å; D193-L197 PolarHBondContact O-N 3.29Å; F194-L197 PolarHBondContact O-N 2.91Å; L197-L199 HydrophobicContact CB-CD1 4.28Å; L197-L199 HydrophobicContact CB-CG 4.11Å; L197-Y234 PolarHBondContact O-OH 2.98Å
198	N	95.9	Very high	95.8	Very high	25 Å²	25	46.1 Å²	46.1	13%	0.134	27%	0.27	C	S	.	.			trans	-94.5	93.9	169.4	-170.9	-23	0	0	0	110.1	F162 L165 D166 S167 N172 S200	F162-N198 PolarHBondContact O-ND2 2.59Å; L165-N198 HydrophobicContact CB-CB 3.91Å; D166-N198 PolarHBondContact O-N 3.33Å; S167-N198 WeakPolarHBondContact OG-CB 3.22Å; S167-N198 PolarHBondContact OG-ND2 2.91Å; N172-N198 PolarHBondContact OD1-O 3.16Å; N198-S200 WeakPolarHBondContact OD1-CB 3.2Å; N198-S200 PolarHBondContact OD1-N 3.27Å; N198-S200 PolarHBondContact OD1-OG 2.97Å; N198-S200 VanDerWaalsContact OD1-OG 3.13Å
199	L	95.8	Very high	95.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	25%	0.245	C	C	.	.			trans	-91.8	5.8	-175.5	-68.6	155.5	0	0	0	113.4	N172 F175 F194 L197 K201 Y202 I203 F230 Y234	N172-L199 HydrophobicContact CB-CD2 4.26Å; N172-L199 VanDerWaalsContact OD1-CD2 3.22Å; N172-L199 WeakPolarHBondContact OD1-CD2 3.4Å; F175-L199 HydrophobicContact CD1-CD1 3.79Å; F175-L199 HydrophobicContact CD1-CD2 3.89Å; F175-L199 HydrophobicContact CE1-CD1 3.7Å; F194-L199 HydrophobicContact CD2-CD1 3.58Å; F194-L199 HydrophobicContact CE2-CD1 3.85Å; L197-L199 HydrophobicContact CB-CD1 4.28Å; L197-L199 HydrophobicContact CB-CG 4.11Å; L199-K201 PolarHBondContact O-N 2.94Å; L199-Y202 PolarHBondContact O-N 3.25Å; L199-I203 HydrophobicContact CB-CD1 4.4Å; L199-I203 VanDerWaalsContact O-CD1 3.24Å; L199-I203 WeakPolarHBondContact O-CD1 3.35Å; L199-I203 WeakPolarHBondContact O-CG1 3.34Å; L199-I203 PolarHBondContact O-N 3.03Å; L199-F230 HydrophobicContact CB-CE1 4.22Å; L199-F230 HydrophobicContact CD1-CE1 3.98Å; L199-F230 HydrophobicContact CD1-CZ 3.85Å; L199-Y234 HydrophobicContact CB-CE2 4.08Å; L199-Y234 PolarHBondContact N-OH 3.39Å
200	S	93.5	Very high	95.8	Very high	59 Å²	59	38.7 Å²	38.7	41%	0.413	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-23.9	-174.8	-59	0	0	0	0	114.6	N198 Y234	N198-S200 WeakPolarHBondContact OD1-CB 3.2Å; N198-S200 PolarHBondContact OD1-N 3.27Å; N198-S200 PolarHBondContact OD1-OG 2.97Å; N198-S200 VanDerWaalsContact OD1-OG 3.13Å; S200-Y234 VanDerWaalsContact OG-CE1 3.28Å; S200-Y234 WeakPolarHBondContact OG-CE1 3.29Å
201	K	93.7	Very high	95.8	Very high	181 Å²	181	38.9 Å²	38.9	79%	0.787	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	0.7	177.3	-64.2	-172.8	178.8	-177.7	0	114.7	L199	L199-K201 PolarHBondContact O-N 2.94Å
202	Y	95.9	Very high	95.5	Very high	33 Å²	33	42.3 Å²	42.3	13%	0.129	24%	0.238	C	C	.	.			trans	-126.5	13.1	-172.4	-57.8	-78	0	0	0	113	L169 N172 L199 G204 E205 A206	L169-Y202 HydrophobicContact CD1-CE1 3.95Å; L169-Y202 WeakPolarHBondContact CD1-OH 3.3Å; N172-Y202 HydrophobicContact CB-CD2 3.52Å; N172-Y202 HydrophobicContact CB-CE1 4.42Å; N172-Y202 HydrophobicContact CB-CE2 3.38Å; N172-Y202 HydrophobicContact CB-CG 4.12Å; L199-Y202 PolarHBondContact O-N 3.25Å; Y202-G204 VanDerWaalsContact C-N 3.32Å; Y202-G204 PolarHBondContact O-N 2.82Å; Y202-E205 WeakPolarHBondContact CA-OE2 3.36Å; Y202-E205 PolarHBondContact O-N 3.46Å; Y202-A206 VanDerWaalsContact O-CB 3.3Å; Y202-A206 WeakPolarHBondContact O-CB 3.4Å; Y202-A206 PolarHBondContact O-N 2.82Å
203	I	96.3	Very high	95.5	Very high	11 Å²	11	36.8 Å²	36.8	6%	0.056	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-40	-175.4	-56.7	-59.1	0	0	0	111.1	L199 A206 V207 F230 Y234 F237 L240	L199-I203 HydrophobicContact CB-CD1 4.4Å; L199-I203 VanDerWaalsContact O-CD1 3.24Å; L199-I203 WeakPolarHBondContact O-CD1 3.35Å; L199-I203 WeakPolarHBondContact O-CG1 3.34Å; L199-I203 PolarHBondContact O-N 3.03Å; I203-A206 PolarHBondContact O-N 3.43Å; I203-V207 WeakPolarHBondContact O-CB 3.44Å; I203-V207 VanDerWaalsContact O-CG2 3.29Å; I203-V207 WeakPolarHBondContact O-CG2 3.1Å; I203-V207 PolarHBondContact O-N 3.5Å; I203-F230 HydrophobicContact CD1-CD1 4.14Å; I203-F230 HydrophobicContact CD1-CE1 4.13Å; I203-Y234 HydrophobicContact CD1-CD1 3.98Å; I203-Y234 HydrophobicContact CD1-CD2 3.72Å; I203-Y234 HydrophobicContact CD1-CE1 4.4Å; I203-Y234 HydrophobicContact CD1-CE2 4.18Å; I203-Y234 HydrophobicContact CD1-CG 3.62Å; I203-F237 HydrophobicContact CG2-CB 4.18Å; I203-F237 HydrophobicContact CG2-CD2 4.11Å; I203-L240 HydrophobicContact CB-CD1 4.44Å; I203-L240 HydrophobicContact CG2-CD1 3.82Å
204	G	94.7	Very high	95.4	Very high	32 Å²	32	43.4 Å²	43.4	33%	0.33	24%	0.235	S	C	.	.	H	α-helix	trans	-67.2	-42.6	179.8	0	0	0	0	0	113.4	Y202 S208	Y202-G204 VanDerWaalsContact C-N 3.32Å; Y202-G204 PolarHBondContact O-N 2.82Å; G204-S208 WeakPolarHBondContact O-CB 3.21Å; G204-S208 PolarHBondContact O-N 2.72Å; G204-S208 PolarHBondContact O-OG 3.17Å
205	E	95.8	Very high	95.2	Very high	93 Å²	93	43.8 Å²	43.8	44%	0.435	24%	0.237	S	C	.	.	H	α-helix	trans	-72.6	-33.7	177	-51.9	98.2	114.1	0	0	112	V176 Y202 S209	V176-E205 HydrophobicContact CG1-CB 3.84Å; Y202-E205 WeakPolarHBondContact CA-OE2 3.36Å; Y202-E205 PolarHBondContact O-N 3.46Å; E205-S209 VanDerWaalsContact O-CB 3.29Å; E205-S209 WeakPolarHBondContact O-CB 3.46Å; E205-S209 PolarHBondContact O-N 3.44Å; E205-S209 PolarHBondContact O-OG 3.32Å
206	A	96.4	Very high	95.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.2	-49.1	171.5	0	0	0	0	0	111.4	V176 L179 Y202 I203 S208 S209 L210 F230	V176-A206 HydrophobicContact CG2-CB 4.27Å; L179-A206 HydrophobicContact CD1-CB 3.9Å; Y202-A206 VanDerWaalsContact O-CB 3.3Å; Y202-A206 WeakPolarHBondContact O-CB 3.4Å; Y202-A206 PolarHBondContact O-N 2.82Å; I203-A206 PolarHBondContact O-N 3.43Å; A206-S208 PolarHBondContact O-N 2.82Å; A206-S209 PolarHBondContact O-N 3.41Å; A206-L210 VanDerWaalsContact O-CG 3.31Å; A206-L210 WeakPolarHBondContact O-CG 3.42Å; A206-L210 PolarHBondContact O-N 3.11Å; A206-F230 HydrophobicContact CB-CE1 3.89Å; A206-F230 HydrophobicContact CB-CZ 3.67Å
207	V	97.4	Very high	95	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.018	24%	0.244	C	C	.	.	H	α-helix	trans	-56	-49.1	173.8	159.4	0	0	0	0	111.1	I203 S209 L210 V211 F237 L240 L241 A244	I203-V207 WeakPolarHBondContact O-CB 3.44Å; I203-V207 VanDerWaalsContact O-CG2 3.29Å; I203-V207 WeakPolarHBondContact O-CG2 3.1Å; I203-V207 PolarHBondContact O-N 3.5Å; V207-S209 VanDerWaalsContact C-N 3.32Å; V207-S209 PolarHBondContact O-N 2.7Å; V207-L210 PolarHBondContact O-N 3.3Å; V207-V211 WeakPolarHBondContact O-CG2 3.35Å; V207-V211 PolarHBondContact O-N 3.49Å; V207-F237 HydrophobicContact CG2-CD2 3.7Å; V207-F237 HydrophobicContact CG2-CE2 3.63Å; V207-L240 HydrophobicContact CG2-CB 4.27Å; V207-L241 HydrophobicContact CG1-CB 4.42Å; V207-L241 HydrophobicContact CG1-CD1 4.05Å; V207-L241 HydrophobicContact CG2-CB 4.09Å; V207-L241 HydrophobicContact CG2-CD1 4.31Å; V207-A244 HydrophobicContact CG1-CB 3.43Å; V207-A244 VanDerWaalsContact CG1-CB 3.43Å
208	S	95.3	Very high	94.9	Very high	58 Å²	58	51.6 Å²	51.6	41%	0.406	27%	0.267	S	S	.	.	H	α-helix	trans	-61.3	-42.2	179.6	-55.6	0	0	0	0	111.5	G204 A206 L210 V211 E212	G204-S208 WeakPolarHBondContact O-CB 3.21Å; G204-S208 PolarHBondContact O-N 2.72Å; G204-S208 PolarHBondContact O-OG 3.17Å; A206-S208 PolarHBondContact O-N 2.82Å; S208-L210 VanDerWaalsContact C-N 3.33Å; S208-L210 PolarHBondContact O-N 2.93Å; S208-V211 PolarHBondContact O-N 2.87Å; S208-E212 WeakPolarHBondContact O-CB 3.34Å; S208-E212 WeakPolarHBondContact O-CG 3.41Å; S208-E212 PolarHBondContact O-N 3Å
209	S	95.8	Very high	94.9	Very high	15 Å²	15	50.9 Å²	50.9	11%	0.105	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-33.8	177.6	-59.2	0	0	0	0	112.9	V176 R180 E205 A206 V207 A213	V176-S209 VanDerWaalsContact CG1-OG 3.32Å; V176-S209 WeakPolarHBondContact CG1-OG 3.46Å; R180-S209 WeakPolarHBondContact CA-O 3.24Å; E205-S209 VanDerWaalsContact O-CB 3.29Å; E205-S209 WeakPolarHBondContact O-CB 3.46Å; E205-S209 PolarHBondContact O-N 3.44Å; E205-S209 PolarHBondContact O-OG 3.32Å; A206-S209 PolarHBondContact O-N 3.41Å; V207-S209 VanDerWaalsContact C-N 3.32Å; V207-S209 PolarHBondContact O-N 2.7Å; S209-A213 WeakPolarHBondContact O-CB 3.06Å; S209-A213 PolarHBondContact O-N 2.74Å
210	L	95.9	Very high	94.9	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-73.4	-41.5	176.7	-73.1	163.4	0	0	0	112.6	L179 L182 A206 V207 S208 A213 F237	L179-L210 HydrophobicContact CB-CD2 4.23Å; L179-L210 HydrophobicContact CB-CG 4.35Å; L179-L210 HydrophobicContact CD1-CD1 4.41Å; L179-L210 HydrophobicContact CD1-CG 4.25Å; L179-L210 HydrophobicContact CD2-CD2 4.4Å; L182-L210 HydrophobicContact CD2-CD2 3.7Å; A206-L210 VanDerWaalsContact O-CG 3.31Å; A206-L210 WeakPolarHBondContact O-CG 3.42Å; A206-L210 PolarHBondContact O-N 3.11Å; V207-L210 PolarHBondContact O-N 3.3Å; S208-L210 VanDerWaalsContact C-N 3.33Å; S208-L210 PolarHBondContact O-N 2.93Å; L210-A213 WeakPolarHBondContact O-CB 3.42Å; L210-A213 PolarHBondContact O-N 2.9Å; L210-F237 HydrophobicContact CD1-CE2 3.96Å; L210-F237 HydrophobicContact CD1-CZ 3.87Å
211	V	95.7	Very high	95	Very high	7 Å²	7	49.3 Å²	49.3	4%	0.042	26%	0.255	C	S	.	.	H	α-helix	trans	-69.2	-36.1	177.5	176.1	0	0	0	0	111.4	V207 S208 L241 A244 W245 H248 K262	V207-V211 WeakPolarHBondContact O-CG2 3.35Å; V207-V211 PolarHBondContact O-N 3.49Å; S208-V211 PolarHBondContact O-N 2.87Å; V211-L241 HydrophobicContact CG2-CD1 3.86Å; V211-A244 HydrophobicContact CG2-CB 3.98Å; V211-W245 HydrophobicContact CG1-CD2 4.22Å; V211-W245 HydrophobicContact CG1-CE3 3.94Å; V211-W245 HydrophobicContact CG1-CH2 4.32Å; V211-W245 HydrophobicContact CG1-CZ3 3.99Å; V211-W245 HydrophobicContact CG2-CD2 4.04Å; V211-W245 HydrophobicContact CG2-CG 4.3Å; V211-W245 HydrophobicContact CG2-CZ2 4.18Å; V211-H248 HydrophobicContact CG1-CB 3.67Å; V211-K262 PolarHBondContact O-NZ 3.22Å
212	E	92.5	Very high	95.1	Very high	92 Å²	92	40.7 Å²	40.7	43%	0.43	22%	0.218	S	C	.	.	H	α-helix	trans	-77.2	-16.4	175.5	-70.6	-177.7	-174.9	0	0	114.4	R180 S208 K214	R180-E212 HydrophobicContact CG-CB 4.5Å; R180-E212 IonicContact CZ-OE2 3.65Å; R180-E212 IonicContact NE-OE2 3.3Å; R180-E212 PolarHBondContact NE-OE2 2.92Å; R180-E212 IonicContact NH2-OE2 3.71Å; R180-E212 PolarHBondContact NH2-OE2 3.01Å; S208-E212 WeakPolarHBondContact O-CB 3.34Å; S208-E212 WeakPolarHBondContact O-CG 3.41Å; S208-E212 PolarHBondContact O-N 3Å; E212-K214 PolarHBondContact O-N 2.9Å
213	A	94.3	Very high	95.2	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.008	21%	0.212	C	C	.	.			trans	-58	128.2	-171.3	0	0	0	0	0	112.6	S209 L210 L215 K262	S209-A213 WeakPolarHBondContact O-CB 3.06Å; S209-A213 PolarHBondContact O-N 2.74Å; L210-A213 WeakPolarHBondContact O-CB 3.42Å; L210-A213 PolarHBondContact O-N 2.9Å; A213-L215 HydrophobicContact CB-CD2 3.9Å; A213-L215 HydrophobicContact CB-CG 4.08Å; A213-L215 PolarHBondContact O-N 3.29Å; A213-K262 WeakPolarHBondContact O-CE 3.46Å
214	K	93	Very high	95.2	Very high	189 Å²	189	39 Å²	39	82%	0.822	21%	0.211	S	C	*	.			trans	-83.4	62.5	178.1	-67.4	-174.1	179.1	-178.9	0	111.3	E212	E212-K214 PolarHBondContact O-N 2.9Å
215	L	93.6	Very high	95.3	Very high	13 Å²	13	39 Å²	39	7%	0.068	20%	0.203	C	C	.	.			trans	-61.5	144.1	179.3	-55.1	-179.8	0	0	0	111.9	L182 A213 D219 V220 A223 F269	L182-L215 HydrophobicContact CD1-CD2 3.69Å; L182-L215 HydrophobicContact CD2-CD2 4.13Å; L182-L215 HydrophobicContact CG-CD2 3.64Å; A213-L215 HydrophobicContact CB-CD2 3.9Å; A213-L215 HydrophobicContact CB-CG 4.08Å; A213-L215 PolarHBondContact O-N 3.29Å; L215-D219 HydrophobicContact CB-CB 4.41Å; L215-D219 HydrophobicContact CD2-CB 4.25Å; L215-V220 HydrophobicContact CD1-CG2 4.48Å; L215-A223 HydrophobicContact CD1-CB 3.67Å; L215-A223 HydrophobicContact CD2-CB 4.38Å; L215-F269 HydrophobicContact CD1-CD1 3.74Å; L215-F269 HydrophobicContact CD1-CE1 3.82Å; L215-F269 HydrophobicContact CD1-CG 4.44Å
216	K	94.3	Very high	95.4	Very high	143 Å²	143	34.6 Å²	34.6	62%	0.622	18%	0.182	S	C	*	.			trans	-81.4	167.4	157.3	-53.6	171	-176.8	175.4	0	109.5	S218 D219	K216-S218 PolarHBondContact O-N 3.41Å; K216-D219 WeakPolarHBondContact CB-OD2 3.5Å; K216-D219 VanDerWaalsContact CG-OD2 3.3Å; K216-D219 WeakPolarHBondContact CG-OD2 3.37Å; K216-D219 PolarHBondContact N-OD2 3.22Å; K216-D219 PolarHBondContact O-N 3Å
217	I	92.6	Very high	95.5	Very high	56 Å²	56	34.6 Å²	34.6	29%	0.287	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-58.5	-31.8	174.4	-63.7	175.4	0	0	0	111.6	T265 R268 H315	I217-T265 HydrophobicContact CG1-CG2 3.77Å; I217-R268 PolarHBondContact O-NH1 2.93Å; I217-H315 WeakPolarHBondContact CG2-NE2 3.43Å
218	S	94.6	Very high	95.5	Very high	71 Å²	71	34.5 Å²	34.5	50%	0.497	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-66.1	-38	173.9	53.3	0	0	0	0	113.6	K216 V220	K216-S218 PolarHBondContact O-N 3.41Å; S218-V220 VanDerWaalsContact C-N 3.28Å; S218-V220 PolarHBondContact O-N 3.28Å
219	D	95.8	Very high	95.6	Very high	10 Å²	10	33.5 Å²	33.5	5%	0.053	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-81.2	-7.2	-168.9	-51.7	-50.4	0	0	0	113.3	L182 T183 E184 L215 K216 G221 C222 A223	L182-D219 HydrophobicContact CD1-CB 4.43Å; T183-D219 WeakPolarHBondContact CA-OD1 3.23Å; E184-D219 PolarHBondContact N-OD1 3.04Å; L215-D219 HydrophobicContact CB-CB 4.41Å; L215-D219 HydrophobicContact CD2-CB 4.25Å; K216-D219 WeakPolarHBondContact CB-OD2 3.5Å; K216-D219 VanDerWaalsContact CG-OD2 3.3Å; K216-D219 WeakPolarHBondContact CG-OD2 3.37Å; K216-D219 PolarHBondContact N-OD2 3.22Å; K216-D219 PolarHBondContact O-N 3Å; D219-G221 PolarHBondContact O-N 3.04Å; D219-C222 PolarHBondContact O-N 3.37Å; D219-A223 PolarHBondContact O-N 3.27Å
220	V	96.4	Very high	95.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-31.8	178.7	-177.3	0	0	0	0	111.4	L215 S218 A223 V224 F269 E272	L215-V220 HydrophobicContact CD1-CG2 4.48Å; S218-V220 VanDerWaalsContact C-N 3.28Å; S218-V220 PolarHBondContact O-N 3.28Å; V220-A223 PolarHBondContact O-N 3.44Å; V220-V224 HydrophobicContact CG1-CG2 4.11Å; V220-V224 WeakPolarHBondContact O-CB 3.38Å; V220-V224 VanDerWaalsContact O-CG2 3.24Å; V220-V224 WeakPolarHBondContact O-CG2 3.39Å; V220-V224 PolarHBondContact O-N 3.32Å; V220-F269 HydrophobicContact CG1-CB 4.15Å; V220-F269 HydrophobicContact CG1-CD2 4.18Å; V220-F269 HydrophobicContact CG1-CG 4.36Å; V220-E272 HydrophobicContact CG1-CG 4.19Å
221	G	94.9	Very high	95.7	Very high	25 Å²	25	33.6 Å²	33.6	26%	0.258	17%	0.171	S	C	.	.	H	α-helix	trans	-61.8	-54.1	177.3	0	0	0	0	0	112.3	D219 A223 V224 H225	D219-G221 PolarHBondContact O-N 3.04Å; G221-A223 VanDerWaalsContact C-N 3.31Å; G221-A223 PolarHBondContact O-N 3.32Å; G221-V224 PolarHBondContact O-N 3.41Å; G221-H225 WeakPolarHBondContact O-CB 3.4Å; G221-H225 PolarHBondContact O-N 3.42Å
222	C	95.9	Very high	95.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56.6	-41	172	178.8	0	0	0	0	112.6	L182 T183 E184 R187 D219 H225 L226	L182-C222 HydrophobicContact CD1-CB 4.1Å; T183-C222 PolarHBondContact O-SG 2.9Å; T183-C222 VanDerWaalsContact O-SG 3.32Å; E184-C222 VanDerWaalsContact OE2-CB 3.3Å; E184-C222 WeakPolarHBondContact OE2-CB 3.46Å; E184-C222 PolarHBondContact OE2-N 2.87Å; R187-C222 VanDerWaalsContact CA-SG 3.59Å; R187-C222 HydrophobicContact CB-CB 4.33Å; D219-C222 PolarHBondContact O-N 3.37Å; C222-H225 PolarHBondContact O-N 3.34Å; C222-L226 WeakPolarHBondContact O-CG 3.3Å; C222-L226 PolarHBondContact O-N 2.92Å
223	A	97.3	Very high	95.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.7	-47.1	176.7	0	0	0	0	0	112.6	L182 L215 D219 V220 G221 L226 C227 F269	L182-A223 HydrophobicContact CD1-CB 4.03Å; L182-A223 HydrophobicContact CD2-CB 4.11Å; L215-A223 HydrophobicContact CD1-CB 3.67Å; L215-A223 HydrophobicContact CD2-CB 4.38Å; D219-A223 PolarHBondContact O-N 3.27Å; V220-A223 PolarHBondContact O-N 3.44Å; G221-A223 VanDerWaalsContact C-N 3.31Å; G221-A223 PolarHBondContact O-N 3.32Å; A223-L226 PolarHBondContact O-N 3.44Å; A223-C227 WeakPolarHBondContact O-CB 3.37Å; A223-C227 PolarHBondContact O-N 3.15Å; A223-C227 PolarHBondContact O-SG 2.87Å; A223-F269 HydrophobicContact CB-CD2 4.48Å; A223-F269 HydrophobicContact CB-CE1 4Å; A223-F269 HydrophobicContact CB-CE2 3.75Å; A223-F269 HydrophobicContact CB-CZ 3.48Å; A223-F269 VanDerWaalsContact CB-CZ 3.48Å
224	V	97.7	Very high	95.9	Very high	8 Å²	8	33.2 Å²	33.2	5%	0.048	17%	0.166	C	C	.	.	H	α-helix	trans	-66.8	-38	178.4	173.2	0	0	0	0	111.8	V220 G221 C227 S228 F269 E272 L273 V276	V220-V224 HydrophobicContact CG1-CG2 4.11Å; V220-V224 WeakPolarHBondContact O-CB 3.38Å; V220-V224 VanDerWaalsContact O-CG2 3.24Å; V220-V224 WeakPolarHBondContact O-CG2 3.39Å; V220-V224 PolarHBondContact O-N 3.32Å; G221-V224 PolarHBondContact O-N 3.41Å; V224-C227 PolarHBondContact O-N 3.06Å; V224-S228 WeakPolarHBondContact O-CB 3.39Å; V224-S228 PolarHBondContact O-N 3.2Å; V224-S228 PolarHBondContact O-OG 2.87Å; V224-F269 HydrophobicContact CG2-CD2 3.63Å; V224-F269 HydrophobicContact CG2-CE2 3.68Å; V224-E272 HydrophobicContact CG1-CB 4.47Å; V224-E272 HydrophobicContact CG2-CB 3.6Å; V224-E272 HydrophobicContact CG2-CG 4.44Å; V224-L273 HydrophobicContact CG2-CD2 4.48Å; V224-V276 HydrophobicContact CG1-CB 4.46Å; V224-V276 HydrophobicContact CG1-CG1 4Å; V224-V276 HydrophobicContact CG1-CG2 3.65Å
225	H	96.9	Very high	95.9	Very high	34 Å²	34	26.6 Å²	26.6	16%	0.157	15%	0.146	C	C	.	.	H	α-helix	trans	-60.2	-50.1	173	171.1	79.7	0	0	0	111.6	S191 G221 C222 S228 L229	S191-H225 PolarHBondContact OG-NE2 2.63Å; G221-H225 WeakPolarHBondContact O-CB 3.4Å; G221-H225 PolarHBondContact O-N 3.42Å; C222-H225 PolarHBondContact O-N 3.34Å; H225-S228 WeakPolarHBondContact O-CB 3.16Å; H225-S228 PolarHBondContact O-N 2.9Å; H225-S228 VanDerWaalsContact O-N 3.16Å; H225-L229 PolarHBondContact O-N 3.18Å
226	L	97.5	Very high	96	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.7	-42.9	177.3	-68.5	171.7	0	0	0	111.9	L179 L182 L190 C222 A223 S228 L229 F230	L179-L226 HydrophobicContact CD2-CD1 4.1Å; L182-L226 HydrophobicContact CD2-CD1 4.31Å; L190-L226 HydrophobicContact CB-CD1 3.93Å; L190-L226 HydrophobicContact CB-CD2 3.85Å; L190-L226 HydrophobicContact CD1-CD1 3.72Å; L190-L226 HydrophobicContact CG-CD1 4.45Å; C222-L226 WeakPolarHBondContact O-CG 3.3Å; C222-L226 PolarHBondContact O-N 2.92Å; A223-L226 PolarHBondContact O-N 3.44Å; L226-S228 VanDerWaalsContact C-N 3.27Å; L226-S228 PolarHBondContact O-N 3.42Å; L226-L229 HydrophobicContact CD2-CD1 4.4Å; L226-L229 PolarHBondContact O-N 2.89Å; L226-F230 WeakPolarHBondContact O-CD2 3.43Å; L226-F230 PolarHBondContact O-N 3.4Å
227	C	97.9	Very high	96.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-57	-40.5	172.5	-73.1	0	0	0	0	112.2	A223 V224 F230 H231 F237 L273 L278	A223-C227 WeakPolarHBondContact O-CB 3.37Å; A223-C227 PolarHBondContact O-N 3.15Å; A223-C227 PolarHBondContact O-SG 2.87Å; V224-C227 PolarHBondContact O-N 3.06Å; C227-F230 WeakPolarHBondContact O-CB 3.41Å; C227-F230 PolarHBondContact O-N 3.21Å; C227-H231 WeakPolarHBondContact O-CB 3.41Å; C227-H231 PolarHBondContact O-N 3.4Å; C227-F237 HydrophobicContact CB-CE1 3.91Å; C227-F237 HydrophobicContact CB-CZ 4.1Å; C227-F237 WeakPolarHBondContact O-CE1 3.28Å; C227-L273 HydrophobicContact CB-CD2 3.65Å; C227-L278 VanDerWaalsContact C-CD1 3.46Å; C227-L278 HydrophobicContact CB-CD1 3.77Å; C227-L278 VanDerWaalsContact O-CD1 3.26Å; C227-L278 WeakPolarHBondContact O-CD1 3.48Å
228	S	97.6	Very high	96.3	Very high	1 Å²	1	23 Å²	23	1%	0.007	13%	0.132	C	C	.	.	H	α-helix	trans	-64	-43.3	176.6	-58.6	0	0	0	0	111.6	N149 V224 H225 L226 F230 H231 Q232	N149-S228 PolarHBondContact ND2-OG 3.44Å; N149-S228 WeakPolarHBondContact OD1-CB 3.46Å; V224-S228 WeakPolarHBondContact O-CB 3.39Å; V224-S228 PolarHBondContact O-N 3.2Å; V224-S228 PolarHBondContact O-OG 2.87Å; H225-S228 WeakPolarHBondContact O-CB 3.16Å; H225-S228 PolarHBondContact O-N 2.9Å; H225-S228 VanDerWaalsContact O-N 3.16Å; L226-S228 VanDerWaalsContact C-N 3.27Å; L226-S228 PolarHBondContact O-N 3.42Å; S228-F230 VanDerWaalsContact C-N 3.34Å; S228-F230 PolarHBondContact O-N 3.3Å; S228-H231 PolarHBondContact O-N 3.5Å; S228-Q232 VanDerWaalsContact O-CB 3.32Å; S228-Q232 WeakPolarHBondContact O-CB 3.34Å; S228-Q232 WeakPolarHBondContact O-CG 3.25Å; S228-Q232 PolarHBondContact O-N 3.26Å
229	L	96.7	Very high	96.4	Very high	36 Å²	36	23.3 Å²	23.3	19%	0.188	13%	0.132	C	C	.	.	H	α-helix	trans	-61.4	-40	173.5	-64.7	-177	0	0	0	112.5	F194 H225 L226 R233	F194-L229 HydrophobicContact CD1-CB 3.97Å; F194-L229 HydrophobicContact CD1-CD1 4.16Å; F194-L229 HydrophobicContact CE1-CB 3.66Å; F194-L229 VanDerWaalsContact CZ-C 3.49Å; F194-L229 HydrophobicContact CZ-CB 4.03Å; F194-L229 VanDerWaalsContact CZ-O 3.26Å; F194-L229 WeakPolarHBondContact CZ-O 3.41Å; H225-L229 PolarHBondContact O-N 3.18Å; L226-L229 HydrophobicContact CD2-CD1 4.4Å; L226-L229 PolarHBondContact O-N 2.89Å; L229-R233 WeakPolarHBondContact O-CB 3.3Å; L229-R233 PolarHBondContact O-N 3.21Å
230	F	97.3	Very high	96.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62	-49.4	173.8	-92.7	-82.3	0	0	0	111.8	F175 L179 F194 L199 I203 A206 L226 C227 S228 R233 Y234 F237	F175-F230 HydrophobicContact CE1-CE2 4.06Å; F175-F230 AromaticContact CE1-CZ 3.96Å; F175-F230 HydrophobicContact CE1-CZ 3.96Å; L179-F230 HydrophobicContact CD1-CE2 4.04Å; L179-F230 HydrophobicContact CD1-CZ 4.11Å; F194-F230 HydrophobicContact CD2-CD2 4.19Å; F194-F230 AromaticContact CD2-CE2 4Å; F194-F230 HydrophobicContact CD2-CE2 4Å; F194-F230 HydrophobicContact CD2-CZ 4.21Å; F194-F230 HydrophobicContact CE2-CB 4.41Å; F194-F230 AromaticContact CE2-CD1 3.81Å; F194-F230 HydrophobicContact CE2-CD1 3.81Å; F194-F230 AromaticContact CE2-CD2 3.73Å; F194-F230 HydrophobicContact CE2-CD2 3.73Å; F194-F230 AromaticContact CE2-CE1 3.96Å; F194-F230 HydrophobicContact CE2-CE1 3.96Å; F194-F230 AromaticContact CE2-CE2 3.89Å; F194-F230 HydrophobicContact CE2-CE2 3.89Å; F194-F230 AromaticContact CE2-CG 3.68Å; F194-F230 HydrophobicContact CE2-CG 3.68Å; F194-F230 HydrophobicContact CE2-CZ 4.01Å; F194-F230 HydrophobicContact CZ-CG 4.35Å; L199-F230 HydrophobicContact CB-CE1 4.22Å; L199-F230 HydrophobicContact CD1-CE1 3.98Å; L199-F230 HydrophobicContact CD1-CZ 3.85Å; I203-F230 HydrophobicContact CD1-CD1 4.14Å; I203-F230 HydrophobicContact CD1-CE1 4.13Å; A206-F230 HydrophobicContact CB-CE1 3.89Å; A206-F230 HydrophobicContact CB-CZ 3.67Å; L226-F230 WeakPolarHBondContact O-CD2 3.43Å; L226-F230 PolarHBondContact O-N 3.4Å; C227-F230 WeakPolarHBondContact O-CB 3.41Å; C227-F230 PolarHBondContact O-N 3.21Å; S228-F230 VanDerWaalsContact C-N 3.34Å; S228-F230 PolarHBondContact O-N 3.3Å; F230-R233 PolarHBondContact O-N 2.86Å; F230-R233 VanDerWaalsContact O-N 3.17Å; F230-Y234 AromaticContact CD1-CD2 3.79Å; F230-Y234 HydrophobicContact CD1-CD2 3.79Å; F230-Y234 HydrophobicContact CD1-CE2 4.01Å; F230-Y234 HydrophobicContact CE1-CD2 4.5Å; F230-Y234 HydrophobicContact CE1-CE2 4.37Å; F230-Y234 WeakPolarHBondContact O-CD2 3.45Å; F230-Y234 PolarHBondContact O-N 3.48Å; F230-F237 HydrophobicContact CB-CB 4.38Å; F230-F237 HydrophobicContact CB-CD1 3.62Å; F230-F237 HydrophobicContact CB-CD2 3.61Å; F230-F237 HydrophobicContact CB-CE1 3.65Å; F230-F237 HydrophobicContact CB-CE2 3.64Å; F230-F237 HydrophobicContact CB-CG 3.6Å; F230-F237 HydrophobicContact CB-CZ 3.65Å; F230-F237 AromaticContact CD1-CD2 3.72Å; F230-F237 HydrophobicContact CD1-CD2 3.72Å; F230-F237 AromaticContact CD1-CE2 3.9Å; F230-F237 HydrophobicContact CD1-CE2 3.9Å; F230-F237 HydrophobicContact CD1-CG 4.39Å; F230-F237 HydrophobicContact CD2-CE2 4.12Å; F230-F237 HydrophobicContact CD2-CZ 4.31Å; F230-F237 AromaticContact CG-CD2 3.8Å; F230-F237 HydrophobicContact CG-CD2 3.8Å; F230-F237 AromaticContact CG-CE2 3.65Å; F230-F237 HydrophobicContact CG-CE2 3.65Å; F230-F237 HydrophobicContact CG-CG 4.3Å; F230-F237 HydrophobicContact CG-CZ 4.02Å
231	H	96.9	Very high	96.5	Very high	20 Å²	20	25.6 Å²	25.6	9%	0.093	14%	0.144	C	C	.	.	H	α-helix	trans	-64.6	-38.2	179.7	173.6	72.9	0	0	0	113.5	N149 R156 C227 S228 R233 F237 L278	N149-H231 PolarHBondContact O-CD2 3.19Å; N149-H231 PolarHBondContact O-NE2 3.1Å; R156-H231 PolarHBondContact NE-O 2.92Å; R156-H231 VanDerWaalsContact NE-O 3.15Å; R156-H231 PolarHBondContact NH2-ND1 3.26Å; R156-H231 PolarHBondContact NH2-O 2.97Å; C227-H231 WeakPolarHBondContact O-CB 3.41Å; C227-H231 PolarHBondContact O-N 3.4Å; S228-H231 PolarHBondContact O-N 3.5Å; H231-R233 PolarHBondContact O-N 3.37Å; H231-F237 HydrophobicContact CB-CD1 4.2Å; H231-L278 HydrophobicContact CB-CD1 3.63Å; H231-L278 HydrophobicContact CB-CG 3.86Å
232	Q	95.8	Very high	96.6	Very high	40 Å²	40	25 Å²	25	19%	0.187	14%	0.135	C	C	.	.	H	α-helix	trans	-67	-21.5	174.9	-71.7	164.6	30.3	0	0	112.8	N149 A152 R156 S228	N149-Q232 PolarHBondContact OD1-NE2 2.95Å; A152-Q232 HydrophobicContact CB-CG 4.2Å; R156-Q232 VanDerWaalsContact CG-O 3.31Å; R156-Q232 WeakPolarHBondContact CG-O 3.45Å; S228-Q232 VanDerWaalsContact O-CB 3.32Å; S228-Q232 WeakPolarHBondContact O-CB 3.34Å; S228-Q232 WeakPolarHBondContact O-CG 3.25Å; S228-Q232 PolarHBondContact O-N 3.26Å
233	R	95.8	Very high	96.6	Very high	39 Å²	39	31.3 Å²	31.3	15%	0.147	17%	0.165	C	C	.	.	H	α-helix	trans	-105.9	-33.3	-179.3	-171	174.8	-71	-159.5	-1.9	114.4	P157 F162 F194 A195 L229 F230 H231	P157-R233 HydrophobicContact CG-CG 4.42Å; F162-R233 HydrophobicContact CE1-CG 3.74Å; F162-R233 HydrophobicContact CZ-CG 3.84Å; F194-R233 HydrophobicContact CE1-CB 4.44Å; F194-R233 HydrophobicContact CZ-CB 4.1Å; F194-R233 PolarHBondContact O-NH1 2.93Å; A195-R233 PolarHBondContact O-NH1 2.76Å; L229-R233 WeakPolarHBondContact O-CB 3.3Å; L229-R233 PolarHBondContact O-N 3.21Å; F230-R233 PolarHBondContact O-N 2.86Å; F230-R233 VanDerWaalsContact O-N 3.17Å; H231-R233 PolarHBondContact O-N 3.37Å
234	Y	95.5	Very high	96.6	Very high	12 Å²	12	32.4 Å²	32.4	5%	0.047	17%	0.174	C	C	.	.			trans	-130.2	118.5	-170.8	-50.8	-77.7	0	0	0	111.2	F162 F194 L197 L199 S200 I203 F230 E236 F237	F162-Y234 HydrophobicContact CD1-CE1 4.24Å; F162-Y234 HydrophobicContact CE1-CD1 4.06Å; F162-Y234 AromaticContact CE1-CE1 3.42Å; F162-Y234 HydrophobicContact CE1-CE1 3.42Å; F162-Y234 VanDerWaalsContact CE1-CE1 3.42Å; F162-Y234 HydrophobicContact CZ-CD1 4.28Å; F162-Y234 HydrophobicContact CZ-CE1 4.09Å; F194-Y234 AromaticContact CE2-CE2 3.81Å; F194-Y234 HydrophobicContact CE2-CE2 3.81Å; F194-Y234 HydrophobicContact CZ-CD2 4.37Å; F194-Y234 AromaticContact CZ-CE2 3.72Å; F194-Y234 HydrophobicContact CZ-CE2 3.72Å; L197-Y234 PolarHBondContact O-OH 2.98Å; L199-Y234 HydrophobicContact CB-CE2 4.08Å; L199-Y234 PolarHBondContact N-OH 3.39Å; S200-Y234 VanDerWaalsContact OG-CE1 3.28Å; S200-Y234 WeakPolarHBondContact OG-CE1 3.29Å; I203-Y234 HydrophobicContact CD1-CD1 3.98Å; I203-Y234 HydrophobicContact CD1-CD2 3.72Å; I203-Y234 HydrophobicContact CD1-CE1 4.4Å; I203-Y234 HydrophobicContact CD1-CE2 4.18Å; I203-Y234 HydrophobicContact CD1-CG 3.62Å; F230-Y234 AromaticContact CD1-CD2 3.79Å; F230-Y234 HydrophobicContact CD1-CD2 3.79Å; F230-Y234 HydrophobicContact CD1-CE2 4.01Å; F230-Y234 HydrophobicContact CE1-CD2 4.5Å; F230-Y234 HydrophobicContact CE1-CE2 4.37Å; F230-Y234 WeakPolarHBondContact O-CD2 3.45Å; F230-Y234 PolarHBondContact O-N 3.48Å; Y234-E236 PolarHBondContact O-N 3.05Å; Y234-F237 PolarHBondContact O-N 3.19Å
235	A	93.6	Very high	96.6	Very high	50 Å²	50	32 Å²	32	41%	0.413	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-40.6	-177.2	0	0	0	0	0	113.5	F237 P239	A235-F237 PolarHBondContact O-N 3.23Å; A235-F237 VanDerWaalsContact O-N 3.15Å; A235-P239 WeakPolarHBondContact O-CD 3.45Å
236	E	94.6	Very high	96.5	Very high	127 Å²	127	35.5 Å²	35.5	59%	0.593	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.6	-178.5	-58.2	-54.6	119.1	0	0	114.4	Y234 L240	Y234-E236 PolarHBondContact O-N 3.05Å; E236-L240 HydrophobicContact CB-CD1 4.14Å; E236-L240 WeakPolarHBondContact O-CB 3.48Å; E236-L240 WeakPolarHBondContact O-CD1 3.47Å; E236-L240 VanDerWaalsContact O-CG 3.27Å; E236-L240 WeakPolarHBondContact O-CG 3.46Å; E236-L240 PolarHBondContact O-N 3.26Å
237	F	97.3	Very high	96.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.8	-50.3	-170.8	177.4	-101	0	0	0	113.4	I203 V207 L210 C227 F230 H231 Y234 A235 L240 L241 L278	I203-F237 HydrophobicContact CG2-CB 4.18Å; I203-F237 HydrophobicContact CG2-CD2 4.11Å; V207-F237 HydrophobicContact CG2-CD2 3.7Å; V207-F237 HydrophobicContact CG2-CE2 3.63Å; L210-F237 HydrophobicContact CD1-CE2 3.96Å; L210-F237 HydrophobicContact CD1-CZ 3.87Å; C227-F237 HydrophobicContact CB-CE1 3.91Å; C227-F237 HydrophobicContact CB-CZ 4.1Å; C227-F237 WeakPolarHBondContact O-CE1 3.28Å; F230-F237 HydrophobicContact CB-CB 4.38Å; F230-F237 HydrophobicContact CB-CD1 3.62Å; F230-F237 HydrophobicContact CB-CD2 3.61Å; F230-F237 HydrophobicContact CB-CE1 3.65Å; F230-F237 HydrophobicContact CB-CE2 3.64Å; F230-F237 HydrophobicContact CB-CG 3.6Å; F230-F237 HydrophobicContact CB-CZ 3.65Å; F230-F237 AromaticContact CD1-CD2 3.72Å; F230-F237 HydrophobicContact CD1-CD2 3.72Å; F230-F237 AromaticContact CD1-CE2 3.9Å; F230-F237 HydrophobicContact CD1-CE2 3.9Å; F230-F237 HydrophobicContact CD1-CG 4.39Å; F230-F237 HydrophobicContact CD2-CE2 4.12Å; F230-F237 HydrophobicContact CD2-CZ 4.31Å; F230-F237 AromaticContact CG-CD2 3.8Å; F230-F237 HydrophobicContact CG-CD2 3.8Å; F230-F237 AromaticContact CG-CE2 3.65Å; F230-F237 HydrophobicContact CG-CE2 3.65Å; F230-F237 HydrophobicContact CG-CG 4.3Å; F230-F237 HydrophobicContact CG-CZ 4.02Å; H231-F237 HydrophobicContact CB-CD1 4.2Å; Y234-F237 PolarHBondContact O-N 3.19Å; A235-F237 PolarHBondContact O-N 3.23Å; A235-F237 VanDerWaalsContact O-N 3.15Å; F237-L240 PolarHBondContact O-N 3.13Å; F237-L241 HydrophobicContact CE1-CD2 3.75Å; F237-L241 HydrophobicContact CZ-CD2 3.91Å; F237-L241 VanDerWaalsContact O-CB 3.25Å; F237-L241 WeakPolarHBondContact O-CB 3.49Å; F237-L241 PolarHBondContact O-N 3.34Å; F237-L278 HydrophobicContact CE1-CD1 4.23Å
238	A	96	Very high	96.2	Very high	10 Å²	10	45.2 Å²	45.2	8%	0.083	23%	0.229	C	C	.	.	H	α-helix	trans	-66.4	-43.5	-176.5	0	0	0	0	0	113.4	L240 L241 L242 L278	A238-L240 PolarHBondContact O-N 3.03Å; A238-L241 PolarHBondContact O-N 2.77Å; A238-L242 WeakPolarHBondContact O-CB 3.31Å; A238-L242 PolarHBondContact O-N 2.87Å; A238-L278 HydrophobicContact CB-CD2 3.8Å; A238-L278 HydrophobicContact CB-CG 4.41Å
239	P	96.3	Very high	95.9	Very high	78 Å²	78	45.4 Å²	45.4	51%	0.506	23%	0.229	S	C	.	.	H	α-helix	trans	-58.7	-45.5	173	-26.5	35.5	0	0	0	113.4	A235 L242 Q243	A235-P239 WeakPolarHBondContact O-CD 3.45Å; P239-L242 PolarHBondContact O-N 2.91Å; P239-Q243 WeakPolarHBondContact O-CB 3.37Å; P239-Q243 PolarHBondContact O-N 3.36Å
240	L	97.4	Very high	95.6	Very high	57 Å²	57	48.8 Å²	48.8	30%	0.298	24%	0.244	S	C	.	.	H	α-helix	trans	-65.8	-40.2	177.9	-70.6	172.3	0	0	0	111.7	I203 V207 E236 F237 A238 Q243 A244	I203-L240 HydrophobicContact CB-CD1 4.44Å; I203-L240 HydrophobicContact CG2-CD1 3.82Å; V207-L240 HydrophobicContact CG2-CB 4.27Å; E236-L240 HydrophobicContact CB-CD1 4.14Å; E236-L240 WeakPolarHBondContact O-CB 3.48Å; E236-L240 WeakPolarHBondContact O-CD1 3.47Å; E236-L240 VanDerWaalsContact O-CG 3.27Å; E236-L240 WeakPolarHBondContact O-CG 3.46Å; E236-L240 PolarHBondContact O-N 3.26Å; F237-L240 PolarHBondContact O-N 3.13Å; A238-L240 PolarHBondContact O-N 3.03Å; L240-Q243 PolarHBondContact O-N 3.02Å; L240-A244 WeakPolarHBondContact O-CB 3.41Å; L240-A244 PolarHBondContact O-N 2.94Å
241	L	97.8	Very high	95.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.5	-43.6	176.6	-173.1	64.1	0	0	0	111.6	V207 V211 F237 A238 A244 W245 L273 L278 F279	V207-L241 HydrophobicContact CG1-CB 4.42Å; V207-L241 HydrophobicContact CG1-CD1 4.05Å; V207-L241 HydrophobicContact CG2-CB 4.09Å; V207-L241 HydrophobicContact CG2-CD1 4.31Å; V211-L241 HydrophobicContact CG2-CD1 3.86Å; F237-L241 HydrophobicContact CE1-CD2 3.75Å; F237-L241 HydrophobicContact CZ-CD2 3.91Å; F237-L241 VanDerWaalsContact O-CB 3.25Å; F237-L241 WeakPolarHBondContact O-CB 3.49Å; F237-L241 PolarHBondContact O-N 3.34Å; A238-L241 PolarHBondContact O-N 2.77Å; L241-A244 PolarHBondContact O-N 3.28Å; L241-W245 PolarHBondContact O-N 3.43Å; L241-L273 HydrophobicContact CD2-CD1 3.98Å; L241-L278 HydrophobicContact CD2-CD2 4Å; L241-F279 HydrophobicContact CB-CE1 4.31Å; L241-F279 HydrophobicContact CB-CZ 4.49Å; L241-F279 HydrophobicContact CD2-CE1 4.26Å; L241-F279 HydrophobicContact CD2-CZ 4.02Å; L241-F279 HydrophobicContact CG-CE1 4.28Å; L241-F279 HydrophobicContact CG-CZ 3.99Å
242	L	96.7	Very high	94.5	Very high	12 Å²	12	53.3 Å²	53.3	6%	0.063	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-41.9	176.2	-177.7	65.2	0	0	0	111.8	A238 P239 W245 K246 F279 E283 L287	A238-L242 WeakPolarHBondContact O-CB 3.31Å; A238-L242 PolarHBondContact O-N 2.87Å; P239-L242 PolarHBondContact O-N 2.91Å; L242-W245 PolarHBondContact O-N 2.57Å; L242-K246 WeakPolarHBondContact O-CG 3.4Å; L242-K246 PolarHBondContact O-N 2.78Å; L242-K246 VanDerWaalsContact O-N 3.07Å; L242-F279 HydrophobicContact CB-CD1 4.14Å; L242-F279 HydrophobicContact CB-CE1 3.76Å; L242-F279 HydrophobicContact CB-CZ 4.39Å; L242-F279 HydrophobicContact CD1-CD1 4.27Å; L242-F279 HydrophobicContact CD1-CE1 4.28Å; L242-F279 HydrophobicContact CD1-CG 4.43Å; L242-F279 HydrophobicContact CD1-CZ 4.44Å; L242-E283 HydrophobicContact CD1-CB 4.33Å; L242-E283 HydrophobicContact CD2-CB 3.74Å; L242-E283 HydrophobicContact CD2-CG 3.78Å; L242-E283 WeakPolarHBondContact CD2-OE1 3.44Å; L242-L287 HydrophobicContact CD1-CD2 4.18Å
243	Q	96.6	Very high	93.8	Very high	134 Å²	134	56.1 Å²	56.1	63%	0.626	29%	0.285	S	S	*	.	H	α-helix	trans	-64.4	-42.3	176.4	-169.1	-176.9	34.2	0	0	111.7	P239 L240 K246 K247	P239-Q243 WeakPolarHBondContact O-CB 3.37Å; P239-Q243 PolarHBondContact O-N 3.36Å; L240-Q243 PolarHBondContact O-N 3.02Å; Q243-K246 PolarHBondContact O-N 3.17Å; Q243-K247 PolarHBondContact O-N 2.91Å
244	A	97	Very high	92.8	Very high	23 Å²	23	62.4 Å²	62.4	19%	0.19	32%	0.316	C	S	.	.	H	α-helix	trans	-64.2	-42.8	177.3	0	0	0	0	0	112.2	V207 V211 L240 L241 K247 H248	V207-A244 HydrophobicContact CG1-CB 3.43Å; V207-A244 VanDerWaalsContact CG1-CB 3.43Å; V211-A244 HydrophobicContact CG2-CB 3.98Å; L240-A244 WeakPolarHBondContact O-CB 3.41Å; L240-A244 PolarHBondContact O-N 2.94Å; L241-A244 PolarHBondContact O-N 3.28Å; A244-K247 PolarHBondContact O-N 3.44Å; A244-H248 WeakPolarHBondContact O-CB 3.41Å; A244-H248 PolarHBondContact O-N 3Å
245	W	97.1	Very high	92	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.4	-46.2	174.2	-81.8	116.8	0	0	0	112.7	V211 L241 L242 K247 H248 F249 D266 F269 I270 F279 L287	V211-W245 HydrophobicContact CG1-CD2 4.22Å; V211-W245 HydrophobicContact CG1-CE3 3.94Å; V211-W245 HydrophobicContact CG1-CH2 4.32Å; V211-W245 HydrophobicContact CG1-CZ3 3.99Å; V211-W245 HydrophobicContact CG2-CD2 4.04Å; V211-W245 HydrophobicContact CG2-CG 4.3Å; V211-W245 HydrophobicContact CG2-CZ2 4.18Å; L241-W245 PolarHBondContact O-N 3.43Å; L242-W245 PolarHBondContact O-N 2.57Å; W245-K247 VanDerWaalsContact C-N 3.33Å; W245-K247 PolarHBondContact O-N 3.43Å; W245-H248 AromaticContact CE3-CD2 3.78Å; W245-H248 AromaticContact CZ3-CD2 3.67Å; W245-H248 AromaticContact CZ3-NE2 3.84Å; W245-H248 PolarHBondContact O-N 3.19Å; W245-F249 HydrophobicContact CB-CD2 4.46Å; W245-F249 HydrophobicContact CB-CE2 4.22Å; W245-F249 HydrophobicContact CD2-CE2 4.27Å; W245-F249 HydrophobicContact CE3-CD2 4.41Å; W245-F249 HydrophobicContact CE3-CE1 4.5Å; W245-F249 AromaticContact CE3-CE2 3.59Å; W245-F249 HydrophobicContact CE3-CE2 3.59Å; W245-F249 AromaticContact CE3-CZ 3.66Å; W245-F249 HydrophobicContact CE3-CZ 3.66Å; W245-F249 HydrophobicContact CZ3-CE2 4.37Å; W245-F249 AromaticContact CZ3-CZ 3.96Å; W245-F249 HydrophobicContact CZ3-CZ 3.96Å; W245-F249 WeakPolarHBondContact O-CD2 3.48Å; W245-F249 PolarHBondContact O-N 2.97Å; W245-D266 HydrophobicContact CH2-CB 4Å; W245-D266 WeakPolarHBondContact CH2-OD1 3.38Å; W245-D266 HydrophobicContact CZ3-CB 3.71Å; W245-F269 HydrophobicContact CH2-CD1 4.06Å; W245-F269 AromaticContact CZ2-CD1 3.56Å; W245-F269 HydrophobicContact CZ2-CD1 3.56Å; W245-F269 AromaticContact CZ2-CE1 3.94Å; W245-F269 HydrophobicContact CZ2-CE1 3.94Å; W245-F269 HydrophobicContact CZ2-CG 4.25Å; W245-I270 HydrophobicContact CD2-CG2 3.62Å; W245-I270 HydrophobicContact CE3-CG2 4.06Å; W245-I270 HydrophobicContact CG-CG2 3.85Å; W245-I270 HydrophobicContact CZ2-CG2 4.3Å; W245-F279 AromaticContact CD1-CZ 3.85Å; W245-L287 HydrophobicContact CB-CD2 4.03Å
246	K	94.8	Very high	90.9	Very high	106 Å²	106	73.4 Å²	73.4	46%	0.461	36%	0.359	S	S	.	.	H	α-helix	trans	-57	-46.8	175.9	-75.5	175.8	177.8	179.5	0	111.5	L242 Q243 H248 F249 E250 L287	L242-K246 WeakPolarHBondContact O-CG 3.4Å; L242-K246 PolarHBondContact O-N 2.78Å; L242-K246 VanDerWaalsContact O-N 3.07Å; Q243-K246 PolarHBondContact O-N 3.17Å; K246-H248 PolarHBondContact O-N 3.4Å; K246-F249 PolarHBondContact O-N 3.47Å; K246-E250 PolarHBondContact O-N 3.26Å; K246-L287 HydrophobicContact CG-CD1 3.89Å
247	K	94.5	Very high	89.9	Confident	165 Å²	165	70.8 Å²	70.8	72%	0.717	36%	0.359	S	S	*	.	H	α-helix	trans	-62.9	-38.9	176.7	-172.2	179	178.4	-176.5	0	112.9	Q243 A244 W245 E250 A251	Q243-K247 PolarHBondContact O-N 2.91Å; A244-K247 PolarHBondContact O-N 3.44Å; W245-K247 VanDerWaalsContact C-N 3.33Å; W245-K247 PolarHBondContact O-N 3.43Å; K247-E250 PolarHBondContact O-N 2.72Å; K247-A251 WeakPolarHBondContact O-CB 3.44Å; K247-A251 PolarHBondContact O-N 3.08Å
248	H	93.9	Very high	89	Confident	39 Å²	39	74.4 Å²	74.4	18%	0.181	38%	0.382	C	S	.	.	H	α-helix	trans	-67.7	-37.2	178	171	90	0	0	0	113	V211 A244 W245 K246 R252 D266	V211-H248 HydrophobicContact CG1-CB 3.67Å; A244-H248 WeakPolarHBondContact O-CB 3.41Å; A244-H248 PolarHBondContact O-N 3Å; W245-H248 AromaticContact CE3-CD2 3.78Å; W245-H248 AromaticContact CZ3-CD2 3.67Å; W245-H248 AromaticContact CZ3-NE2 3.84Å; W245-H248 PolarHBondContact O-N 3.19Å; K246-H248 PolarHBondContact O-N 3.4Å; H248-R252 PolarHBondContact NE2-NE 2.93Å; H248-R252 WeakPolarHBondContact O-CG 3.39Å; H248-R252 PolarHBondContact O-N 3.4Å; H248-D266 IonicContact CD2-OD2 3.9Å; H248-D266 IonicContact CE1-OD2 2.64Å; H248-D266 IonicContact NE2-OD2 2.73Å; H248-D266 PolarHBondContact NE2-OD2 3Å
249	F	92.1	Very high	88.6	Confident	5 Å²	5	77.8 Å²	77.8	2%	0.022	40%	0.399	C	S	.	.	H	α-helix	trans	-75.9	-33.6	174.4	-66.5	-56	0	0	0	112.7	W245 K246 R252 L263 D266 I270 L287 Q291	W245-F249 HydrophobicContact CB-CD2 4.46Å; W245-F249 HydrophobicContact CB-CE2 4.22Å; W245-F249 HydrophobicContact CD2-CE2 4.27Å; W245-F249 HydrophobicContact CE3-CD2 4.41Å; W245-F249 HydrophobicContact CE3-CE1 4.5Å; W245-F249 AromaticContact CE3-CE2 3.59Å; W245-F249 HydrophobicContact CE3-CE2 3.59Å; W245-F249 AromaticContact CE3-CZ 3.66Å; W245-F249 HydrophobicContact CE3-CZ 3.66Å; W245-F249 HydrophobicContact CZ3-CE2 4.37Å; W245-F249 AromaticContact CZ3-CZ 3.96Å; W245-F249 HydrophobicContact CZ3-CZ 3.96Å; W245-F249 WeakPolarHBondContact O-CD2 3.48Å; W245-F249 PolarHBondContact O-N 2.97Å; K246-F249 PolarHBondContact O-N 3.47Å; F249-R252 WeakPolarHBondContact O-CB 3.35Å; F249-R252 PolarHBondContact O-N 2.88Å; F249-L263 HydrophobicContact CD1-CD1 4.49Å; F249-L263 HydrophobicContact CE1-CD1 4.03Å; F249-D266 HydrophobicContact CE1-CB 4.1Å; F249-D266 HydrophobicContact CZ-CB 4.08Å; F249-I270 HydrophobicContact CE2-CD1 3.93Å; F249-I270 HydrophobicContact CE2-CG2 4.17Å; F249-I270 HydrophobicContact CZ-CD1 4.12Å; F249-I270 HydrophobicContact CZ-CG2 4.39Å; F249-L287 HydrophobicContact CD2-CD1 4.09Å; F249-L287 HydrophobicContact CD2-CD2 4.44Å; F249-L287 HydrophobicContact CD2-CG 4.41Å; F249-L287 HydrophobicContact CE2-CD2 4.22Å; F249-L287 HydrophobicContact CE2-CG 4.4Å; F249-Q291 HydrophobicContact CD1-CG 4.18Å; F249-Q291 HydrophobicContact CD2-CG 4.19Å; F249-Q291 HydrophobicContact CE1-CG 4.4Å; F249-Q291 HydrophobicContact CE2-CG 4.42Å; F249-Q291 HydrophobicContact CG-CG 4.07Å
250	E	89.6	Confident	88.4	Confident	108 Å²	108	75.6 Å²	75.6	51%	0.505	38%	0.384	S	S	.	.	H	α-helix	trans	-64.6	-47.6	173.3	-158.3	63.3	-153.4	0	0	111.4	K246 K247 R252 K253	K246-E250 PolarHBondContact O-N 3.26Å; K247-E250 PolarHBondContact O-N 2.72Å; E250-R252 PolarHBondContact O-N 3.28Å; E250-K253 WeakPolarHBondContact O-CB 3.28Å; E250-K253 PolarHBondContact O-N 2.96Å; E250-K253 IonicContact OE1-NZ 2.7Å; E250-K253 WeakPolarHBondContact OE2-CE 3.34Å; E250-K253 IonicContact OE2-NZ 3.66Å; E250-K253 PolarHBondContact OE2-NZ 2.86Å
251	A	88.1	Confident	88.2	Confident	60 Å²	60	76.1 Å²	76.1	50%	0.496	39%	0.392	S	S	.	.	H	α-helix	trans	-61.5	-16.1	176.5	0	0	0	0	0	114	K247	K247-A251 WeakPolarHBondContact O-CB 3.44Å; K247-A251 PolarHBondContact O-N 3.08Å
252	R	84.3	Confident	87.9	Confident	55 Å²	55	77.1 Å²	77.1	21%	0.208	40%	0.397	C	S	.	.	H	α-helix	trans	-83.8	-19	172.8	-79.3	170.7	165.8	-89	-3.9	114	H248 F249 E250 E254 D255 N259 D266	H248-R252 PolarHBondContact NE2-NE 2.93Å; H248-R252 WeakPolarHBondContact O-CG 3.39Å; H248-R252 PolarHBondContact O-N 3.4Å; F249-R252 WeakPolarHBondContact O-CB 3.35Å; F249-R252 PolarHBondContact O-N 2.88Å; E250-R252 PolarHBondContact O-N 3.28Å; R252-E254 PolarHBondContact O-N 3.46Å; R252-D255 PolarHBondContact O-N 3.44Å; R252-N259 PolarHBondContact NH1-O 3.38Å; R252-D266 IonicContact NH2-OD2 3.71Å
253	K	79.8	Confident	87.8	Confident	99 Å²	99	77.2 Å²	77.2	43%	0.43	40%	0.397	S	S	.	.	H	α-helix	trans	-70.9	-20.8	175.6	-63.6	171.9	-176.5	168.1	0	111.9	E250 E290	E250-K253 WeakPolarHBondContact O-CB 3.28Å; E250-K253 PolarHBondContact O-N 2.96Å; E250-K253 IonicContact OE1-NZ 2.7Å; E250-K253 WeakPolarHBondContact OE2-CE 3.34Å; E250-K253 IonicContact OE2-NZ 3.66Å; E250-K253 PolarHBondContact OE2-NZ 2.86Å; K253-E290 IonicContact NZ-OE1 2.64Å; K253-E290 PolarHBondContact NZ-OE1 3.23Å
254	E	75.8	Confident	87.8	Confident	170 Å²	170	73.5 Å²	73.5	79%	0.794	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-12.1	176.5	-58.3	-174.8	157.9	0	0	113.7	R252	R252-E254 PolarHBondContact O-N 3.46Å
255	D	78.1	Confident	87.7	Confident	88 Å²	88	72.7 Å²	72.7	47%	0.471	37%	0.37	S	S	.	.			trans	-82.3	125.9	-176.6	-169.8	-8.9	0	0	0	111.5	R252 A257	R252-D255 PolarHBondContact O-N 3.44Å; D255-A257 VanDerWaalsContact C-N 3.3Å; D255-A257 PolarHBondContact O-N 3.14Å; D255-A257 PolarHBondContact OD1-N 3.22Å
256	K	70	Confident	87.7	Confident	206 Å²	206	72.7 Å²	72.7	90%	0.896	37%	0.371	S	S	*	.	S	Bend	trans	-77	-13.2	-178.5	-63.2	-174.4	179.2	-176.6	0	113.8
257	A	74.1	Confident	87.7	Confident	71 Å²	71	67.7 Å²	67.7	59%	0.587	35%	0.349	S	S	*	.	S	Bend	trans	-127.1	81.8	-176.1	0	0	0	0	0	110.9	D255 N259	D255-A257 VanDerWaalsContact C-N 3.3Å; D255-A257 PolarHBondContact O-N 3.14Å; D255-A257 PolarHBondContact OD1-N 3.22Å; A257-N259 PolarHBondContact O-N 3.07Å
258	P	77.9	Confident	87.9	Confident	76 Å²	76	61.3 Å²	61.3	49%	0.494	32%	0.32	S	S	.	.			trans	-60.2	114	-170.6	23.1	-33.8	0	0	0	112	V260	P258-V260 VanDerWaalsContact C-N 3.28Å; P258-V260 WeakPolarHBondContact O-CG2 3.32Å; P258-V260 PolarHBondContact O-N 3.2Å
259	N	88.9	Confident	88.1	Confident	82 Å²	82	59.5 Å²	59.5	44%	0.439	31%	0.312	S	S	.	.			trans	-73.9	83.7	175.2	-171.6	-35.6	0	0	0	110.6	R252 A257 S261 K262 L263	R252-N259 PolarHBondContact NH1-O 3.38Å; A257-N259 PolarHBondContact O-N 3.07Å; N259-S261 VanDerWaalsContact C-N 3.32Å; N259-S261 PolarHBondContact O-N 2.92Å; N259-K262 PolarHBondContact O-N 3.34Å; N259-K262 WeakPolarHBondContact OD1-CB 3.29Å; N259-K262 PolarHBondContact OD1-N 3.04Å; N259-L263 PolarHBondContact O-N 3.26Å
260	V	91.6	Very high	88.3	Confident	32 Å²	32	59.3 Å²	59.3	19%	0.194	31%	0.311	C	S	.	.	H	α-helix	trans	-56.8	-41.2	-178.9	-174.4	0	0	0	0	111.8	P258 K262 L263 R264 V308	P258-V260 VanDerWaalsContact C-N 3.28Å; P258-V260 WeakPolarHBondContact O-CG2 3.32Å; P258-V260 PolarHBondContact O-N 3.2Å; V260-K262 PolarHBondContact O-N 3.14Å; V260-L263 PolarHBondContact O-N 3.12Å; V260-R264 WeakPolarHBondContact O-CB 3.4Å; V260-R264 PolarHBondContact O-N 3.41Å; V260-V308 HydrophobicContact CG1-CG2 3.56Å
261	S	92.6	Very high	88.7	Confident	67 Å²	67	54.2 Å²	54.2	47%	0.469	29%	0.287	S	S	.	.	H	α-helix	trans	-66.4	-34	-177.8	-78.1	0	0	0	0	113.8	N259 R264	N259-S261 VanDerWaalsContact C-N 3.32Å; N259-S261 PolarHBondContact O-N 2.92Å; S261-R264 PolarHBondContact OG-NH2 3.49Å
262	K	92.9	Very high	89.1	Confident	21 Å²	21	52 Å²	52	9%	0.091	27%	0.267	C	S	.	.	H	α-helix	trans	-79.5	-35.6	171.7	-180	65.2	162.3	81.1	0	111.5	V211 A213 N259 V260 R264 T265 D266	V211-K262 PolarHBondContact O-NZ 3.22Å; A213-K262 WeakPolarHBondContact O-CE 3.46Å; N259-K262 PolarHBondContact O-N 3.34Å; N259-K262 WeakPolarHBondContact OD1-CB 3.29Å; N259-K262 PolarHBondContact OD1-N 3.04Å; V260-K262 PolarHBondContact O-N 3.14Å; K262-R264 VanDerWaalsContact C-N 3.27Å; K262-R264 PolarHBondContact O-N 3Å; K262-T265 PolarHBondContact O-N 3.26Å; K262-T265 PolarHBondContact O-OG1 3.2Å; K262-D266 WeakPolarHBondContact CG-OD2 3.45Å; K262-D266 IonicContact NZ-OD1 2.59Å; K262-D266 PolarHBondContact NZ-OD1 3.01Å; K262-D266 IonicContact NZ-OD2 2.62Å; K262-D266 PolarHBondContact NZ-OD2 3.33Å; K262-D266 VanDerWaalsContact O-CB 3.28Å; K262-D266 WeakPolarHBondContact O-CB 3.3Å; K262-D266 PolarHBondContact O-N 2.67Å
263	L	94	Very high	89.8	Confident	15 Å²	15	49.4 Å²	49.4	8%	0.079	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-36.6	173.5	-177.2	59.9	0	0	0	111.9	F249 N259 V260 D266 L267 I295 V308	F249-L263 HydrophobicContact CD1-CD1 4.49Å; F249-L263 HydrophobicContact CE1-CD1 4.03Å; N259-L263 PolarHBondContact O-N 3.26Å; V260-L263 PolarHBondContact O-N 3.12Å; L263-D266 PolarHBondContact O-N 3.36Å; L263-L267 WeakPolarHBondContact O-CB 3.48Å; L263-L267 PolarHBondContact O-N 3.43Å; L263-I295 HydrophobicContact CD2-CD1 4.28Å; L263-I295 HydrophobicContact CD2-CG1 4.35Å; L263-V308 HydrophobicContact CG-CG1 4.4Å
264	R	95.8	Very high	90.6	Very high	55 Å²	55	44.7 Å²	44.7	21%	0.208	24%	0.236	C	C	.	.	H	α-helix	trans	-59.1	-45.4	175.5	-174.7	166.3	60.8	-119.1	-9.6	113.1	V260 S261 K262 S307 V308 S311	V260-R264 WeakPolarHBondContact O-CB 3.4Å; V260-R264 PolarHBondContact O-N 3.41Å; S261-R264 PolarHBondContact OG-NH2 3.49Å; K262-R264 VanDerWaalsContact C-N 3.27Å; K262-R264 PolarHBondContact O-N 3Å; R264-S307 WeakPolarHBondContact CD-O 3.4Å; R264-S307 PolarHBondContact NH1-OG 3.44Å; R264-V308 HydrophobicContact CB-CG2 4.03Å; R264-S311 VanDerWaalsContact CG-CB 3.47Å
265	T	96.3	Very high	91.6	Very high	6 Å²	6	36.6 Å²	36.6	4%	0.037	20%	0.198	C	C	.	.	H	α-helix	trans	-78.4	-34.1	177.2	44.5	0	0	0	0	112.3	I217 K262 R268 F269	I217-T265 HydrophobicContact CG1-CG2 3.77Å; K262-T265 PolarHBondContact O-N 3.26Å; K262-T265 PolarHBondContact O-OG1 3.2Å; T265-R268 PolarHBondContact O-N 3.37Å; T265-F269 VanDerWaalsContact O-CB 3.28Å; T265-F269 WeakPolarHBondContact O-CB 3.38Å; T265-F269 PolarHBondContact O-N 3.2Å
266	D	95.8	Very high	92.5	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-64.9	-44.9	177.5	-70.1	-7.8	0	0	0	112.3	W245 H248 F249 R252 K262 L263 R268 F269 I270	W245-D266 HydrophobicContact CH2-CB 4Å; W245-D266 WeakPolarHBondContact CH2-OD1 3.38Å; W245-D266 HydrophobicContact CZ3-CB 3.71Å; H248-D266 IonicContact CD2-OD2 3.9Å; H248-D266 IonicContact CE1-OD2 2.64Å; H248-D266 IonicContact NE2-OD2 2.73Å; H248-D266 PolarHBondContact NE2-OD2 3Å; F249-D266 HydrophobicContact CE1-CB 4.1Å; F249-D266 HydrophobicContact CZ-CB 4.08Å; R252-D266 IonicContact NH2-OD2 3.71Å; K262-D266 WeakPolarHBondContact CG-OD2 3.45Å; K262-D266 IonicContact NZ-OD1 2.59Å; K262-D266 PolarHBondContact NZ-OD1 3.01Å; K262-D266 IonicContact NZ-OD2 2.62Å; K262-D266 PolarHBondContact NZ-OD2 3.33Å; K262-D266 VanDerWaalsContact O-CB 3.28Å; K262-D266 WeakPolarHBondContact O-CB 3.3Å; K262-D266 PolarHBondContact O-N 2.67Å; L263-D266 PolarHBondContact O-N 3.36Å; D266-R268 PolarHBondContact O-N 2.82Å; D266-F269 PolarHBondContact O-N 3.5Å; D266-I270 PolarHBondContact O-N 2.7Å
267	L	96.6	Very high	93.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-40.8	177.7	-174.2	63.6	0	0	0	111.7	L263 I270 A271 I288 Q291 L292 I295 V308 F312	L263-L267 WeakPolarHBondContact O-CB 3.48Å; L263-L267 PolarHBondContact O-N 3.43Å; L267-I270 HydrophobicContact CD1-CD1 4.26Å; L267-I270 WeakPolarHBondContact O-CG1 3.36Å; L267-A271 WeakPolarHBondContact O-CB 3.36Å; L267-A271 PolarHBondContact O-N 2.63Å; L267-I288 HydrophobicContact CD1-CG2 4.17Å; L267-Q291 HydrophobicContact CD1-CB 4.07Å; L267-L292 HydrophobicContact CD2-CD2 3.91Å; L267-L292 HydrophobicContact CD2-CG 4.32Å; L267-I295 HydrophobicContact CD2-CD1 4.15Å; L267-V308 HydrophobicContact CB-CG1 4.36Å; L267-V308 HydrophobicContact CD2-CG1 3.6Å; L267-F312 HydrophobicContact CD2-CB 4.02Å; L267-F312 HydrophobicContact CD2-CD2 4.17Å; L267-F312 HydrophobicContact CD2-CG 4.2Å; L267-F312 HydrophobicContact CG-CD2 3.98Å; L267-F312 HydrophobicContact CG-CG 4.49Å
268	R	97.3	Very high	94.7	Very high	32 Å²	32	20.1 Å²	20.1	12%	0.121	11%	0.113	C	C	.	.	H	α-helix	trans	-63	-44.6	171.6	-173.2	-172.9	167.9	-165.5	-6.4	110.9	I217 T265 D266 A271 E272 H315	I217-R268 PolarHBondContact O-NH1 2.93Å; T265-R268 PolarHBondContact O-N 3.37Å; D266-R268 PolarHBondContact O-N 2.82Å; R268-A271 WeakPolarHBondContact O-CB 3.49Å; R268-A271 PolarHBondContact O-N 3.09Å; R268-E272 HydrophobicContact CG-CG 4.11Å; R268-E272 IonicContact CZ-OE1 2.65Å; R268-E272 VanDerWaalsContact CZ-OE1 3.28Å; R268-E272 IonicContact NE-OE1 2.63Å; R268-E272 PolarHBondContact NE-OE1 2.91Å; R268-E272 IonicContact NH2-OE1 3.19Å; R268-E272 PolarHBondContact NH2-OE1 2.96Å; R268-E272 WeakPolarHBondContact O-CG 3.1Å; R268-E272 PolarHBondContact O-N 3.27Å; R268-H315 HydrophobicContact CG-CB 4.1Å
269	F	97.8	Very high	95.6	Very high	1 Å²	1	16.7 Å²	16.7	0%	0.004	9%	0.09	C	C	.	.	H	α-helix	trans	-64.4	-45	-175.1	-169.5	-170.2	0	0	0	111.7	L215 V220 A223 V224 W245 T265 D266 A271 E272 L273	L215-F269 HydrophobicContact CD1-CD1 3.74Å; L215-F269 HydrophobicContact CD1-CE1 3.82Å; L215-F269 HydrophobicContact CD1-CG 4.44Å; V220-F269 HydrophobicContact CG1-CB 4.15Å; V220-F269 HydrophobicContact CG1-CD2 4.18Å; V220-F269 HydrophobicContact CG1-CG 4.36Å; A223-F269 HydrophobicContact CB-CD2 4.48Å; A223-F269 HydrophobicContact CB-CE1 4Å; A223-F269 HydrophobicContact CB-CE2 3.75Å; A223-F269 HydrophobicContact CB-CZ 3.48Å; A223-F269 VanDerWaalsContact CB-CZ 3.48Å; V224-F269 HydrophobicContact CG2-CD2 3.63Å; V224-F269 HydrophobicContact CG2-CE2 3.68Å; W245-F269 HydrophobicContact CH2-CD1 4.06Å; W245-F269 AromaticContact CZ2-CD1 3.56Å; W245-F269 HydrophobicContact CZ2-CD1 3.56Å; W245-F269 AromaticContact CZ2-CE1 3.94Å; W245-F269 HydrophobicContact CZ2-CE1 3.94Å; W245-F269 HydrophobicContact CZ2-CG 4.25Å; T265-F269 VanDerWaalsContact O-CB 3.28Å; T265-F269 WeakPolarHBondContact O-CB 3.38Å; T265-F269 PolarHBondContact O-N 3.2Å; D266-F269 PolarHBondContact O-N 3.5Å; F269-A271 VanDerWaalsContact C-N 3.29Å; F269-A271 PolarHBondContact O-N 3.48Å; F269-E272 PolarHBondContact O-N 3.42Å; F269-L273 HydrophobicContact CD2-CD1 3.84Å; F269-L273 HydrophobicContact CD2-CD2 4.45Å; F269-L273 HydrophobicContact CD2-CG 3.87Å; F269-L273 HydrophobicContact CE2-CD1 3.8Å; F269-L273 HydrophobicContact CE2-CD2 3.97Å; F269-L273 HydrophobicContact CE2-CG 3.87Å; F269-L273 HydrophobicContact CG-CD1 4.45Å; F269-L273 HydrophobicContact CZ-CD1 4.37Å; F269-L273 WeakPolarHBondContact O-CB 3.37Å; F269-L273 VanDerWaalsContact O-CG 3.23Å; F269-L273 WeakPolarHBondContact O-CG 3.46Å; F269-L273 PolarHBondContact O-N 3.4Å
270	I	97.5	Very high	95.9	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-66.5	-30	174.5	64.8	165.4	0	0	0	113	W245 F249 D266 L267 T274 L287 I288	W245-I270 HydrophobicContact CD2-CG2 3.62Å; W245-I270 HydrophobicContact CE3-CG2 4.06Å; W245-I270 HydrophobicContact CG-CG2 3.85Å; W245-I270 HydrophobicContact CZ2-CG2 4.3Å; F249-I270 HydrophobicContact CE2-CD1 3.93Å; F249-I270 HydrophobicContact CE2-CG2 4.17Å; F249-I270 HydrophobicContact CZ-CD1 4.12Å; F249-I270 HydrophobicContact CZ-CG2 4.39Å; D266-I270 PolarHBondContact O-N 2.7Å; L267-I270 HydrophobicContact CD1-CD1 4.26Å; L267-I270 WeakPolarHBondContact O-CG1 3.36Å; I270-T274 PolarHBondContact O-N 2.78Å; I270-T274 VanDerWaalsContact O-N 3.17Å; I270-T274 PolarHBondContact O-OG1 2.96Å; I270-L287 HydrophobicContact CD1-CD2 4.01Å; I270-L287 HydrophobicContact CD1-CG 3.9Å; I270-L287 HydrophobicContact CG2-CD2 4.37Å; I270-I288 HydrophobicContact CD1-CG1 3.8Å; I270-I288 HydrophobicContact CG1-CG1 3.94Å
271	A	97.5	Very high	96.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-65.7	-52.7	172.9	0	0	0	0	0	111.5	L267 R268 F269 L273 T274 I275 I288 F312 C316 I320	L267-A271 WeakPolarHBondContact O-CB 3.36Å; L267-A271 PolarHBondContact O-N 2.63Å; R268-A271 WeakPolarHBondContact O-CB 3.49Å; R268-A271 PolarHBondContact O-N 3.09Å; F269-A271 VanDerWaalsContact C-N 3.29Å; F269-A271 PolarHBondContact O-N 3.48Å; A271-L273 VanDerWaalsContact C-N 3.32Å; A271-L273 PolarHBondContact O-N 3.5Å; A271-T274 WeakPolarHBondContact O-CA 3.27Å; A271-T274 WeakPolarHBondContact O-CB 3.48Å; A271-T274 PolarHBondContact O-N 2.92Å; A271-I275 VanDerWaalsContact O-CG1 3.31Å; A271-I275 WeakPolarHBondContact O-CG1 3.44Å; A271-I275 PolarHBondContact O-N 3.34Å; A271-I288 HydrophobicContact CB-CD1 4.12Å; A271-F312 HydrophobicContact CB-CD2 4.34Å; A271-F312 HydrophobicContact CB-CE2 3.97Å; A271-C316 HydrophobicContact CB-CB 3.78Å; A271-I320 HydrophobicContact CB-CG1 4.33Å
272	E	97.4	Very high	96.1	Very high	15 Å²	15	24 Å²	24	7%	0.07	11%	0.109	C	C	.	.	H	α-helix	trans	-58.6	-41.3	176.8	-58.9	-83	-159.4	0	0	111.6	R142 V220 V224 R268 F269 T274 I275 V276	R142-E272 IonicContact CZ-OE2 3.78Å; R142-E272 IonicContact NE-OE2 3.89Å; R142-E272 PolarHBondContact NE-OE2 2.65Å; R142-E272 VanDerWaalsContact NE-OE2 3.07Å; R142-E272 VanDerWaalsContact NH2-CD 3.32Å; R142-E272 IonicContact NH2-OE1 3.85Å; R142-E272 PolarHBondContact NH2-OE1 2.9Å; R142-E272 IonicContact NH2-OE2 2.8Å; R142-E272 PolarHBondContact NH2-OE2 2.71Å; V220-E272 HydrophobicContact CG1-CG 4.19Å; V224-E272 HydrophobicContact CG1-CB 4.47Å; V224-E272 HydrophobicContact CG2-CB 3.6Å; V224-E272 HydrophobicContact CG2-CG 4.44Å; R268-E272 HydrophobicContact CG-CG 4.11Å; R268-E272 IonicContact CZ-OE1 2.65Å; R268-E272 VanDerWaalsContact CZ-OE1 3.28Å; R268-E272 IonicContact NE-OE1 2.63Å; R268-E272 PolarHBondContact NE-OE1 2.91Å; R268-E272 IonicContact NH2-OE1 3.19Å; R268-E272 PolarHBondContact NH2-OE1 2.96Å; R268-E272 WeakPolarHBondContact O-CG 3.1Å; R268-E272 PolarHBondContact O-N 3.27Å; F269-E272 PolarHBondContact O-N 3.42Å; E272-T274 PolarHBondContact O-N 2.94Å; E272-I275 PolarHBondContact O-N 3.03Å; E272-V276 WeakPolarHBondContact O-CG2 3.46Å; E272-V276 PolarHBondContact O-N 3.31Å
273	L	97.8	Very high	96.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.2	-28.3	175.1	-70.2	170.5	0	0	0	113.5	V224 C227 L241 F269 A271 L278 F279	V224-L273 HydrophobicContact CG2-CD2 4.48Å; C227-L273 HydrophobicContact CB-CD2 3.65Å; L241-L273 HydrophobicContact CD2-CD1 3.98Å; F269-L273 HydrophobicContact CD2-CD1 3.84Å; F269-L273 HydrophobicContact CD2-CD2 4.45Å; F269-L273 HydrophobicContact CD2-CG 3.87Å; F269-L273 HydrophobicContact CE2-CD1 3.8Å; F269-L273 HydrophobicContact CE2-CD2 3.97Å; F269-L273 HydrophobicContact CE2-CG 3.87Å; F269-L273 HydrophobicContact CG-CD1 4.45Å; F269-L273 HydrophobicContact CZ-CD1 4.37Å; F269-L273 WeakPolarHBondContact O-CB 3.37Å; F269-L273 VanDerWaalsContact O-CG 3.23Å; F269-L273 WeakPolarHBondContact O-CG 3.46Å; F269-L273 PolarHBondContact O-N 3.4Å; A271-L273 VanDerWaalsContact C-N 3.32Å; A271-L273 PolarHBondContact O-N 3.5Å; L273-L278 HydrophobicContact CD2-CB 4.45Å; L273-L278 HydrophobicContact CD2-CD1 3.99Å; L273-L278 HydrophobicContact CD2-CD2 4.27Å; L273-L278 HydrophobicContact CD2-CG 4.49Å; L273-L278 WeakPolarHBondContact O-CB 3.3Å; L273-L278 PolarHBondContact O-N 2.94Å; L273-F279 HydrophobicContact CB-CD2 3.91Å; L273-F279 HydrophobicContact CB-CE2 3.79Å; L273-F279 HydrophobicContact CB-CZ 4.49Å; L273-F279 HydrophobicContact CD1-CE2 3.84Å; L273-F279 HydrophobicContact CD1-CZ 4.01Å; L273-F279 HydrophobicContact CG-CE2 4.47Å; L273-F279 PolarHBondContact O-N 3.46Å
274	T	97.6	Very high	96.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-80.7	-43	175.2	-52.9	0	0	0	0	111.1	R146 I270 A271 E272 G277 G284 L285 I288	R146-T274 PolarHBondContact NH1-O 2.86Å; I270-T274 PolarHBondContact O-N 2.78Å; I270-T274 VanDerWaalsContact O-N 3.17Å; I270-T274 PolarHBondContact O-OG1 2.96Å; A271-T274 WeakPolarHBondContact O-CA 3.27Å; A271-T274 WeakPolarHBondContact O-CB 3.48Å; A271-T274 PolarHBondContact O-N 2.92Å; E272-T274 PolarHBondContact O-N 2.94Å; T274-G277 PolarHBondContact O-N 2.84Å; T274-G277 VanDerWaalsContact O-N 3.08Å; T274-G284 WeakPolarHBondContact OG1-CA 3.48Å; T274-L285 HydrophobicContact CG2-CD2 4.12Å; T274-L285 HydrophobicContact CG2-CG 4.21Å; T274-I288 HydrophobicContact CG2-CD1 4.43Å
275	I	97	Very high	96.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.7	-49.1	176	-65.6	168.7	0	0	0	110	R142 R146 A271 E272 G277 C316 D319 I320 I344	R142-I275 HydrophobicContact CB-CG2 3.93Å; R142-I275 HydrophobicContact CG-CG2 3.7Å; R146-I275 VanDerWaalsContact CD-O 3.28Å; R146-I275 WeakPolarHBondContact CD-O 3.49Å; R146-I275 PolarHBondContact NH1-O 2.98Å; A271-I275 VanDerWaalsContact O-CG1 3.31Å; A271-I275 WeakPolarHBondContact O-CG1 3.44Å; A271-I275 PolarHBondContact O-N 3.34Å; E272-I275 PolarHBondContact O-N 3.03Å; I275-G277 PolarHBondContact O-N 3.26Å; I275-G277 VanDerWaalsContact O-N 3.09Å; I275-C316 HydrophobicContact CD1-CB 4.01Å; I275-D319 HydrophobicContact CD1-CB 3.9Å; I275-D319 HydrophobicContact CG1-CB 3.94Å; I275-D319 HydrophobicContact CG2-CB 4.33Å; I275-I320 HydrophobicContact CD1-CD1 4.3Å; I275-I320 HydrophobicContact CD1-CG1 4.04Å; I275-I320 HydrophobicContact CG1-CD1 3.74Å; I275-I320 HydrophobicContact CG1-CG1 4.05Å; I275-I344 HydrophobicContact CG2-CD1 3.82Å; I275-I344 HydrophobicContact CG2-CG2 4.03Å
276	V	97	Very high	96.4	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.012	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	12.8	176.8	-51.6	0	0	0	0	114	L145 R146 N149 V224 E272 L278	L145-V276 HydrophobicContact CB-CB 3.93Å; L145-V276 HydrophobicContact CB-CG1 3.87Å; L145-V276 HydrophobicContact CD1-CG1 4.12Å; R146-V276 WeakPolarHBondContact CA-O 3.36Å; N149-V276 WeakPolarHBondContact CB-O 3.3Å; N149-V276 PolarHBondContact ND2-O 2.92Å; V224-V276 HydrophobicContact CG1-CB 4.46Å; V224-V276 HydrophobicContact CG1-CG1 4Å; V224-V276 HydrophobicContact CG1-CG2 3.65Å; E272-V276 WeakPolarHBondContact O-CG2 3.46Å; E272-V276 PolarHBondContact O-N 3.31Å; V276-L278 VanDerWaalsContact C-N 3.29Å; V276-L278 HydrophobicContact CG2-CB 4.42Å; V276-L278 PolarHBondContact O-N 3.41Å
277	G	95.5	Very high	96.4	Very high	11 Å²	11	27.5 Å²	27.5	11%	0.113	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	25.7	169.6	0	0	0	0	0	115.4	T274 I275 F279	T274-G277 PolarHBondContact O-N 2.84Å; T274-G277 VanDerWaalsContact O-N 3.08Å; I275-G277 PolarHBondContact O-N 3.26Å; I275-G277 VanDerWaalsContact O-N 3.09Å; G277-F279 CarbonylContact C-O 3.59Å
278	L	95.1	Very high	96.4	Very high	6 Å²	6	27.5 Å²	27.5	3%	0.031	14%	0.136	C	C	.	.	S	Bend	trans	-83.6	-37.8	174.5	-171.9	151.3	0	0	0	111	C227 H231 F237 A238 L241 L273 V276	C227-L278 VanDerWaalsContact C-CD1 3.46Å; C227-L278 HydrophobicContact CB-CD1 3.77Å; C227-L278 VanDerWaalsContact O-CD1 3.26Å; C227-L278 WeakPolarHBondContact O-CD1 3.48Å; H231-L278 HydrophobicContact CB-CD1 3.63Å; H231-L278 HydrophobicContact CB-CG 3.86Å; F237-L278 HydrophobicContact CE1-CD1 4.23Å; A238-L278 HydrophobicContact CB-CD2 3.8Å; A238-L278 HydrophobicContact CB-CG 4.41Å; L241-L278 HydrophobicContact CD2-CD2 4Å; L273-L278 HydrophobicContact CD2-CB 4.45Å; L273-L278 HydrophobicContact CD2-CD1 3.99Å; L273-L278 HydrophobicContact CD2-CD2 4.27Å; L273-L278 HydrophobicContact CD2-CG 4.49Å; L273-L278 WeakPolarHBondContact O-CB 3.3Å; L273-L278 PolarHBondContact O-N 2.94Å; V276-L278 VanDerWaalsContact C-N 3.29Å; V276-L278 HydrophobicContact CG2-CB 4.42Å; V276-L278 PolarHBondContact O-N 3.41Å
279	F	96.8	Very high	96.4	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.018	15%	0.147	C	C	.	.	S	Bend	trans	-93.3	148.5	157.6	-56.8	-39	0	0	0	109.5	L241 L242 W245 L273 G277	L241-F279 HydrophobicContact CB-CE1 4.31Å; L241-F279 HydrophobicContact CB-CZ 4.49Å; L241-F279 HydrophobicContact CD2-CE1 4.26Å; L241-F279 HydrophobicContact CD2-CZ 4.02Å; L241-F279 HydrophobicContact CG-CE1 4.28Å; L241-F279 HydrophobicContact CG-CZ 3.99Å; L242-F279 HydrophobicContact CB-CD1 4.14Å; L242-F279 HydrophobicContact CB-CE1 3.76Å; L242-F279 HydrophobicContact CB-CZ 4.39Å; L242-F279 HydrophobicContact CD1-CD1 4.27Å; L242-F279 HydrophobicContact CD1-CE1 4.28Å; L242-F279 HydrophobicContact CD1-CG 4.43Å; L242-F279 HydrophobicContact CD1-CZ 4.44Å; W245-F279 AromaticContact CD1-CZ 3.85Å; L273-F279 HydrophobicContact CB-CD2 3.91Å; L273-F279 HydrophobicContact CB-CE2 3.79Å; L273-F279 HydrophobicContact CB-CZ 4.49Å; L273-F279 HydrophobicContact CD1-CE2 3.84Å; L273-F279 HydrophobicContact CD1-CZ 4.01Å; L273-F279 HydrophobicContact CG-CE2 4.47Å; L273-F279 PolarHBondContact O-N 3.46Å; G277-F279 CarbonylContact C-O 3.59Å
280	T	94.9	Very high	96.3	Very high	78 Å²	78	33.7 Å²	33.7	48%	0.479	16%	0.164	S	C	.	.			trans	-68.3	152.5	168.9	67.6	0	0	0	0	110.2	R282 E283 G284	T280-R282 PolarHBondContact O-N 3.23Å; T280-R282 VanDerWaalsContact O-N 3.1Å; T280-E283 WeakPolarHBondContact CB-OE2 3.49Å; T280-E283 WeakPolarHBondContact CG2-OE2 3.49Å; T280-E283 PolarHBondContact N-OE2 3.13Å; T280-E283 PolarHBondContact O-N 3.05Å; T280-E283 VanDerWaalsContact OG1-CD 3.29Å; T280-E283 WeakPolarHBondContact OG1-CG 3.14Å; T280-E283 PolarHBondContact OG1-N 3.02Å; T280-E283 PolarHBondContact OG1-OE2 2.94Å; T280-G284 PolarHBondContact O-N 2.91Å
281	D	94.2	Very high	96.2	Very high	31 Å²	31	34.3 Å²	34.3	17%	0.166	17%	0.166	C	C	.	.	H	α-helix	trans	-48.3	-41.8	175.8	-63.5	4.3	0	0	0	111.9	R146 E283 L285 K349	R146-D281 IonicContact CZ-OD1 2.6Å; R146-D281 IonicContact NH1-OD1 3.12Å; R146-D281 IonicContact NH2-OD1 2.69Å; R146-D281 PolarHBondContact NH2-OD1 2.67Å; R146-D281 IonicContact NH2-OD2 2.68Å; D281-E283 PolarHBondContact O-N 3.3Å; D281-L285 HydrophobicContact CB-CD1 4.09Å; D281-L285 WeakPolarHBondContact O-CB 3.33Å; D281-L285 WeakPolarHBondContact O-CG 3.41Å; D281-L285 PolarHBondContact O-N 3.01Å; D281-K349 HydrophobicContact CB-CD 4.45Å; D281-K349 IonicContact OD2-NZ 3.91Å; D281-K349 PolarHBondContact OD2-NZ 2.91Å
282	R	94	Very high	96	Very high	225 Å²	225	34.4 Å²	34.4	85%	0.849	17%	0.167	S	C	*	.	H	α-helix	trans	-62.8	-40.4	-179.2	-176.1	-179.1	179.2	-169.4	0.3	112.4	T280 S286	T280-R282 PolarHBondContact O-N 3.23Å; T280-R282 VanDerWaalsContact O-N 3.1Å; R282-S286 WeakPolarHBondContact O-CB 3.4Å
283	E	95.5	Very high	95.9	Very high	73 Å²	73	39.6 Å²	39.6	34%	0.341	19%	0.189	S	C	.	.	H	α-helix	trans	-80.4	-48.2	-177	-67.7	164	127.7	0	0	111.6	L242 T280 D281 L287	L242-E283 HydrophobicContact CD1-CB 4.33Å; L242-E283 HydrophobicContact CD2-CB 3.74Å; L242-E283 HydrophobicContact CD2-CG 3.78Å; L242-E283 WeakPolarHBondContact CD2-OE1 3.44Å; T280-E283 WeakPolarHBondContact CB-OE2 3.49Å; T280-E283 WeakPolarHBondContact CG2-OE2 3.49Å; T280-E283 PolarHBondContact N-OE2 3.13Å; T280-E283 PolarHBondContact O-N 3.05Å; T280-E283 VanDerWaalsContact OG1-CD 3.29Å; T280-E283 WeakPolarHBondContact OG1-CG 3.14Å; T280-E283 PolarHBondContact OG1-N 3.02Å; T280-E283 PolarHBondContact OG1-OE2 2.94Å; D281-E283 PolarHBondContact O-N 3.3Å; E283-L287 PolarHBondContact O-N 3.31Å; E283-L287 VanDerWaalsContact O-N 3.17Å
284	G	95.6	Very high	95.6	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-67.8	-51.4	-176.9	0	0	0	0	0	112.3	T274 T280 S286 L287 I288	T274-G284 WeakPolarHBondContact OG1-CA 3.48Å; T280-G284 PolarHBondContact O-N 2.91Å; G284-S286 VanDerWaalsContact C-N 3.34Å; G284-S286 PolarHBondContact O-N 3.24Å; G284-L287 PolarHBondContact O-N 3.24Å; G284-L287 VanDerWaalsContact O-N 3.13Å; G284-I288 WeakPolarHBondContact O-CD1 3.35Å; G284-I288 VanDerWaalsContact O-CG1 3.23Å; G284-I288 WeakPolarHBondContact O-CG1 3.43Å; G284-I288 PolarHBondContact O-N 2.78Å
285	L	96.5	Very high	95.4	Very high	15 Å²	15	42.8 Å²	42.8	8%	0.079	21%	0.206	C	C	.	.	H	α-helix	trans	-63.5	-39.9	178.8	-59.1	177.2	0	0	0	111.2	T274 D281 L287 I288 Y289 I320 I345 K349 F353	T274-L285 HydrophobicContact CG2-CD2 4.12Å; T274-L285 HydrophobicContact CG2-CG 4.21Å; D281-L285 HydrophobicContact CB-CD1 4.09Å; D281-L285 WeakPolarHBondContact O-CB 3.33Å; D281-L285 WeakPolarHBondContact O-CG 3.41Å; D281-L285 PolarHBondContact O-N 3.01Å; L285-L287 VanDerWaalsContact C-N 3.27Å; L285-L287 PolarHBondContact O-N 3.37Å; L285-I288 HydrophobicContact CD2-CD1 4.44Å; L285-I288 PolarHBondContact O-N 3.08Å; L285-Y289 WeakPolarHBondContact O-CB 3.4Å; L285-Y289 PolarHBondContact O-N 2.96Å; L285-I320 HydrophobicContact CD2-CD1 3.69Å; L285-I320 HydrophobicContact CD2-CG2 4Å; L285-I345 HydrophobicContact CD1-CG2 4.01Å; L285-K349 HydrophobicContact CD1-CB 3.89Å; L285-K349 HydrophobicContact CD1-CD 4.05Å; L285-K349 HydrophobicContact CD1-CG 4.4Å; L285-F353 HydrophobicContact CB-CE2 4.06Å; L285-F353 HydrophobicContact CB-CZ 3.83Å; L285-F353 HydrophobicContact CD2-CE2 3.85Å; L285-F353 HydrophobicContact CD2-CZ 3.96Å; L285-F353 HydrophobicContact CG-CE2 4.37Å; L285-F353 HydrophobicContact CG-CZ 4.45Å; L285-F353 WeakPolarHBondContact O-CZ 3.36Å
286	S	96.4	Very high	95.1	Very high	77 Å²	77	43.8 Å²	43.8	54%	0.538	21%	0.212	S	C	.	.	H	α-helix	trans	-59.8	-37.2	175.2	-176.6	0	0	0	0	112.5	R282 G284 E290	R282-S286 WeakPolarHBondContact O-CB 3.4Å; G284-S286 VanDerWaalsContact C-N 3.34Å; G284-S286 PolarHBondContact O-N 3.24Å; S286-E290 PolarHBondContact O-N 3.2Å; S286-E290 VanDerWaalsContact O-N 3.17Å
287	L	95.9	Very high	94.8	Very high	5 Å²	5	45.5 Å²	45.5	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-74.3	-43.2	179.3	-173.2	65	0	0	0	112	L242 W245 K246 F249 I270 E283 G284 L285 Y289 E290 Q291	L242-L287 HydrophobicContact CD1-CD2 4.18Å; W245-L287 HydrophobicContact CB-CD2 4.03Å; K246-L287 HydrophobicContact CG-CD1 3.89Å; F249-L287 HydrophobicContact CD2-CD1 4.09Å; F249-L287 HydrophobicContact CD2-CD2 4.44Å; F249-L287 HydrophobicContact CD2-CG 4.41Å; F249-L287 HydrophobicContact CE2-CD2 4.22Å; F249-L287 HydrophobicContact CE2-CG 4.4Å; I270-L287 HydrophobicContact CD1-CD2 4.01Å; I270-L287 HydrophobicContact CD1-CG 3.9Å; I270-L287 HydrophobicContact CG2-CD2 4.37Å; E283-L287 PolarHBondContact O-N 3.31Å; E283-L287 VanDerWaalsContact O-N 3.17Å; G284-L287 PolarHBondContact O-N 3.24Å; G284-L287 VanDerWaalsContact O-N 3.13Å; L285-L287 VanDerWaalsContact C-N 3.27Å; L285-L287 PolarHBondContact O-N 3.37Å; L287-Y289 VanDerWaalsContact C-N 3.31Å; L287-Y289 PolarHBondContact O-N 3.35Å; L287-E290 PolarHBondContact O-N 3.12Å; L287-Q291 WeakPolarHBondContact O-CG 3.16Å; L287-Q291 PolarHBondContact O-N 3.13Å
288	I	97.6	Very high	94.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-41	176.1	-61.2	157	0	0	0	110.2	L267 I270 A271 T274 G284 L285 Q291 L292 F312 I320 F353	L267-I288 HydrophobicContact CD1-CG2 4.17Å; I270-I288 HydrophobicContact CD1-CG1 3.8Å; I270-I288 HydrophobicContact CG1-CG1 3.94Å; A271-I288 HydrophobicContact CB-CD1 4.12Å; T274-I288 HydrophobicContact CG2-CD1 4.43Å; G284-I288 WeakPolarHBondContact O-CD1 3.35Å; G284-I288 VanDerWaalsContact O-CG1 3.23Å; G284-I288 WeakPolarHBondContact O-CG1 3.43Å; G284-I288 PolarHBondContact O-N 2.78Å; L285-I288 HydrophobicContact CD2-CD1 4.44Å; L285-I288 PolarHBondContact O-N 3.08Å; I288-Q291 PolarHBondContact O-N 3.33Å; I288-L292 HydrophobicContact CG2-CD1 3.89Å; I288-L292 PolarHBondContact O-N 3.26Å; I288-F312 HydrophobicContact CG2-CE2 3.65Å; I288-F312 HydrophobicContact CG2-CZ 3.9Å; I288-I320 HydrophobicContact CD1-CD1 4.15Å; I288-I320 HydrophobicContact CG2-CG2 4.48Å; I288-F353 HydrophobicContact CB-CE1 4.06Å; I288-F353 HydrophobicContact CG2-CD1 4.35Å; I288-F353 HydrophobicContact CG2-CE1 3.75Å
289	Y	96.9	Very high	94.3	Very high	87 Å²	87	49.5 Å²	49.5	34%	0.341	25%	0.252	S	S	.	.	H	α-helix	trans	-66.8	-42.3	-179.4	-171.9	-92.3	0	0	0	112.1	L285 L287 Q291 K293 P352 F353 L356	L285-Y289 WeakPolarHBondContact O-CB 3.4Å; L285-Y289 PolarHBondContact O-N 2.96Å; L287-Y289 VanDerWaalsContact C-N 3.31Å; L287-Y289 PolarHBondContact O-N 3.35Å; Y289-Q291 VanDerWaalsContact C-N 3.33Å; Y289-Q291 PolarHBondContact O-N 3.33Å; Y289-K293 HydrophobicContact CE1-CD 4.37Å; Y289-K293 WeakPolarHBondContact O-CB 3.37Å; Y289-K293 PolarHBondContact O-N 3.48Å; Y289-P352 HydrophobicContact CD2-CB 4.09Å; Y289-P352 HydrophobicContact CE2-CB 3.58Å; Y289-F353 HydrophobicContact CD2-CD1 4.27Å; Y289-F353 HydrophobicContact CD2-CE1 4.02Å; Y289-F353 HydrophobicContact CD2-CZ 4.29Å; Y289-F353 HydrophobicContact CG-CE1 4.41Å; Y289-L356 HydrophobicContact CD2-CD1 3.58Å; Y289-L356 HydrophobicContact CD2-CG 4.48Å; Y289-L356 HydrophobicContact CE1-CD1 4.47Å; Y289-L356 HydrophobicContact CE2-CD1 3.33Å; Y289-L356 HydrophobicContact CE2-CG 3.81Å; Y289-L356 HydrophobicContact CG-CD1 4.25Å
290	E	95.4	Very high	93.8	Very high	76 Å²	76	57.9 Å²	57.9	36%	0.355	28%	0.283	S	S	.	.	H	α-helix	trans	-58.4	-46.6	173.3	-165.8	-171.6	152	0	0	110.8	K253 S286 L287 K293 N294	K253-E290 IonicContact NZ-OE1 2.64Å; K253-E290 PolarHBondContact NZ-OE1 3.23Å; S286-E290 PolarHBondContact O-N 3.2Å; S286-E290 VanDerWaalsContact O-N 3.17Å; L287-E290 PolarHBondContact O-N 3.12Å; E290-K293 PolarHBondContact O-N 3.02Å; E290-N294 WeakPolarHBondContact O-CB 3.3Å; E290-N294 PolarHBondContact O-N 3.32Å; E290-N294 PolarHBondContact O-ND2 3.03Å
291	Q	94.8	Very high	93.3	Very high	14 Å²	14	61.2 Å²	61.2	7%	0.065	29%	0.294	C	S	.	.	H	α-helix	trans	-70.1	-36.9	-177.4	-66.5	-55.9	95.2	0	0	113.8	F249 L267 L287 I288 Y289 N294 I295	F249-Q291 HydrophobicContact CD1-CG 4.18Å; F249-Q291 HydrophobicContact CD2-CG 4.19Å; F249-Q291 HydrophobicContact CE1-CG 4.4Å; F249-Q291 HydrophobicContact CE2-CG 4.42Å; F249-Q291 HydrophobicContact CG-CG 4.07Å; L267-Q291 HydrophobicContact CD1-CB 4.07Å; L287-Q291 WeakPolarHBondContact O-CG 3.16Å; L287-Q291 PolarHBondContact O-N 3.13Å; I288-Q291 PolarHBondContact O-N 3.33Å; Y289-Q291 VanDerWaalsContact C-N 3.33Å; Y289-Q291 PolarHBondContact O-N 3.33Å; Q291-N294 PolarHBondContact O-N 3.06Å; Q291-N294 PolarHBondContact OE1-ND2 3.14Å; Q291-I295 WeakPolarHBondContact O-CG1 3.35Å; Q291-I295 PolarHBondContact O-N 2.9Å; Q291-I295 VanDerWaalsContact O-N 3.07Å
292	L	95.2	Very high	92.9	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-67.5	-41.9	171.7	-77	167.1	0	0	0	112	L267 I288 N294 I295 I296 F312 F353 L356	L267-L292 HydrophobicContact CD2-CD2 3.91Å; L267-L292 HydrophobicContact CD2-CG 4.32Å; I288-L292 HydrophobicContact CG2-CD1 3.89Å; I288-L292 PolarHBondContact O-N 3.26Å; L292-N294 VanDerWaalsContact C-N 3.31Å; L292-N294 PolarHBondContact O-N 3.34Å; L292-I295 WeakPolarHBondContact O-CB 3.37Å; L292-I295 PolarHBondContact O-N 3.32Å; L292-I296 WeakPolarHBondContact O-CD1 3.19Å; L292-I296 WeakPolarHBondContact O-CG1 3.37Å; L292-I296 PolarHBondContact O-N 3.4Å; L292-F312 HydrophobicContact CD1-CD1 4.2Å; L292-F312 HydrophobicContact CD1-CE1 3.69Å; L292-F312 HydrophobicContact CD1-CE2 4.38Å; L292-F312 HydrophobicContact CD1-CZ 3.78Å; L292-F312 HydrophobicContact CD2-CD1 4.26Å; L292-F353 HydrophobicContact CD1-CD1 3.74Å; L292-F353 HydrophobicContact CD1-CE1 4.25Å; L292-L356 HydrophobicContact CB-CD1 4.1Å
293	K	94.6	Very high	92.9	Very high	124 Å²	124	54 Å²	54	54%	0.539	28%	0.276	S	S	.	.	H	α-helix	trans	-62.5	-38.5	175.3	-173.8	-179.6	178.8	-175.5	0	111.9	Y289 E290 I296 G297 L356	Y289-K293 HydrophobicContact CE1-CD 4.37Å; Y289-K293 WeakPolarHBondContact O-CB 3.37Å; Y289-K293 PolarHBondContact O-N 3.48Å; E290-K293 PolarHBondContact O-N 3.02Å; K293-I296 PolarHBondContact O-N 3.46Å; K293-G297 PolarHBondContact O-N 3.07Å; K293-L356 HydrophobicContact CB-CD1 4.35Å
294	N	92.2	Very high	92.7	Very high	62 Å²	62	54.1 Å²	54.1	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-63.5	-43.9	174.3	-70.5	-23.8	0	0	0	111.1	E290 Q291 L292 G297 T298	E290-N294 WeakPolarHBondContact O-CB 3.3Å; E290-N294 PolarHBondContact O-N 3.32Å; E290-N294 PolarHBondContact O-ND2 3.03Å; Q291-N294 PolarHBondContact O-N 3.06Å; Q291-N294 PolarHBondContact OE1-ND2 3.14Å; L292-N294 VanDerWaalsContact C-N 3.31Å; L292-N294 PolarHBondContact O-N 3.34Å; N294-G297 PolarHBondContact O-N 2.62Å; N294-T298 PolarHBondContact O-N 2.85Å; N294-T298 VanDerWaalsContact O-N 3.14Å; N294-T298 PolarHBondContact O-OG1 2.89Å; N294-T298 VanDerWaalsContact O-OG1 3.12Å
295	I	92.9	Very high	92.7	Very high	6 Å²	6	54.5 Å²	54.5	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-58.2	-50.1	174.1	-73.2	162.9	0	0	0	111.3	L263 L267 Q291 L292 G297 T298 D299 H305 V308 V309 Y360	L263-I295 HydrophobicContact CD2-CD1 4.28Å; L263-I295 HydrophobicContact CD2-CG1 4.35Å; L267-I295 HydrophobicContact CD2-CD1 4.15Å; Q291-I295 WeakPolarHBondContact O-CG1 3.35Å; Q291-I295 PolarHBondContact O-N 2.9Å; Q291-I295 VanDerWaalsContact O-N 3.07Å; L292-I295 WeakPolarHBondContact O-CB 3.37Å; L292-I295 PolarHBondContact O-N 3.32Å; I295-G297 VanDerWaalsContact C-N 3.29Å; I295-G297 PolarHBondContact O-N 3.21Å; I295-T298 PolarHBondContact O-N 3.35Å; I295-T298 VanDerWaalsContact O-N 3.14Å; I295-D299 WeakPolarHBondContact O-CB 3.45Å; I295-D299 PolarHBondContact O-N 3.08Å; I295-H305 HydrophobicContact CG1-CB 4.4Å; I295-H305 HydrophobicContact CG2-CB 3.71Å; I295-V308 HydrophobicContact CD1-CB 4.43Å; I295-V308 HydrophobicContact CD1-CG1 3.71Å; I295-V309 HydrophobicContact CG2-CG2 3.95Å; I295-Y360 HydrophobicContact CG2-CD2 4.39Å; I295-Y360 HydrophobicContact CG2-CE2 3.93Å
296	I	91	Very high	92.7	Very high	21 Å²	21	54.3 Å²	54.3	11%	0.108	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-34.1	179.1	-67.9	156.1	0	0	0	111.9	L292 K293 T298 L356 E359 Y360	L292-I296 WeakPolarHBondContact O-CD1 3.19Å; L292-I296 WeakPolarHBondContact O-CG1 3.37Å; L292-I296 PolarHBondContact O-N 3.4Å; K293-I296 PolarHBondContact O-N 3.46Å; I296-T298 VanDerWaalsContact C-N 3.31Å; I296-T298 PolarHBondContact O-N 3.14Å; I296-L356 HydrophobicContact CD1-CB 3.52Å; I296-L356 HydrophobicContact CD1-CD1 4.27Å; I296-L356 HydrophobicContact CD1-CD2 3.75Å; I296-L356 HydrophobicContact CD1-CG 4.03Å; I296-L356 WeakPolarHBondContact CD1-O 3.47Å; I296-E359 HydrophobicContact CG2-CG 4.29Å; I296-Y360 HydrophobicContact CG1-CD2 3.77Å; I296-Y360 HydrophobicContact CG1-CG 4.37Å
297	G	89.4	Confident	92.6	Very high	38 Å²	38	52.5 Å²	52.5	39%	0.392	27%	0.27	S	S	.	.	H	α-helix	trans	-61.9	-37.3	173.7	0	0	0	0	0	113.2	K293 N294 I295 R300	K293-G297 PolarHBondContact O-N 3.07Å; N294-G297 PolarHBondContact O-N 2.62Å; I295-G297 VanDerWaalsContact C-N 3.29Å; I295-G297 PolarHBondContact O-N 3.21Å; G297-R300 PolarHBondContact O-NE 3Å
298	T	90	Very high	92.6	Very high	99 Å²	99	52.3 Å²	52.3	61%	0.607	27%	0.269	S	S	*	.	H	α-helix	trans	-85.7	-48.3	-178.2	-54.8	0	0	0	0	113.1	N294 I295 I296 R300	N294-T298 PolarHBondContact O-N 2.85Å; N294-T298 VanDerWaalsContact O-N 3.14Å; N294-T298 PolarHBondContact O-OG1 2.89Å; N294-T298 VanDerWaalsContact O-OG1 3.12Å; I295-T298 PolarHBondContact O-N 3.35Å; I295-T298 VanDerWaalsContact O-N 3.14Å; I296-T298 VanDerWaalsContact C-N 3.31Å; I296-T298 PolarHBondContact O-N 3.14Å; T298-R300 VanDerWaalsContact C-N 3.29Å; T298-R300 PolarHBondContact O-N 2.84Å
299	D	91.1	Very high	92.6	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	27%	0.269	C	S	.	.			trans	-80.8	68.8	-176	-88.6	14.4	0	0	0	111.7	I295 H303 T304 H305 Y360	I295-D299 WeakPolarHBondContact O-CB 3.45Å; I295-D299 PolarHBondContact O-N 3.08Å; D299-H303 PolarHBondContact O-NE2 3.34Å; D299-H303 WeakPolarHBondContact OD2-CA 3.36Å; D299-T304 PolarHBondContact OD1-N 3.38Å; D299-T304 VanDerWaalsContact OD1-N 3.11Å; D299-T304 PolarHBondContact OD1-OG1 3.42Å; D299-T304 PolarHBondContact OD2-N 2.76Å; D299-H305 IonicContact OD1-CE1 3.72Å; D299-H305 IonicContact OD1-CG 2.89Å; D299-H305 PolarHBondContact OD1-N 2.94Å; D299-H305 IonicContact OD1-ND1 3.89Å; D299-H305 PolarHBondContact OD1-ND1 3.25Å; D299-H305 VanDerWaalsContact OD2-CA 3.32Å; D299-H305 WeakPolarHBondContact OD2-CA 3.13Å; D299-H305 VanDerWaalsContact OD2-CB 3.25Å; D299-H305 WeakPolarHBondContact OD2-CB 3.39Å; D299-H305 IonicContact OD2-CG 2.65Å; D299-H305 PolarHBondContact OD2-N 3.27Å; D299-H305 IonicContact OD2-ND1 3.78Å; D299-Y360 HydrophobicContact CB-CE2 3.59Å; D299-Y360 PolarHBondContact OD2-OH 2.57Å
300	R	85.6	Confident	92.6	Very high	180 Å²	180	49.2 Å²	49.2	68%	0.679	26%	0.258	S	S	*	.	S	Bend	trans	-93.6	-35.8	174.5	-64.1	-177.6	177.8	-150	-9.4	113.6	G297 T298 H303 S363	G297-R300 PolarHBondContact O-NE 3Å; T298-R300 VanDerWaalsContact C-N 3.29Å; T298-R300 PolarHBondContact O-N 2.84Å; R300-H303 PolarHBondContact O-CE1 3.31Å; R300-S363 PolarHBondContact O-OG 2.79Å
301	E	84	Confident	92.7	Very high	149 Å²	149	46 Å²	46	70%	0.696	24%	0.244	S	C	*	.	S	Bend	trans	-116.4	-66.1	-175.5	-65.6	-179.9	-164.8	0	0	110.9	H303 H367	E301-H303 PolarHBondContact O-CE1 3.26Å; E301-H303 PolarHBondContact O-N 2.78Å; E301-H303 PolarHBondContact O-ND1 3.37Å; E301-H367 PolarHBondContact O-CD2 2.76Å; E301-H367 PolarHBondContact O-CE1 2.84Å; E301-H367 VanDerWaalsContact O-CE1 3.26Å; E301-H367 PolarHBondContact O-ND1 3.38Å; E301-H367 PolarHBondContact O-NE2 3.36Å
302	T	85.8	Confident	92.8	Very high	100 Å²	100	45.4 Å²	45.4	61%	0.613	24%	0.241	S	C	*	.	S	Bend	trans	-86.4	-3.3	-169.7	53.1	0	0	0	0	116	T304	T302-T304 VanDerWaalsContact C-N 3.29Å; T302-T304 PolarHBondContact O-N 3.44Å; T302-T304 VanDerWaalsContact O-N 3.09Å
303	H	94.6	Very high	92.9	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.019	24%	0.242	C	C	.	.			trans	47.2	39.8	171	-64.6	85.4	0	0	0	116.5	D299 R300 E301 H305 V306 Y360 S363 L364 H367	D299-H303 PolarHBondContact O-NE2 3.34Å; D299-H303 WeakPolarHBondContact OD2-CA 3.36Å; R300-H303 PolarHBondContact O-CE1 3.31Å; E301-H303 PolarHBondContact O-CE1 3.26Å; E301-H303 PolarHBondContact O-N 2.78Å; E301-H303 PolarHBondContact O-ND1 3.37Å; H303-H305 VanDerWaalsContact C-N 3.26Å; H303-H305 PolarHBondContact O-N 2.95Å; H303-V306 WeakPolarHBondContact O-CB 3.19Å; H303-V306 WeakPolarHBondContact O-CG1 3.44Å; H303-V306 PolarHBondContact O-N 3.11Å; H303-Y360 AromaticContact CD2-CZ 3.92Å; H303-S363 PolarHBondContact CE1-O 2.7Å; H303-S363 PolarHBondContact CE1-OG 2.95Å; H303-S363 VanDerWaalsContact NE2-CB 3.32Å; H303-S363 WeakPolarHBondContact NE2-CB 3.38Å; H303-S363 PolarHBondContact NE2-OG 2.97Å; H303-L364 HydrophobicContact CB-CD1 3.66Å; H303-L364 WeakPolarHBondContact NE2-CA 3.37Å; H303-L364 PolarHBondContact NE2-N 3.49Å; H303-L364 VanDerWaalsContact NE2-N 3.14Å; H303-H367 AromaticContact CG-ND1 3.73Å; H303-H367 WeakPolarHBondContact ND1-CB 3.22Å; H303-H367 AromaticContact ND1-CG 3.48Å; H303-H367 AromaticContact ND1-ND1 3.14Å; H303-H367 PolarHBondContact ND1-ND1 3.4Å; H303-H367 VanDerWaalsContact ND1-ND1 3.14Å
304	T	92.3	Very high	92.9	Very high	75 Å²	75	46 Å²	46	46%	0.46	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-25.7	-173.4	60.9	0	0	0	0	115.1	D299 T302	D299-T304 PolarHBondContact OD1-N 3.38Å; D299-T304 VanDerWaalsContact OD1-N 3.11Å; D299-T304 PolarHBondContact OD1-OG1 3.42Å; D299-T304 PolarHBondContact OD2-N 2.76Å; T302-T304 VanDerWaalsContact C-N 3.29Å; T302-T304 PolarHBondContact O-N 3.44Å; T302-T304 VanDerWaalsContact O-N 3.09Å
305	H	94.7	Very high	93	Very high	9 Å²	9	45.1 Å²	45.1	4%	0.042	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	9	-178.4	-57.2	90.2	0	0	0	113.3	I295 D299 H303 S307 V308 V309	I295-H305 HydrophobicContact CG1-CB 4.4Å; I295-H305 HydrophobicContact CG2-CB 3.71Å; D299-H305 IonicContact OD1-CE1 3.72Å; D299-H305 IonicContact OD1-CG 2.89Å; D299-H305 PolarHBondContact OD1-N 2.94Å; D299-H305 IonicContact OD1-ND1 3.89Å; D299-H305 PolarHBondContact OD1-ND1 3.25Å; D299-H305 VanDerWaalsContact OD2-CA 3.32Å; D299-H305 WeakPolarHBondContact OD2-CA 3.13Å; D299-H305 VanDerWaalsContact OD2-CB 3.25Å; D299-H305 WeakPolarHBondContact OD2-CB 3.39Å; D299-H305 IonicContact OD2-CG 2.65Å; D299-H305 PolarHBondContact OD2-N 3.27Å; D299-H305 IonicContact OD2-ND1 3.78Å; H303-H305 VanDerWaalsContact C-N 3.26Å; H303-H305 PolarHBondContact O-N 2.95Å; H305-S307 PolarHBondContact O-N 2.65Å; H305-S307 VanDerWaalsContact O-N 3.08Å; H305-V308 HydrophobicContact CB-CB 4.36Å; H305-V308 HydrophobicContact CB-CG2 4.23Å; H305-V308 WeakPolarHBondContact O-CA 3.46Å; H305-V308 WeakPolarHBondContact O-CB 3.2Å; H305-V308 PolarHBondContact O-N 3.38Å; H305-V309 PolarHBondContact O-N 2.95Å
306	V	95.6	Very high	93.2	Very high	12 Å²	12	44.9 Å²	44.9	7%	0.073	24%	0.237	C	C	.	.	H	α-helix	trans	-54.9	-34.9	-177.5	67.6	0	0	0	0	113	H303 V308 V309 I310 Y360 L364 N413	H303-V306 WeakPolarHBondContact O-CB 3.19Å; H303-V306 WeakPolarHBondContact O-CG1 3.44Å; H303-V306 PolarHBondContact O-N 3.11Å; V306-V308 VanDerWaalsContact C-N 3.3Å; V306-V308 PolarHBondContact O-N 2.97Å; V306-V309 PolarHBondContact O-N 2.82Å; V306-I310 HydrophobicContact CG2-CD1 3.88Å; V306-I310 HydrophobicContact CG2-CG1 4.36Å; V306-I310 WeakPolarHBondContact O-CG1 3.43Å; V306-I310 PolarHBondContact O-N 2.88Å; V306-Y360 WeakPolarHBondContact CA-OH 3.17Å; V306-Y360 HydrophobicContact CB-CE1 4.31Å; V306-Y360 WeakPolarHBondContact CB-OH 3.38Å; V306-Y360 HydrophobicContact CG2-CE1 4.14Å; V306-Y360 PolarHBondContact N-OH 3.26Å; V306-Y360 VanDerWaalsContact N-OH 3.07Å; V306-L364 HydrophobicContact CG2-CD1 4.11Å; V306-L364 HydrophobicContact CG2-CD2 3.83Å; V306-N413 HydrophobicContact CG1-CB 4.05Å; V306-N413 HydrophobicContact CG2-CB 3.9Å
307	S	95.3	Very high	93.4	Very high	38 Å²	38	43.9 Å²	43.9	27%	0.266	23%	0.232	S	C	.	.	H	α-helix	trans	-68.4	-23.5	174.3	74.6	0	0	0	0	114.4	R264 H305 S311	R264-S307 WeakPolarHBondContact CD-O 3.4Å; R264-S307 PolarHBondContact NH1-OG 3.44Å; H305-S307 PolarHBondContact O-N 2.65Å; H305-S307 VanDerWaalsContact O-N 3.08Å; S307-S311 WeakPolarHBondContact O-CB 3.24Å; S307-S311 PolarHBondContact O-N 3.38Å
308	V	96.1	Very high	93.6	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-71.4	-48.6	170.6	180	0	0	0	0	109.3	V260 L263 R264 L267 I295 H305 V306 S311 F312	V260-V308 HydrophobicContact CG1-CG2 3.56Å; L263-V308 HydrophobicContact CG-CG1 4.4Å; R264-V308 HydrophobicContact CB-CG2 4.03Å; L267-V308 HydrophobicContact CB-CG1 4.36Å; L267-V308 HydrophobicContact CD2-CG1 3.6Å; I295-V308 HydrophobicContact CD1-CB 4.43Å; I295-V308 HydrophobicContact CD1-CG1 3.71Å; H305-V308 HydrophobicContact CB-CB 4.36Å; H305-V308 HydrophobicContact CB-CG2 4.23Å; H305-V308 WeakPolarHBondContact O-CA 3.46Å; H305-V308 WeakPolarHBondContact O-CB 3.2Å; H305-V308 PolarHBondContact O-N 3.38Å; V306-V308 VanDerWaalsContact C-N 3.3Å; V306-V308 PolarHBondContact O-N 2.97Å; V308-S311 PolarHBondContact O-N 3.26Å; V308-F312 WeakPolarHBondContact O-CB 3.36Å; V308-F312 PolarHBondContact O-N 2.78Å
309	V	97.3	Very high	93.8	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-48.3	-178.9	-177.6	0	0	0	0	111.1	I295 H305 V306 S311 F312 C313 L357 Y360 L417	I295-V309 HydrophobicContact CG2-CG2 3.95Å; H305-V309 PolarHBondContact O-N 2.95Å; V306-V309 PolarHBondContact O-N 2.82Å; V309-S311 VanDerWaalsContact C-N 3.34Å; V309-S311 PolarHBondContact O-N 3.31Å; V309-F312 PolarHBondContact O-N 3.03Å; V309-C313 PolarHBondContact O-N 2.89Å; V309-C313 PolarHBondContact O-SG 2.61Å; V309-L357 HydrophobicContact CG1-CD2 3.61Å; V309-Y360 HydrophobicContact CB-CD1 4.43Å; V309-Y360 HydrophobicContact CB-CE1 4.25Å; V309-Y360 HydrophobicContact CG1-CD1 4.09Å; V309-Y360 HydrophobicContact CG1-CE1 4.38Å; V309-Y360 HydrophobicContact CG1-CG 4.45Å; V309-Y360 HydrophobicContact CG2-CD1 4.23Å; V309-Y360 HydrophobicContact CG2-CD2 4.14Å; V309-Y360 HydrophobicContact CG2-CE1 4Å; V309-Y360 HydrophobicContact CG2-CE2 3.87Å; V309-Y360 HydrophobicContact CG2-CG 4.31Å; V309-L417 HydrophobicContact CG1-CD1 4.08Å; V309-L417 HydrophobicContact CG1-CD2 4.26Å
310	I	97.2	Very high	94.1	Very high	21 Å²	21	39.2 Å²	39.2	11%	0.108	19%	0.194	C	C	.	.	H	α-helix	trans	-58.4	-45.2	175.2	-70.1	166.6	0	0	0	111.2	V306 F312 C313 K314 N413 T416 L417 L420	V306-I310 HydrophobicContact CG2-CD1 3.88Å; V306-I310 HydrophobicContact CG2-CG1 4.36Å; V306-I310 WeakPolarHBondContact O-CG1 3.43Å; V306-I310 PolarHBondContact O-N 2.88Å; I310-F312 VanDerWaalsContact C-N 3.32Å; I310-F312 PolarHBondContact O-N 3.26Å; I310-C313 PolarHBondContact O-N 3.09Å; I310-K314 VanDerWaalsContact O-CB 3.3Å; I310-K314 WeakPolarHBondContact O-CB 3.48Å; I310-K314 PolarHBondContact O-N 3.1Å; I310-N413 HydrophobicContact CD1-CB 3.85Å; I310-N413 WeakPolarHBondContact CD1-O 3.31Å; I310-N413 WeakPolarHBondContact CD1-OD1 3.48Å; I310-T416 HydrophobicContact CD1-CG2 4.43Å; I310-T416 HydrophobicContact CG2-CG2 3.7Å; I310-L417 HydrophobicContact CG1-CB 4.17Å; I310-L417 HydrophobicContact CG1-CD1 4.43Å; I310-L420 HydrophobicContact CG2-CD1 4.04Å
311	S	96.9	Very high	94.6	Very high	10 Å²	10	30.7 Å²	30.7	7%	0.07	16%	0.162	C	C	.	.	H	α-helix	trans	-66.5	-32.3	179	-176.7	0	0	0	0	113	R264 S307 V308 V309 H315	R264-S311 VanDerWaalsContact CG-CB 3.47Å; S307-S311 WeakPolarHBondContact O-CB 3.24Å; S307-S311 PolarHBondContact O-N 3.38Å; V308-S311 PolarHBondContact O-N 3.26Å; V309-S311 VanDerWaalsContact C-N 3.34Å; V309-S311 PolarHBondContact O-N 3.31Å; S311-H315 WeakPolarHBondContact O-CB 3.42Å; S311-H315 PolarHBondContact O-CD2 3.45Å; S311-H315 VanDerWaalsContact O-CD2 3.27Å; S311-H315 PolarHBondContact O-N 2.96Å
312	F	97.5	Very high	95.1	Very high	1 Å²	1	24.6 Å²	24.6	0%	0.004	14%	0.139	C	C	.	.	H	α-helix	trans	-70.1	-49.4	173.3	171.3	-97.5	0	0	0	110.7	L267 A271 I288 L292 V308 V309 I310 H315 C316 G317 I320 L357	L267-F312 HydrophobicContact CD2-CB 4.02Å; L267-F312 HydrophobicContact CD2-CD2 4.17Å; L267-F312 HydrophobicContact CD2-CG 4.2Å; L267-F312 HydrophobicContact CG-CD2 3.98Å; L267-F312 HydrophobicContact CG-CG 4.49Å; A271-F312 HydrophobicContact CB-CD2 4.34Å; A271-F312 HydrophobicContact CB-CE2 3.97Å; I288-F312 HydrophobicContact CG2-CE2 3.65Å; I288-F312 HydrophobicContact CG2-CZ 3.9Å; L292-F312 HydrophobicContact CD1-CD1 4.2Å; L292-F312 HydrophobicContact CD1-CE1 3.69Å; L292-F312 HydrophobicContact CD1-CE2 4.38Å; L292-F312 HydrophobicContact CD1-CZ 3.78Å; L292-F312 HydrophobicContact CD2-CD1 4.26Å; V308-F312 WeakPolarHBondContact O-CB 3.36Å; V308-F312 PolarHBondContact O-N 2.78Å; V309-F312 PolarHBondContact O-N 3.03Å; I310-F312 VanDerWaalsContact C-N 3.32Å; I310-F312 PolarHBondContact O-N 3.26Å; F312-H315 PolarHBondContact O-N 3.35Å; F312-C316 HydrophobicContact CD2-CB 4.41Å; F312-C316 HydrophobicContact CE2-CB 4.34Å; F312-C316 PolarHBondContact O-N 3Å; F312-G317 PolarHBondContact O-N 3.32Å; F312-I320 HydrophobicContact CE2-CG2 4.32Å; F312-I320 HydrophobicContact CZ-CB 3.99Å; F312-I320 HydrophobicContact CZ-CG2 3.68Å; F312-L357 HydrophobicContact CD1-CD2 4.47Å; F312-L357 HydrophobicContact CE1-CD1 4.31Å
313	C	96.8	Very high	95.5	Very high	5 Å²	5	20.5 Å²	20.5	3%	0.034	11%	0.113	C	C	.	.	H	α-helix	trans	-60.4	-49.9	179.7	-62.3	0	0	0	0	111.8	V309 I310 H315 G317 L323 L420	V309-C313 PolarHBondContact O-N 2.89Å; V309-C313 PolarHBondContact O-SG 2.61Å; I310-C313 PolarHBondContact O-N 3.09Å; C313-H315 VanDerWaalsContact C-N 3.31Å; C313-H315 PolarHBondContact O-N 3.28Å; C313-G317 WeakPolarHBondContact O-CA 3.19Å; C313-G317 PolarHBondContact O-N 2.97Å; C313-G317 VanDerWaalsContact O-N 3.09Å; C313-L323 HydrophobicContact CB-CD1 3.73Å; C313-L420 HydrophobicContact CB-CB 4.16Å; C313-L420 HydrophobicContact CB-CD1 3.98Å
314	K	95.4	Very high	95.5	Very high	132 Å²	132	24.1 Å²	24.1	57%	0.574	14%	0.135	S	C	*	.	H	α-helix	trans	-61.4	-34.8	-178.6	179.2	168.7	-179.2	170.7	0	113.5	I310 L420	I310-K314 VanDerWaalsContact O-CB 3.3Å; I310-K314 WeakPolarHBondContact O-CB 3.48Å; I310-K314 PolarHBondContact O-N 3.1Å; K314-L420 HydrophobicContact CB-CD1 4.03Å; K314-L420 HydrophobicContact CB-CD2 4.12Å
315	H	94.8	Very high	95.7	Very high	45 Å²	45	21.7 Å²	21.7	21%	0.208	12%	0.121	C	C	.	.	H	α-helix	trans	-100.1	-34.8	-174.3	-71.4	-58.5	0	0	0	114.3	R142 I217 R268 S311 F312 C313	R142-H315 PolarHBondContact NH2-O 2.73Å; I217-H315 WeakPolarHBondContact CG2-NE2 3.43Å; R268-H315 HydrophobicContact CG-CB 4.1Å; S311-H315 WeakPolarHBondContact O-CB 3.42Å; S311-H315 PolarHBondContact O-CD2 3.45Å; S311-H315 VanDerWaalsContact O-CD2 3.27Å; S311-H315 PolarHBondContact O-N 2.96Å; F312-H315 PolarHBondContact O-N 3.35Å; C313-H315 VanDerWaalsContact C-N 3.31Å; C313-H315 PolarHBondContact O-N 3.28Å
316	C	95.6	Very high	95.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-132.6	-1	-169.8	-59.8	0	0	0	0	114	A271 I275 F312 D318 I320	A271-C316 HydrophobicContact CB-CB 3.78Å; I275-C316 HydrophobicContact CD1-CB 4.01Å; F312-C316 HydrophobicContact CD2-CB 4.41Å; F312-C316 HydrophobicContact CE2-CB 4.34Å; F312-C316 PolarHBondContact O-N 3Å; C316-D318 VanDerWaalsContact C-N 3.26Å; C316-D318 VanDerWaalsContact C-OD1 3.31Å; C316-D318 WeakPolarHBondContact CA-OD1 3.32Å; C316-D318 PolarHBondContact O-N 3.25Å; C316-I320 HydrophobicContact CB-CG1 4.3Å; C316-I320 VanDerWaalsContact O-CB 3.31Å; C316-I320 WeakPolarHBondContact O-CB 3.18Å; C316-I320 WeakPolarHBondContact O-CG1 3.49Å; C316-I320 PolarHBondContact O-N 3.12Å
317	G	95.3	Very high	95.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-69.3	-25	-179.7	0	0	0	0	0	113.5	F312 C313 A321 G322 L323	F312-G317 PolarHBondContact O-N 3.32Å; C313-G317 WeakPolarHBondContact O-CA 3.19Å; C313-G317 PolarHBondContact O-N 2.97Å; C313-G317 VanDerWaalsContact O-N 3.09Å; G317-A321 CarbonylContact O-C 3.56Å; G317-A321 VanDerWaalsContact O-C 3.31Å; G317-A321 WeakPolarHBondContact O-CA 3.25Å; G317-A321 PolarHBondContact O-N 3.35Å; G317-G322 PolarHBondContact O-N 2.9Å; G317-L323 PolarHBondContact O-N 3.39Å
318	D	93.9	Very high	95.4	Very high	35 Å²	35	31 Å²	31	19%	0.187	15%	0.152	C	C	.	.	H	α-helix	trans	-58.2	-47.7	174.1	45.7	7.4	0	0	0	112.9	R138 R142 C316 S342	R138-D318 IonicContact CZ-OD2 2.72Å; R138-D318 IonicContact NE-OD2 3.66Å; R138-D318 PolarHBondContact NE-OD2 3.17Å; R138-D318 IonicContact NH2-OD2 3.73Å; R138-D318 PolarHBondContact NH2-OD2 3.27Å; R142-D318 IonicContact CZ-OD1 3.8Å; R142-D318 IonicContact NH1-OD1 2.68Å; R142-D318 PolarHBondContact NH1-OD1 3.1Å; R142-D318 IonicContact NH1-OD2 2.7Å; R142-D318 PolarHBondContact NH1-OD2 2.97Å; C316-D318 VanDerWaalsContact C-N 3.26Å; C316-D318 VanDerWaalsContact C-OD1 3.31Å; C316-D318 WeakPolarHBondContact CA-OD1 3.32Å; C316-D318 PolarHBondContact O-N 3.25Å; D318-S342 PolarHBondContact O-OG 3.14Å
319	D	95.2	Very high	95.2	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.032	17%	0.168	C	C	.	.	H	α-helix	trans	-92.2	-38.8	178.8	-72.6	-55.5	0	0	0	113.4	R142 I275 I344 I345 Q350	R142-D319 VanDerWaalsContact CD-OD2 3.3Å; R142-D319 WeakPolarHBondContact CD-OD2 3.44Å; R142-D319 IonicContact CZ-OD2 2.68Å; R142-D319 IonicContact NE-OD2 3.59Å; R142-D319 IonicContact NH1-OD2 3.26Å; R142-D319 PolarHBondContact NH1-OD2 3Å; I275-D319 HydrophobicContact CD1-CB 3.9Å; I275-D319 HydrophobicContact CG1-CB 3.94Å; I275-D319 HydrophobicContact CG2-CB 4.33Å; D319-I344 HydrophobicContact CB-CB 4.44Å; D319-I344 WeakPolarHBondContact OD1-CB 3.46Å; D319-I345 WeakPolarHBondContact O-CB 3.5Å; D319-I345 WeakPolarHBondContact O-CG1 3.41Å; D319-Q350 PolarHBondContact O-NE2 3.16Å
320	I	96.6	Very high	95	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-84.9	-30.9	-173.3	-58.2	-68.8	0	0	0	113.1	A271 I275 L285 I288 F312 C316 I345 Q350 F353	A271-I320 HydrophobicContact CB-CG1 4.33Å; I275-I320 HydrophobicContact CD1-CD1 4.3Å; I275-I320 HydrophobicContact CD1-CG1 4.04Å; I275-I320 HydrophobicContact CG1-CD1 3.74Å; I275-I320 HydrophobicContact CG1-CG1 4.05Å; L285-I320 HydrophobicContact CD2-CD1 3.69Å; L285-I320 HydrophobicContact CD2-CG2 4Å; I288-I320 HydrophobicContact CD1-CD1 4.15Å; I288-I320 HydrophobicContact CG2-CG2 4.48Å; F312-I320 HydrophobicContact CE2-CG2 4.32Å; F312-I320 HydrophobicContact CZ-CB 3.99Å; F312-I320 HydrophobicContact CZ-CG2 3.68Å; C316-I320 HydrophobicContact CB-CG1 4.3Å; C316-I320 VanDerWaalsContact O-CB 3.31Å; C316-I320 WeakPolarHBondContact O-CB 3.18Å; C316-I320 WeakPolarHBondContact O-CG1 3.49Å; C316-I320 PolarHBondContact O-N 3.12Å; I320-I345 HydrophobicContact CD1-CG1 4.46Å; I320-Q350 WeakPolarHBondContact O-CA 3.37Å; I320-F353 HydrophobicContact CG2-CD1 4.04Å; I320-F353 HydrophobicContact CG2-CD2 3.96Å; I320-F353 HydrophobicContact CG2-CE1 4.14Å; I320-F353 HydrophobicContact CG2-CE2 4.09Å; I320-F353 HydrophobicContact CG2-CG 3.94Å; I320-F353 HydrophobicContact CG2-CZ 4.17Å; I320-F353 WeakPolarHBondContact O-CD2 3.27Å
321	A	95.8	Very high	94.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-126.5	6.4	-171.6	0	0	0	0	0	114.1	G317 L323 F353 L357	G317-A321 CarbonylContact O-C 3.56Å; G317-A321 VanDerWaalsContact O-C 3.31Å; G317-A321 WeakPolarHBondContact O-CA 3.25Å; G317-A321 PolarHBondContact O-N 3.35Å; A321-L323 VanDerWaalsContact C-N 3.25Å; A321-L323 HydrophobicContact CB-CD2 4.26Å; A321-L323 HydrophobicContact CB-CG 4.05Å; A321-L323 PolarHBondContact O-N 3.41Å; A321-F353 HydrophobicContact CB-CB 3.69Å; A321-L357 HydrophobicContact CB-CD1 3.87Å
322	G	94.6	Very high	94.5	Very high	21 Å²	21	39.8 Å²	39.8	22%	0.216	20%	0.199	C	C	.	.			trans	61.8	29.4	179	0	0	0	0	0	113.7	G317	G317-G322 PolarHBondContact O-N 2.9Å
323	L	95.1	Very high	94.3	Very high	15 Å²	15	46.9 Å²	46.9	8%	0.079	23%	0.232	C	C	.	.			trans	-75	131.8	-177.2	-58.2	-173	0	0	0	111.4	C313 G317 A321 L357 L421	C313-L323 HydrophobicContact CB-CD1 3.73Å; G317-L323 PolarHBondContact O-N 3.39Å; A321-L323 VanDerWaalsContact C-N 3.25Å; A321-L323 HydrophobicContact CB-CD2 4.26Å; A321-L323 HydrophobicContact CB-CG 4.05Å; A321-L323 PolarHBondContact O-N 3.41Å; L323-L357 HydrophobicContact CD1-CD1 4.17Å; L323-L357 HydrophobicContact CD2-CD1 4.44Å; L323-L421 HydrophobicContact CD1-CD2 3.82Å; L323-L421 HydrophobicContact CD2-CD2 3.67Å; L323-L421 HydrophobicContact CG-CD2 4.42Å
324	V	94.4	Very high	94	Very high	79 Å²	79	52 Å²	52	48%	0.479	25%	0.254	S	S	.	.			trans	-121.4	92.1	168.5	-174.3	0	0	0	0	107.6	V328 K329	V324-V328 HydrophobicContact CG1-CB 4.48Å; V324-V328 HydrophobicContact CG1-CG1 4.15Å; V324-K329 HydrophobicContact CG1-CG 3.85Å; V324-K329 WeakPolarHBondContact O-CE 3.5Å
325	P	95.3	Very high	93.9	Very high	24 Å²	24	48 Å²	48	16%	0.156	24%	0.236	C	C	.	.			trans	-56	151.8	-175.8	-29.6	36.9	0	0	0	114	R327 V328 K329 D419 L420	P325-R327 PolarHBondContact O-N 3.4Å; P325-V328 HydrophobicContact CB-CG2 4.22Å; P325-V328 HydrophobicContact CG-CG2 4.36Å; P325-V328 WeakPolarHBondContact O-CA 3.32Å; P325-V328 WeakPolarHBondContact O-CB 3.37Å; P325-V328 PolarHBondContact O-N 3.1Å; P325-K329 PolarHBondContact O-N 3.01Å; P325-K329 VanDerWaalsContact O-N 3.1Å; P325-D419 CarbonylContact C-O 3.6Å; P325-D419 VanDerWaalsContact CA-O 3.22Å; P325-D419 WeakPolarHBondContact CA-O 3.34Å; P325-D419 WeakPolarHBondContact CB-O 3.49Å; P325-L420 HydrophobicContact CB-CD2 4.38Å; P325-L420 HydrophobicContact CG-CD2 3.95Å
326	R	94.3	Very high	93.7	Very high	77 Å²	77	49 Å²	49	29%	0.291	26%	0.259	S	S	.	.	H	α-helix	trans	-57.1	-44.5	-180	-178.5	170.2	-64.3	-168.1	-1.3	112.3	V328 K329 L330 D419 D422 E423 N424	R326-V328 PolarHBondContact O-N 3.25Å; R326-K329 PolarHBondContact O-N 3.03Å; R326-L330 HydrophobicContact CG-CD1 3.88Å; R326-L330 HydrophobicContact CG-CG 4.28Å; R326-L330 WeakPolarHBondContact O-CB 3.34Å; R326-L330 WeakPolarHBondContact O-CG 3.39Å; R326-L330 PolarHBondContact O-N 2.9Å; R326-D419 WeakPolarHBondContact CB-OD1 3.36Å; R326-D419 PolarHBondContact N-O 2.75Å; R326-D422 HydrophobicContact CB-CB 4.44Å; R326-D422 WeakPolarHBondContact CB-OD1 3.5Å; R326-D422 IonicContact CZ-OD1 2.78Å; R326-D422 VanDerWaalsContact CZ-OD1 3.23Å; R326-D422 IonicContact NE-OD1 2.68Å; R326-D422 PolarHBondContact NE-OD1 3.44Å; R326-D422 PolarHBondContact NH2-O 2.99Å; R326-D422 IonicContact NH2-OD1 3.48Å; R326-D422 PolarHBondContact NH2-OD1 1.85Å; R326-E423 PolarHBondContact NH2-O 3.48Å; R326-N424 PolarHBondContact NH1-OD1 2.82Å; R326-N424 PolarHBondContact NH2-OD1 3.07Å
327	R	92.1	Very high	93.6	Very high	154 Å²	154	50 Å²	50	58%	0.581	27%	0.265	S	S	*	.	H	α-helix	trans	-51.5	-38.7	169.3	-78.9	172.2	-164.8	-105.7	-5.1	114.3	L131 P325 A331 D419	L131-R327 HydrophobicContact CD2-CB 4.16Å; P325-R327 PolarHBondContact O-N 3.4Å; R327-A331 VanDerWaalsContact O-CB 3.23Å; R327-A331 WeakPolarHBondContact O-CB 3.35Å; R327-A331 PolarHBondContact O-N 3.49Å; R327-D419 WeakPolarHBondContact CD-OD2 3.47Å; R327-D419 WeakPolarHBondContact CG-OD1 3.36Å; R327-D419 PolarHBondContact N-OD1 3.09Å; R327-D419 IonicContact NE-OD2 2.73Å; R327-D419 PolarHBondContact NE-OD2 2.91Å
328	V	93.1	Very high	93.5	Very high	25 Å²	25	53.6 Å²	53.6	15%	0.152	29%	0.294	C	S	.	.	H	α-helix	trans	-71.2	-42.9	179.8	173.5	0	0	0	0	110.5	L131 V324 P325 R326 A332 F339	L131-V328 HydrophobicContact CD2-CG2 4Å; L131-V328 HydrophobicContact CG-CG2 4.43Å; V324-V328 HydrophobicContact CG1-CB 4.48Å; V324-V328 HydrophobicContact CG1-CG1 4.15Å; P325-V328 HydrophobicContact CB-CG2 4.22Å; P325-V328 HydrophobicContact CG-CG2 4.36Å; P325-V328 WeakPolarHBondContact O-CA 3.32Å; P325-V328 WeakPolarHBondContact O-CB 3.37Å; P325-V328 PolarHBondContact O-N 3.1Å; R326-V328 PolarHBondContact O-N 3.25Å; V328-A332 WeakPolarHBondContact O-CB 3.46Å; V328-A332 PolarHBondContact O-N 3.01Å; V328-F339 HydrophobicContact CG1-CB 4.12Å; V328-F339 HydrophobicContact CG1-CD1 3.66Å; V328-F339 HydrophobicContact CG1-CD2 3.82Å; V328-F339 HydrophobicContact CG1-CE1 3.95Å; V328-F339 HydrophobicContact CG1-CE2 4.11Å; V328-F339 HydrophobicContact CG1-CG 3.59Å; V328-F339 HydrophobicContact CG1-CZ 4.18Å; V328-F339 HydrophobicContact CG2-CE1 4.28Å
329	K	92.6	Very high	93.5	Very high	80 Å²	80	53.7 Å²	53.7	35%	0.348	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-51	174.6	-61.4	-172.4	-179.6	-176.5	0	111.7	V324 P325 R326 A331 A332 E333 D422	V324-K329 HydrophobicContact CG1-CG 3.85Å; V324-K329 WeakPolarHBondContact O-CE 3.5Å; P325-K329 PolarHBondContact O-N 3.01Å; P325-K329 VanDerWaalsContact O-N 3.1Å; R326-K329 PolarHBondContact O-N 3.03Å; K329-A331 VanDerWaalsContact C-N 3.35Å; K329-A331 PolarHBondContact O-N 3.21Å; K329-A332 WeakPolarHBondContact O-CB 3.46Å; K329-A332 PolarHBondContact O-N 3.23Å; K329-A332 VanDerWaalsContact O-N 3.13Å; K329-E333 WeakPolarHBondContact O-CG 3.44Å; K329-E333 PolarHBondContact O-N 3.43Å; K329-D422 WeakPolarHBondContact CD-OD2 3.39Å; K329-D422 VanDerWaalsContact CE-OD2 3.29Å; K329-D422 WeakPolarHBondContact CE-OD2 3.25Å; K329-D422 IonicContact NZ-OD2 3.06Å; K329-D422 PolarHBondContact NZ-OD2 2.78Å
330	L	91.9	Very high	93.3	Very high	97 Å²	97	55 Å²	55	51%	0.508	30%	0.302	S	S	.	.	H	α-helix	trans	-61.1	-41	179.5	-67.9	174.1	0	0	0	112	R326 K334	R326-L330 HydrophobicContact CG-CD1 3.88Å; R326-L330 HydrophobicContact CG-CG 4.28Å; R326-L330 WeakPolarHBondContact O-CB 3.34Å; R326-L330 WeakPolarHBondContact O-CG 3.39Å; R326-L330 PolarHBondContact O-N 2.9Å; L330-K334 WeakPolarHBondContact O-CB 3.21Å; L330-K334 PolarHBondContact O-N 2.85Å
331	A	92.4	Very high	92.7	Very high	7 Å²	7	58 Å²	58	6%	0.058	32%	0.321	C	S	.	.	H	α-helix	trans	-67.9	-35.6	175.2	0	0	0	0	0	112.8	R327 K329 F335 F339	R327-A331 VanDerWaalsContact O-CB 3.23Å; R327-A331 WeakPolarHBondContact O-CB 3.35Å; R327-A331 PolarHBondContact O-N 3.49Å; K329-A331 VanDerWaalsContact C-N 3.35Å; K329-A331 PolarHBondContact O-N 3.21Å; A331-F335 HydrophobicContact CB-CD2 4.32Å; A331-F335 WeakPolarHBondContact O-CB 3.44Å; A331-F335 PolarHBondContact O-N 3.27Å; A331-F339 HydrophobicContact CB-CE2 4.1Å; A331-F339 HydrophobicContact CB-CZ 4.13Å
332	A	92.4	Very high	92.2	Very high	32 Å²	32	60.7 Å²	60.7	26%	0.264	34%	0.34	S	S	.	.	H	α-helix	trans	-65.3	-47.1	174.9	0	0	0	0	0	111.7	V328 K329 G336 L337 F339	V328-A332 WeakPolarHBondContact O-CB 3.46Å; V328-A332 PolarHBondContact O-N 3.01Å; K329-A332 WeakPolarHBondContact O-CB 3.46Å; K329-A332 PolarHBondContact O-N 3.23Å; K329-A332 VanDerWaalsContact O-N 3.13Å; A332-G336 CarbonylContact O-C 3.58Å; A332-G336 WeakPolarHBondContact O-CA 3.19Å; A332-G336 PolarHBondContact O-N 3.45Å; A332-L337 WeakPolarHBondContact CA-O 3.5Å; A332-L337 WeakPolarHBondContact CB-O 3.41Å; A332-L337 PolarHBondContact O-N 3Å; A332-L337 VanDerWaalsContact O-N 3.15Å; A332-F339 HydrophobicContact CB-CD2 4.02Å; A332-F339 HydrophobicContact CB-CE2 4.26Å
333	E	92.3	Very high	91.9	Very high	151 Å²	151	64.8 Å²	64.8	71%	0.706	35%	0.353	S	S	*	.	H	α-helix	trans	-71.3	-49.6	-179.2	-70.2	169.3	-171.4	0	0	112.3	K329	K329-E333 WeakPolarHBondContact O-CG 3.44Å; K329-E333 PolarHBondContact O-N 3.43Å
334	K	91.9	Very high	91.7	Very high	113 Å²	113	64.8 Å²	64.8	49%	0.491	35%	0.353	S	S	.	.	H	α-helix	trans	-73.1	-29.1	-174	-171.4	172.3	175.5	175.2	0	113.9	E124 L330	E124-K334 IonicContact OE1-NZ 2.71Å; E124-K334 PolarHBondContact OE1-NZ 2.91Å; E124-K334 IonicContact OE2-NZ 3.22Å; E124-K334 PolarHBondContact OE2-NZ 2.96Å; L330-K334 WeakPolarHBondContact O-CB 3.21Å; L330-K334 PolarHBondContact O-N 2.85Å
335	F	91.8	Very high	91.7	Very high	46 Å²	46	61.3 Å²	61.3	20%	0.202	33%	0.332	C	S	.	.	H	α-helix	trans	-119.3	2.1	-176.4	-52.5	-56.1	0	0	0	114.2	E124 K125 A331 L337	E124-F335 HydrophobicContact CB-CZ 4.47Å; E124-F335 HydrophobicContact CG-CE2 4.48Å; E124-F335 HydrophobicContact CG-CZ 4.09Å; K125-F335 HydrophobicContact CB-CD1 4.33Å; K125-F335 HydrophobicContact CB-CE1 3.78Å; K125-F335 HydrophobicContact CB-CZ 3.94Å; K125-F335 HydrophobicContact CG-CD1 4.08Å; K125-F335 HydrophobicContact CG-CE1 4.05Å; A331-F335 HydrophobicContact CB-CD2 4.32Å; A331-F335 WeakPolarHBondContact O-CB 3.44Å; A331-F335 PolarHBondContact O-N 3.27Å; F335-L337 HydrophobicContact CB-CD1 3.9Å; F335-L337 HydrophobicContact CB-CG 3.88Å; F335-L337 HydrophobicContact CD2-CD1 4.45Å
336	G	90.9	Very high	91.6	Very high	67 Å²	67	62.4 Å²	62.4	69%	0.691	34%	0.34	S	S	*	.			trans	70	27.5	178.9	0	0	0	0	0	114.5	A332	A332-G336 CarbonylContact O-C 3.58Å; A332-G336 WeakPolarHBondContact O-CA 3.19Å; A332-G336 PolarHBondContact O-N 3.45Å
337	L	93.6	Very high	91.4	Very high	22 Å²	22	63.6 Å²	63.6	12%	0.115	36%	0.356	C	S	.	.			trans	-90.4	118	-170	-64.7	175.3	0	0	0	112.9	H132 A332 F335 F339	H132-L337 HydrophobicContact CB-CD1 4.18Å; A332-L337 WeakPolarHBondContact CA-O 3.5Å; A332-L337 WeakPolarHBondContact CB-O 3.41Å; A332-L337 PolarHBondContact O-N 3Å; A332-L337 VanDerWaalsContact O-N 3.15Å; F335-L337 HydrophobicContact CB-CD1 3.9Å; F335-L337 HydrophobicContact CB-CG 3.88Å; F335-L337 HydrophobicContact CD2-CD1 4.45Å; L337-F339 HydrophobicContact CB-CD2 4.33Å; L337-F339 HydrophobicContact CB-CE2 3.9Å; L337-F339 WeakPolarHBondContact O-CD2 3.44Å; L337-F339 PolarHBondContact O-N 2.73Å
338	A	93.1	Very high	91.5	Very high	75 Å²	75	64 Å²	64	62%	0.62	37%	0.365	S	S	*	.			trans	-82.1	99.8	176.6	0	0	0	0	0	111.9	H132 W136	H132-A338 PolarHBondContact CD2-O 3.07Å; H132-A338 PolarHBondContact NE2-O 3Å; W136-A338 PolarHBondContact NE1-O 3.38Å
339	F	93.5	Very high	91.6	Very high	37 Å²	37	66.8 Å²	66.8	16%	0.162	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-76	161.6	176.6	-78.2	-96.7	0	0	0	112.9	L131 H132 A135 V328 A331 A332 L337	L131-F339 HydrophobicContact CD2-CZ 4.49Å; L131-F339 HydrophobicContact CG-CE1 4.11Å; L131-F339 HydrophobicContact CG-CZ 4.34Å; H132-F339 VanDerWaalsContact CA-CE1 3.46Å; H132-F339 HydrophobicContact CB-CE1 4.01Å; H132-F339 HydrophobicContact CB-CE2 4.45Å; H132-F339 HydrophobicContact CB-CZ 3.88Å; A135-F339 HydrophobicContact CB-CD1 3.86Å; A135-F339 HydrophobicContact CB-CE1 4.23Å; V328-F339 HydrophobicContact CG1-CB 4.12Å; V328-F339 HydrophobicContact CG1-CD1 3.66Å; V328-F339 HydrophobicContact CG1-CD2 3.82Å; V328-F339 HydrophobicContact CG1-CE1 3.95Å; V328-F339 HydrophobicContact CG1-CE2 4.11Å; V328-F339 HydrophobicContact CG1-CG 3.59Å; V328-F339 HydrophobicContact CG1-CZ 4.18Å; V328-F339 HydrophobicContact CG2-CE1 4.28Å; A331-F339 HydrophobicContact CB-CE2 4.1Å; A331-F339 HydrophobicContact CB-CZ 4.13Å; A332-F339 HydrophobicContact CB-CD2 4.02Å; A332-F339 HydrophobicContact CB-CE2 4.26Å; L337-F339 HydrophobicContact CB-CD2 4.33Å; L337-F339 HydrophobicContact CB-CE2 3.9Å; L337-F339 WeakPolarHBondContact O-CD2 3.44Å; L337-F339 PolarHBondContact O-N 2.73Å
340	P	91.9	Very high	91.8	Very high	33 Å²	33	63.5 Å²	63.5	21%	0.214	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-66	142.1	-178	-15.6	27.3	0	0	0	113.3	A135 W136 H139	A135-P340 HydrophobicContact CB-CG 4Å; W136-P340 HydrophobicContact CB-CG 4.45Å; W136-P340 HydrophobicContact CD2-CB 4.31Å; W136-P340 HydrophobicContact CD2-CG 3.72Å; W136-P340 HydrophobicContact CE3-CB 4.33Å; W136-P340 HydrophobicContact CE3-CG 4.12Å; W136-P340 HydrophobicContact CG-CG 3.86Å; W136-P340 HydrophobicContact CH2-CB 4.4Å; W136-P340 HydrophobicContact CZ2-CB 4.36Å; W136-P340 HydrophobicContact CZ2-CG 4.41Å; W136-P340 HydrophobicContact CZ3-CB 4.37Å; H139-P340 HydrophobicContact CB-CB 3.74Å; H139-P340 HydrophobicContact CB-CG 3.95Å
341	P	84.1	Confident	91.9	Very high	63 Å²	63	62.9 Å²	62.9	41%	0.409	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-73.4	152	172.2	30.8	-34.9	0	0	0	112.4	H139 E343	H139-P341 PolarHBondContact CE1-O 2.71Å; H139-P341 VanDerWaalsContact CE1-O 3.27Å; H139-P341 PolarHBondContact ND1-O 3.33Å; P341-E343 HydrophobicContact CB-CG 4.16Å; P341-E343 HydrophobicContact CG-CG 3.93Å; P341-E343 WeakPolarHBondContact CG-OE1 3.41Å; P341-E343 PolarHBondContact O-N 3.4Å
342	S	85.1	Confident	92.1	Very high	56 Å²	56	64.9 Å²	64.9	39%	0.392	37%	0.367	S	S	.	.			trans	-81.8	99.4	173.3	-161.3	0	0	0	0	109.6	D318 Q350	D318-S342 PolarHBondContact O-OG 3.14Å; S342-Q350 PolarHBondContact OG-NE2 2.78Å
343	E	87.5	Confident	92.3	Very high	108 Å²	108	63.5 Å²	63.5	51%	0.505	36%	0.356	S	S	.	.			trans	-115.3	-12.1	-173.9	-67.5	-178.7	178.6	0	0	114.1	K143 P341	K143-E343 WeakPolarHBondContact CE-OE2 3.33Å; K143-E343 IonicContact NZ-OE1 3.71Å; K143-E343 IonicContact NZ-OE2 2.71Å; K143-E343 PolarHBondContact NZ-OE2 3.16Å; P341-E343 HydrophobicContact CB-CG 4.16Å; P341-E343 HydrophobicContact CG-CG 3.93Å; P341-E343 WeakPolarHBondContact CG-OE1 3.41Å; P341-E343 PolarHBondContact O-N 3.4Å
344	I	91.8	Very high	92.5	Very high	14 Å²	14	58.3 Å²	58.3	7%	0.072	33%	0.331	C	S	.	.	S	Bend	trans	-83.3	-36.9	-166.3	-68	-174.5	0	0	0	113.1	R142 R146 I275 D319	R142-I344 HydrophobicContact CB-CD1 3.71Å; R146-I344 PolarHBondContact NH2-O 3.32Å; R146-I344 VanDerWaalsContact NH2-O 3.08Å; I275-I344 HydrophobicContact CG2-CD1 3.82Å; I275-I344 HydrophobicContact CG2-CG2 4.03Å; D319-I344 HydrophobicContact CB-CB 4.44Å; D319-I344 WeakPolarHBondContact OD1-CB 3.46Å
345	I	93.8	Very high	92.7	Very high	6 Å²	6	57.1 Å²	57.1	3%	0.031	33%	0.33	C	S	.	.	S	Bend	trans	-125.8	140.7	178.5	-53.1	-62.5	0	0	0	107.6	L285 D319 I320 K349 Q350	L285-I345 HydrophobicContact CD1-CG2 4.01Å; D319-I345 WeakPolarHBondContact O-CB 3.5Å; D319-I345 WeakPolarHBondContact O-CG1 3.41Å; I320-I345 HydrophobicContact CD1-CG1 4.46Å; I345-K349 HydrophobicContact CG2-CB 3.63Å; I345-K349 HydrophobicContact CG2-CD 4.12Å; I345-Q350 HydrophobicContact CB-CG 4.25Å; I345-Q350 HydrophobicContact CG2-CG 4Å; I345-Q350 PolarHBondContact O-NE2 3.35Å
346	S	93	Very high	92.9	Very high	47 Å²	47	55.4 Å²	55.4	33%	0.329	32%	0.323	S	S	.	.			trans	-72.5	147.4	178	56.7	0	0	0	0	112.3	E348 K349 Q350	S346-E348 VanDerWaalsContact C-N 3.25Å; S346-E348 PolarHBondContact O-N 2.75Å; S346-K349 WeakPolarHBondContact O-CA 3.41Å; S346-K349 WeakPolarHBondContact O-CB 3.2Å; S346-K349 PolarHBondContact O-N 2.92Å; S346-K349 WeakPolarHBondContact OG-CD 3.37Å; S346-K349 WeakPolarHBondContact OG-CG 3.43Å; S346-Q350 PolarHBondContact O-N 3.04Å; S346-Q350 VanDerWaalsContact O-N 3.14Å
347	T	91.7	Very high	93.2	Very high	103 Å²	103	52.2 Å²	52.2	63%	0.632	29%	0.29	S	S	*	.	H	α-helix	trans	-51.3	-41.1	179.4	49	0	0	0	0	113.3	K349 Q350 Q351	T347-K349 PolarHBondContact O-N 3.18Å; T347-Q350 WeakPolarHBondContact O-CB 3.1Å; T347-Q350 PolarHBondContact O-N 3.42Å; T347-Q351 PolarHBondContact O-N 3.02Å
348	E	93.8	Very high	93.3	Very high	162 Å²	162	56 Å²	56	76%	0.757	30%	0.303	S	S	*	.	H	α-helix	trans	-52.8	-38	173.5	-60.3	177.5	155.9	0	0	113.5	S346	S346-E348 VanDerWaalsContact C-N 3.25Å; S346-E348 PolarHBondContact O-N 2.75Å
349	K	94.6	Very high	93.4	Very high	84 Å²	84	57.9 Å²	57.9	37%	0.365	30%	0.299	S	S	.	.	H	α-helix	trans	-85.4	-21.2	179.5	-62.8	173.5	-171.4	163.6	0	112.4	D281 L285 I345 S346 T347 F353	D281-K349 HydrophobicContact CB-CD 4.45Å; D281-K349 IonicContact OD2-NZ 3.91Å; D281-K349 PolarHBondContact OD2-NZ 2.91Å; L285-K349 HydrophobicContact CD1-CB 3.89Å; L285-K349 HydrophobicContact CD1-CD 4.05Å; L285-K349 HydrophobicContact CD1-CG 4.4Å; I345-K349 HydrophobicContact CG2-CB 3.63Å; I345-K349 HydrophobicContact CG2-CD 4.12Å; S346-K349 WeakPolarHBondContact O-CA 3.41Å; S346-K349 WeakPolarHBondContact O-CB 3.2Å; S346-K349 PolarHBondContact O-N 2.92Å; S346-K349 WeakPolarHBondContact OG-CD 3.37Å; S346-K349 WeakPolarHBondContact OG-CG 3.43Å; T347-K349 PolarHBondContact O-N 3.18Å; K349-F353 VanDerWaalsContact O-CD2 3.29Å; K349-F353 WeakPolarHBondContact O-CD2 3.21Å; K349-F353 WeakPolarHBondContact O-CE2 3.37Å
350	Q	95.8	Very high	93.6	Very high	11 Å²	11	56.2 Å²	56.2	5%	0.051	29%	0.292	C	S	.	.	H	α-helix	trans	-79.2	-36.6	176.6	-67.2	173.8	-27.3	0	0	112.1	D319 I320 S342 I345 S346 T347 P352 F353 Q354	D319-Q350 PolarHBondContact O-NE2 3.16Å; I320-Q350 WeakPolarHBondContact O-CA 3.37Å; S342-Q350 PolarHBondContact OG-NE2 2.78Å; I345-Q350 HydrophobicContact CB-CG 4.25Å; I345-Q350 HydrophobicContact CG2-CG 4Å; I345-Q350 PolarHBondContact O-NE2 3.35Å; S346-Q350 PolarHBondContact O-N 3.04Å; S346-Q350 VanDerWaalsContact O-N 3.14Å; T347-Q350 WeakPolarHBondContact O-CB 3.1Å; T347-Q350 PolarHBondContact O-N 3.42Å; Q350-P352 VanDerWaalsContact C-CD 3.45Å; Q350-F353 WeakPolarHBondContact O-CB 3.48Å; Q350-F353 PolarHBondContact O-N 3.31Å; Q350-Q354 PolarHBondContact O-N 2.98Å; Q350-Q354 VanDerWaalsContact O-N 3.15Å
351	Q	95.4	Very high	93.8	Very high	83 Å²	83	55.3 Å²	55.3	39%	0.388	28%	0.284	S	S	.	.	H	α-helix	trans	-53.4	-41	-174.5	-163.9	62.7	58.5	0	0	115	T347 F353 Q354 N355	T347-Q351 PolarHBondContact O-N 3.02Å; Q351-F353 VanDerWaalsContact C-N 3.26Å; Q351-F353 PolarHBondContact O-N 3.06Å; Q351-Q354 PolarHBondContact O-N 3.19Å; Q351-N355 PolarHBondContact NE2-OD1 3.04Å; Q351-N355 PolarHBondContact O-N 2.96Å; Q351-N355 PolarHBondContact O-OD1 3.13Å
352	P	96.3	Very high	94.4	Very high	49 Å²	49	55.6 Å²	55.6	32%	0.318	29%	0.285	S	S	.	.	H	α-helix	trans	-60.3	-34.5	176.5	-24.1	35.4	0	0	0	113.3	Y289 Q350 L356	Y289-P352 HydrophobicContact CD2-CB 4.09Å; Y289-P352 HydrophobicContact CE2-CB 3.58Å; Q350-P352 VanDerWaalsContact C-CD 3.45Å; P352-L356 WeakPolarHBondContact O-CG 3.39Å; P352-L356 PolarHBondContact O-N 2.83Å; P352-L356 VanDerWaalsContact O-N 3.16Å
353	F	97.5	Very high	94.9	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.018	28%	0.276	C	S	.	.	H	α-helix	trans	-73.4	-43.7	176.8	-61.5	-80.9	0	0	0	111.6	L285 I288 Y289 L292 I320 A321 K349 Q350 Q351 N355 L356 L357	L285-F353 HydrophobicContact CB-CE2 4.06Å; L285-F353 HydrophobicContact CB-CZ 3.83Å; L285-F353 HydrophobicContact CD2-CE2 3.85Å; L285-F353 HydrophobicContact CD2-CZ 3.96Å; L285-F353 HydrophobicContact CG-CE2 4.37Å; L285-F353 HydrophobicContact CG-CZ 4.45Å; L285-F353 WeakPolarHBondContact O-CZ 3.36Å; I288-F353 HydrophobicContact CB-CE1 4.06Å; I288-F353 HydrophobicContact CG2-CD1 4.35Å; I288-F353 HydrophobicContact CG2-CE1 3.75Å; Y289-F353 HydrophobicContact CD2-CD1 4.27Å; Y289-F353 HydrophobicContact CD2-CE1 4.02Å; Y289-F353 HydrophobicContact CD2-CZ 4.29Å; Y289-F353 HydrophobicContact CG-CE1 4.41Å; L292-F353 HydrophobicContact CD1-CD1 3.74Å; L292-F353 HydrophobicContact CD1-CE1 4.25Å; I320-F353 HydrophobicContact CG2-CD1 4.04Å; I320-F353 HydrophobicContact CG2-CD2 3.96Å; I320-F353 HydrophobicContact CG2-CE1 4.14Å; I320-F353 HydrophobicContact CG2-CE2 4.09Å; I320-F353 HydrophobicContact CG2-CG 3.94Å; I320-F353 HydrophobicContact CG2-CZ 4.17Å; I320-F353 WeakPolarHBondContact O-CD2 3.27Å; A321-F353 HydrophobicContact CB-CB 3.69Å; K349-F353 VanDerWaalsContact O-CD2 3.29Å; K349-F353 WeakPolarHBondContact O-CD2 3.21Å; K349-F353 WeakPolarHBondContact O-CE2 3.37Å; Q350-F353 WeakPolarHBondContact O-CB 3.48Å; Q350-F353 PolarHBondContact O-N 3.31Å; Q351-F353 VanDerWaalsContact C-N 3.26Å; Q351-F353 PolarHBondContact O-N 3.06Å; F353-N355 VanDerWaalsContact C-N 3.26Å; F353-N355 PolarHBondContact O-N 3.17Å; F353-L356 PolarHBondContact O-N 3.34Å; F353-L357 VanDerWaalsContact O-CG 3.26Å; F353-L357 WeakPolarHBondContact O-CG 3.48Å; F353-L357 PolarHBondContact O-N 2.84Å
354	Q	95.4	Very high	95.3	Very high	41 Å²	41	49.1 Å²	49.1	19%	0.192	25%	0.252	C	S	.	.	H	α-helix	trans	-58.5	-40.6	175.5	-166.9	-173.1	84.2	0	0	111.4	Q350 Q351 L357 R358	Q350-Q354 PolarHBondContact O-N 2.98Å; Q350-Q354 VanDerWaalsContact O-N 3.15Å; Q351-Q354 PolarHBondContact O-N 3.19Å; Q354-L357 PolarHBondContact O-N 2.6Å; Q354-R358 WeakPolarHBondContact O-CG 3.44Å; Q354-R358 PolarHBondContact O-N 2.85Å
355	N	95.8	Very high	95.5	Very high	88 Å²	88	49.7 Å²	49.7	47%	0.471	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-48.6	176.4	-66.7	-0.3	0	0	0	111.9	Q351 F353 L357 R358 E359	Q351-N355 PolarHBondContact NE2-OD1 3.04Å; Q351-N355 PolarHBondContact O-N 2.96Å; Q351-N355 PolarHBondContact O-OD1 3.13Å; F353-N355 VanDerWaalsContact C-N 3.26Å; F353-N355 PolarHBondContact O-N 3.17Å; N355-L357 VanDerWaalsContact C-N 3.32Å; N355-L357 PolarHBondContact O-N 3.11Å; N355-R358 PolarHBondContact O-N 3.04Å; N355-E359 PolarHBondContact O-N 3.32Å
356	L	96.4	Very high	95.6	Very high	10 Å²	10	56.3 Å²	56.3	5%	0.052	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-40.8	175.7	-79.4	-172.8	0	0	0	112.4	Y289 L292 K293 I296 P352 F353 E359 Y360	Y289-L356 HydrophobicContact CD2-CD1 3.58Å; Y289-L356 HydrophobicContact CD2-CG 4.48Å; Y289-L356 HydrophobicContact CE1-CD1 4.47Å; Y289-L356 HydrophobicContact CE2-CD1 3.33Å; Y289-L356 HydrophobicContact CE2-CG 3.81Å; Y289-L356 HydrophobicContact CG-CD1 4.25Å; L292-L356 HydrophobicContact CB-CD1 4.1Å; K293-L356 HydrophobicContact CB-CD1 4.35Å; I296-L356 HydrophobicContact CD1-CB 3.52Å; I296-L356 HydrophobicContact CD1-CD1 4.27Å; I296-L356 HydrophobicContact CD1-CD2 3.75Å; I296-L356 HydrophobicContact CD1-CG 4.03Å; I296-L356 WeakPolarHBondContact CD1-O 3.47Å; P352-L356 WeakPolarHBondContact O-CG 3.39Å; P352-L356 PolarHBondContact O-N 2.83Å; P352-L356 VanDerWaalsContact O-N 3.16Å; F353-L356 PolarHBondContact O-N 3.34Å; L356-E359 PolarHBondContact O-N 3.25Å; L356-Y360 PolarHBondContact O-N 3.34Å
357	L	97.1	Very high	95.7	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-69.3	-36.3	179.3	-67.7	172.4	0	0	0	112.5	V309 F312 A321 L323 F353 Q354 N355 Y360 F361 L421	V309-L357 HydrophobicContact CG1-CD2 3.61Å; F312-L357 HydrophobicContact CD1-CD2 4.47Å; F312-L357 HydrophobicContact CE1-CD1 4.31Å; A321-L357 HydrophobicContact CB-CD1 3.87Å; L323-L357 HydrophobicContact CD1-CD1 4.17Å; L323-L357 HydrophobicContact CD2-CD1 4.44Å; F353-L357 VanDerWaalsContact O-CG 3.26Å; F353-L357 WeakPolarHBondContact O-CG 3.48Å; F353-L357 PolarHBondContact O-N 2.84Å; Q354-L357 PolarHBondContact O-N 2.6Å; N355-L357 VanDerWaalsContact C-N 3.32Å; N355-L357 PolarHBondContact O-N 3.11Å; L357-Y360 PolarHBondContact O-N 3.1Å; L357-F361 WeakPolarHBondContact O-CB 3.48Å; L357-F361 PolarHBondContact O-N 2.81Å; L357-L421 HydrophobicContact CB-CD1 4.39Å; L357-L421 HydrophobicContact CB-CD2 3.81Å; L357-L421 HydrophobicContact CD1-CD2 4.12Å
358	R	95.5	Very high	95.9	Very high	101 Å²	101	50.6 Å²	50.6	38%	0.381	25%	0.245	S	C	.	.	H	α-helix	trans	-67.3	-38	172	-78.1	176.7	155.6	147.3	-0.1	112.7	Q354 N355 F361 T362 E423	Q354-R358 WeakPolarHBondContact O-CG 3.44Å; Q354-R358 PolarHBondContact O-N 2.85Å; N355-R358 PolarHBondContact O-N 3.04Å; R358-F361 PolarHBondContact O-N 2.93Å; R358-T362 WeakPolarHBondContact O-CB 3.42Å; R358-T362 PolarHBondContact O-N 3.4Å; R358-T362 PolarHBondContact O-OG1 2.75Å; R358-E423 IonicContact CZ-OE1 2.73Å; R358-E423 IonicContact NE-OE1 2.73Å; R358-E423 PolarHBondContact NE-OE1 2.98Å; R358-E423 IonicContact NH2-OE1 3.46Å; R358-E423 PolarHBondContact NH2-OE1 2.66Å
359	E	95.9	Very high	95.9	Very high	115 Å²	115	47.1 Å²	47.1	54%	0.537	23%	0.228	S	C	.	.	H	α-helix	trans	-60.9	-47.1	172.2	-172.2	-179.9	177.9	0	0	110.9	I296 N355 L356 T362 S363	I296-E359 HydrophobicContact CG2-CG 4.29Å; N355-E359 PolarHBondContact O-N 3.32Å; L356-E359 PolarHBondContact O-N 3.25Å; E359-T362 PolarHBondContact O-N 3.06Å; E359-S363 PolarHBondContact O-N 3.03Å
360	Y	96.9	Very high	95.9	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-59.2	-48.8	174.6	-168.3	-86.7	0	0	0	112.1	I295 I296 D299 H303 V306 V309 L356 L357 T362 S363 L364 L417	I295-Y360 HydrophobicContact CG2-CD2 4.39Å; I295-Y360 HydrophobicContact CG2-CE2 3.93Å; I296-Y360 HydrophobicContact CG1-CD2 3.77Å; I296-Y360 HydrophobicContact CG1-CG 4.37Å; D299-Y360 HydrophobicContact CB-CE2 3.59Å; D299-Y360 PolarHBondContact OD2-OH 2.57Å; H303-Y360 AromaticContact CD2-CZ 3.92Å; V306-Y360 WeakPolarHBondContact CA-OH 3.17Å; V306-Y360 HydrophobicContact CB-CE1 4.31Å; V306-Y360 WeakPolarHBondContact CB-OH 3.38Å; V306-Y360 HydrophobicContact CG2-CE1 4.14Å; V306-Y360 PolarHBondContact N-OH 3.26Å; V306-Y360 VanDerWaalsContact N-OH 3.07Å; V309-Y360 HydrophobicContact CB-CD1 4.43Å; V309-Y360 HydrophobicContact CB-CE1 4.25Å; V309-Y360 HydrophobicContact CG1-CD1 4.09Å; V309-Y360 HydrophobicContact CG1-CE1 4.38Å; V309-Y360 HydrophobicContact CG1-CG 4.45Å; V309-Y360 HydrophobicContact CG2-CD1 4.23Å; V309-Y360 HydrophobicContact CG2-CD2 4.14Å; V309-Y360 HydrophobicContact CG2-CE1 4Å; V309-Y360 HydrophobicContact CG2-CE2 3.87Å; V309-Y360 HydrophobicContact CG2-CG 4.31Å; L356-Y360 PolarHBondContact O-N 3.34Å; L357-Y360 PolarHBondContact O-N 3.1Å; Y360-T362 VanDerWaalsContact C-N 3.27Å; Y360-T362 PolarHBondContact O-N 3.45Å; Y360-S363 WeakPolarHBondContact O-CB 3.23Å; Y360-S363 PolarHBondContact O-N 3.13Å; Y360-S363 VanDerWaalsContact O-N 3.13Å; Y360-L364 HydrophobicContact CE1-CB 4.47Å; Y360-L364 HydrophobicContact CE1-CD2 4.39Å; Y360-L364 WeakPolarHBondContact O-CB 3.06Å; Y360-L364 PolarHBondContact O-N 2.85Å; Y360-L417 HydrophobicContact CD1-CD2 3.78Å; Y360-L417 HydrophobicContact CE1-CD2 4.17Å
361	F	97	Very high	95.8	Very high	13 Å²	13	48.4 Å²	48.4	6%	0.057	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-35.3	178.6	-179.3	-105	0	0	0	112.6	L357 R358 L364 T365 T414 L417 A418 L421 E423	L357-F361 WeakPolarHBondContact O-CB 3.48Å; L357-F361 PolarHBondContact O-N 2.81Å; R358-F361 PolarHBondContact O-N 2.93Å; F361-L364 PolarHBondContact O-N 2.87Å; F361-T365 VanDerWaalsContact O-CB 3.24Å; F361-T365 WeakPolarHBondContact O-CB 3.29Å; F361-T365 PolarHBondContact O-N 3.28Å; F361-T365 PolarHBondContact O-OG1 2.95Å; F361-T414 HydrophobicContact CE2-CG2 3.81Å; F361-L417 HydrophobicContact CB-CD2 4.32Å; F361-L417 HydrophobicContact CD2-CB 4.35Å; F361-L417 HydrophobicContact CD2-CD2 4.15Å; F361-L417 HydrophobicContact CD2-CG 4.1Å; F361-A418 HydrophobicContact CE2-CB 3.71Å; F361-A418 HydrophobicContact CZ-CB 3.79Å; F361-L421 HydrophobicContact CB-CD1 3.68Å; F361-L421 HydrophobicContact CD2-CD1 4.46Å; F361-L421 HydrophobicContact CG-CD1 4.09Å; F361-E423 HydrophobicContact CD1-CB 3.86Å; F361-E423 HydrophobicContact CD1-CG 4.04Å; F361-E423 HydrophobicContact CE1-CB 3.48Å; F361-E423 VanDerWaalsContact CE1-CB 3.48Å; F361-E423 HydrophobicContact CE1-CG 4.17Å; F361-E423 HydrophobicContact CZ-CB 4.01Å
362	T	95.4	Very high	95.8	Very high	70 Å²	70	45.6 Å²	45.6	43%	0.429	22%	0.221	S	C	.	.	H	α-helix	trans	-67.5	-36.9	174.8	-58.3	0	0	0	0	112.1	R358 E359 Y360 K366	R358-T362 WeakPolarHBondContact O-CB 3.42Å; R358-T362 PolarHBondContact O-N 3.4Å; R358-T362 PolarHBondContact O-OG1 2.75Å; E359-T362 PolarHBondContact O-N 3.06Å; Y360-T362 VanDerWaalsContact C-N 3.27Å; Y360-T362 PolarHBondContact O-N 3.45Å; T362-K366 WeakPolarHBondContact O-CG 3.5Å; T362-K366 PolarHBondContact O-N 3.26Å
363	S	96.1	Very high	95.6	Very high	28 Å²	28	51.4 Å²	51.4	20%	0.196	24%	0.236	C	C	.	.	H	α-helix	trans	-67	-48.3	172.1	-166.6	0	0	0	0	111.7	R300 H303 E359 Y360 T365 K366 H367	R300-S363 PolarHBondContact O-OG 2.79Å; H303-S363 PolarHBondContact CE1-O 2.7Å; H303-S363 PolarHBondContact CE1-OG 2.95Å; H303-S363 VanDerWaalsContact NE2-CB 3.32Å; H303-S363 WeakPolarHBondContact NE2-CB 3.38Å; H303-S363 PolarHBondContact NE2-OG 2.97Å; E359-S363 PolarHBondContact O-N 3.03Å; Y360-S363 WeakPolarHBondContact O-CB 3.23Å; Y360-S363 PolarHBondContact O-N 3.13Å; Y360-S363 VanDerWaalsContact O-N 3.13Å; S363-T365 VanDerWaalsContact C-N 3.31Å; S363-T365 PolarHBondContact O-N 3.41Å; S363-K366 WeakPolarHBondContact O-CB 3.3Å; S363-K366 PolarHBondContact O-N 3.14Å; S363-H367 PolarHBondContact O-N 2.9Å; S363-H367 VanDerWaalsContact O-N 3.08Å
364	L	96.4	Very high	95.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-40.1	178.5	-173.1	69.3	0	0	0	112.2	H303 V306 Y360 F361 K366 H367 L368 L410 T414 L417	H303-L364 HydrophobicContact CB-CD1 3.66Å; H303-L364 WeakPolarHBondContact NE2-CA 3.37Å; H303-L364 PolarHBondContact NE2-N 3.49Å; H303-L364 VanDerWaalsContact NE2-N 3.14Å; V306-L364 HydrophobicContact CG2-CD1 4.11Å; V306-L364 HydrophobicContact CG2-CD2 3.83Å; Y360-L364 HydrophobicContact CE1-CB 4.47Å; Y360-L364 HydrophobicContact CE1-CD2 4.39Å; Y360-L364 WeakPolarHBondContact O-CB 3.06Å; Y360-L364 PolarHBondContact O-N 2.85Å; F361-L364 PolarHBondContact O-N 2.87Å; L364-K366 VanDerWaalsContact C-N 3.34Å; L364-K366 PolarHBondContact O-N 3.18Å; L364-H367 PolarHBondContact O-N 2.97Å; L364-L368 PolarHBondContact O-N 3.04Å; L364-L410 HydrophobicContact CD1-CD1 3.63Å; L364-T414 HydrophobicContact CD2-CG2 4.05Å; L364-T414 HydrophobicContact CG-CG2 4.22Å; L364-T414 WeakPolarHBondContact CG-OG1 3.27Å; L364-L417 HydrophobicContact CD2-CD2 3.86Å
365	T	95.9	Very high	95.2	Very high	25 Å²	25	53.4 Å²	53.4	15%	0.153	25%	0.246	C	C	.	.	H	α-helix	trans	-63.3	-35.8	174.1	-72.3	0	0	0	0	112.8	F361 S363 K369 P426	F361-T365 VanDerWaalsContact O-CB 3.24Å; F361-T365 WeakPolarHBondContact O-CB 3.29Å; F361-T365 PolarHBondContact O-N 3.28Å; F361-T365 PolarHBondContact O-OG1 2.95Å; S363-T365 VanDerWaalsContact C-N 3.31Å; S363-T365 PolarHBondContact O-N 3.41Å; T365-K369 WeakPolarHBondContact O-CB 3.29Å; T365-K369 WeakPolarHBondContact O-CG 3.35Å; T365-K369 PolarHBondContact O-N 3Å; T365-P426 HydrophobicContact CG2-CB 3.77Å; T365-P426 HydrophobicContact CG2-CG 3.9Å
366	K	94.9	Very high	95	Very high	145 Å²	145	50.1 Å²	50.1	63%	0.63	23%	0.228	S	C	*	.	H	α-helix	trans	-69.4	-42	175.4	-70.6	167.1	-177.4	175.2	0	111.4	T362 S363 L364 K369 K370	T362-K366 WeakPolarHBondContact O-CG 3.5Å; T362-K366 PolarHBondContact O-N 3.26Å; S363-K366 WeakPolarHBondContact O-CB 3.3Å; S363-K366 PolarHBondContact O-N 3.14Å; L364-K366 VanDerWaalsContact C-N 3.34Å; L364-K366 PolarHBondContact O-N 3.18Å; K366-K369 PolarHBondContact O-N 3.02Å; K366-K370 PolarHBondContact O-N 3.14Å
367	H	95.1	Very high	94.5	Very high	31 Å²	31	54 Å²	54	14%	0.144	25%	0.248	C	C	.	.	H	α-helix	trans	-60.1	-50.6	173.4	-179.4	-150	0	0	0	111	E301 H303 S363 L364 K369 K370 D371 L410	E301-H367 PolarHBondContact O-CD2 2.76Å; E301-H367 PolarHBondContact O-CE1 2.84Å; E301-H367 VanDerWaalsContact O-CE1 3.26Å; E301-H367 PolarHBondContact O-ND1 3.38Å; E301-H367 PolarHBondContact O-NE2 3.36Å; H303-H367 AromaticContact CG-ND1 3.73Å; H303-H367 WeakPolarHBondContact ND1-CB 3.22Å; H303-H367 AromaticContact ND1-CG 3.48Å; H303-H367 AromaticContact ND1-ND1 3.14Å; H303-H367 PolarHBondContact ND1-ND1 3.4Å; H303-H367 VanDerWaalsContact ND1-ND1 3.14Å; S363-H367 PolarHBondContact O-N 2.9Å; S363-H367 VanDerWaalsContact O-N 3.08Å; L364-H367 PolarHBondContact O-N 2.97Å; H367-K369 VanDerWaalsContact C-N 3.32Å; H367-K369 PolarHBondContact O-N 3.21Å; H367-K370 WeakPolarHBondContact O-CA 3.31Å; H367-K370 WeakPolarHBondContact O-CB 3.47Å; H367-K370 PolarHBondContact O-N 2.76Å; H367-D371 IonicContact CD2-OD1 2.81Å; H367-D371 PolarHBondContact CD2-OD1 3.02Å; H367-D371 VanDerWaalsContact CD2-OD1 3.22Å; H367-D371 IonicContact CD2-OD2 2.79Å; H367-D371 IonicContact NE2-OD1 3.65Å; H367-D371 IonicContact NE2-OD2 2.91Å; H367-D371 PolarHBondContact O-N 3.2Å; H367-L410 WeakPolarHBondContact ND1-CD1 3.49Å; H367-L410 WeakPolarHBondContact ND1-CD2 3.37Å
368	L	96.1	Very high	94.1	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-39.6	177.9	-174	69	0	0	0	113	L364 K370 H372 Y407 L410 L411 T414 M425 P426 L428	L364-L368 PolarHBondContact O-N 3.04Å; L368-K370 VanDerWaalsContact C-N 3.32Å; L368-K370 PolarHBondContact O-N 3.45Å; L368-H372 VanDerWaalsContact O-CB 3.25Å; L368-H372 WeakPolarHBondContact O-CB 3.49Å; L368-H372 PolarHBondContact O-N 3.33Å; L368-Y407 HydrophobicContact CD1-CD2 4.05Å; L368-Y407 HydrophobicContact CD1-CE2 3.42Å; L368-Y407 VanDerWaalsContact CD1-CE2 3.42Å; L368-Y407 HydrophobicContact CG-CE2 4.3Å; L368-L410 HydrophobicContact CB-CD2 4.27Å; L368-L410 HydrophobicContact CB-CG 4.44Å; L368-L410 HydrophobicContact CD1-CB 4.29Å; L368-L410 HydrophobicContact CD1-CD2 4.03Å; L368-L410 HydrophobicContact CD1-CG 3.88Å; L368-L411 HydrophobicContact CD1-CB 4.01Å; L368-L411 HydrophobicContact CD1-CD1 4.31Å; L368-L411 HydrophobicContact CD2-CD1 3.98Å; L368-T414 HydrophobicContact CD2-CG2 3.85Å; L368-M425 HydrophobicContact CD2-CE 3.72Å; L368-P426 HydrophobicContact CD2-CG 4.08Å; L368-L428 HydrophobicContact CD2-CD1 3.92Å; L368-L428 HydrophobicContact CD2-CD2 4.41Å; L368-L428 HydrophobicContact CG-CD1 4.31Å; L368-L428 HydrophobicContact CG-CD2 4.2Å
369	K	94.6	Very high	93.7	Very high	89 Å²	89	53.6 Å²	53.6	39%	0.387	25%	0.252	S	S	.	.	H	α-helix	trans	-69	-26	174.7	-77.2	-168.3	178.3	-166.8	0	113.7	T365 K366 H367 R373 P426 E427 L428	T365-K369 WeakPolarHBondContact O-CB 3.29Å; T365-K369 WeakPolarHBondContact O-CG 3.35Å; T365-K369 PolarHBondContact O-N 3Å; K366-K369 PolarHBondContact O-N 3.02Å; H367-K369 VanDerWaalsContact C-N 3.32Å; H367-K369 PolarHBondContact O-N 3.21Å; K369-R373 WeakPolarHBondContact O-CD 3.36Å; K369-R373 WeakPolarHBondContact O-CG 3.35Å; K369-P426 HydrophobicContact CD-CB 4.35Å; K369-P426 HydrophobicContact CG-CB 4.25Å; K369-E427 WeakPolarHBondContact CE-O 3.47Å; K369-L428 HydrophobicContact CG-CD2 4.23Å
370	K	94.1	Very high	93.1	Very high	108 Å²	108	51.1 Å²	51.1	47%	0.47	24%	0.238	S	C	.	.	H	α-helix	trans	-72.5	-57.9	172.8	-179.3	-163.3	165.1	-164	0	109.5	K366 H367 L368 H372 R373 E374	K366-K370 PolarHBondContact O-N 3.14Å; H367-K370 WeakPolarHBondContact O-CA 3.31Å; H367-K370 WeakPolarHBondContact O-CB 3.47Å; H367-K370 PolarHBondContact O-N 2.76Å; L368-K370 VanDerWaalsContact C-N 3.32Å; L368-K370 PolarHBondContact O-N 3.45Å; K370-H372 VanDerWaalsContact C-N 3.29Å; K370-H372 PolarHBondContact O-N 3.19Å; K370-R373 WeakPolarHBondContact O-CB 3.35Å; K370-R373 PolarHBondContact O-N 2.79Å; K370-E374 VanDerWaalsContact CE-CD 3.43Å; K370-E374 WeakPolarHBondContact CE-OE1 3.33Å; K370-E374 WeakPolarHBondContact CE-OE2 3.47Å; K370-E374 IonicContact NZ-OE1 3.7Å; K370-E374 IonicContact NZ-OE2 3.56Å; K370-E374 PolarHBondContact O-N 3.09Å
371	D	94.8	Very high	92.5	Very high	14 Å²	14	55.8 Å²	55.8	8%	0.075	26%	0.259	C	S	.	.	H	α-helix	trans	-60.2	-37.3	-176.4	-68.3	28	0	0	0	112.1	H367 R373 E374 L375 F403 Y407 L410	H367-D371 IonicContact CD2-OD1 2.81Å; H367-D371 PolarHBondContact CD2-OD1 3.02Å; H367-D371 VanDerWaalsContact CD2-OD1 3.22Å; H367-D371 IonicContact CD2-OD2 2.79Å; H367-D371 IonicContact NE2-OD1 3.65Å; H367-D371 IonicContact NE2-OD2 2.91Å; H367-D371 PolarHBondContact O-N 3.2Å; D371-R373 VanDerWaalsContact C-N 3.32Å; D371-R373 PolarHBondContact O-N 2.94Å; D371-E374 PolarHBondContact O-N 3.04Å; D371-L375 VanDerWaalsContact O-CB 3.31Å; D371-L375 WeakPolarHBondContact O-CB 3.34Å; D371-L375 PolarHBondContact O-N 3.45Å; D371-F403 HydrophobicContact CB-CZ 4.42Å; D371-Y407 HydrophobicContact CB-CD2 3.83Å; D371-Y407 HydrophobicContact CB-CE2 4.46Å; D371-L410 HydrophobicContact CB-CD2 4.21Å; D371-L410 WeakPolarHBondContact OD2-CD2 3.19Å
372	H	94.4	Very high	91.9	Very high	24 Å²	24	55.9 Å²	55.9	11%	0.111	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-39.9	173.6	-178.5	77.2	0	0	0	112.6	L368 K370 Q376 Y407 L428 P429 Q430	L368-H372 VanDerWaalsContact O-CB 3.25Å; L368-H372 WeakPolarHBondContact O-CB 3.49Å; L368-H372 PolarHBondContact O-N 3.33Å; K370-H372 VanDerWaalsContact C-N 3.29Å; K370-H372 PolarHBondContact O-N 3.19Å; H372-Q376 PolarHBondContact NE2-NE2 3.28Å; H372-Q376 WeakPolarHBondContact O-CB 3.41Å; H372-Q376 VanDerWaalsContact O-CG 3.32Å; H372-Q376 WeakPolarHBondContact O-CG 3.34Å; H372-Q376 PolarHBondContact O-N 3.21Å; H372-Q376 VanDerWaalsContact O-N 3.15Å; H372-Y407 HydrophobicContact CB-CE2 3.73Å; H372-Y407 AromaticContact ND1-CZ 3.67Å; H372-Y407 PolarHBondContact ND1-OH 2.89Å; H372-L428 HydrophobicContact CB-CD2 4Å; H372-P429 WeakPolarHBondContact NE2-CA 3.43Å; H372-P429 PolarHBondContact NE2-O 3.33Å; H372-Q430 PolarHBondContact NE2-N 3.45Å
373	R	91.9	Very high	91.1	Very high	171 Å²	171	60.3 Å²	60.3	65%	0.645	27%	0.269	S	S	*	.	H	α-helix	trans	-71.6	-39.2	176.6	-70.5	170.6	171.9	-171.5	-4.1	111.7	K369 K370 D371 N377	K369-R373 WeakPolarHBondContact O-CD 3.36Å; K369-R373 WeakPolarHBondContact O-CG 3.35Å; K370-R373 WeakPolarHBondContact O-CB 3.35Å; K370-R373 PolarHBondContact O-N 2.79Å; D371-R373 VanDerWaalsContact C-N 3.32Å; D371-R373 PolarHBondContact O-N 2.94Å; R373-N377 WeakPolarHBondContact O-CB 3.45Å; R373-N377 PolarHBondContact O-N 3.43Å; R373-N377 PolarHBondContact O-ND2 2.9Å
374	E	92.4	Very high	90	Very high	74 Å²	74	63.9 Å²	63.9	35%	0.346	28%	0.278	S	S	.	.	H	α-helix	trans	-68.4	-43.9	178.9	-71.9	177	-177.1	0	0	111.2	K370 D371 Q376 N377 I378 F403	K370-E374 VanDerWaalsContact CE-CD 3.43Å; K370-E374 WeakPolarHBondContact CE-OE1 3.33Å; K370-E374 WeakPolarHBondContact CE-OE2 3.47Å; K370-E374 IonicContact NZ-OE1 3.7Å; K370-E374 IonicContact NZ-OE2 3.56Å; K370-E374 PolarHBondContact O-N 3.09Å; D371-E374 PolarHBondContact O-N 3.04Å; E374-Q376 PolarHBondContact O-N 2.99Å; E374-N377 PolarHBondContact O-N 3.3Å; E374-N377 VanDerWaalsContact O-N 3.14Å; E374-I378 WeakPolarHBondContact O-CG1 3.4Å; E374-I378 PolarHBondContact O-N 3.12Å; E374-F403 HydrophobicContact CB-CE1 4.08Å; E374-F403 HydrophobicContact CB-CZ 3.82Å
375	L	92.9	Very high	89	Confident	13 Å²	13	65.6 Å²	65.6	7%	0.068	29%	0.288	C	S	.	.	H	α-helix	trans	-57.2	-48.9	172.6	-179.6	64.2	0	0	0	111.4	D371 N377 I378 E379 Y400 F403 A404 Y407	D371-L375 VanDerWaalsContact O-CB 3.31Å; D371-L375 WeakPolarHBondContact O-CB 3.34Å; D371-L375 PolarHBondContact O-N 3.45Å; L375-N377 VanDerWaalsContact C-N 3.3Å; L375-N377 PolarHBondContact O-N 2.99Å; L375-I378 PolarHBondContact O-N 3.32Å; L375-E379 PolarHBondContact O-N 2.95Å; L375-Y400 HydrophobicContact CD1-CD2 3.95Å; L375-Y400 HydrophobicContact CD1-CE2 3.57Å; L375-F403 HydrophobicContact CB-CD1 4.11Å; L375-F403 HydrophobicContact CB-CE1 4Å; L375-F403 HydrophobicContact CD1-CD1 4.11Å; L375-A404 HydrophobicContact CD1-CB 3.98Å; L375-Y407 HydrophobicContact CD2-CD1 3.4Å; L375-Y407 HydrophobicContact CD2-CE1 3.96Å; L375-Y407 HydrophobicContact CD2-CG 3.83Å
376	Q	90.2	Very high	87.6	Confident	19 Å²	19	68.9 Å²	68.9	9%	0.089	30%	0.304	C	S	.	.	H	α-helix	trans	-61.4	-35.7	176.1	-76.9	-174.4	-14.6	0	0	113.3	H372 E374 E379 R380 P429	H372-Q376 PolarHBondContact NE2-NE2 3.28Å; H372-Q376 WeakPolarHBondContact O-CB 3.41Å; H372-Q376 VanDerWaalsContact O-CG 3.32Å; H372-Q376 WeakPolarHBondContact O-CG 3.34Å; H372-Q376 PolarHBondContact O-N 3.21Å; H372-Q376 VanDerWaalsContact O-N 3.15Å; E374-Q376 PolarHBondContact O-N 2.99Å; Q376-E379 PolarHBondContact O-N 3.11Å; Q376-R380 WeakPolarHBondContact O-CB 3.44Å; Q376-R380 WeakPolarHBondContact O-CD 3.42Å; Q376-R380 WeakPolarHBondContact O-CG 3.41Å; Q376-R380 PolarHBondContact O-N 3.48Å; Q376-P429 PolarHBondContact NE2-O 3.22Å
377	N	87.5	Confident	85.8	Confident	90 Å²	90	64.4 Å²	64.4	48%	0.481	29%	0.285	S	S	.	.	H	α-helix	trans	-68.7	-40.6	176.2	-73.1	-17.5	0	0	0	111.6	R373 E374 L375 R380 Q381	R373-N377 WeakPolarHBondContact O-CB 3.45Å; R373-N377 PolarHBondContact O-N 3.43Å; R373-N377 PolarHBondContact O-ND2 2.9Å; E374-N377 PolarHBondContact O-N 3.3Å; E374-N377 VanDerWaalsContact O-N 3.14Å; L375-N377 VanDerWaalsContact C-N 3.3Å; L375-N377 PolarHBondContact O-N 2.99Å; N377-R380 PolarHBondContact O-N 3.23Å; N377-R380 PolarHBondContact OD1-NH1 3.25Å; N377-Q381 WeakPolarHBondContact O-CB 3.42Å; N377-Q381 PolarHBondContact O-N 2.92Å
378	I	88.9	Confident	84.1	Confident	45 Å²	45	65.2 Å²	65.2	23%	0.231	29%	0.294	C	S	.	.	H	α-helix	trans	-61.8	-47	172.8	-64.5	163.6	0	0	0	110	E374 L375 R380 Q381 N382 Y400 F403	E374-I378 WeakPolarHBondContact O-CG1 3.4Å; E374-I378 PolarHBondContact O-N 3.12Å; L375-I378 PolarHBondContact O-N 3.32Å; I378-R380 PolarHBondContact O-N 2.91Å; I378-Q381 PolarHBondContact O-N 3.27Å; I378-N382 WeakPolarHBondContact O-CB 3.5Å; I378-N382 PolarHBondContact O-N 3.36Å; I378-N382 PolarHBondContact O-OD1 3.09Å; I378-Y400 HydrophobicContact CG2-CD2 3.86Å; I378-Y400 HydrophobicContact CG2-CG 4.43Å; I378-F403 HydrophobicContact CD1-CD1 4.13Å; I378-F403 HydrophobicContact CD1-CE1 4.46Å; I378-F403 HydrophobicContact CD1-CG 4.22Å
379	E	87	Confident	82.2	Confident	50 Å²	50	70.3 Å²	70.3	23%	0.234	32%	0.316	C	S	.	.	H	α-helix	trans	-56.7	-49.8	174.7	-77.5	-170.8	-128.3	0	0	112.5	L375 Q376 Q381 N382 R383 Y400	L375-E379 PolarHBondContact O-N 2.95Å; Q376-E379 PolarHBondContact O-N 3.11Å; E379-Q381 VanDerWaalsContact C-N 3.3Å; E379-Q381 PolarHBondContact O-N 3.44Å; E379-N382 PolarHBondContact O-N 3Å; E379-R383 WeakPolarHBondContact O-CB 3.42Å; E379-R383 VanDerWaalsContact O-CG 3.26Å; E379-R383 WeakPolarHBondContact O-CG 3.47Å; E379-R383 PolarHBondContact O-N 3.46Å; E379-R383 IonicContact OE2-CZ 2.72Å; E379-R383 IonicContact OE2-NE 3.13Å; E379-R383 IonicContact OE2-NH2 2.69Å; E379-R383 PolarHBondContact OE2-NH2 3Å; E379-Y400 HydrophobicContact CG-CD2 4.47Å; E379-Y400 HydrophobicContact CG-CE2 3.57Å
380	R	82.7	Confident	80.5	Confident	63 Å²	63	68.7 Å²	68.7	24%	0.238	33%	0.325	C	S	.	.	H	α-helix	trans	-60.4	-40.1	179.4	-71.1	163.4	-170.7	140	1.7	111.3	Q376 N377 I378 R384 D431	Q376-R380 WeakPolarHBondContact O-CB 3.44Å; Q376-R380 WeakPolarHBondContact O-CD 3.42Å; Q376-R380 WeakPolarHBondContact O-CG 3.41Å; Q376-R380 PolarHBondContact O-N 3.48Å; N377-R380 PolarHBondContact O-N 3.23Å; N377-R380 PolarHBondContact OD1-NH1 3.25Å; I378-R380 PolarHBondContact O-N 2.91Å; R380-R384 WeakPolarHBondContact O-CG 3.46Å; R380-R384 PolarHBondContact O-N 3.18Å; R380-R384 VanDerWaalsContact O-N 3.11Å; R380-D431 IonicContact CZ-OD1 3.66Å; R380-D431 IonicContact CZ-OD2 2.61Å; R380-D431 IonicContact NE-OD1 2.75Å; R380-D431 IonicContact NE-OD2 2.56Å; R380-D431 PolarHBondContact NE-OD2 2.97Å; R380-D431 IonicContact NH2-OD1 3.6Å; R380-D431 PolarHBondContact NH2-OD1 3.4Å; R380-D431 IonicContact NH2-OD2 3.8Å; R380-D431 PolarHBondContact NH2-OD2 3.15Å; R380-D431 VanDerWaalsContact NH2-OD2 3.13Å
381	Q	83.3	Confident	79.4	Confident	99 Å²	99	70.2 Å²	70.2	46%	0.463	33%	0.333	S	S	.	.	H	α-helix	trans	-72.2	-38.8	177.1	-165.1	-174.7	20.2	0	0	111.9	N377 I378 E379 R384 I385	N377-Q381 WeakPolarHBondContact O-CB 3.42Å; N377-Q381 PolarHBondContact O-N 2.92Å; I378-Q381 PolarHBondContact O-N 3.27Å; E379-Q381 VanDerWaalsContact C-N 3.3Å; E379-Q381 PolarHBondContact O-N 3.44Å; Q381-R384 PolarHBondContact O-N 2.98Å; Q381-I385 HydrophobicContact CG-CD1 4.04Å; Q381-I385 WeakPolarHBondContact O-CG1 3.47Å; Q381-I385 PolarHBondContact O-N 3.37Å
382	N	86.1	Confident	78.7	Confident	15 Å²	15	71.6 Å²	71.6	8%	0.08	34%	0.341	C	S	.	.	H	α-helix	trans	-62.6	-44.2	175.5	-71	4.4	0	0	0	111.2	I378 E379 I385 L386 L392 R396	I378-N382 WeakPolarHBondContact O-CB 3.5Å; I378-N382 PolarHBondContact O-N 3.36Å; I378-N382 PolarHBondContact O-OD1 3.09Å; E379-N382 PolarHBondContact O-N 3Å; N382-I385 PolarHBondContact O-N 3.21Å; N382-L386 WeakPolarHBondContact O-CB 3.28Å; N382-L386 PolarHBondContact O-N 3.33Å; N382-L392 HydrophobicContact CB-CD1 4Å; N382-L392 HydrophobicContact CB-CD2 4.31Å; N382-R396 VanDerWaalsContact OD1-CZ 3.25Å; N382-R396 PolarHBondContact OD1-NE 3.4Å; N382-R396 PolarHBondContact OD1-NH2 2.92Å
383	R	78.8	Confident	78.3	Confident	163 Å²	163	74 Å²	74	62%	0.615	36%	0.36	S	S	*	.	H	α-helix	trans	-61.1	-42.7	174.1	-67	169.7	-160.9	-125.6	10.3	111.8	E379 H387	E379-R383 WeakPolarHBondContact O-CB 3.42Å; E379-R383 VanDerWaalsContact O-CG 3.26Å; E379-R383 WeakPolarHBondContact O-CG 3.47Å; E379-R383 PolarHBondContact O-N 3.46Å; E379-R383 IonicContact OE2-CZ 2.72Å; E379-R383 IonicContact OE2-NE 3.13Å; E379-R383 IonicContact OE2-NH2 2.69Å; E379-R383 PolarHBondContact OE2-NH2 3Å; R383-H387 WeakPolarHBondContact O-CB 3.27Å; R383-H387 PolarHBondContact O-N 3.48Å
384	R	72.5	Confident	78.1	Confident	103 Å²	103	74 Å²	74	39%	0.389	37%	0.368	S	S	.	.	H	α-helix	trans	-60.4	-43.9	174.3	-75.8	175.1	180	-158.9	-0	112.4	R380 Q381 H387 S388 P447	R380-R384 WeakPolarHBondContact O-CG 3.46Å; R380-R384 PolarHBondContact O-N 3.18Å; R380-R384 VanDerWaalsContact O-N 3.11Å; Q381-R384 PolarHBondContact O-N 2.98Å; R384-H387 PolarHBondContact O-N 3.33Å; R384-S388 PolarHBondContact O-N 3.34Å; R384-S388 VanDerWaalsContact O-N 3.07Å; R384-S388 PolarHBondContact O-OG 3.35Å; R384-P447 PolarHBondContact NH1-O 2.97Å; R384-P447 PolarHBondContact NH2-O 3.07Å
385	I	75.1	Confident	77.9	Confident	37 Å²	37	75.6 Å²	75.6	19%	0.19	38%	0.378	C	S	.	.	H	α-helix	trans	-69.2	-43.4	179.9	-69	162.8	0	0	0	111	Q381 N382 H387 S388 K389 L392 R396	Q381-I385 HydrophobicContact CG-CD1 4.04Å; Q381-I385 WeakPolarHBondContact O-CG1 3.47Å; Q381-I385 PolarHBondContact O-N 3.37Å; N382-I385 PolarHBondContact O-N 3.21Å; I385-H387 VanDerWaalsContact C-N 3.26Å; I385-H387 PolarHBondContact O-N 2.9Å; I385-S388 PolarHBondContact O-N 3Å; I385-S388 VanDerWaalsContact O-N 3.1Å; I385-S388 PolarHBondContact O-OG 3.5Å; I385-K389 HydrophobicContact CG2-CB 4.49Å; I385-K389 HydrophobicContact CG2-CD 4.45Å; I385-K389 HydrophobicContact CG2-CG 4.47Å; I385-K389 PolarHBondContact O-N 2.97Å; I385-L392 HydrophobicContact CB-CD1 4.15Å; I385-L392 HydrophobicContact CG2-CD1 3.97Å; I385-R396 VanDerWaalsContact CD1-CZ 3.47Å
386	L	66.8	Low	77.7	Confident	94 Å²	94	77.8 Å²	77.8	49%	0.492	39%	0.386	S	S	.	.	H	α-helix	trans	-59.6	-38.5	175.6	-170.6	66.4	0	0	0	111.3	N382 G390	N382-L386 WeakPolarHBondContact O-CB 3.28Å; N382-L386 PolarHBondContact O-N 3.33Å; L386-G390 CarbonylContact O-C 3.59Å; L386-G390 WeakPolarHBondContact O-CA 3.46Å; L386-G390 PolarHBondContact O-N 3.37Å
387	H	57.2	Low	77.6	Confident	51 Å²	51	81.3 Å²	81.3	24%	0.236	40%	0.402	C	S	.	.	H	α-helix	trans	-73.7	-24.7	176.1	-164.5	-43.3	0	0	0	113.7	R383 R384 I385 P716	R383-H387 WeakPolarHBondContact O-CB 3.27Å; R383-H387 PolarHBondContact O-N 3.48Å; R384-H387 PolarHBondContact O-N 3.33Å; I385-H387 VanDerWaalsContact C-N 3.26Å; I385-H387 PolarHBondContact O-N 2.9Å; H387-P716 PolarHBondContact CE1-O 3.35Å
388	S	58.5	Low	77.8	Confident	47 Å²	47	82.4 Å²	82.4	33%	0.329	40%	0.403	S	S	.	.	H	α-helix	trans	-97.1	-45	-178.4	67.8	0	0	0	0	113.9	R384 I385 R721	R384-S388 PolarHBondContact O-N 3.34Å; R384-S388 VanDerWaalsContact O-N 3.07Å; R384-S388 PolarHBondContact O-OG 3.35Å; I385-S388 PolarHBondContact O-N 3Å; I385-S388 VanDerWaalsContact O-N 3.1Å; I385-S388 PolarHBondContact O-OG 3.5Å; S388-R721 PolarHBondContact O-NE 3.11Å; S388-R721 VanDerWaalsContact O-NE 3.1Å; S388-R721 PolarHBondContact O-NH2 2.97Å
389	K	57.6	Low	78	Confident	107 Å²	107	86.3 Å²	86.3	47%	0.465	42%	0.42	S	S	.	.	H	α-helix	trans	-89.8	-25.8	178.6	-63.9	-163.3	178.6	-172.3	0	112.7	I385 E391 E515 R721	I385-K389 HydrophobicContact CG2-CB 4.49Å; I385-K389 HydrophobicContact CG2-CD 4.45Å; I385-K389 HydrophobicContact CG2-CG 4.47Å; I385-K389 PolarHBondContact O-N 2.97Å; K389-E391 VanDerWaalsContact C-N 3.31Å; K389-E515 IonicContact NZ-OE1 2.57Å; K389-E515 PolarHBondContact NZ-OE1 3.05Å; K389-R721 PolarHBondContact O-NH2 3.42Å
390	G	58.6	Low	78.2	Confident	56 Å²	56	87 Å²	87	58%	0.577	42%	0.421	S	S	*	.	S	Bend	trans	92.3	-10.8	-178.6	0	0	0	0	0	113.7	L386	L386-G390 CarbonylContact O-C 3.59Å; L386-G390 WeakPolarHBondContact O-CA 3.46Å; L386-G390 PolarHBondContact O-N 3.37Å
391	E	69.4	Low	78.8	Confident	139 Å²	139	89.1 Å²	89.1	65%	0.65	43%	0.433	S	S	*	.	S	Bend	trans	-145.2	171.5	-174	64.3	-169.3	176.6	0	0	110.3	K389	K389-E391 VanDerWaalsContact C-N 3.31Å
392	L	81.2	Confident	79.3	Confident	43 Å²	43	90 Å²	90	23%	0.225	44%	0.437	C	S	.	.			trans	-132.4	128.9	174.5	-163.5	84.1	0	0	0	109	N382 I385 R396 H397	N382-L392 HydrophobicContact CB-CD1 4Å; N382-L392 HydrophobicContact CB-CD2 4.31Å; I385-L392 HydrophobicContact CB-CD1 4.15Å; I385-L392 HydrophobicContact CG2-CD1 3.97Å; L392-R396 HydrophobicContact CD1-CG 4.4Å; L392-R396 HydrophobicContact CG-CB 4.48Å; L392-R396 HydrophobicContact CG-CG 4.41Å; L392-H397 HydrophobicContact CD2-CB 4.14Å
393	S	86.1	Confident	79.7	Confident	74 Å²	74	91.7 Å²	91.7	52%	0.517	44%	0.444	S	S	.	.			trans	-54.1	138.9	176.2	165.7	0	0	0	0	112.2	D395 R396 H397	S393-D395 PolarHBondContact O-N 3.3Å; S393-R396 CarbonylContact O-C 3.58Å; S393-R396 WeakPolarHBondContact O-CA 3.49Å; S393-R396 WeakPolarHBondContact O-CB 3.47Å; S393-R396 PolarHBondContact O-N 3.48Å; S393-H397 PolarHBondContact O-N 2.96Å
394	E	87	Confident	80.4	Confident	173 Å²	173	84.9 Å²	84.9	81%	0.808	42%	0.423	S	S	*	.	H	α-helix	trans	-55.6	-45.1	179.9	-63.6	-163.7	138.5	0	0	112.9	R396 H397 K398	E394-R396 PolarHBondContact O-N 3.12Å; E394-H397 WeakPolarHBondContact O-CB 3.12Å; E394-H397 PolarHBondContact O-N 3.24Å; E394-H397 VanDerWaalsContact O-N 3.16Å; E394-K398 VanDerWaalsContact O-CB 3.31Å; E394-K398 WeakPolarHBondContact O-CB 3.38Å; E394-K398 PolarHBondContact O-N 2.92Å
395	D	89.1	Confident	81.5	Confident	106 Å²	106	83.2 Å²	83.2	57%	0.567	42%	0.424	S	S	*	.	H	α-helix	trans	-59	-38.3	177.2	-82.2	-42.9	0	0	0	111.5	S393 Q399	S393-D395 PolarHBondContact O-N 3.3Å; D395-Q399 WeakPolarHBondContact O-CB 3.46Å; D395-Q399 WeakPolarHBondContact O-CG 3.33Å; D395-Q399 PolarHBondContact O-N 3.02Å
396	R	88.9	Confident	82.4	Confident	59 Å²	59	84 Å²	84	22%	0.223	43%	0.433	C	S	.	.	H	α-helix	trans	-75.4	-32.4	179.1	-171.7	171.7	175.8	102.5	25.2	112.4	N382 I385 L392 S393 E394 Y400	N382-R396 VanDerWaalsContact OD1-CZ 3.25Å; N382-R396 PolarHBondContact OD1-NE 3.4Å; N382-R396 PolarHBondContact OD1-NH2 2.92Å; I385-R396 VanDerWaalsContact CD1-CZ 3.47Å; L392-R396 HydrophobicContact CD1-CG 4.4Å; L392-R396 HydrophobicContact CG-CB 4.48Å; L392-R396 HydrophobicContact CG-CG 4.41Å; S393-R396 CarbonylContact O-C 3.58Å; S393-R396 WeakPolarHBondContact O-CA 3.49Å; S393-R396 WeakPolarHBondContact O-CB 3.47Å; S393-R396 PolarHBondContact O-N 3.48Å; E394-R396 PolarHBondContact O-N 3.12Å; R396-Y400 PolarHBondContact O-N 3.44Å
397	H	86.8	Confident	83.8	Confident	93 Å²	93	80 Å²	80	43%	0.431	41%	0.411	S	S	.	.	H	α-helix	trans	-64.9	-49.9	170.2	-170.3	75.7	0	0	0	110.6	L392 S393 E394 Y400 E401	L392-H397 HydrophobicContact CD2-CB 4.14Å; S393-H397 PolarHBondContact O-N 2.96Å; E394-H397 WeakPolarHBondContact O-CB 3.12Å; E394-H397 PolarHBondContact O-N 3.24Å; E394-H397 VanDerWaalsContact O-N 3.16Å; H397-Y400 WeakPolarHBondContact O-CB 3.48Å; H397-Y400 PolarHBondContact O-N 2.92Å; H397-Y400 VanDerWaalsContact O-N 3.14Å; H397-E401 PolarHBondContact O-N 3.06Å
398	K	93	Very high	85.6	Confident	114 Å²	114	83 Å²	83	50%	0.496	43%	0.425	S	S	.	.	H	α-helix	trans	-62.5	-43.8	179.1	-179.4	-178.1	169.8	-168.1	0	113.1	E394 Y400 E401 E402	E394-K398 VanDerWaalsContact O-CB 3.31Å; E394-K398 WeakPolarHBondContact O-CB 3.38Å; E394-K398 PolarHBondContact O-N 2.92Å; K398-Y400 VanDerWaalsContact C-N 3.26Å; K398-Y400 PolarHBondContact O-N 3.08Å; K398-E401 PolarHBondContact O-N 2.83Å; K398-E402 WeakPolarHBondContact CE-OE1 3.46Å; K398-E402 WeakPolarHBondContact O-CB 3.31Å; K398-E402 WeakPolarHBondContact O-CG 3.34Å; K398-E402 PolarHBondContact O-N 3.34Å
399	Q	91.8	Very high	87.3	Confident	127 Å²	127	86.9 Å²	86.9	59%	0.593	44%	0.436	S	S	*	.	H	α-helix	trans	-57.8	-40.4	173.4	-77.1	169.1	27.7	0	0	111.7	D395 F403	D395-Q399 WeakPolarHBondContact O-CB 3.46Å; D395-Q399 WeakPolarHBondContact O-CG 3.33Å; D395-Q399 PolarHBondContact O-N 3.02Å; Q399-F403 WeakPolarHBondContact O-CB 3.18Å; Q399-F403 PolarHBondContact O-N 3.19Å
400	Y	92.9	Very high	89.1	Confident	65 Å²	65	82.5 Å²	82.5	26%	0.255	42%	0.418	S	S	.	.	H	α-helix	trans	-66.8	-44	174.5	165.8	-98.6	0	0	0	112.2	L375 I378 E379 R396 H397 K398 F403 A404	L375-Y400 HydrophobicContact CD1-CD2 3.95Å; L375-Y400 HydrophobicContact CD1-CE2 3.57Å; I378-Y400 HydrophobicContact CG2-CD2 3.86Å; I378-Y400 HydrophobicContact CG2-CG 4.43Å; E379-Y400 HydrophobicContact CG-CD2 4.47Å; E379-Y400 HydrophobicContact CG-CE2 3.57Å; R396-Y400 PolarHBondContact O-N 3.44Å; H397-Y400 WeakPolarHBondContact O-CB 3.48Å; H397-Y400 PolarHBondContact O-N 2.92Å; H397-Y400 VanDerWaalsContact O-N 3.14Å; K398-Y400 VanDerWaalsContact C-N 3.26Å; K398-Y400 PolarHBondContact O-N 3.08Å; Y400-F403 PolarHBondContact O-N 3.02Å; Y400-A404 WeakPolarHBondContact O-CB 3.39Å; Y400-A404 PolarHBondContact O-N 3.18Å
401	E	94.1	Very high	90.9	Very high	107 Å²	107	80.9 Å²	80.9	50%	0.5	40%	0.396	S	S	.	.	H	α-helix	trans	-62.2	-42.8	176	-71.1	-158.7	121.6	0	0	112.7	H397 K398 T405	H397-E401 PolarHBondContact O-N 3.06Å; K398-E401 PolarHBondContact O-N 2.83Å; E401-T405 WeakPolarHBondContact O-CB 3.4Å; E401-T405 PolarHBondContact O-N 3.39Å; E401-T405 PolarHBondContact O-OG1 3Å
402	E	94.2	Very high	92.2	Very high	117 Å²	117	76.5 Å²	76.5	55%	0.547	38%	0.383	S	S	.	.	H	α-helix	trans	-62.9	-44.7	177.3	-73.5	-178.9	-168.7	0	0	111.1	K398 T405 S406	K398-E402 WeakPolarHBondContact CE-OE1 3.46Å; K398-E402 WeakPolarHBondContact O-CB 3.31Å; K398-E402 WeakPolarHBondContact O-CG 3.34Å; K398-E402 PolarHBondContact O-N 3.34Å; E402-T405 PolarHBondContact O-N 3.48Å; E402-S406 PolarHBondContact O-N 3.14Å; E402-S406 PolarHBondContact O-OG 3.47Å
403	F	94.9	Very high	92.9	Very high	50 Å²	50	76.7 Å²	76.7	22%	0.219	39%	0.385	C	S	.	.	H	α-helix	trans	-71	-40	178.6	-162.3	-88.1	0	0	0	113	D371 E374 L375 I378 Q399 Y400 T405 S406 Y407	D371-F403 HydrophobicContact CB-CZ 4.42Å; E374-F403 HydrophobicContact CB-CE1 4.08Å; E374-F403 HydrophobicContact CB-CZ 3.82Å; L375-F403 HydrophobicContact CB-CD1 4.11Å; L375-F403 HydrophobicContact CB-CE1 4Å; L375-F403 HydrophobicContact CD1-CD1 4.11Å; I378-F403 HydrophobicContact CD1-CD1 4.13Å; I378-F403 HydrophobicContact CD1-CE1 4.46Å; I378-F403 HydrophobicContact CD1-CG 4.22Å; Q399-F403 WeakPolarHBondContact O-CB 3.18Å; Q399-F403 PolarHBondContact O-N 3.19Å; Y400-F403 PolarHBondContact O-N 3.02Å; F403-T405 VanDerWaalsContact C-N 3.27Å; F403-T405 PolarHBondContact O-N 3.31Å; F403-S406 WeakPolarHBondContact CA-OG 3.36Å; F403-S406 PolarHBondContact O-N 3.01Å; F403-S406 PolarHBondContact O-OG 2.79Å; F403-Y407 VanDerWaalsContact O-CB 3.31Å; F403-Y407 WeakPolarHBondContact O-CB 3.44Å; F403-Y407 PolarHBondContact O-N 2.94Å
404	A	93.6	Very high	93.4	Very high	20 Å²	20	73.2 Å²	73.2	17%	0.165	36%	0.36	C	S	.	.	H	α-helix	trans	-62.1	-38.8	171.8	0	0	0	0	0	110.9	L375 Y400 Y407 Q408	L375-A404 HydrophobicContact CD1-CB 3.98Å; Y400-A404 WeakPolarHBondContact O-CB 3.39Å; Y400-A404 PolarHBondContact O-N 3.18Å; A404-Y407 PolarHBondContact O-N 3.16Å; A404-Q408 WeakPolarHBondContact O-CB 3.45Å; A404-Q408 VanDerWaalsContact O-CG 3.28Å; A404-Q408 WeakPolarHBondContact O-CG 3.46Å; A404-Q408 PolarHBondContact O-N 3.33Å
405	T	95.4	Very high	93.9	Very high	68 Å²	68	69.6 Å²	69.6	42%	0.417	34%	0.343	S	S	.	.	H	α-helix	trans	-70	-34.8	178.2	-65.8	0	0	0	0	112.9	E401 E402 F403 K409	E401-T405 WeakPolarHBondContact O-CB 3.4Å; E401-T405 PolarHBondContact O-N 3.39Å; E401-T405 PolarHBondContact O-OG1 3Å; E402-T405 PolarHBondContact O-N 3.48Å; F403-T405 VanDerWaalsContact C-N 3.27Å; F403-T405 PolarHBondContact O-N 3.31Å; T405-K409 HydrophobicContact CG2-CD 4.48Å; T405-K409 VanDerWaalsContact CG2-NZ 3.31Å; T405-K409 VanDerWaalsContact O-CD 3.28Å; T405-K409 WeakPolarHBondContact O-CD 3.42Å; T405-K409 VanDerWaalsContact O-CG 3.27Å; T405-K409 WeakPolarHBondContact O-CG 3.25Å; T405-K409 PolarHBondContact O-N 3.41Å
406	S	93.3	Very high	94.2	Very high	54 Å²	54	67.4 Å²	67.4	38%	0.378	33%	0.334	S	S	.	.	H	α-helix	trans	-70.6	-43.5	170.3	54.1	0	0	0	0	111.4	E402 F403 Q408 K409 L410	E402-S406 PolarHBondContact O-N 3.14Å; E402-S406 PolarHBondContact O-OG 3.47Å; F403-S406 WeakPolarHBondContact CA-OG 3.36Å; F403-S406 PolarHBondContact O-N 3.01Å; F403-S406 PolarHBondContact O-OG 2.79Å; S406-Q408 PolarHBondContact O-N 3.17Å; S406-K409 WeakPolarHBondContact O-CB 3.25Å; S406-K409 PolarHBondContact O-N 2.89Å; S406-L410 PolarHBondContact O-N 3.38Å
407	Y	95.4	Very high	94.6	Very high	10 Å²	10	64.6 Å²	64.6	4%	0.039	32%	0.323	C	S	.	.	H	α-helix	trans	-58.9	-47.2	177.4	175.8	-105.2	0	0	0	112.7	L368 D371 H372 L375 F403 A404 K409 L410 L411	L368-Y407 HydrophobicContact CD1-CD2 4.05Å; L368-Y407 HydrophobicContact CD1-CE2 3.42Å; L368-Y407 VanDerWaalsContact CD1-CE2 3.42Å; L368-Y407 HydrophobicContact CG-CE2 4.3Å; D371-Y407 HydrophobicContact CB-CD2 3.83Å; D371-Y407 HydrophobicContact CB-CE2 4.46Å; H372-Y407 HydrophobicContact CB-CE2 3.73Å; H372-Y407 AromaticContact ND1-CZ 3.67Å; H372-Y407 PolarHBondContact ND1-OH 2.89Å; L375-Y407 HydrophobicContact CD2-CD1 3.4Å; L375-Y407 HydrophobicContact CD2-CE1 3.96Å; L375-Y407 HydrophobicContact CD2-CG 3.83Å; F403-Y407 VanDerWaalsContact O-CB 3.31Å; F403-Y407 WeakPolarHBondContact O-CB 3.44Å; F403-Y407 PolarHBondContact O-N 2.94Å; A404-Y407 PolarHBondContact O-N 3.16Å; Y407-K409 VanDerWaalsContact C-N 3.29Å; Y407-K409 PolarHBondContact O-N 2.92Å; Y407-L410 WeakPolarHBondContact O-CB 3.47Å; Y407-L410 PolarHBondContact O-N 3.07Å; Y407-L411 HydrophobicContact CE1-CD2 4.26Å; Y407-L411 WeakPolarHBondContact O-CB 3.48Å; Y407-L411 PolarHBondContact O-N 3.01Å
408	Q	95.3	Very high	95.1	Very high	113 Å²	113	60.3 Å²	60.3	53%	0.528	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-36.5	177.9	-72.1	-66.4	-14.7	0	0	112.4	A404 S406 A412	A404-Q408 WeakPolarHBondContact O-CB 3.45Å; A404-Q408 VanDerWaalsContact O-CG 3.28Å; A404-Q408 WeakPolarHBondContact O-CG 3.46Å; A404-Q408 PolarHBondContact O-N 3.33Å; S406-Q408 PolarHBondContact O-N 3.17Å; Q408-A412 WeakPolarHBondContact O-CB 3.42Å; Q408-A412 PolarHBondContact O-N 3.44Å
409	K	95.1	Very high	95.3	Very high	130 Å²	130	56.4 Å²	56.4	57%	0.565	29%	0.289	S	S	*	.	H	α-helix	trans	-67.4	-40.4	172.7	-68.3	165.3	-169.8	168.3	0	111.4	T405 S406 Y407 N413	T405-K409 HydrophobicContact CG2-CD 4.48Å; T405-K409 VanDerWaalsContact CG2-NZ 3.31Å; T405-K409 VanDerWaalsContact O-CD 3.28Å; T405-K409 WeakPolarHBondContact O-CD 3.42Å; T405-K409 VanDerWaalsContact O-CG 3.27Å; T405-K409 WeakPolarHBondContact O-CG 3.25Å; T405-K409 PolarHBondContact O-N 3.41Å; S406-K409 WeakPolarHBondContact O-CB 3.25Å; S406-K409 PolarHBondContact O-N 2.89Å; Y407-K409 VanDerWaalsContact C-N 3.29Å; Y407-K409 PolarHBondContact O-N 2.92Å; K409-N413 WeakPolarHBondContact O-CB 3.45Å; K409-N413 VanDerWaalsContact O-CG 3.31Å; K409-N413 PolarHBondContact O-N 3.38Å; K409-N413 PolarHBondContact O-ND2 3.21Å
410	L	95.3	Very high	95.5	Very high	14 Å²	14	51 Å²	51	7%	0.073	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-43.6	176.5	-175.7	64.2	0	0	0	111.3	L364 H367 L368 D371 S406 Y407 N413 T414	L364-L410 HydrophobicContact CD1-CD1 3.63Å; H367-L410 WeakPolarHBondContact ND1-CD1 3.49Å; H367-L410 WeakPolarHBondContact ND1-CD2 3.37Å; L368-L410 HydrophobicContact CB-CD2 4.27Å; L368-L410 HydrophobicContact CB-CG 4.44Å; L368-L410 HydrophobicContact CD1-CB 4.29Å; L368-L410 HydrophobicContact CD1-CD2 4.03Å; L368-L410 HydrophobicContact CD1-CG 3.88Å; D371-L410 HydrophobicContact CB-CD2 4.21Å; D371-L410 WeakPolarHBondContact OD2-CD2 3.19Å; S406-L410 PolarHBondContact O-N 3.38Å; Y407-L410 WeakPolarHBondContact O-CB 3.47Å; Y407-L410 PolarHBondContact O-N 3.07Å; L410-N413 PolarHBondContact O-N 3.01Å; L410-T414 WeakPolarHBondContact O-CB 3.2Å; L410-T414 PolarHBondContact O-N 2.92Å; L410-T414 PolarHBondContact O-OG1 3.43Å
411	L	96.3	Very high	95.7	Very high	23 Å²	23	48.6 Å²	48.6	12%	0.12	26%	0.255	C	S	.	.	H	α-helix	trans	-59.6	-53.4	176.5	178.9	59.3	0	0	0	111.5	L368 Y407 N413 T414 Q415 M425 L428	L368-L411 HydrophobicContact CD1-CB 4.01Å; L368-L411 HydrophobicContact CD1-CD1 4.31Å; L368-L411 HydrophobicContact CD2-CD1 3.98Å; Y407-L411 HydrophobicContact CE1-CD2 4.26Å; Y407-L411 WeakPolarHBondContact O-CB 3.48Å; Y407-L411 PolarHBondContact O-N 3.01Å; L411-N413 VanDerWaalsContact C-N 3.34Å; L411-N413 PolarHBondContact O-N 2.88Å; L411-T414 PolarHBondContact O-N 3.18Å; L411-T414 VanDerWaalsContact O-N 3.13Å; L411-Q415 HydrophobicContact CD1-CG 4.32Å; L411-Q415 WeakPolarHBondContact O-CG 3.4Å; L411-Q415 PolarHBondContact O-N 2.74Å; L411-M425 HydrophobicContact CD1-CE 3.71Å; L411-L428 HydrophobicContact CD1-CD1 3.7Å
412	A	96.6	Very high	95.8	Very high	46 Å²	46	45.5 Å²	45.5	38%	0.38	24%	0.242	S	C	.	.	H	α-helix	trans	-62.5	-38.4	179.7	0	0	0	0	0	112.9	Q408 T416	Q408-A412 WeakPolarHBondContact O-CB 3.42Å; Q408-A412 PolarHBondContact O-N 3.44Å; A412-T416 WeakPolarHBondContact O-CB 3.37Å; A412-T416 PolarHBondContact O-N 3.31Å; A412-T416 PolarHBondContact O-OG1 3.03Å
413	N	96	Very high	95.8	Very high	48 Å²	48	42.3 Å²	42.3	26%	0.257	23%	0.227	S	C	.	.	H	α-helix	trans	-64.5	-42.9	173	-79.2	-53.2	0	0	0	111.6	V306 I310 K409 L410 L411 T416 L417	V306-N413 HydrophobicContact CG1-CB 4.05Å; V306-N413 HydrophobicContact CG2-CB 3.9Å; I310-N413 HydrophobicContact CD1-CB 3.85Å; I310-N413 WeakPolarHBondContact CD1-O 3.31Å; I310-N413 WeakPolarHBondContact CD1-OD1 3.48Å; K409-N413 WeakPolarHBondContact O-CB 3.45Å; K409-N413 VanDerWaalsContact O-CG 3.31Å; K409-N413 PolarHBondContact O-N 3.38Å; K409-N413 PolarHBondContact O-ND2 3.21Å; L410-N413 PolarHBondContact O-N 3.01Å; L411-N413 VanDerWaalsContact C-N 3.34Å; L411-N413 PolarHBondContact O-N 2.88Å; N413-T416 PolarHBondContact O-N 2.9Å; N413-L417 PolarHBondContact O-N 3.13Å
414	T	96.8	Very high	95.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.3	-42.6	179.4	-50.6	0	0	0	0	111.3	F361 L364 L368 L410 L411 T416 L417 A418 M425	F361-T414 HydrophobicContact CE2-CG2 3.81Å; L364-T414 HydrophobicContact CD2-CG2 4.05Å; L364-T414 HydrophobicContact CG-CG2 4.22Å; L364-T414 WeakPolarHBondContact CG-OG1 3.27Å; L368-T414 HydrophobicContact CD2-CG2 3.85Å; L410-T414 WeakPolarHBondContact O-CB 3.2Å; L410-T414 PolarHBondContact O-N 2.92Å; L410-T414 PolarHBondContact O-OG1 3.43Å; L411-T414 PolarHBondContact O-N 3.18Å; L411-T414 VanDerWaalsContact O-N 3.13Å; T414-T416 VanDerWaalsContact C-N 3.34Å; T414-T416 PolarHBondContact O-N 2.9Å; T414-L417 PolarHBondContact O-N 3.3Å; T414-A418 WeakPolarHBondContact O-CB 3.22Å; T414-A418 PolarHBondContact O-N 2.93Å; T414-M425 HydrophobicContact CG2-CE 4.23Å; T414-M425 HydrophobicContact CG2-SD 3.91Å
415	Q	96.4	Very high	95.8	Very high	98 Å²	98	47.3 Å²	47.3	46%	0.458	25%	0.252	S	S	.	.	H	α-helix	trans	-59.1	-43.2	172.6	-71.6	169.6	-22.3	0	0	112	L411 A418 D419 M425	L411-Q415 HydrophobicContact CD1-CG 4.32Å; L411-Q415 WeakPolarHBondContact O-CG 3.4Å; L411-Q415 PolarHBondContact O-N 2.74Å; Q415-A418 PolarHBondContact O-N 3.33Å; Q415-D419 PolarHBondContact O-N 2.87Å; Q415-M425 VanDerWaalsContact CA-SD 3.57Å; Q415-M425 HydrophobicContact CB-SD 4.23Å; Q415-M425 HydrophobicContact CG-CE 3.68Å; Q415-M425 HydrophobicContact CG-CG 4.1Å; Q415-M425 HydrophobicContact CG-SD 3.69Å
416	T	97.1	Very high	95.6	Very high	59 Å²	59	44.9 Å²	44.9	36%	0.362	24%	0.238	S	C	.	.	H	α-helix	trans	-65.6	-38.2	177.8	-55.5	0	0	0	0	111.7	I310 A412 N413 T414 L420	I310-T416 HydrophobicContact CD1-CG2 4.43Å; I310-T416 HydrophobicContact CG2-CG2 3.7Å; A412-T416 WeakPolarHBondContact O-CB 3.37Å; A412-T416 PolarHBondContact O-N 3.31Å; A412-T416 PolarHBondContact O-OG1 3.03Å; N413-T416 PolarHBondContact O-N 2.9Å; T414-T416 VanDerWaalsContact C-N 3.34Å; T414-T416 PolarHBondContact O-N 2.9Å; T416-L420 HydrophobicContact CG2-CD1 4.2Å; T416-L420 WeakPolarHBondContact O-CD1 3.45Å; T416-L420 VanDerWaalsContact O-CG 3.25Å; T416-L420 WeakPolarHBondContact O-CG 3.36Å; T416-L420 PolarHBondContact O-N 3.33Å
417	L	96.8	Very high	95.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-74	-36.6	176.8	-171.3	59.2	0	0	0	112.2	V309 I310 Y360 F361 L364 N413 T414 L420 L421	V309-L417 HydrophobicContact CG1-CD1 4.08Å; V309-L417 HydrophobicContact CG1-CD2 4.26Å; I310-L417 HydrophobicContact CG1-CB 4.17Å; I310-L417 HydrophobicContact CG1-CD1 4.43Å; Y360-L417 HydrophobicContact CD1-CD2 3.78Å; Y360-L417 HydrophobicContact CE1-CD2 4.17Å; F361-L417 HydrophobicContact CB-CD2 4.32Å; F361-L417 HydrophobicContact CD2-CB 4.35Å; F361-L417 HydrophobicContact CD2-CD2 4.15Å; F361-L417 HydrophobicContact CD2-CG 4.1Å; L364-L417 HydrophobicContact CD2-CD2 3.86Å; N413-L417 PolarHBondContact O-N 3.13Å; T414-L417 PolarHBondContact O-N 3.3Å; L417-L420 PolarHBondContact O-N 3.28Å; L417-L421 HydrophobicContact CD1-CD1 4.04Å; L417-L421 HydrophobicContact CD1-CG 4.08Å; L417-L421 HydrophobicContact CG-CD1 3.92Å; L417-L421 HydrophobicContact CG-CG 4.33Å; L417-L421 WeakPolarHBondContact O-CG 3.42Å; L417-L421 PolarHBondContact O-N 3.36Å
418	A	97.2	Very high	95.1	Very high	4 Å²	4	51.4 Å²	51.4	3%	0.033	26%	0.263	C	S	.	.	H	α-helix	trans	-58.2	-49.7	173.6	0	0	0	0	0	111.4	F361 T414 Q415 L420 L421 D422 E423 M425	F361-A418 HydrophobicContact CE2-CB 3.71Å; F361-A418 HydrophobicContact CZ-CB 3.79Å; T414-A418 WeakPolarHBondContact O-CB 3.22Å; T414-A418 PolarHBondContact O-N 2.93Å; Q415-A418 PolarHBondContact O-N 3.33Å; A418-L420 VanDerWaalsContact C-N 3.34Å; A418-L420 PolarHBondContact O-N 3.43Å; A418-L421 PolarHBondContact O-N 2.8Å; A418-D422 WeakPolarHBondContact O-CA 3.43Å; A418-D422 PolarHBondContact O-N 2.91Å; A418-E423 PolarHBondContact O-N 2.68Å; A418-M425 HydrophobicContact CB-CG 4.18Å; A418-M425 HydrophobicContact CB-SD 4Å
419	D	96.4	Very high	94.4	Very high	32 Å²	32	50.3 Å²	50.3	17%	0.171	27%	0.266	C	S	.	.	H	α-helix	trans	-57.8	-43	174.9	178.2	48.7	0	0	0	112.3	P325 R326 R327 Q415 L421 D422	P325-D419 CarbonylContact C-O 3.6Å; P325-D419 VanDerWaalsContact CA-O 3.22Å; P325-D419 WeakPolarHBondContact CA-O 3.34Å; P325-D419 WeakPolarHBondContact CB-O 3.49Å; R326-D419 WeakPolarHBondContact CB-OD1 3.36Å; R326-D419 PolarHBondContact N-O 2.75Å; R327-D419 WeakPolarHBondContact CD-OD2 3.47Å; R327-D419 WeakPolarHBondContact CG-OD1 3.36Å; R327-D419 PolarHBondContact N-OD1 3.09Å; R327-D419 IonicContact NE-OD2 2.73Å; R327-D419 PolarHBondContact NE-OD2 2.91Å; Q415-D419 PolarHBondContact O-N 2.87Å; D419-L421 PolarHBondContact O-N 3.02Å; D419-D422 PolarHBondContact O-N 2.96Å
420	L	96.6	Very high	93.3	Very high	14 Å²	14	51.7 Å²	51.7	7%	0.073	27%	0.274	C	S	.	.	H	α-helix	trans	-70.5	-28.5	-179.9	-72.3	169.3	0	0	0	114.4	I310 C313 K314 P325 T416 L417 A418	I310-L420 HydrophobicContact CG2-CD1 4.04Å; C313-L420 HydrophobicContact CB-CB 4.16Å; C313-L420 HydrophobicContact CB-CD1 3.98Å; K314-L420 HydrophobicContact CB-CD1 4.03Å; K314-L420 HydrophobicContact CB-CD2 4.12Å; P325-L420 HydrophobicContact CB-CD2 4.38Å; P325-L420 HydrophobicContact CG-CD2 3.95Å; T416-L420 HydrophobicContact CG2-CD1 4.2Å; T416-L420 WeakPolarHBondContact O-CD1 3.45Å; T416-L420 VanDerWaalsContact O-CG 3.25Å; T416-L420 WeakPolarHBondContact O-CG 3.36Å; T416-L420 PolarHBondContact O-N 3.33Å; L417-L420 PolarHBondContact O-N 3.28Å; A418-L420 VanDerWaalsContact C-N 3.34Å; A418-L420 PolarHBondContact O-N 3.43Å
421	L	96.2	Very high	91.4	Very high	14 Å²	14	54.8 Å²	54.8	7%	0.073	29%	0.291	C	S	.	.	H	α-helix	trans	-95.2	-8.8	177.2	-60	178.2	0	0	0	113.3	L323 L357 F361 L417 A418 D419 E423	L323-L421 HydrophobicContact CD1-CD2 3.82Å; L323-L421 HydrophobicContact CD2-CD2 3.67Å; L323-L421 HydrophobicContact CG-CD2 4.42Å; L357-L421 HydrophobicContact CB-CD1 4.39Å; L357-L421 HydrophobicContact CB-CD2 3.81Å; L357-L421 HydrophobicContact CD1-CD2 4.12Å; F361-L421 HydrophobicContact CB-CD1 3.68Å; F361-L421 HydrophobicContact CD2-CD1 4.46Å; F361-L421 HydrophobicContact CG-CD1 4.09Å; L417-L421 HydrophobicContact CD1-CD1 4.04Å; L417-L421 HydrophobicContact CD1-CG 4.08Å; L417-L421 HydrophobicContact CG-CD1 3.92Å; L417-L421 HydrophobicContact CG-CG 4.33Å; L417-L421 WeakPolarHBondContact O-CG 3.42Å; L417-L421 PolarHBondContact O-N 3.36Å; A418-L421 PolarHBondContact O-N 2.8Å; D419-L421 PolarHBondContact O-N 3.02Å; L421-E423 HydrophobicContact CB-CB 4.43Å; L421-E423 HydrophobicContact CB-CG 3.8Å; L421-E423 PolarHBondContact O-N 2.78Å
422	D	95.9	Very high	88.8	Confident	42 Å²	42	62.1 Å²	62.1	23%	0.225	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	34.4	-165.4	-168.7	30.7	0	0	0	114	R326 K329 A418 D419	R326-D422 HydrophobicContact CB-CB 4.44Å; R326-D422 WeakPolarHBondContact CB-OD1 3.5Å; R326-D422 IonicContact CZ-OD1 2.78Å; R326-D422 VanDerWaalsContact CZ-OD1 3.23Å; R326-D422 IonicContact NE-OD1 2.68Å; R326-D422 PolarHBondContact NE-OD1 3.44Å; R326-D422 PolarHBondContact NH2-O 2.99Å; R326-D422 IonicContact NH2-OD1 3.48Å; R326-D422 PolarHBondContact NH2-OD1 1.85Å; K329-D422 WeakPolarHBondContact CD-OD2 3.39Å; K329-D422 VanDerWaalsContact CE-OD2 3.29Å; K329-D422 WeakPolarHBondContact CE-OD2 3.25Å; K329-D422 IonicContact NZ-OD2 3.06Å; K329-D422 PolarHBondContact NZ-OD2 2.78Å; A418-D422 WeakPolarHBondContact O-CA 3.43Å; A418-D422 PolarHBondContact O-N 2.91Å; D419-D422 PolarHBondContact O-N 2.96Å
423	E	95.8	Very high	86.1	Confident	50 Å²	50	65.9 Å²	65.9	23%	0.234	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-90.6	153.3	172.8	-64.6	-62.5	159.1	0	0	110.6	R326 R358 F361 A418 L421	R326-E423 PolarHBondContact NH2-O 3.48Å; R358-E423 IonicContact CZ-OE1 2.73Å; R358-E423 IonicContact NE-OE1 2.73Å; R358-E423 PolarHBondContact NE-OE1 2.98Å; R358-E423 IonicContact NH2-OE1 3.46Å; R358-E423 PolarHBondContact NH2-OE1 2.66Å; F361-E423 HydrophobicContact CD1-CB 3.86Å; F361-E423 HydrophobicContact CD1-CG 4.04Å; F361-E423 HydrophobicContact CE1-CB 3.48Å; F361-E423 VanDerWaalsContact CE1-CB 3.48Å; F361-E423 HydrophobicContact CE1-CG 4.17Å; F361-E423 HydrophobicContact CZ-CB 4.01Å; A418-E423 PolarHBondContact O-N 2.68Å; L421-E423 HydrophobicContact CB-CB 4.43Å; L421-E423 HydrophobicContact CB-CG 3.8Å; L421-E423 PolarHBondContact O-N 2.78Å
424	N	93.8	Very high	83.3	Confident	114 Å²	114	69.1 Å²	69.1	61%	0.61	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-79	140.6	175.1	-75.6	-28.8	0	0	0	111.5	R326	R326-N424 PolarHBondContact NH1-OD1 2.82Å; R326-N424 PolarHBondContact NH2-OD1 3.07Å
425	M	94.3	Very high	80.4	Confident	60 Å²	60	75.4 Å²	75.4	30%	0.296	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-60.4	142.8	168.9	-83.1	-65	-66	0	0	110.3	L368 L411 T414 Q415 A418 L428	L368-M425 HydrophobicContact CD2-CE 3.72Å; L411-M425 HydrophobicContact CD1-CE 3.71Å; T414-M425 HydrophobicContact CG2-CE 4.23Å; T414-M425 HydrophobicContact CG2-SD 3.91Å; Q415-M425 VanDerWaalsContact CA-SD 3.57Å; Q415-M425 HydrophobicContact CB-SD 4.23Å; Q415-M425 HydrophobicContact CG-CE 3.68Å; Q415-M425 HydrophobicContact CG-CG 4.1Å; Q415-M425 HydrophobicContact CG-SD 3.69Å; A418-M425 HydrophobicContact CB-CG 4.18Å; A418-M425 HydrophobicContact CB-SD 4Å; M425-L428 HydrophobicContact CE-CD1 4.33Å
426	P	91.8	Very high	77.7	Confident	18 Å²	18	77.7 Å²	77.7	12%	0.117	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-57.8	145.7	169.4	24	-34.9	0	0	0	111.8	T365 L368 K369 L428	T365-P426 HydrophobicContact CG2-CB 3.77Å; T365-P426 HydrophobicContact CG2-CG 3.9Å; L368-P426 HydrophobicContact CD2-CG 4.08Å; K369-P426 HydrophobicContact CD-CB 4.35Å; K369-P426 HydrophobicContact CG-CB 4.25Å; P426-L428 HydrophobicContact CG-CD2 4.42Å; P426-L428 HydrophobicContact CG-CG 4.43Å; P426-L428 PolarHBondContact O-N 2.91Å
427	E	87.4	Confident	74.6	Confident	163 Å²	163	83 Å²	83	76%	0.762	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-58	125.3	158.7	-67.6	-179.1	170.7	0	0	109.8	K369	K369-E427 WeakPolarHBondContact CE-O 3.47Å
428	L	89.9	Confident	71.5	Confident	37 Å²	37	92.1 Å²	92.1	19%	0.194	47%	0.465	C	S	.	.			trans	-121	89.5	175.1	-63.8	168.5	0	0	0	106.2	L368 K369 H372 L411 M425 P426 Q430	L368-L428 HydrophobicContact CD2-CD1 3.92Å; L368-L428 HydrophobicContact CD2-CD2 4.41Å; L368-L428 HydrophobicContact CG-CD1 4.31Å; L368-L428 HydrophobicContact CG-CD2 4.2Å; K369-L428 HydrophobicContact CG-CD2 4.23Å; H372-L428 HydrophobicContact CB-CD2 4Å; L411-L428 HydrophobicContact CD1-CD1 3.7Å; M425-L428 HydrophobicContact CE-CD1 4.33Å; P426-L428 HydrophobicContact CG-CD2 4.42Å; P426-L428 HydrophobicContact CG-CG 4.43Å; P426-L428 PolarHBondContact O-N 2.91Å; L428-Q430 PolarHBondContact O-N 3.48Å
429	P	81.5	Confident	68.2	Low	90 Å²	90	95 Å²	95	58%	0.584	50%	0.495	S	S	*	.			trans	-61.9	107.1	-176.9	-21.9	33.5	0	0	0	109	H372 Q376	H372-P429 WeakPolarHBondContact NE2-CA 3.43Å; H372-P429 PolarHBondContact NE2-O 3.33Å; Q376-P429 PolarHBondContact NE2-O 3.22Å
430	Q	70.8	Confident	65.3	Low	159 Å²	159	100.4 Å²	100.4	74%	0.743	53%	0.532	S	S	*	.			trans	-62.5	142.2	164.7	-65.4	177.5	-6.2	0	0	107.2	H372 L428 K432	H372-Q430 PolarHBondContact NE2-N 3.45Å; L428-Q430 PolarHBondContact O-N 3.48Å; Q430-K432 PolarHBondContact O-N 2.89Å
431	D	55.3	Low	62	Low	79 Å²	79	103 Å²	103	42%	0.422	56%	0.562	S	S	.	*			trans	-62.8	93.3	162.4	-97	7.7	0	0	0	105.8	R380 T433	R380-D431 IonicContact CZ-OD1 3.66Å; R380-D431 IonicContact CZ-OD2 2.61Å; R380-D431 IonicContact NE-OD1 2.75Å; R380-D431 IonicContact NE-OD2 2.56Å; R380-D431 PolarHBondContact NE-OD2 2.97Å; R380-D431 IonicContact NH2-OD1 3.6Å; R380-D431 PolarHBondContact NH2-OD1 3.4Å; R380-D431 IonicContact NH2-OD2 3.8Å; R380-D431 PolarHBondContact NH2-OD2 3.15Å; R380-D431 VanDerWaalsContact NH2-OD2 3.13Å; D431-T433 PolarHBondContact O-N 2.83Å
432	K	42.8	Very low	59	Low	178 Å²	178	110.4 Å²	110.4	77%	0.774	60%	0.6	S	S	*	*			trans	-47.9	132.7	158.6	-67.8	-177.5	-179.6	180	0	105.4	Q430 V434	Q430-K432 PolarHBondContact O-N 2.89Å; K432-V434 WeakPolarHBondContact O-CG2 3.5Å; K432-V434 PolarHBondContact O-N 3.27Å
433	T	39.9	Very low	55.8	Low	125 Å²	125	113.9 Å²	113.9	77%	0.767	62%	0.619	S	S	*	*			trans	-56.5	104.7	167.8	45.3	0	0	0	0	107.2	D431 Q435	D431-T433 PolarHBondContact O-N 2.83Å; T433-Q435 PolarHBondContact O-N 3.27Å
434	V	36	Very low	52.9	Low	115 Å²	115	118.6 Å²	118.6	70%	0.697	64%	0.644	S	S	*	*			trans	-77.4	74.4	-169.2	-170.9	0	0	0	0	109.2	K432	K432-V434 WeakPolarHBondContact O-CG2 3.5Å; K432-V434 PolarHBondContact O-N 3.27Å
435	Q	36.2	Very low	49.7	Very low	132 Å²	132	121.9 Å²	121.9	62%	0.617	65%	0.653	S	S	*	*			trans	-68	148.7	155.3	-66.3	-174.7	-35.9	0	0	108.6	T433	T433-Q435 PolarHBondContact O-N 3.27Å
436	E	39.9	Very low	46.6	Very low	146 Å²	146	124.2 Å²	124.2	68%	0.682	67%	0.671	S	S	*	*	S	Bend	trans	61.8	60.7	162	-61.3	172.6	-163.3	0	0	115.9	K765	E436-K765 IonicContact OE1-NZ 2.73Å; E436-K765 PolarHBondContact OE1-NZ 3.38Å; E436-K765 IonicContact OE2-NZ 3.56Å
437	E	32.6	Very low	43.9	Very low	171 Å²	171	128.9 Å²	128.9	80%	0.799	70%	0.701	S	S	*	*				-170.8	142.4	125.4	-110.1	177.7	-178.9	0	0	112.7
438	H	31	Very low	40.9	Very low	191 Å²	191	123.8 Å²	123.8	88%	0.884	69%	0.693	S	S	*	*			trans	167	138.8	140.2	-93.7	75.8	0	0	0	110
439	G	28.8	Very low	38.2	Very low	65 Å²	65	127.9 Å²	127.9	67%	0.67	71%	0.709	S	S	*	*			trans	-86.2	177.6	177.1	0	0	0	0	0	114
440	P	34.3	Very low	35.9	Very low	145 Å²	145	126.6 Å²	126.6	94%	0.942	70%	0.7	S	S	*	*	S	Bend	trans	-77	125.4	-174.5	30.5	-34.3	0	0	0	112.8
441	G	28.4	Very low	34.3	Very low	70 Å²	70	121.3 Å²	121.3	72%	0.722	69%	0.689	S	S	*	*			trans	167.1	84.1	174	0	0	0	0	0	112.7	D443	G441-D443 PolarHBondContact O-N 3.01Å
442	I	33.2	Very low	33.3	Very low	168 Å²	168	126 Å²	126	86%	0.862	71%	0.709	S	S	*	*			trans	-87.7	102.2	172.6	-60.9	177	0	0	0	108.3
443	D	28	Very low	33.3	Very low	115 Å²	115	123.5 Å²	123.5	62%	0.615	70%	0.695	S	S	*	*			trans	-86.1	137.5	166.7	-172.3	-1.2	0	0	0	109.8	G441 F445	G441-D443 PolarHBondContact O-N 3.01Å; D443-F445 VanDerWaalsContact C-N 3.26Å; D443-F445 PolarHBondContact O-N 3.22Å
444	I	34.9	Very low	33.3	Very low	150 Å²	150	125.8 Å²	125.8	77%	0.769	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-19.1	-169.9	-73.9	173.2	0	0	0	112.3
445	F	27.4	Very low	33.9	Very low	182 Å²	182	122.8 Å²	122.8	80%	0.798	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	8.5	-171.3	-75.9	-82.5	0	0	0	116.6	D443	D443-F445 VanDerWaalsContact C-N 3.26Å; D443-F445 PolarHBondContact O-N 3.22Å
446	T	28.7	Very low	34.4	Very low	110 Å²	110	122.3 Å²	122.3	68%	0.675	67%	0.674	S	S	*	*			trans	-130.6	108.5	176.8	-55	0	0	0	0	113.1	G448	T446-G448 VanDerWaalsContact C-N 3.27Å; T446-G448 PolarHBondContact O-N 2.94Å
447	P	34.2	Very low	35	Very low	115 Å²	115	118.1 Å²	118.1	75%	0.747	67%	0.67	S	S	*	*			trans	-77.4	62.9	-175	30.3	-35.3	0	0	0	114.7	R384 K449	R384-P447 PolarHBondContact NH1-O 2.97Å; R384-P447 PolarHBondContact NH2-O 3.07Å; P447-K449 PolarHBondContact O-N 3.21Å
448	G	26.1	Very low	36.6	Very low	57 Å²	57	111.9 Å²	111.9	59%	0.588	65%	0.652	S	S	*	*			trans	-99.6	68.2	-167.6	0	0	0	0	0	117.4	T446	T446-G448 VanDerWaalsContact C-N 3.27Å; T446-G448 PolarHBondContact O-N 2.94Å
449	K	31.7	Very low	38.9	Very low	123 Å²	123	105.6 Å²	105.6	54%	0.535	62%	0.624	S	S	.	*			trans	66.8	131.6	172.4	-57.8	178.3	178.1	179.1	0	115	P447 G451	P447-K449 PolarHBondContact O-N 3.21Å; K449-G451 PolarHBondContact O-N 3.24Å
450	P	35	Very low	41.5	Very low	62 Å²	62	103.5 Å²	103.5	40%	0.403	60%	0.596	S	S	.	*			trans	-65.1	134.1	160.6	30.1	-32.6	0	0	0	108.7	L720	P450-L720 HydrophobicContact CB-CD1 4.42Å
451	G	36	Very low	43.3	Very low	49 Å²	49	101 Å²	101	51%	0.505	57%	0.572	S	S	.	*			trans	-79.2	140.2	178.2	0	0	0	0	0	111.8	K449 Y453	K449-G451 PolarHBondContact O-N 3.24Å; G451-Y453 PolarHBondContact O-N 2.96Å
452	E	35.1	Very low	45.8	Very low	178 Å²	178	102 Å²	102	83%	0.832	56%	0.561	S	S	*	*			trans	-70.2	107.8	161.6	-70.5	178.1	157.7	0	0	107.6	E454	E452-E454 PolarHBondContact O-N 2.91Å; E452-E454 VanDerWaalsContact O-N 3.09Å
453	Y	42.5	Very low	47.9	Very low	124 Å²	124	99.2 Å²	99.2	49%	0.486	54%	0.544	S	S	.	.			trans	-66.5	106.4	172.2	-86.8	-111.5	0	0	0	108.9	G451 L455 H719	G451-Y453 PolarHBondContact O-N 2.96Å; Y453-L455 PolarHBondContact O-N 3.34Å; Y453-H719 AromaticContact CD2-CE1 3.37Å; Y453-H719 WeakPolarHBondContact CD2-CE1 3.27Å; Y453-H719 AromaticContact CD2-NE2 3.22Å; Y453-H719 WeakPolarHBondContact CD2-NE2 3.37Å; Y453-H719 AromaticContact CE2-CE1 3.7Å; Y453-H719 AromaticContact CE2-NE2 3.49Å; Y453-H719 WeakPolarHBondContact CE2-NE2 3Å; Y453-H719 AromaticContact CG-CE1 3.78Å
454	E	39.1	Very low	50.5	Low	173 Å²	173	100.1 Å²	100.1	81%	0.808	55%	0.549	S	S	*	.			trans	-67.4	79.7	166.6	-80.2	-161.1	142.5	0	0	110.2	E452 E456	E452-E454 PolarHBondContact O-N 2.91Å; E452-E454 VanDerWaalsContact O-N 3.09Å; E454-E456 PolarHBondContact O-N 2.86Å
455	L	49.4	Very low	52.9	Low	52 Å²	52	94.1 Å²	94.1	27%	0.272	52%	0.522	S	S	.	.			trans	-71.1	80.5	169.6	-77.6	148.2	0	0	0	108.7	Y453 G457 G458 R714	Y453-L455 PolarHBondContact O-N 3.34Å; L455-G457 PolarHBondContact O-N 3.48Å; L455-G458 PolarHBondContact O-N 3.06Å; L455-R714 HydrophobicContact CD1-CB 3.89Å; L455-R714 HydrophobicContact CD1-CG 3.71Å; L455-R714 HydrophobicContact CD2-CG 3.95Å; L455-R714 HydrophobicContact CG-CG 4.33Å
456	E	45.2	Very low	55.7	Low	122 Å²	122	90.5 Å²	90.5	57%	0.57	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	8.9	-174.8	-147.5	-155.8	-178.3	0	0	115.1	E454 K760	E454-E456 PolarHBondContact O-N 2.86Å; E456-K760 WeakPolarHBondContact OE2-CD 3.27Å; E456-K760 WeakPolarHBondContact OE2-CE 3.42Å; E456-K760 IonicContact OE2-NZ 2.74Å; E456-K760 PolarHBondContact OE2-NZ 2.93Å
457	G	53.4	Low	58.4	Low	58 Å²	58	87.9 Å²	87.9	60%	0.598	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-0.5	169.6	0	0	0	0	0	114.4	L455	L455-G457 PolarHBondContact O-N 3.48Å
458	G	65.6	Low	61.1	Low	40 Å²	40	84 Å²	84	41%	0.412	46%	0.456	S	S	.	.			trans	75.1	-172	-174.2	0	0	0	0	0	114	L455 W460 R714	L455-G458 PolarHBondContact O-N 3.06Å; G458-W460 VanDerWaalsContact C-N 3.28Å; G458-W460 PolarHBondContact O-N 2.99Å; G458-R714 WeakPolarHBondContact O-CD 3.41Å; G458-R714 PolarHBondContact O-NH1 3.19Å
459	I	79.9	Confident	64.2	Low	59 Å²	59	82.9 Å²	82.9	30%	0.303	43%	0.434	S	S	.	.	S	Bend	trans	-64.9	-33.5	-177.6	-61.9	175.3	0	0	0	111.6	F711	I459-F711 HydrophobicContact CG2-CD2 3.53Å; I459-F711 HydrophobicContact CG2-CE2 3.96Å; I459-F711 HydrophobicContact CG2-CG 4.43Å
460	W	84.5	Confident	66.8	Low	21 Å²	21	81 Å²	81	8%	0.08	43%	0.427	C	S	.	.	S	Bend	trans	-94.2	167.1	-175.8	-55	107	0	0	0	112.5	G458 R466 Y469 E470 K673 F711 R714	G458-W460 VanDerWaalsContact C-N 3.28Å; G458-W460 PolarHBondContact O-N 2.99Å; W460-R466 HydrophobicContact CB-CB 4.08Å; W460-R466 HydrophobicContact CG-CB 3.92Å; W460-R466 HydrophobicContact CG-CG 4.26Å; W460-Y469 HydrophobicContact CD2-CD2 4.5Å; W460-Y469 AromaticContact CE3-CD2 3.69Å; W460-Y469 HydrophobicContact CE3-CD2 3.69Å; W460-Y469 HydrophobicContact CE3-CE2 4.36Å; W460-Y469 HydrophobicContact CE3-CG 4.33Å; W460-Y469 HydrophobicContact CH2-CD1 4.24Å; W460-Y469 AromaticContact CH2-CD2 3.74Å; W460-Y469 HydrophobicContact CH2-CD2 3.74Å; W460-Y469 AromaticContact CH2-CG 3.52Å; W460-Y469 HydrophobicContact CH2-CG 3.52Å; W460-Y469 HydrophobicContact CZ2-CG 4.24Å; W460-Y469 HydrophobicContact CZ3-CD1 4.37Å; W460-Y469 AromaticContact CZ3-CD2 3.26Å; W460-Y469 HydrophobicContact CZ3-CD2 3.26Å; W460-Y469 AromaticContact CZ3-CE2 3.91Å; W460-Y469 HydrophobicContact CZ3-CE2 3.91Å; W460-Y469 AromaticContact CZ3-CG 3.57Å; W460-Y469 HydrophobicContact CZ3-CG 3.57Å; W460-E470 HydrophobicContact CZ2-CG 4.27Å; W460-E470 VanDerWaalsContact NE1-CD 3.26Å; W460-E470 PolarHBondContact NE1-OE1 3.05Å; W460-K673 HydrophobicContact CH2-CB 3.97Å; W460-K673 HydrophobicContact CH2-CG 4.34Å; W460-K673 HydrophobicContact CZ3-CB 4.17Å; W460-K673 HydrophobicContact CZ3-CD 4.2Å; W460-K673 HydrophobicContact CZ3-CG 4.14Å; W460-F711 AromaticContact CH2-CD2 3.51Å; W460-F711 HydrophobicContact CH2-CD2 3.51Å; W460-F711 AromaticContact CH2-CE2 3.6Å; W460-F711 HydrophobicContact CH2-CE2 3.6Å; W460-F711 HydrophobicContact CZ2-CD2 4.01Å; W460-F711 AromaticContact CZ2-CE2 3.84Å; W460-F711 HydrophobicContact CZ2-CE2 3.84Å; W460-F711 AromaticContact CZ3-CD2 3.85Å; W460-F711 HydrophobicContact CZ3-CD2 3.85Å; W460-F711 HydrophobicContact CZ3-CE2 4.4Å; W460-R714 PolarHBondContact O-NH1 3.4Å
461	E	70.7	Confident	69.4	Low	94 Å²	94	82.2 Å²	82.2	44%	0.439	43%	0.431	S	S	.	.	S	Bend	trans	-82.7	-38.5	-179.7	-56	-164	-174.6	0	0	112.4	R710 Y752	E461-R710 WeakPolarHBondContact OE1-CD 3.49Å; E461-R710 IonicContact OE1-CZ 3.09Å; E461-R710 IonicContact OE1-NE 3.87Å; E461-R710 IonicContact OE1-NH1 2.7Å; E461-R710 PolarHBondContact OE1-NH1 3Å; E461-R710 IonicContact OE2-NH1 3.98Å; E461-R710 PolarHBondContact OE2-NH1 3.23Å; E461-Y752 PolarHBondContact OE1-OH 3.32Å
462	D	80.3	Confident	71.8	Confident	89 Å²	89	82.7 Å²	82.7	48%	0.476	42%	0.421	S	S	.	.	S	Bend	trans	-149	175.3	178.7	55.9	49.4	0	0	0	110.2	D464 A465 R466	D462-D464 VanDerWaalsContact C-N 3.32Å; D462-D464 PolarHBondContact OD1-N 2.97Å; D462-A465 WeakPolarHBondContact OD1-CB 3.31Å; D462-A465 PolarHBondContact OD1-N 3.36Å; D462-R466 PolarHBondContact O-N 2.95Å
463	E	77.9	Confident	74.2	Confident	110 Å²	110	76.5 Å²	76.5	51%	0.514	39%	0.394	S	S	.	.	H	α-helix	trans	-74.5	-17.3	178.9	-77.6	-71.6	147	0	0	113.2	R466 N467	E463-R466 WeakPolarHBondContact OE1-CD 2.83Å; E463-R466 IonicContact OE1-CZ 3.85Å; E463-R466 IonicContact OE1-NH1 3.64Å; E463-R466 PolarHBondContact OE1-NH1 2.84Å; E463-R466 IonicContact OE2-NH1 3.74Å; E463-N467 WeakPolarHBondContact O-CB 3.37Å; E463-N467 PolarHBondContact O-N 2.72Å; E463-N467 PolarHBondContact O-ND2 3.01Å
464	D	83.1	Confident	76.1	Confident	134 Å²	134	74.9 Å²	74.9	72%	0.717	39%	0.393	S	S	*	.	H	α-helix	trans	-77.2	-45.1	177.6	-77.6	-29.4	0	0	0	110.8	D462 R466 N467 F468	D462-D464 VanDerWaalsContact C-N 3.32Å; D462-D464 PolarHBondContact OD1-N 2.97Å; D464-R466 VanDerWaalsContact C-N 3.32Å; D464-R466 PolarHBondContact O-N 3.39Å; D464-N467 PolarHBondContact O-N 2.86Å; D464-F468 PolarHBondContact O-N 2.98Å
465	A	84.3	Confident	78.1	Confident	25 Å²	25	66.8 Å²	66.8	21%	0.207	36%	0.355	C	S	.	.	H	α-helix	trans	-58.2	-45.3	168.8	0	0	0	0	0	110.6	D462 N467 F468 Y469	D462-A465 WeakPolarHBondContact OD1-CB 3.31Å; D462-A465 PolarHBondContact OD1-N 3.36Å; A465-N467 PolarHBondContact O-N 3.32Å; A465-F468 WeakPolarHBondContact O-CA 3.4Å; A465-F468 WeakPolarHBondContact O-CB 3.44Å; A465-F468 PolarHBondContact O-N 2.83Å; A465-Y469 WeakPolarHBondContact O-CD2 3.41Å; A465-Y469 PolarHBondContact O-N 3.49Å
466	R	86.6	Confident	79.4	Confident	106 Å²	106	69.5 Å²	69.5	40%	0.4	37%	0.365	S	S	.	.	H	α-helix	trans	-57.5	-47.2	174.8	-174.2	178.7	-174.9	-164.9	-1.3	112.3	W460 D462 E463 D464 F468 Y469 E470	W460-R466 HydrophobicContact CB-CB 4.08Å; W460-R466 HydrophobicContact CG-CB 3.92Å; W460-R466 HydrophobicContact CG-CG 4.26Å; D462-R466 PolarHBondContact O-N 2.95Å; E463-R466 WeakPolarHBondContact OE1-CD 2.83Å; E463-R466 IonicContact OE1-CZ 3.85Å; E463-R466 IonicContact OE1-NH1 3.64Å; E463-R466 PolarHBondContact OE1-NH1 2.84Å; E463-R466 IonicContact OE2-NH1 3.74Å; D464-R466 VanDerWaalsContact C-N 3.32Å; D464-R466 PolarHBondContact O-N 3.39Å; R466-F468 PolarHBondContact O-N 2.81Å; R466-Y469 PolarHBondContact O-N 2.61Å; R466-E470 HydrophobicContact CG-CG 4.17Å; R466-E470 VanDerWaalsContact CG-OE2 3.31Å; R466-E470 WeakPolarHBondContact CG-OE2 3.3Å; R466-E470 IonicContact CZ-OE2 2.67Å; R466-E470 IonicContact NE-OE2 3.79Å; R466-E470 PolarHBondContact NE-OE2 3.37Å; R466-E470 IonicContact NH2-OE2 2.7Å; R466-E470 WeakPolarHBondContact O-CB 3.46Å; R466-E470 PolarHBondContact O-N 3.23Å
467	N	86.6	Confident	80.9	Confident	55 Å²	55	67 Å²	67	29%	0.294	37%	0.365	S	S	.	.	H	α-helix	trans	-64	-28.9	174.8	-85.5	-75.7	0	0	0	112.6	E463 D464 A465 N471 R622	E463-N467 WeakPolarHBondContact O-CB 3.37Å; E463-N467 PolarHBondContact O-N 2.72Å; E463-N467 PolarHBondContact O-ND2 3.01Å; D464-N467 PolarHBondContact O-N 2.86Å; A465-N467 PolarHBondContact O-N 3.32Å; N467-N471 HydrophobicContact CB-CB 4.49Å; N467-N471 VanDerWaalsContact O-CB 3.31Å; N467-N471 WeakPolarHBondContact O-CB 3.32Å; N467-N471 PolarHBondContact O-N 3.11Å; N467-N471 PolarHBondContact OD1-ND2 3.42Å; N467-R622 PolarHBondContact O-NH1 3.34Å
468	F	90.8	Very high	81.7	Confident	32 Å²	32	70.5 Å²	70.5	14%	0.14	37%	0.365	C	S	.	.	H	α-helix	trans	-73.5	-37.4	175.5	-171.6	-96.9	0	0	0	113.6	D464 A465 R466 P618 F619 R622 F674	D464-F468 PolarHBondContact O-N 2.98Å; A465-F468 WeakPolarHBondContact O-CA 3.4Å; A465-F468 WeakPolarHBondContact O-CB 3.44Å; A465-F468 PolarHBondContact O-N 2.83Å; R466-F468 PolarHBondContact O-N 2.81Å; F468-P618 HydrophobicContact CE1-CB 3.77Å; F468-P618 HydrophobicContact CZ-CB 4Å; F468-F619 AromaticContact CE2-CD1 3.84Å; F468-F619 HydrophobicContact CE2-CD1 3.84Å; F468-F619 AromaticContact CE2-CE1 3.74Å; F468-F619 HydrophobicContact CE2-CE1 3.74Å; F468-F619 AromaticContact CZ-CD1 3.9Å; F468-F619 HydrophobicContact CZ-CD1 3.9Å; F468-F619 HydrophobicContact CZ-CE1 4.1Å; F468-R622 HydrophobicContact CZ-CB 4.11Å; F468-R622 PolarHBondContact O-NH1 2.9Å; F468-F674 HydrophobicContact CD1-CE2 4.49Å; F468-F674 AromaticContact CD1-CZ 3.93Å; F468-F674 HydrophobicContact CD1-CZ 3.93Å; F468-F674 AromaticContact CE1-CE2 3.96Å; F468-F674 HydrophobicContact CE1-CE2 3.96Å; F468-F674 AromaticContact CE1-CZ 3.65Å; F468-F674 HydrophobicContact CE1-CZ 3.65Å; F468-F674 HydrophobicContact CZ-CZ 4.4Å; F468-F674 WeakPolarHBondContact O-CE1 3.36Å; F468-F674 WeakPolarHBondContact O-CZ 3.21Å
469	Y	90.9	Very high	81.9	Confident	34 Å²	34	68.9 Å²	68.9	13%	0.133	35%	0.347	C	S	.	.	H	α-helix	trans	-96.5	-28.5	-176.9	-64.4	-75.6	0	0	0	115.1	W460 A465 R466 E670 K673 F674	W460-Y469 HydrophobicContact CD2-CD2 4.5Å; W460-Y469 AromaticContact CE3-CD2 3.69Å; W460-Y469 HydrophobicContact CE3-CD2 3.69Å; W460-Y469 HydrophobicContact CE3-CE2 4.36Å; W460-Y469 HydrophobicContact CE3-CG 4.33Å; W460-Y469 HydrophobicContact CH2-CD1 4.24Å; W460-Y469 AromaticContact CH2-CD2 3.74Å; W460-Y469 HydrophobicContact CH2-CD2 3.74Å; W460-Y469 AromaticContact CH2-CG 3.52Å; W460-Y469 HydrophobicContact CH2-CG 3.52Å; W460-Y469 HydrophobicContact CZ2-CG 4.24Å; W460-Y469 HydrophobicContact CZ3-CD1 4.37Å; W460-Y469 AromaticContact CZ3-CD2 3.26Å; W460-Y469 HydrophobicContact CZ3-CD2 3.26Å; W460-Y469 AromaticContact CZ3-CE2 3.91Å; W460-Y469 HydrophobicContact CZ3-CE2 3.91Å; W460-Y469 AromaticContact CZ3-CG 3.57Å; W460-Y469 HydrophobicContact CZ3-CG 3.57Å; A465-Y469 WeakPolarHBondContact O-CD2 3.41Å; A465-Y469 PolarHBondContact O-N 3.49Å; R466-Y469 PolarHBondContact O-N 2.61Å; Y469-E670 PolarHBondContact OH-OE2 3.42Å; Y469-K673 HydrophobicContact CD1-CB 3.69Å; Y469-K673 HydrophobicContact CE1-CB 3.68Å; Y469-K673 HydrophobicContact CE1-CD 4.03Å; Y469-K673 HydrophobicContact CE1-CG 4.48Å; Y469-K673 HydrophobicContact CE2-CD 4.31Å; Y469-K673 HydrophobicContact CG-CB 4.35Å; Y469-K673 WeakPolarHBondContact OH-CE 3.48Å; Y469-K673 PolarHBondContact OH-NZ 3.13Å; Y469-F674 HydrophobicContact CD1-CD1 4.19Å; Y469-F674 AromaticContact CD1-CD2 3.74Å; Y469-F674 HydrophobicContact CD1-CD2 3.74Å; Y469-F674 AromaticContact CD1-CE1 3.88Å; Y469-F674 HydrophobicContact CD1-CE1 3.88Å; Y469-F674 AromaticContact CD1-CE2 3.4Å; Y469-F674 HydrophobicContact CD1-CE2 3.4Å; Y469-F674 HydrophobicContact CD1-CG 4.13Å; Y469-F674 AromaticContact CD1-CZ 3.45Å; Y469-F674 HydrophobicContact CD1-CZ 3.45Å; Y469-F674 VanDerWaalsContact CD1-CZ 3.45Å; Y469-F674 AromaticContact CE1-CD2 3.98Å; Y469-F674 HydrophobicContact CE1-CD2 3.98Å; Y469-F674 AromaticContact CE1-CE2 3.5Å; Y469-F674 HydrophobicContact CE1-CE2 3.5Å; Y469-F674 VanDerWaalsContact CE1-CE2 3.5Å; Y469-F674 AromaticContact CE1-CZ 3.92Å; Y469-F674 HydrophobicContact CE1-CZ 3.92Å; Y469-F674 HydrophobicContact CG-CZ 4.31Å
470	E	87.1	Confident	81.4	Confident	83 Å²	83	69.9 Å²	69.9	39%	0.388	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-34.8	-177.7	-56.7	-167.7	154.1	0	0	113.7	W460 R466 L472	W460-E470 HydrophobicContact CZ2-CG 4.27Å; W460-E470 VanDerWaalsContact NE1-CD 3.26Å; W460-E470 PolarHBondContact NE1-OE1 3.05Å; R466-E470 HydrophobicContact CG-CG 4.17Å; R466-E470 VanDerWaalsContact CG-OE2 3.31Å; R466-E470 WeakPolarHBondContact CG-OE2 3.3Å; R466-E470 IonicContact CZ-OE2 2.67Å; R466-E470 IonicContact NE-OE2 3.79Å; R466-E470 PolarHBondContact NE-OE2 3.37Å; R466-E470 IonicContact NH2-OE2 2.7Å; R466-E470 WeakPolarHBondContact O-CB 3.46Å; R466-E470 PolarHBondContact O-N 3.23Å; E470-L472 PolarHBondContact O-N 3.47Å
471	N	88.7	Confident	80.5	Confident	88 Å²	88	71.8 Å²	71.8	47%	0.471	38%	0.377	S	S	.	.			trans	-90.9	79.6	-174.1	-167.4	-5.9	0	0	0	110.8	N467 R622	N467-N471 HydrophobicContact CB-CB 4.49Å; N467-N471 VanDerWaalsContact O-CB 3.31Å; N467-N471 WeakPolarHBondContact O-CB 3.32Å; N467-N471 PolarHBondContact O-N 3.11Å; N467-N471 PolarHBondContact OD1-ND2 3.42Å; N471-R622 VanDerWaalsContact O-CZ 3.3Å; N471-R622 PolarHBondContact O-NH1 3.02Å; N471-R622 PolarHBondContact O-NH2 3.45Å
472	L	87.2	Confident	80.3	Confident	59 Å²	59	74.2 Å²	74.2	31%	0.309	39%	0.392	S	S	.	.			trans	-92.4	152.8	176	-62.1	175.1	0	0	0	111.2	E470 D474 R622 A625 F674	E470-L472 PolarHBondContact O-N 3.47Å; L472-D474 PolarHBondContact O-N 3.11Å; L472-R622 HydrophobicContact CD2-CG 3.83Å; L472-A625 HydrophobicContact CD1-CB 4Å; L472-F674 HydrophobicContact CD2-CD1 4.38Å; L472-F674 HydrophobicContact CD2-CE1 3.94Å
473	I	85.1	Confident	79.3	Confident	49 Å²	49	73.3 Å²	73.3	25%	0.251	39%	0.386	S	S	.	.			trans	-74.7	125.6	172.2	-60.4	-166.6	0	0	0	109.9	L475 F478 D583 M587	I473-L475 HydrophobicContact CG2-CD2 4.31Å; I473-L475 PolarHBondContact O-N 3.33Å; I473-F478 HydrophobicContact CG2-CD2 3.99Å; I473-F478 HydrophobicContact CG2-CE2 4.02Å; I473-D583 HydrophobicContact CD1-CB 3.7Å; I473-D583 HydrophobicContact CG1-CB 4.2Å; I473-M587 HydrophobicContact CD1-CE 3.84Å; I473-M587 HydrophobicContact CD1-SD 4.41Å; I473-M587 HydrophobicContact CG2-SD 4.46Å
474	D	81.4	Confident	78.8	Confident	90 Å²	90	69.2 Å²	69.2	48%	0.481	37%	0.367	S	S	.	.			trans	-71.6	92.7	169.2	178.9	18.7	0	0	0	111.1	L472 K476 A477 F478	L472-D474 PolarHBondContact O-N 3.11Å; D474-K476 PolarHBondContact O-N 2.79Å; D474-K476 VanDerWaalsContact OD1-CB 3.3Å; D474-K476 WeakPolarHBondContact OD1-CB 3.45Å; D474-K476 PolarHBondContact OD1-N 3.08Å; D474-A477 HydrophobicContact CB-CB 4.45Å; D474-A477 PolarHBondContact O-N 3.04Å; D474-F478 WeakPolarHBondContact O-CD2 3.48Å
475	L	81.6	Confident	77.5	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-58.8	-24.9	175.2	-64	-173.5	0	0	0	113	I473 A477 F478 V479 M587 C590 T626 L627	I473-L475 HydrophobicContact CG2-CD2 4.31Å; I473-L475 PolarHBondContact O-N 3.33Å; L475-A477 VanDerWaalsContact C-N 3.28Å; L475-A477 PolarHBondContact O-N 3.1Å; L475-F478 PolarHBondContact O-N 3.25Å; L475-V479 HydrophobicContact CB-CG2 4.31Å; L475-V479 VanDerWaalsContact O-CB 3.23Å; L475-V479 WeakPolarHBondContact O-CB 3.47Å; L475-V479 VanDerWaalsContact O-CG2 3.28Å; L475-V479 WeakPolarHBondContact O-CG2 3.24Å; L475-V479 PolarHBondContact O-N 2.94Å; L475-M587 HydrophobicContact CD2-CB 4.43Å; L475-M587 HydrophobicContact CD2-CG 3.48Å; L475-M587 VanDerWaalsContact CD2-CG 3.48Å; L475-C590 HydrophobicContact CD1-CB 4.03Å; L475-T626 HydrophobicContact CD1-CG2 4.18Å; L475-T626 VanDerWaalsContact CD1-O 3.24Å; L475-T626 WeakPolarHBondContact CD1-O 3.5Å; L475-T626 HydrophobicContact CD2-CG2 4.3Å; L475-T626 HydrophobicContact CG-CG2 4.05Å; L475-L627 HydrophobicContact CD1-CD2 4.06Å
476	K	76.8	Confident	76.1	Confident	109 Å²	109	73.5 Å²	73.5	47%	0.474	38%	0.38	S	S	.	.	H	α-helix	trans	-70.5	-25	-179.9	-62.2	-176.6	176.2	179.3	0	112.7	D474 F484 P629	D474-K476 PolarHBondContact O-N 2.79Å; D474-K476 VanDerWaalsContact OD1-CB 3.3Å; D474-K476 WeakPolarHBondContact OD1-CB 3.45Å; D474-K476 PolarHBondContact OD1-N 3.08Å; K476-F484 HydrophobicContact CB-CZ 4.12Å; K476-F484 HydrophobicContact CG-CE1 4.47Å; K476-F484 HydrophobicContact CG-CE2 4.32Å; K476-F484 HydrophobicContact CG-CZ 4.09Å; K476-P629 WeakPolarHBondContact CE-O 3.46Å; K476-P629 PolarHBondContact NZ-O 3.39Å
477	A	77.4	Confident	74.4	Confident	70 Å²	70	70.5 Å²	70.5	58%	0.579	37%	0.372	S	S	*	.	H	α-helix	trans	-74.7	-28	173.7	0	0	0	0	0	113.2	D474 L475	D474-A477 HydrophobicContact CB-CB 4.45Å; D474-A477 PolarHBondContact O-N 3.04Å; L475-A477 VanDerWaalsContact C-N 3.28Å; L475-A477 PolarHBondContact O-N 3.1Å
478	F	69.9	Low	72.5	Confident	132 Å²	132	73.6 Å²	73.6	58%	0.579	39%	0.385	S	S	*	.	H	α-helix	trans	-105.3	-22.4	-174.4	-63.9	-75.4	0	0	0	114.5	I473 D474 L475 M591	I473-F478 HydrophobicContact CG2-CD2 3.99Å; I473-F478 HydrophobicContact CG2-CE2 4.02Å; D474-F478 WeakPolarHBondContact O-CD2 3.48Å; L475-F478 PolarHBondContact O-N 3.25Å; F478-M591 HydrophobicContact CB-CE 4.23Å; F478-M591 WeakPolarHBondContact O-CE 3.46Å
479	V	68.4	Low	70.4	Confident	6 Å²	6	79.2 Å²	79.2	4%	0.036	41%	0.409	C	S	.	.	S	Bend	trans	-103.2	133	-174.5	-179.8	0	0	0	0	110.5	L475 A481 L483 F484 C590 M591	L475-V479 HydrophobicContact CB-CG2 4.31Å; L475-V479 VanDerWaalsContact O-CB 3.23Å; L475-V479 WeakPolarHBondContact O-CB 3.47Å; L475-V479 VanDerWaalsContact O-CG2 3.28Å; L475-V479 WeakPolarHBondContact O-CG2 3.24Å; L475-V479 PolarHBondContact O-N 2.94Å; V479-A481 PolarHBondContact O-N 3.18Å; V479-L483 HydrophobicContact CG1-CB 3.93Å; V479-L483 HydrophobicContact CG1-CD1 3.68Å; V479-L483 HydrophobicContact CG1-CG 4.41Å; V479-F484 HydrophobicContact CB-CE1 4.05Å; V479-F484 HydrophobicContact CG1-CD1 4.17Å; V479-F484 HydrophobicContact CG1-CE1 4.08Å; V479-F484 VanDerWaalsContact O-CE1 3.31Å; V479-F484 WeakPolarHBondContact O-CE1 3.39Å; V479-C590 HydrophobicContact CG2-CB 4.44Å; V479-M591 HydrophobicContact CG2-CE 3.82Å; V479-M591 HydrophobicContact CG2-CG 4.04Å
480	P	70.9	Confident	68.1	Low	80 Å²	80	80.5 Å²	80.5	52%	0.519	42%	0.423	S	S	.	.			trans	-58.8	131.4	176.5	-26.9	34.9	0	0	0	113.5	I482 L483	P480-I482 PolarHBondContact O-N 3.35Å; P480-L483 PolarHBondContact O-N 3.19Å
481	A	64.6	Low	65.6	Low	61 Å²	61	78.4 Å²	78.4	50%	0.504	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	1.3	-176.8	0	0	0	0	0	116.5	V479 F484 K485	V479-A481 PolarHBondContact O-N 3.18Å; A481-F484 HydrophobicContact CB-CE2 3.94Å; A481-F484 HydrophobicContact CB-CZ 3.97Å; A481-K485 WeakPolarHBondContact O-CB 3.3Å
482	I	66.3	Low	63	Low	145 Å²	145	80.5 Å²	80.5	74%	0.744	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-32.4	168.7	-61.9	172.7	0	0	0	110.4	P480 F484	P480-I482 PolarHBondContact O-N 3.35Å; I482-F484 PolarHBondContact O-N 3.45Å
483	L	59.5	Low	60.4	Low	69 Å²	69	81.1 Å²	81.1	36%	0.361	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-9.5	-171.9	-68.2	171	0	0	0	114.9	V479 P480 N594	V479-L483 HydrophobicContact CG1-CB 3.93Å; V479-L483 HydrophobicContact CG1-CD1 3.68Å; V479-L483 HydrophobicContact CG1-CG 4.41Å; P480-L483 PolarHBondContact O-N 3.19Å; L483-N594 PolarHBondContact O-ND2 2.94Å
484	F	66.9	Low	58.1	Low	25 Å²	25	86.1 Å²	86.1	11%	0.11	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	11.9	175.5	46.3	-99.6	0	0	0	113.5	K476 V479 A481 I482 D486 N487 C630	K476-F484 HydrophobicContact CB-CZ 4.12Å; K476-F484 HydrophobicContact CG-CE1 4.47Å; K476-F484 HydrophobicContact CG-CE2 4.32Å; K476-F484 HydrophobicContact CG-CZ 4.09Å; V479-F484 HydrophobicContact CB-CE1 4.05Å; V479-F484 HydrophobicContact CG1-CD1 4.17Å; V479-F484 HydrophobicContact CG1-CE1 4.08Å; V479-F484 VanDerWaalsContact O-CE1 3.31Å; V479-F484 WeakPolarHBondContact O-CE1 3.39Å; A481-F484 HydrophobicContact CB-CE2 3.94Å; A481-F484 HydrophobicContact CB-CZ 3.97Å; I482-F484 PolarHBondContact O-N 3.45Å; F484-D486 VanDerWaalsContact C-N 3.26Å; F484-D486 PolarHBondContact O-N 2.89Å; F484-N487 WeakPolarHBondContact O-CB 3.48Å; F484-N487 PolarHBondContact O-N 3.35Å; F484-C630 HydrophobicContact CB-CB 4.05Å; F484-C630 HydrophobicContact CD1-CB 4.37Å; F484-C630 HydrophobicContact CG-CB 4.49Å
485	K	57.3	Low	55.8	Low	124 Å²	124	88.9 Å²	88.9	54%	0.539	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-17.1	-172.8	-140.1	172.5	-174.1	175.7	0	115.2	A481	A481-K485 WeakPolarHBondContact O-CB 3.3Å
486	D	54.5	Low	53.4	Low	124 Å²	124	96.2 Å²	96.2	66%	0.663	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-19.7	173.1	-70.1	-41.4	0	0	0	112.5	F484 E488 K489	F484-D486 VanDerWaalsContact C-N 3.26Å; F484-D486 PolarHBondContact O-N 2.89Å; D486-E488 VanDerWaalsContact C-N 3.33Å; D486-E488 PolarHBondContact O-N 2.94Å; D486-K489 PolarHBondContact O-N 3.23Å; D486-K489 IonicContact OD1-NZ 2.66Å; D486-K489 PolarHBondContact OD1-NZ 3.24Å
487	N	50.7	Low	51	Low	44 Å²	44	97.1 Å²	97.1	24%	0.235	52%	0.52	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-19.4	180	-143.3	54.4	0	0	0	112.7	F484 K489 S490	F484-N487 WeakPolarHBondContact O-CB 3.48Å; F484-N487 PolarHBondContact O-N 3.35Å; N487-K489 VanDerWaalsContact C-N 3.28Å; N487-K489 PolarHBondContact O-N 3.47Å; N487-S490 PolarHBondContact O-OG 3.5Å; N487-S490 VanDerWaalsContact O-OG 3.08Å
488	E	47.2	Very low	48.9	Very low	120 Å²	120	101.9 Å²	101.9	56%	0.561	54%	0.536	S	S	*	.	H	α-helix	trans	-71.6	-23	174.3	-63.3	-174	140.8	0	0	112.5	D486	D486-E488 VanDerWaalsContact C-N 3.33Å; D486-E488 PolarHBondContact O-N 2.94Å
489	K	45.8	Very low	47.2	Very low	149 Å²	149	99.6 Å²	99.6	65%	0.648	54%	0.541	S	S	*	.	H	α-helix	trans	-81.6	-21.9	-177.3	-67.7	175.2	-172.6	154.1	0	113.9	D486 N487	D486-K489 PolarHBondContact O-N 3.23Å; D486-K489 IonicContact OD1-NZ 2.66Å; D486-K489 PolarHBondContact OD1-NZ 3.24Å; N487-K489 VanDerWaalsContact C-N 3.28Å; N487-K489 PolarHBondContact O-N 3.47Å
490	S	42.3	Very low	45.6	Very low	61 Å²	61	108.6 Å²	108.6	43%	0.427	58%	0.58	S	S	.	*	H	α-helix	trans	-86.4	-32.3	177.3	41.4	0	0	0	0	112.9	N487 S493	N487-S490 PolarHBondContact O-OG 3.5Å; N487-S490 VanDerWaalsContact O-OG 3.08Å; S490-S493 PolarHBondContact O-OG 3.47Å; S490-S493 VanDerWaalsContact O-OG 3.14Å
491	G	35.2	Very low	43.5	Very low	39 Å²	39	113 Å²	113	40%	0.402	60%	0.599	S	S	.	*	H	α-helix	trans	-69.6	-43.2	176.8	0	0	0	0	0	113.3	S493 K494	G491-S493 PolarHBondContact O-N 3.19Å; G491-K494 PolarHBondContact O-N 2.87Å
492	L	34.2	Very low	42.1	Very low	132 Å²	132	112.7 Å²	112.7	69%	0.691	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-2.8	-175.6	-76.8	170	0	0	0	115.4
493	S	32.9	Very low	40.5	Very low	73 Å²	73	116.8 Å²	116.8	51%	0.51	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.9	11.8	177.6	57.5	0	0	0	0	114.4	S490 G491	S490-S493 PolarHBondContact O-OG 3.47Å; S490-S493 VanDerWaalsContact O-OG 3.14Å; G491-S493 PolarHBondContact O-N 3.19Å
494	K	35.8	Very low	39	Very low	153 Å²	153	122.5 Å²	122.5	67%	0.665	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	-43.6	167.5	-78.8	-174.9	173.5	177.6	0	112.6	G491 K496	G491-K494 PolarHBondContact O-N 2.87Å; K494-K496 PolarHBondContact O-N 2.93Å
495	D	33.8	Very low	37.1	Very low	149 Å²	149	125 Å²	125	80%	0.797	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	24.1	-177.8	-62.4	-24.7	0	0	0	115.7
496	K	31	Very low	36.1	Very low	156 Å²	156	128.7 Å²	128.7	68%	0.678	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.1	-18	-177.2	-85.5	-170.1	175.4	171.7	0	117.9	K494	K494-K496 PolarHBondContact O-N 2.93Å
497	D	27.2	Very low	34.8	Very low	127 Å²	127	130.4 Å²	130.4	68%	0.679	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-90.5	-22.3	-175.7	-71.1	-16.9	0	0	0	113	A499 K500	D497-A499 PolarHBondContact O-N 2.98Å; D497-K500 PolarHBondContact O-N 3.46Å
498	D	32.2	Very low	34	Very low	171 Å²	171	135.2 Å²	135.2	91%	0.914	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-64.2	3.9	170.5	-70.9	-34.9	0	0	0	114.4
499	A	34.4	Very low	33.4	Very low	83 Å²	83	134.2 Å²	134.2	69%	0.686	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-119.9	10.2	-178.5	0	0	0	0	0	114.1	D497	D497-A499 PolarHBondContact O-N 2.98Å
500	K	35	Very low	32.7	Very low	196 Å²	196	130.8 Å²	130.8	85%	0.852	73%	0.728	S	S	*	*	S	Bend	trans	-170.4	85.2	168.9	-118.5	170.3	-171.5	174.6	0	116.3	D497	D497-K500 PolarHBondContact O-N 3.46Å
501	D	26.8	Very low	32.4	Very low	171 Å²	171	133.8 Å²	133.8	91%	0.914	74%	0.743	S	S	*	*				-151.2	160.4	122.4	-142.1	-24.7	0	0	0	111.5
502	G	35.3	Very low	32.5	Very low	55 Å²	55	139.9 Å²	139.9	57%	0.567	76%	0.761	S	S	*	*			trans	179.7	95	179.6	0	0	0	0	0	114.5
503	R	31.7	Very low	32.5	Very low	231 Å²	231	140.6 Å²	140.6	87%	0.872	76%	0.761	S	S	*	*			trans	-171.1	152.2	142.6	-106	153.7	-159.2	-159.4	2.6	114.3
504	E	29.7	Very low	32.8	Very low	190 Å²	190	142.6 Å²	142.6	89%	0.888	77%	0.765	S	S	*	*			trans	67.1	68.7	155.9	-68	173.6	-139.6	0	0	117.7
505	G	27	Very low	33.1	Very low	77 Å²	77	141 Å²	141	79%	0.794	76%	0.76	S	S	*	*			trans	-137.6	141.7	151.4	0	0	0	0	0	109.3
506	K	36	Very low	33.3	Very low	202 Å²	202	139.6 Å²	139.6	88%	0.878	75%	0.752	S	S	*	*			trans	-82.6	128.3	167.6	-71.8	179.3	177.9	-179	0	108
507	D	26.5	Very low	33.7	Very low	160 Å²	160	138 Å²	138	86%	0.856	75%	0.747	S	S	*	*				-160.3	120.4	124.5	-92	-36.7	0	0	0	109.8
508	V	33.4	Very low	34.2	Very low	145 Å²	145	137.9 Å²	137.9	88%	0.879	75%	0.746	S	S	*	*			trans	-142.9	83.4	-179.3	-176.7	0	0	0	0	106.6
509	S	34.4	Very low	34.5	Very low	98 Å²	98	138.1 Å²	138.1	69%	0.685	74%	0.741	S	S	*	*	S	Bend	trans	-164.4	-28.9	176.2	-160.6	0	0	0	0	115
510	A	31.9	Very low	34.6	Very low	78 Å²	78	137.3 Å²	137.3	65%	0.645	74%	0.735	S	S	*	*	S	Bend	trans	-85.3	-16.7	-165.5	0	0	0	0	0	115.7
511	T	37	Very low	34.7	Very low	123 Å²	123	134.4 Å²	134.4	76%	0.755	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-20.1	-166.6	-11	0	0	0	0	115.1
512	E	36.9	Very low	35.3	Very low	167 Å²	167	133 Å²	133	78%	0.78	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-26.7	176.4	-66.2	-175.3	137.4	0	0	111.9	E515	E512-E515 PolarHBondContact O-N 3.43Å
513	E	34.1	Very low	35.5	Very low	148 Å²	148	138 Å²	138	69%	0.692	73%	0.732	S	S	*	*	H	α-helix	trans	-69	-36.3	-177	-154.7	154.7	-140.3	0	0	111.7	E515 L516 E517	E513-E515 PolarHBondContact O-N 3.45Å; E513-L516 PolarHBondContact O-N 2.96Å; E513-E517 PolarHBondContact O-N 3.5Å
514	L	37.9	Very low	35.4	Very low	114 Å²	114	131.2 Å²	131.2	60%	0.597	73%	0.726	S	S	*	*	H	α-helix	trans	-72.1	-20.5	175.1	-118.6	79.3	0	0	0	114.6
515	E	43.2	Very low	35.9	Very low	119 Å²	119	129.6 Å²	129.6	56%	0.556	72%	0.723	S	S	*	*	H	α-helix	trans	-82.6	-20.1	176.4	-111.7	176.6	-165.4	0	0	112.5	K389 E512 E513	K389-E515 IonicContact NZ-OE1 2.57Å; K389-E515 PolarHBondContact NZ-OE1 3.05Å; E512-E515 PolarHBondContact O-N 3.43Å; E513-E515 PolarHBondContact O-N 3.45Å
516	L	38.3	Very low	36.1	Very low	120 Å²	120	133.8 Å²	133.8	63%	0.628	72%	0.722	S	S	*	*	H	α-helix	trans	-76.7	-35.9	166.6	-79	162.8	0	0	0	112.6	E513 L518 E519 A520	E513-L516 PolarHBondContact O-N 2.96Å; L516-L518 PolarHBondContact O-N 3.17Å; L516-E519 PolarHBondContact O-N 3.4Å; L516-E519 VanDerWaalsContact O-N 3.08Å; L516-A520 PolarHBondContact O-N 3.07Å
517	E	38.3	Very low	36.1	Very low	124 Å²	124	129.2 Å²	129.2	58%	0.579	71%	0.713	S	S	*	*	H	α-helix	trans	-61.1	-29.7	-179.9	-164.9	178.9	-131.8	0	0	112.6	E513 A520	E513-E517 PolarHBondContact O-N 3.5Å; E517-A520 PolarHBondContact O-N 3.29Å
518	L	39	Very low	36.5	Very low	124 Å²	124	127.6 Å²	127.6	65%	0.649	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-21.9	176.1	-90	154.1	0	0	0	114.6	L516 L521	L516-L518 PolarHBondContact O-N 3.17Å; L518-L521 HydrophobicContact CD2-CD1 4.07Å
519	E	38	Very low	36.4	Very low	175 Å²	175	129.7 Å²	129.7	82%	0.818	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-14.3	169.3	-65	-163	147	0	0	112.3	L516	L516-E519 PolarHBondContact O-N 3.4Å; L516-E519 VanDerWaalsContact O-N 3.08Å
520	A	36	Very low	36.5	Very low	66 Å²	66	130.5 Å²	130.5	55%	0.545	70%	0.7	S	S	.	*			trans	-91.9	11.2	-178.4	0	0	0	0	0	114.7	L516 E517 D522	L516-A520 PolarHBondContact O-N 3.07Å; E517-A520 PolarHBondContact O-N 3.29Å; A520-D522 PolarHBondContact O-N 3.36Å
521	L	37.2	Very low	36.6	Very low	136 Å²	136	135.9 Å²	135.9	71%	0.712	71%	0.712	S	S	*	*			trans	-75	35.2	-176.8	-76.9	171.9	0	0	0	115.1	L518	L518-L521 HydrophobicContact CD2-CD1 4.07Å
522	D	38.6	Very low	36.3	Very low	141 Å²	141	132.5 Å²	132.5	75%	0.754	70%	0.701	S	S	*	*	S	Bend	trans	-130.4	110.1	165.5	-151.9	4.1	0	0	0	109.4	A520	A520-D522 PolarHBondContact O-N 3.36Å
523	I	39.4	Very low	36.3	Very low	159 Å²	159	127.3 Å²	127.3	82%	0.815	69%	0.692	S	S	*	*	S	Bend	trans	74.7	69.1	174.8	-37.4	174.4	0	0	0	117.6
524	A	30.8	Very low	36.6	Very low	89 Å²	89	126.3 Å²	126.3	74%	0.736	69%	0.692	S	S	*	*			trans	-166.1	144.7	140.4	0	0	0	0	0	112.6
525	D	39.2	Very low	37	Very low	156 Å²	156	123.2 Å²	123.2	83%	0.834	68%	0.675	S	S	*	*			trans	-102	102.3	160	-94.4	-46	0	0	0	107.6
526	E	31.7	Very low	37.3	Very low	166 Å²	166	122.1 Å²	122.1	78%	0.776	68%	0.676	S	S	*	*			trans	-99.7	139.8	167.9	-87	-74.7	145.1	0	0	110
527	P	35.3	Very low	37.8	Very low	105 Å²	105	123.9 Å²	123.9	68%	0.682	68%	0.681	S	S	*	*			trans	-82	120.3	-178	31.9	-32.6	0	0	0	112	E529	P527-E529 PolarHBondContact O-N 3.34Å; P527-E529 VanDerWaalsContact O-N 3.1Å
528	L	35.2	Very low	38.3	Very low	127 Å²	127	120.9 Å²	120.9	67%	0.665	67%	0.669	S	S	*	*			trans	-57.2	112.6	172.2	-73.6	164.8	0	0	0	111.7
529	E	32.5	Very low	38.9	Very low	189 Å²	189	119.1 Å²	119.1	88%	0.883	66%	0.657	S	S	*	*			trans	-70.2	144.3	163.9	-63.4	-157.5	141.8	0	0	110.3	P527	P527-E529 PolarHBondContact O-N 3.34Å; P527-E529 VanDerWaalsContact O-N 3.1Å
530	L	36.5	Very low	39.7	Very low	115 Å²	115	115.7 Å²	115.7	60%	0.602	64%	0.641	S	S	*	*			trans	-101.3	116.4	-179.1	-71.1	168.2	0	0	0	109.9	G532	L530-G532 PolarHBondContact O-N 2.9Å
531	E	33	Very low	40.5	Very low	191 Å²	191	116 Å²	116	89%	0.893	63%	0.633	S	S	*	*			trans	-70.7	108.2	174	-68.4	-165.6	118.2	0	0	111.2	G533	E531-G533 PolarHBondContact O-N 2.82Å
532	G	31.4	Very low	41.3	Very low	51 Å²	51	110.8 Å²	110.8	53%	0.526	61%	0.61	S	S	.	*			trans	-75.1	31.5	-171.6	0	0	0	0	0	116.9	L530	L530-G532 PolarHBondContact O-N 2.9Å
533	G	36	Very low	42.3	Very low	58 Å²	58	110.4 Å²	110.4	60%	0.598	60%	0.601	S	S	*	*	S	Bend	trans	-76.2	-76.5	-179.5	0	0	0	0	0	112.9	E531 E535	E531-G533 PolarHBondContact O-N 2.82Å; G533-E535 PolarHBondContact O-N 3.23Å
534	D	41.9	Very low	43.2	Very low	128 Å²	128	108 Å²	108	68%	0.684	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	0.9	-176.7	-73.7	-4.1	0	0	0	114.8	N538	D534-N538 PolarHBondContact O-ND2 3.28Å; D534-N538 VanDerWaalsContact O-ND2 3.09Å
535	E	45.9	Very low	44.3	Very low	49 Å²	49	104.5 Å²	104.5	23%	0.229	55%	0.554	C	S	.	*	H	α-helix	trans	-72.7	-38.9	-173.8	-65.3	-152.1	116.5	0	0	112.9	G533 R651	G533-E535 PolarHBondContact O-N 3.23Å; E535-R651 IonicContact OE1-CZ 3.84Å; E535-R651 IonicContact OE1-NH2 3.55Å; E535-R651 PolarHBondContact OE1-NH2 3.28Å; E535-R651 IonicContact OE2-NH2 2.75Å; E535-R651 PolarHBondContact OE2-NH2 3.36Å; E535-R651 VanDerWaalsContact OE2-NH2 3.11Å
536	V	48.6	Very low	45.1	Very low	96 Å²	96	101.1 Å²	101.1	58%	0.582	54%	0.535	S	S	*	.	H	α-helix	trans	-74.6	-43.9	-170.6	-174.1	0	0	0	0	112	N538 E539 E540	V536-N538 PolarHBondContact O-N 3.36Å; V536-E539 PolarHBondContact O-N 3.17Å; V536-E540 VanDerWaalsContact O-CB 3.31Å; V536-E540 WeakPolarHBondContact O-CB 3.39Å; V536-E540 PolarHBondContact O-N 3.02Å
537	E	50.3	Low	46.1	Very low	157 Å²	157	98.6 Å²	98.6	73%	0.734	53%	0.527	S	S	*	.	H	α-helix	trans	-66.5	-40.4	-173.3	-62.2	-157.7	149.5	0	0	112.8	L541	E537-L541 WeakPolarHBondContact O-CB 3.46Å; E537-L541 PolarHBondContact O-N 3.17Å
538	N	47.9	Very low	46.8	Very low	61 Å²	61	96.3 Å²	96.3	33%	0.326	51%	0.507	S	S	.	.	H	α-helix	trans	-69.7	-39.6	179.3	-73.9	-73.9	0	0	0	112.4	D534 V536 L541 A542	D534-N538 PolarHBondContact O-ND2 3.28Å; D534-N538 VanDerWaalsContact O-ND2 3.09Å; V536-N538 PolarHBondContact O-N 3.36Å; N538-L541 PolarHBondContact O-N 3.29Å; N538-A542 WeakPolarHBondContact O-CB 3.38Å; N538-A542 PolarHBondContact O-N 3.17Å
539	E	51.1	Low	47.2	Very low	87 Å²	87	97.2 Å²	97.2	41%	0.407	51%	0.508	S	S	.	.	H	α-helix	trans	-73.9	-30.6	179.3	-159.9	163.6	-150.9	0	0	111.6	V536 K543 R651	V536-E539 PolarHBondContact O-N 3.17Å; E539-K543 PolarHBondContact O-N 2.56Å; E539-R651 IonicContact OE1-NH1 2.84Å; E539-R651 PolarHBondContact OE1-NH1 3.26Å; E539-R651 IonicContact OE2-CZ 2.71Å; E539-R651 IonicContact OE2-NH1 2.6Å; E539-R651 PolarHBondContact OE2-NH1 3.14Å; E539-R651 IonicContact OE2-NH2 3.85Å
540	E	54.3	Low	47.8	Very low	102 Å²	102	97.1 Å²	97.1	48%	0.477	51%	0.508	S	S	.	.	H	α-helix	trans	-76.4	-35.2	171.4	-161.4	-176.2	-115.4	0	0	112.8	V536 K543 K544	V536-E540 VanDerWaalsContact O-CB 3.31Å; V536-E540 WeakPolarHBondContact O-CB 3.39Å; V536-E540 PolarHBondContact O-N 3.02Å; E540-K543 PolarHBondContact O-N 2.89Å; E540-K544 HydrophobicContact CG-CD 4.47Å; E540-K544 WeakPolarHBondContact O-CG 3.44Å; E540-K544 PolarHBondContact O-N 2.78Å; E540-K544 WeakPolarHBondContact OE2-CE 3.45Å; E540-K544 IonicContact OE2-NZ 2.93Å; E540-K544 PolarHBondContact OE2-NZ 3.02Å
541	L	53.3	Low	48.1	Very low	74 Å²	74	100 Å²	100	39%	0.387	52%	0.518	S	S	.	.	H	α-helix	trans	-64.6	-45.2	174.6	179.8	63.4	0	0	0	111.5	E537 N538 K543 K544 L545	E537-L541 WeakPolarHBondContact O-CB 3.46Å; E537-L541 PolarHBondContact O-N 3.17Å; N538-L541 PolarHBondContact O-N 3.29Å; L541-K543 VanDerWaalsContact C-N 3.27Å; L541-K543 PolarHBondContact O-N 3.48Å; L541-K544 PolarHBondContact O-N 2.98Å; L541-L545 HydrophobicContact CD1-CD1 4.38Å; L541-L545 HydrophobicContact CD1-CG 4.44Å; L541-L545 HydrophobicContact CG-CD1 4.22Å; L541-L545 WeakPolarHBondContact O-CB 3.24Å; L541-L545 WeakPolarHBondContact O-CG 3.34Å; L541-L545 PolarHBondContact O-N 2.86Å
542	A	55.4	Low	48.5	Very low	26 Å²	26	95.2 Å²	95.2	22%	0.215	50%	0.496	C	S	.	.	H	α-helix	trans	-59.4	-37.8	175.1	0	0	0	0	0	112	N538 L546	N538-A542 WeakPolarHBondContact O-CB 3.38Å; N538-A542 PolarHBondContact O-N 3.17Å; A542-L546 WeakPolarHBondContact O-CG 3.31Å; A542-L546 PolarHBondContact O-N 2.94Å
543	K	59	Low	49.1	Very low	133 Å²	133	98.6 Å²	98.6	58%	0.578	50%	0.502	S	S	*	.	H	α-helix	trans	-66.3	-50.4	171.9	-97.4	178.8	173.6	172.6	0	113.1	E539 E540 L541 L545 L546 D547	E539-K543 PolarHBondContact O-N 2.56Å; E540-K543 PolarHBondContact O-N 2.89Å; L541-K543 VanDerWaalsContact C-N 3.27Å; L541-K543 PolarHBondContact O-N 3.48Å; K543-L545 PolarHBondContact O-N 3.47Å; K543-L546 CarbonylContact O-C 3.59Å; K543-L546 WeakPolarHBondContact O-CA 3.47Å; K543-L546 PolarHBondContact O-N 3.49Å; K543-D547 PolarHBondContact O-N 3.49Å
544	K	57.4	Low	49.6	Very low	108 Å²	108	105 Å²	105	47%	0.47	52%	0.516	S	S	.	.	H	α-helix	trans	-55.4	-39.3	177.2	-75.1	166.7	-178.1	161.4	0	112	E540 L541 L546 E548	E540-K544 HydrophobicContact CG-CD 4.47Å; E540-K544 WeakPolarHBondContact O-CG 3.44Å; E540-K544 PolarHBondContact O-N 2.78Å; E540-K544 WeakPolarHBondContact OE2-CE 3.45Å; E540-K544 IonicContact OE2-NZ 2.93Å; E540-K544 PolarHBondContact OE2-NZ 3.02Å; L541-K544 PolarHBondContact O-N 2.98Å; K544-L546 PolarHBondContact O-N 2.97Å; K544-E548 WeakPolarHBondContact O-CB 3.5Å; K544-E548 WeakPolarHBondContact O-CG 3.33Å; K544-E548 PolarHBondContact O-N 3.1Å; K544-E548 VanDerWaalsContact O-N 3.15Å
545	L	55	Low	49.9	Very low	16 Å²	16	108.2 Å²	108.2	8%	0.084	53%	0.527	C	S	.	.	H	α-helix	trans	-69.2	-12.1	176	-73.8	172.6	0	0	0	114.4	L541 K543 R604	L541-L545 HydrophobicContact CD1-CD1 4.38Å; L541-L545 HydrophobicContact CD1-CG 4.44Å; L541-L545 HydrophobicContact CG-CD1 4.22Å; L541-L545 WeakPolarHBondContact O-CB 3.24Å; L541-L545 WeakPolarHBondContact O-CG 3.34Å; L541-L545 PolarHBondContact O-N 2.86Å; K543-L545 PolarHBondContact O-N 3.47Å; L545-R604 PolarHBondContact O-NE 2.99Å; L545-R604 PolarHBondContact O-NH2 3.3Å
546	L	55.1	Low	49.7	Very low	84 Å²	84	109.7 Å²	109.7	44%	0.44	55%	0.547	S	S	.	.	H	α-helix	trans	-100.5	-47.3	171.5	-67	166.6	0	0	0	111.3	A542 K543 K544 E548 Q549	A542-L546 WeakPolarHBondContact O-CG 3.31Å; A542-L546 PolarHBondContact O-N 2.94Å; K543-L546 CarbonylContact O-C 3.59Å; K543-L546 WeakPolarHBondContact O-CA 3.47Å; K543-L546 PolarHBondContact O-N 3.49Å; K544-L546 PolarHBondContact O-N 2.97Å; L546-E548 VanDerWaalsContact C-N 3.28Å; L546-E548 PolarHBondContact O-N 3.46Å; L546-Q549 WeakPolarHBondContact O-CB 3.32Å; L546-Q549 PolarHBondContact O-N 3.45Å
547	D	53.5	Low	49.6	Very low	114 Å²	114	111.2 Å²	111.2	61%	0.61	56%	0.562	S	S	*	*	H	α-helix	trans	-67.5	-22.1	-175.7	-64.2	-24.8	0	0	0	113.5	K543 Q549 E550	K543-D547 PolarHBondContact O-N 3.49Å; D547-Q549 PolarHBondContact O-N 3.02Å; D547-E550 PolarHBondContact O-N 2.86Å
548	E	50.3	Low	49.4	Very low	56 Å²	56	110.5 Å²	110.5	26%	0.262	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-54.3	-15.2	170.2	-93.2	-178.1	175.6	0	0	113.9	K544 L546 E550 R600 R604	K544-E548 WeakPolarHBondContact O-CB 3.5Å; K544-E548 WeakPolarHBondContact O-CG 3.33Å; K544-E548 PolarHBondContact O-N 3.1Å; K544-E548 VanDerWaalsContact O-N 3.15Å; L546-E548 VanDerWaalsContact C-N 3.28Å; L546-E548 PolarHBondContact O-N 3.46Å; E548-E550 VanDerWaalsContact C-N 3.3Å; E548-E550 PolarHBondContact O-N 2.85Å; E548-R600 IonicContact OE1-CZ 2.72Å; E548-R600 IonicContact OE1-NH1 3.06Å; E548-R600 PolarHBondContact OE1-NH1 3.25Å; E548-R600 IonicContact OE1-NH2 3.46Å; E548-R600 PolarHBondContact OE1-NH2 3.06Å; E548-R600 IonicContact OE2-CZ 3.22Å; E548-R600 IonicContact OE2-NH1 3.89Å; E548-R600 PolarHBondContact OE2-NH1 2.83Å; E548-R600 IonicContact OE2-NH2 3.93Å; E548-R604 IonicContact OE2-NH2 3.62Å; E548-R604 PolarHBondContact OE2-NH2 2.94Å
549	Q	42.3	Very low	49.7	Very low	147 Å²	147	109.5 Å²	109.5	69%	0.687	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-66.1	-23.7	-178.9	-172	167.6	-2.5	0	0	114.3	L546 D547	L546-Q549 WeakPolarHBondContact O-CB 3.32Å; L546-Q549 PolarHBondContact O-N 3.45Å; D547-Q549 PolarHBondContact O-N 3.02Å
550	E	45.1	Very low	50.3	Low	187 Å²	187	110.2 Å²	110.2	87%	0.874	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-86.9	-7.2	-178.4	-66.4	-161	150.7	0	0	115	D547 E548	D547-E550 PolarHBondContact O-N 2.86Å; E548-E550 VanDerWaalsContact C-N 3.3Å; E548-E550 PolarHBondContact O-N 2.85Å
551	Q	43.7	Very low	51.1	Low	176 Å²	176	112.1 Å²	112.1	82%	0.822	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	-23.5	-174.8	-69.8	-171.1	-8.2	0	0	116.1	D553	Q551-D553 VanDerWaalsContact C-N 3.32Å; Q551-D553 PolarHBondContact O-N 3.27Å
552	E	40.9	Very low	52	Low	89 Å²	89	111.7 Å²	111.7	42%	0.416	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.3	-11.7	-178.5	-76.2	-161.4	146.6	0	0	114.9
553	D	44.2	Very low	53.1	Low	123 Å²	123	114.5 Å²	114.5	66%	0.658	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-6.3	-170.7	-111.5	-9.6	0	0	0	115.7	Q551 K563	Q551-D553 VanDerWaalsContact C-N 3.32Å; Q551-D553 PolarHBondContact O-N 3.27Å; D553-K563 IonicContact OD1-NZ 2.84Å; D553-K563 PolarHBondContact OD1-NZ 3.45Å
554	E	45.8	Very low	54.1	Low	193 Å²	193	113.9 Å²	113.9	90%	0.902	60%	0.604	S	S	*	*	S	Bend	trans	-97.7	-27.1	176.1	-68.4	-148.1	131.7	0	0	115.5
555	E	49	Very low	55.4	Low	195 Å²	195	112 Å²	112	91%	0.911	60%	0.598	S	S	*	*	S	Bend	trans	-117	63.6	-172.8	-68.4	-150.2	134	0	0	115.4
556	A	41.7	Very low	56.8	Low	79 Å²	79	111.2 Å²	111.2	65%	0.653	59%	0.594	S	S	*	*			trans	-142.2	59.2	172.4	0	0	0	0	0	114.3	T558	A556-T558 PolarHBondContact O-N 3.01Å
557	S	45.5	Very low	58.3	Low	128 Å²	128	109.7 Å²	109.7	90%	0.895	59%	0.586	S	S	*	*			trans	-71.4	10.8	-173.1	-152.9	0	0	0	0	116.4
558	T	46.1	Very low	59.9	Low	143 Å²	143	106.8 Å²	106.8	88%	0.877	58%	0.578	S	S	*	*	S	Bend	trans	-139.5	68.1	-176.3	50.6	0	0	0	0	112.7	A556	A556-T558 PolarHBondContact O-N 3.01Å
559	G	54.8	Low	61.9	Low	40 Å²	40	104.7 Å²	104.7	41%	0.412	57%	0.568	S	S	.	*			trans	174.3	19.8	174.3	0	0	0	0	0	119.2	H561 L562 K563	G559-H561 VanDerWaalsContact C-N 3.28Å; G559-H561 PolarHBondContact O-N 3.43Å; G559-H561 VanDerWaalsContact O-N 3.1Å; G559-L562 PolarHBondContact O-N 2.87Å; G559-K563 PolarHBondContact O-N 3.31Å; G559-K563 VanDerWaalsContact O-N 3.16Å
560	S	63.8	Low	64.2	Low	102 Å²	102	100 Å²	100	71%	0.713	55%	0.547	S	S	*	.	H	α-helix	trans	-52.5	-38.4	-170.3	55.6	0	0	0	0	115.1	L564	S560-L564 WeakPolarHBondContact O-CG 3.38Å; S560-L564 PolarHBondContact O-N 3.24Å
561	H	70.8	Confident	66.3	Low	141 Å²	141	98.2 Å²	98.2	65%	0.653	54%	0.539	S	S	*	.	H	α-helix	trans	-67	-35.6	177.3	-167.9	-90.3	0	0	0	113.1	G559 I565	G559-H561 VanDerWaalsContact C-N 3.28Å; G559-H561 PolarHBondContact O-N 3.43Å; G559-H561 VanDerWaalsContact O-N 3.1Å; H561-I565 WeakPolarHBondContact ND1-CD1 3.48Å; H561-I565 WeakPolarHBondContact O-CG1 3.28Å; H561-I565 PolarHBondContact O-N 3.41Å; H561-I565 VanDerWaalsContact O-N 3.15Å
562	L	73.1	Confident	68.5	Low	66 Å²	66	95.7 Å²	95.7	35%	0.346	53%	0.527	S	S	.	.	H	α-helix	trans	-77	-35.2	179.8	-173.7	61.2	0	0	0	111.8	G559 L564 I565 V566	G559-L562 PolarHBondContact O-N 2.87Å; L562-L564 VanDerWaalsContact C-N 3.34Å; L562-L564 PolarHBondContact O-N 3.27Å; L562-I565 PolarHBondContact O-N 3.27Å; L562-V566 WeakPolarHBondContact O-CG2 3.2Å; L562-V566 PolarHBondContact O-N 3.4Å
563	K	77.1	Confident	70.8	Confident	85 Å²	85	91.6 Å²	91.6	37%	0.37	51%	0.508	S	S	.	.	H	α-helix	trans	-56.5	-49.8	170.7	-172.8	170.1	-179.3	177.4	0	110	D553 G559 I565 V566 D567	D553-K563 IonicContact OD1-NZ 2.84Å; D553-K563 PolarHBondContact OD1-NZ 3.45Å; G559-K563 PolarHBondContact O-N 3.31Å; G559-K563 VanDerWaalsContact O-N 3.16Å; K563-I565 PolarHBondContact O-N 3.23Å; K563-V566 PolarHBondContact O-N 3.21Å; K563-D567 WeakPolarHBondContact CG-OD2 3.38Å; K563-D567 WeakPolarHBondContact O-CB 2.94Å; K563-D567 PolarHBondContact O-N 3.45Å
564	L	81.4	Confident	73	Confident	119 Å²	119	87.7 Å²	87.7	62%	0.623	49%	0.49	S	S	*	.	H	α-helix	trans	-59.8	-37.7	176.4	-72.2	167.9	0	0	0	114.3	S560 L562 A568	S560-L564 WeakPolarHBondContact O-CG 3.38Å; S560-L564 PolarHBondContact O-N 3.24Å; L562-L564 VanDerWaalsContact C-N 3.34Å; L562-L564 PolarHBondContact O-N 3.27Å; L564-A568 VanDerWaalsContact O-CB 3.25Å; L564-A568 WeakPolarHBondContact O-CB 3.3Å; L564-A568 PolarHBondContact O-N 3.06Å
565	I	83.3	Confident	75.1	Confident	68 Å²	68	83.6 Å²	83.6	35%	0.349	47%	0.474	S	S	.	.	H	α-helix	trans	-64.8	-46.8	175.7	-71.1	164.7	0	0	0	110.9	H561 L562 K563 A568 F569 M593	H561-I565 WeakPolarHBondContact ND1-CD1 3.48Å; H561-I565 WeakPolarHBondContact O-CG1 3.28Å; H561-I565 PolarHBondContact O-N 3.41Å; H561-I565 VanDerWaalsContact O-N 3.15Å; L562-I565 PolarHBondContact O-N 3.27Å; K563-I565 PolarHBondContact O-N 3.23Å; I565-A568 PolarHBondContact O-N 3.27Å; I565-F569 WeakPolarHBondContact O-CB 3.42Å; I565-F569 PolarHBondContact O-N 3.22Å; I565-M593 HydrophobicContact CG2-CE 4.41Å; I565-M593 HydrophobicContact CG2-CG 3.98Å; I565-M593 HydrophobicContact CG2-SD 3.76Å
566	V	85.6	Confident	77.1	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.006	43%	0.433	C	S	.	.	H	α-helix	trans	-68.1	-41	-178.2	174.8	0	0	0	0	111.2	L562 K563 A568 F569 I570 M593 N598 K601	L562-V566 WeakPolarHBondContact O-CG2 3.2Å; L562-V566 PolarHBondContact O-N 3.4Å; K563-V566 PolarHBondContact O-N 3.21Å; V566-A568 VanDerWaalsContact C-N 3.31Å; V566-A568 PolarHBondContact O-N 3.4Å; V566-F569 PolarHBondContact O-N 3.42Å; V566-I570 HydrophobicContact CG1-CD1 4.09Å; V566-I570 WeakPolarHBondContact O-CG1 3.39Å; V566-I570 PolarHBondContact O-N 3.07Å; V566-M593 HydrophobicContact CG2-CB 4.13Å; V566-M593 HydrophobicContact CG2-CG 3.9Å; V566-M593 HydrophobicContact CG2-SD 4.02Å; V566-N598 HydrophobicContact CG1-CB 4.42Å; V566-N598 HydrophobicContact CG2-CB 4.33Å; V566-K601 HydrophobicContact CG1-CD 4.48Å
567	D	85.8	Confident	79.3	Confident	52 Å²	52	74.2 Å²	74.2	28%	0.278	42%	0.422	S	S	.	.	H	α-helix	trans	-65.4	-36.3	176.8	-60.4	-19.5	0	0	0	110.9	K563 Q571	K563-D567 WeakPolarHBondContact CG-OD2 3.38Å; K563-D567 WeakPolarHBondContact O-CB 2.94Å; K563-D567 PolarHBondContact O-N 3.45Å; D567-Q571 VanDerWaalsContact O-CG 3.29Å; D567-Q571 WeakPolarHBondContact O-CG 3.28Å; D567-Q571 PolarHBondContact O-N 3.42Å; D567-Q571 VanDerWaalsContact O-N 3.1Å
568	A	88	Confident	81.4	Confident	52 Å²	52	71.6 Å²	71.6	43%	0.43	40%	0.398	S	S	.	.	H	α-helix	trans	-69.6	-38.7	172.9	0	0	0	0	0	113	L564 I565 V566 Q571 Q572	L564-A568 VanDerWaalsContact O-CB 3.25Å; L564-A568 WeakPolarHBondContact O-CB 3.3Å; L564-A568 PolarHBondContact O-N 3.06Å; I565-A568 PolarHBondContact O-N 3.27Å; V566-A568 VanDerWaalsContact C-N 3.31Å; V566-A568 PolarHBondContact O-N 3.4Å; A568-Q571 PolarHBondContact O-N 2.88Å; A568-Q572 WeakPolarHBondContact O-CB 3.47Å; A568-Q572 PolarHBondContact O-N 3.32Å
569	F	91.4	Very high	83.4	Confident	13 Å²	13	69.6 Å²	69.6	6%	0.057	37%	0.374	C	S	.	.	H	α-helix	trans	-61.1	-44.6	173.9	175.3	-94	0	0	0	111.6	I565 V566 Q571 Q572 L573 A585 F589 M593 L602	I565-F569 WeakPolarHBondContact O-CB 3.42Å; I565-F569 PolarHBondContact O-N 3.22Å; V566-F569 PolarHBondContact O-N 3.42Å; F569-Q571 VanDerWaalsContact C-N 3.33Å; F569-Q571 PolarHBondContact O-N 2.87Å; F569-Q572 PolarHBondContact O-N 3.37Å; F569-Q572 VanDerWaalsContact O-N 3.09Å; F569-L573 HydrophobicContact CD1-CD1 4.36Å; F569-L573 HydrophobicContact CE1-CD1 3.66Å; F569-L573 HydrophobicContact CZ-CD1 3.76Å; F569-L573 PolarHBondContact O-N 2.72Å; F569-A585 HydrophobicContact CE2-CB 3.75Å; F569-A585 WeakPolarHBondContact CE2-O 3.27Å; F569-A585 HydrophobicContact CZ-CB 3.96Å; F569-A585 WeakPolarHBondContact CZ-O 3.32Å; F569-F589 AromaticContact CD1-CD2 3.99Å; F569-F589 HydrophobicContact CD1-CD2 3.99Å; F569-F589 HydrophobicContact CE1-CB 4.22Å; F569-F589 AromaticContact CE1-CD2 3.61Å; F569-F589 HydrophobicContact CE1-CD2 3.61Å; F569-F589 HydrophobicContact CE1-CE2 4.39Å; F569-F589 HydrophobicContact CE1-CG 4.22Å; F569-F589 HydrophobicContact CE2-CB 4.14Å; F569-F589 HydrophobicContact CZ-CB 3.73Å; F569-F589 HydrophobicContact CZ-CD2 4.02Å; F569-F589 HydrophobicContact CZ-CG 4.22Å; F569-M593 HydrophobicContact CB-CE 3.95Å; F569-M593 HydrophobicContact CB-SD 3.64Å; F569-M593 HydrophobicContact CD1-SD 4.36Å; F569-M593 HydrophobicContact CD2-CE 3.4Å; F569-M593 HydrophobicContact CD2-SD 4.13Å; F569-M593 HydrophobicContact CE2-CE 3.98Å; F569-M593 HydrophobicContact CG-CE 3.73Å; F569-M593 HydrophobicContact CG-SD 3.8Å; F569-L602 HydrophobicContact CE1-CD1 4.21Å
570	I	90.4	Very high	85.1	Confident	47 Å²	47	72.4 Å²	72.4	24%	0.241	38%	0.38	C	S	.	.	H	α-helix	trans	-63	-38.6	175.6	-70.1	167.7	0	0	0	111.2	V566 Q572 L573 P574 K601 A605	V566-I570 HydrophobicContact CG1-CD1 4.09Å; V566-I570 WeakPolarHBondContact O-CG1 3.39Å; V566-I570 PolarHBondContact O-N 3.07Å; I570-Q572 VanDerWaalsContact C-N 3.3Å; I570-Q572 PolarHBondContact O-N 3.21Å; I570-L573 WeakPolarHBondContact O-CB 3.19Å; I570-L573 PolarHBondContact O-N 2.97Å; I570-P574 WeakPolarHBondContact O-CD 3.5Å; I570-K601 HydrophobicContact CD1-CB 4.25Å; I570-A605 HydrophobicContact CD1-CB 4.3Å; I570-A605 HydrophobicContact CG1-CB 4.24Å; I570-A605 HydrophobicContact CG2-CB 3.81Å
571	Q	89.1	Confident	86.4	Confident	151 Å²	151	71 Å²	71	71%	0.706	36%	0.363	S	S	*	.	H	α-helix	trans	-68	-27.5	173.2	-71.7	170.8	28.9	0	0	113.3	D567 A568 F569	D567-Q571 VanDerWaalsContact O-CG 3.29Å; D567-Q571 WeakPolarHBondContact O-CG 3.28Å; D567-Q571 PolarHBondContact O-N 3.42Å; D567-Q571 VanDerWaalsContact O-N 3.1Å; A568-Q571 PolarHBondContact O-N 2.88Å; F569-Q571 VanDerWaalsContact C-N 3.33Å; F569-Q571 PolarHBondContact O-N 2.87Å
572	Q	89.8	Confident	87.5	Confident	122 Å²	122	64.2 Å²	64.2	57%	0.57	33%	0.332	S	S	*	.	H	α-helix	trans	-80.5	-29.2	177	-172.1	168.7	-14.7	0	0	112.7	A568 F569 I570 P574 N575	A568-Q572 WeakPolarHBondContact O-CB 3.47Å; A568-Q572 PolarHBondContact O-N 3.32Å; F569-Q572 PolarHBondContact O-N 3.37Å; F569-Q572 VanDerWaalsContact O-N 3.09Å; I570-Q572 VanDerWaalsContact C-N 3.3Å; I570-Q572 PolarHBondContact O-N 3.21Å; Q572-P574 VanDerWaalsContact C-CD 3.46Å; Q572-N575 WeakPolarHBondContact O-CB 3.38Å; Q572-N575 PolarHBondContact O-N 3.34Å; Q572-N575 PolarHBondContact O-ND2 3.19Å; Q572-N575 VanDerWaalsContact O-ND2 3.08Å
573	L	90	Very high	88.4	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.016	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-48.4	-43.5	-174.8	-145	75.4	0	0	0	115.4	F569 I570 N575 C576 L602 L606 Y620 L623	F569-L573 HydrophobicContact CD1-CD1 4.36Å; F569-L573 HydrophobicContact CE1-CD1 3.66Å; F569-L573 HydrophobicContact CZ-CD1 3.76Å; F569-L573 PolarHBondContact O-N 2.72Å; I570-L573 WeakPolarHBondContact O-CB 3.19Å; I570-L573 PolarHBondContact O-N 2.97Å; L573-N575 PolarHBondContact O-N 2.98Å; L573-C576 WeakPolarHBondContact O-CB 3.49Å; L573-C576 PolarHBondContact O-N 3.28Å; L573-L602 HydrophobicContact CD2-CD1 4.24Å; L573-L606 HydrophobicContact CD2-CD2 3.87Å; L573-Y620 HydrophobicContact CD2-CD1 4.44Å; L573-Y620 HydrophobicContact CD2-CE1 3.83Å; L573-Y620 HydrophobicContact CD2-CE2 4.41Å; L573-Y620 HydrophobicContact CG-CE1 3.86Å; L573-L623 HydrophobicContact CD1-CD2 3.87Å; L573-L623 HydrophobicContact CD2-CD2 4.37Å
574	P	91.1	Very high	89	Confident	42 Å²	42	64 Å²	64	27%	0.273	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-67.7	-4.4	179.5	-21.4	35.1	0	0	0	115.3	I570 Q572 R613 L616	I570-P574 WeakPolarHBondContact O-CD 3.5Å; Q572-P574 VanDerWaalsContact C-CD 3.46Å; P574-R613 PolarHBondContact O-NH2 2.68Å; P574-L616 HydrophobicContact CB-CD1 4.05Å
575	N	90.1	Very high	89.4	Confident	106 Å²	106	58.7 Å²	58.7	57%	0.567	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-101.5	-6.5	175.3	-50.7	-76.8	0	0	0	112.6	Q572 L573 V577	Q572-N575 WeakPolarHBondContact O-CB 3.38Å; Q572-N575 PolarHBondContact O-N 3.34Å; Q572-N575 PolarHBondContact O-ND2 3.19Å; Q572-N575 VanDerWaalsContact O-ND2 3.08Å; L573-N575 PolarHBondContact O-N 2.98Å; N575-V577 PolarHBondContact O-N 3.16Å
576	C	90.8	Very high	89.8	Confident	8 Å²	8	55.4 Å²	55.4	5%	0.054	29%	0.285	C	S	.	.			trans	-81.3	53.1	179	-65.1	0	0	0	0	111.9	L573 N578 L581 I582	L573-C576 WeakPolarHBondContact O-CB 3.49Å; L573-C576 PolarHBondContact O-N 3.28Å; C576-N578 PolarHBondContact O-N 3.33Å; C576-L581 HydrophobicContact CB-CB 4.2Å; C576-I582 HydrophobicContact CB-CB 4.31Å; C576-I582 HydrophobicContact CB-CD1 3.68Å
577	V	87.8	Confident	89.9	Confident	70 Å²	70	57.7 Å²	57.7	42%	0.424	30%	0.297	S	S	.	.			trans	-84.2	25.7	-172.8	-61.6	0	0	0	0	114.1	N575 L616 F619	N575-V577 PolarHBondContact O-N 3.16Å; V577-L616 HydrophobicContact CG1-CD2 4Å; V577-F619 VanDerWaalsContact O-CZ 3.28Å; V577-F619 WeakPolarHBondContact O-CZ 3.39Å
578	N	89.3	Confident	90	Very high	72 Å²	72	58.3 Å²	58.3	39%	0.385	30%	0.3	S	S	.	.	S	Bend	trans	-150.1	163.2	170.8	72.5	46.2	0	0	0	111.2	C576 D580 L581 I582	C576-N578 PolarHBondContact O-N 3.33Å; N578-D580 PolarHBondContact O-N 2.84Å; N578-D580 PolarHBondContact OD1-N 3.06Å; N578-L581 WeakPolarHBondContact ND2-CD1 3.21Å; N578-L581 PolarHBondContact O-N 3.27Å; N578-L581 WeakPolarHBondContact OD1-CB 3.47Å; N578-L581 WeakPolarHBondContact OD1-CG 3.32Å; N578-L581 PolarHBondContact OD1-N 3.03Å; N578-I582 PolarHBondContact O-N 2.94Å
579	R	88.9	Confident	90.1	Very high	102 Å²	102	56 Å²	56	39%	0.385	28%	0.28	S	S	.	.	H	α-helix	trans	-53.2	-53.2	-176.8	-169.4	-165.4	64.4	-168.7	-5.8	112.5	L581 I582 D583	R579-L581 VanDerWaalsContact C-N 3.31Å; R579-L581 PolarHBondContact O-N 3.34Å; R579-I582 WeakPolarHBondContact O-CG2 3.49Å; R579-I582 PolarHBondContact O-N 3.25Å; R579-D583 VanDerWaalsContact O-CB 3.31Å; R579-D583 WeakPolarHBondContact O-CB 3.31Å; R579-D583 PolarHBondContact O-N 3.31Å
580	D	89.4	Confident	89.9	Confident	99 Å²	99	55.3 Å²	55.3	53%	0.529	28%	0.277	S	S	.	.	H	α-helix	trans	-72.1	-27.1	-170.4	-53.6	-18.6	0	0	0	112.1	N578 K584	N578-D580 PolarHBondContact O-N 2.84Å; N578-D580 PolarHBondContact OD1-N 3.06Å; D580-K584 WeakPolarHBondContact O-CB 3.04Å; D580-K584 PolarHBondContact O-N 2.78Å
581	L	91.7	Very high	89.6	Confident	71 Å²	71	56.8 Å²	56.8	37%	0.372	28%	0.284	S	S	.	.	H	α-helix	trans	-73.7	-44.4	171.2	-72.6	177.4	0	0	0	112.5	C576 N578 R579 K584 A585	C576-L581 HydrophobicContact CB-CB 4.2Å; N578-L581 WeakPolarHBondContact ND2-CD1 3.21Å; N578-L581 PolarHBondContact O-N 3.27Å; N578-L581 WeakPolarHBondContact OD1-CB 3.47Å; N578-L581 WeakPolarHBondContact OD1-CG 3.32Å; N578-L581 PolarHBondContact OD1-N 3.03Å; R579-L581 VanDerWaalsContact C-N 3.31Å; R579-L581 PolarHBondContact O-N 3.34Å; L581-K584 PolarHBondContact O-N 3.3Å; L581-A585 WeakPolarHBondContact O-CB 3.48Å; L581-A585 PolarHBondContact O-N 2.93Å
582	I	93.3	Very high	89.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-72.3	-36.1	-178.4	-160.6	70.9	0	0	0	111.8	C576 N578 R579 A585 A586 F619 L623	C576-I582 HydrophobicContact CB-CB 4.31Å; C576-I582 HydrophobicContact CB-CD1 3.68Å; N578-I582 PolarHBondContact O-N 2.94Å; R579-I582 WeakPolarHBondContact O-CG2 3.49Å; R579-I582 PolarHBondContact O-N 3.25Å; I582-A585 WeakPolarHBondContact O-CB 3.46Å; I582-A585 PolarHBondContact O-N 3.31Å; I582-A586 PolarHBondContact O-N 3.02Å; I582-F619 HydrophobicContact CB-CB 4.47Å; I582-F619 HydrophobicContact CD1-CB 4.43Å; I582-F619 HydrophobicContact CG1-CB 4.2Å; I582-F619 WeakPolarHBondContact CG1-O 3.45Å; I582-F619 HydrophobicContact CG2-CD1 4.24Å; I582-L623 HydrophobicContact CD1-CB 4.12Å; I582-L623 HydrophobicContact CD1-CD2 4.05Å; I582-L623 HydrophobicContact CG1-CB 3.88Å
583	D	91.3	Very high	89	Confident	6 Å²	6	48.9 Å²	48.9	3%	0.032	25%	0.251	C	S	.	.	H	α-helix	trans	-66.6	-38.3	173.8	-68.3	-1	0	0	0	111.4	I473 R579 A585 A586 M587 R622	I473-D583 HydrophobicContact CD1-CB 3.7Å; I473-D583 HydrophobicContact CG1-CB 4.2Å; R579-D583 VanDerWaalsContact O-CB 3.31Å; R579-D583 WeakPolarHBondContact O-CB 3.31Å; R579-D583 PolarHBondContact O-N 3.31Å; D583-A585 VanDerWaalsContact C-N 3.34Å; D583-A586 WeakPolarHBondContact O-CB 3.41Å; D583-A586 PolarHBondContact O-N 2.71Å; D583-M587 PolarHBondContact O-N 2.9Å; D583-R622 IonicContact OD1-CZ 3.89Å; D583-R622 IonicContact OD1-NE 3.8Å; D583-R622 PolarHBondContact OD1-NE 2.98Å; D583-R622 IonicContact OD1-NH2 3.79Å; D583-R622 PolarHBondContact OD1-NH2 3.2Å; D583-R622 IonicContact OD2-CZ 2.96Å; D583-R622 IonicContact OD2-NE 3.9Å; D583-R622 IonicContact OD2-NH2 2.76Å; D583-R622 PolarHBondContact OD2-NH2 2.83Å
584	K	90.4	Very high	88.8	Confident	139 Å²	139	50 Å²	50	60%	0.604	26%	0.257	S	S	*	.	H	α-helix	trans	-64.9	-38.1	171.6	-177	177.6	178.1	-177.7	0	112	D580 L581 A586 M587 D588	D580-K584 WeakPolarHBondContact O-CB 3.04Å; D580-K584 PolarHBondContact O-N 2.78Å; L581-K584 PolarHBondContact O-N 3.3Å; K584-A586 VanDerWaalsContact C-N 3.33Å; K584-M587 PolarHBondContact O-N 2.85Å; K584-D588 WeakPolarHBondContact O-CB 3.38Å; K584-D588 PolarHBondContact O-N 3.13Å
585	A	90.8	Very high	88.5	Confident	8 Å²	8	50.8 Å²	50.8	7%	0.066	26%	0.26	C	S	.	.	H	α-helix	trans	-64.6	-37.5	173.5	0	0	0	0	0	111.7	F569 L581 I582 D583 F589	F569-A585 HydrophobicContact CE2-CB 3.75Å; F569-A585 WeakPolarHBondContact CE2-O 3.27Å; F569-A585 HydrophobicContact CZ-CB 3.96Å; F569-A585 WeakPolarHBondContact CZ-O 3.32Å; L581-A585 WeakPolarHBondContact O-CB 3.48Å; L581-A585 PolarHBondContact O-N 2.93Å; I582-A585 WeakPolarHBondContact O-CB 3.46Å; I582-A585 PolarHBondContact O-N 3.31Å; D583-A585 VanDerWaalsContact C-N 3.34Å; A585-F589 VanDerWaalsContact O-CB 3.29Å; A585-F589 WeakPolarHBondContact O-CB 3.35Å; A585-F589 PolarHBondContact O-N 2.84Å
586	A	91.3	Very high	88.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-47	173.1	0	0	0	0	0	112	I582 D583 K584 C590 L623 T626 L627	I582-A586 PolarHBondContact O-N 3.02Å; D583-A586 WeakPolarHBondContact O-CB 3.41Å; D583-A586 PolarHBondContact O-N 2.71Å; K584-A586 VanDerWaalsContact C-N 3.33Å; A586-C590 VanDerWaalsContact O-CB 3.25Å; A586-C590 WeakPolarHBondContact O-CB 3.19Å; A586-C590 PolarHBondContact O-N 3.4Å; A586-L623 HydrophobicContact CB-CD1 3.52Å; A586-T626 HydrophobicContact CB-CG2 3.75Å; A586-L627 HydrophobicContact CB-CD2 4.29Å; A586-L627 HydrophobicContact CB-CG 4.42Å
587	M	87.4	Confident	87.9	Confident	49 Å²	49	54.1 Å²	54.1	24%	0.241	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-47.7	176.1	-74.9	-175.3	-74.6	0	0	112.4	I473 L475 D583 K584 F589 C590 M591	I473-M587 HydrophobicContact CD1-CE 3.84Å; I473-M587 HydrophobicContact CD1-SD 4.41Å; I473-M587 HydrophobicContact CG2-SD 4.46Å; L475-M587 HydrophobicContact CD2-CB 4.43Å; L475-M587 HydrophobicContact CD2-CG 3.48Å; L475-M587 VanDerWaalsContact CD2-CG 3.48Å; D583-M587 PolarHBondContact O-N 2.9Å; K584-M587 PolarHBondContact O-N 2.85Å; M587-F589 PolarHBondContact O-N 3.38Å; M587-C590 PolarHBondContact O-N 2.95Å; M587-M591 WeakPolarHBondContact O-CB 3.47Å; M587-M591 WeakPolarHBondContact O-CG 3.28Å; M587-M591 PolarHBondContact O-N 2.88Å
588	D	88.1	Confident	87.9	Confident	65 Å²	65	51.3 Å²	51.3	35%	0.348	26%	0.257	S	S	.	.	H	α-helix	trans	-62.2	-44	180	-171.6	30.5	0	0	0	111.6	K584 M591 N592 M593	K584-D588 WeakPolarHBondContact O-CB 3.38Å; K584-D588 PolarHBondContact O-N 3.13Å; D588-M591 PolarHBondContact O-N 2.85Å; D588-N592 WeakPolarHBondContact O-CB 3.47Å; D588-N592 PolarHBondContact O-N 3.14Å; D588-N592 PolarHBondContact OD1-ND2 3.44Å; D588-M593 HydrophobicContact CB-CE 4.4Å; D588-M593 WeakPolarHBondContact OD2-CE 3.44Å
589	F	89.5	Confident	87.9	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.009	25%	0.247	C	C	.	.	I	π-helix	trans	-62.9	-45.3	175	-171.1	-94.4	0	0	0	112.2	F569 A585 M587 M591 M593 N594 N598 R599 L602 L627 M631	F569-F589 AromaticContact CD1-CD2 3.99Å; F569-F589 HydrophobicContact CD1-CD2 3.99Å; F569-F589 HydrophobicContact CE1-CB 4.22Å; F569-F589 AromaticContact CE1-CD2 3.61Å; F569-F589 HydrophobicContact CE1-CD2 3.61Å; F569-F589 HydrophobicContact CE1-CE2 4.39Å; F569-F589 HydrophobicContact CE1-CG 4.22Å; F569-F589 HydrophobicContact CE2-CB 4.14Å; F569-F589 HydrophobicContact CZ-CB 3.73Å; F569-F589 HydrophobicContact CZ-CD2 4.02Å; F569-F589 HydrophobicContact CZ-CG 4.22Å; A585-F589 VanDerWaalsContact O-CB 3.29Å; A585-F589 WeakPolarHBondContact O-CB 3.35Å; A585-F589 PolarHBondContact O-N 2.84Å; M587-F589 PolarHBondContact O-N 3.38Å; F589-M591 PolarHBondContact O-N 3.36Å; F589-M593 HydrophobicContact CD2-CB 3.73Å; F589-M593 HydrophobicContact CD2-SD 4.23Å; F589-M593 HydrophobicContact CE2-CB 4.01Å; F589-M593 HydrophobicContact CG-CB 4.28Å; F589-M593 CarbonylContact O-C 3.31Å; F589-M593 WeakPolarHBondContact O-CA 3.32Å; F589-M593 PolarHBondContact O-N 3.34Å; F589-N594 PolarHBondContact O-N 2.81Å; F589-N598 HydrophobicContact CE2-CB 4.41Å; F589-N598 HydrophobicContact CZ-CB 4.26Å; F589-R599 HydrophobicContact CE1-CG 4.1Å; F589-R599 HydrophobicContact CZ-CG 4.3Å; F589-L602 HydrophobicContact CD1-CD2 3.95Å; F589-L602 HydrophobicContact CD2-CD2 4.29Å; F589-L602 HydrophobicContact CE1-CD2 3.62Å; F589-L602 HydrophobicContact CE2-CB 4.18Å; F589-L602 HydrophobicContact CE2-CD2 3.99Å; F589-L602 HydrophobicContact CG-CD2 4.28Å; F589-L602 HydrophobicContact CZ-CB 3.93Å; F589-L602 HydrophobicContact CZ-CD2 3.64Å; F589-L602 HydrophobicContact CZ-CG 4.39Å; F589-L627 HydrophobicContact CD1-CD1 4.13Å; F589-L627 HydrophobicContact CD1-CD2 4.19Å; F589-M631 HydrophobicContact CD1-SD 4.22Å; F589-M631 HydrophobicContact CE1-SD 3.91Å
590	C	87	Confident	87.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.24	C	C	.	.	I	π-helix	trans	-66.2	-36.2	-179.2	-167.1	0	0	0	0	113.1	L475 V479 A586 M587 N594 L627 M631	L475-C590 HydrophobicContact CD1-CB 4.03Å; V479-C590 HydrophobicContact CG2-CB 4.44Å; A586-C590 VanDerWaalsContact O-CB 3.25Å; A586-C590 WeakPolarHBondContact O-CB 3.19Å; A586-C590 PolarHBondContact O-N 3.4Å; M587-C590 PolarHBondContact O-N 2.95Å; C590-N594 WeakPolarHBondContact O-CB 3.32Å; C590-L627 HydrophobicContact CB-CD2 4.15Å; C590-M631 HydrophobicContact CB-CE 4.28Å
591	M	84.1	Confident	87.8	Confident	78 Å²	78	45.9 Å²	45.9	38%	0.384	23%	0.225	S	C	.	.	I	π-helix	trans	-83.2	-43	-179.6	-68.8	-175	-179.5	0	0	113.3	F478 V479 M587 D588 F589	F478-M591 HydrophobicContact CB-CE 4.23Å; F478-M591 WeakPolarHBondContact O-CE 3.46Å; V479-M591 HydrophobicContact CG2-CE 3.82Å; V479-M591 HydrophobicContact CG2-CG 4.04Å; M587-M591 WeakPolarHBondContact O-CB 3.47Å; M587-M591 WeakPolarHBondContact O-CG 3.28Å; M587-M591 PolarHBondContact O-N 2.88Å; D588-M591 PolarHBondContact O-N 2.85Å; F589-M591 PolarHBondContact O-N 3.36Å
592	N	82	Confident	87.8	Confident	105 Å²	105	42.5 Å²	42.5	56%	0.561	21%	0.207	S	C	*	.	I	π-helix	trans	-110.4	-16.5	-166	-62.5	-42.1	0	0	0	114.5	D588	D588-N592 WeakPolarHBondContact O-CB 3.47Å; D588-N592 PolarHBondContact O-N 3.14Å; D588-N592 PolarHBondContact OD1-ND2 3.44Å
593	M	84.1	Confident	87.7	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.01	21%	0.209	C	C	.	.	I	π-helix	trans	-129.7	-5.3	-170.1	-65.6	175.4	-98.3	0	0	115.1	I565 V566 F569 D588 F589 T595 N598	I565-M593 HydrophobicContact CG2-CE 4.41Å; I565-M593 HydrophobicContact CG2-CG 3.98Å; I565-M593 HydrophobicContact CG2-SD 3.76Å; V566-M593 HydrophobicContact CG2-CB 4.13Å; V566-M593 HydrophobicContact CG2-CG 3.9Å; V566-M593 HydrophobicContact CG2-SD 4.02Å; F569-M593 HydrophobicContact CB-CE 3.95Å; F569-M593 HydrophobicContact CB-SD 3.64Å; F569-M593 HydrophobicContact CD1-SD 4.36Å; F569-M593 HydrophobicContact CD2-CE 3.4Å; F569-M593 HydrophobicContact CD2-SD 4.13Å; F569-M593 HydrophobicContact CE2-CE 3.98Å; F569-M593 HydrophobicContact CG-CE 3.73Å; F569-M593 HydrophobicContact CG-SD 3.8Å; D588-M593 HydrophobicContact CB-CE 4.4Å; D588-M593 WeakPolarHBondContact OD2-CE 3.44Å; F589-M593 HydrophobicContact CD2-CB 3.73Å; F589-M593 HydrophobicContact CD2-SD 4.23Å; F589-M593 HydrophobicContact CE2-CB 4.01Å; F589-M593 HydrophobicContact CG-CB 4.28Å; F589-M593 CarbonylContact O-C 3.31Å; F589-M593 WeakPolarHBondContact O-CA 3.32Å; F589-M593 PolarHBondContact O-N 3.34Å; M593-T595 PolarHBondContact O-N 2.99Å; M593-N598 VanDerWaalsContact O-CB 3.25Å; M593-N598 WeakPolarHBondContact O-CB 3.31Å; M593-N598 PolarHBondContact O-ND2 3.35Å
594	N	85.7	Confident	87.6	Confident	27 Å²	27	44.4 Å²	44.4	14%	0.144	22%	0.215	C	C	.	.			trans	-63.4	95.7	-176	-177.7	12.5	0	0	0	113.3	L483 F589 C590 R599 M631	L483-N594 PolarHBondContact O-ND2 2.94Å; F589-N594 PolarHBondContact O-N 2.81Å; C590-N594 WeakPolarHBondContact O-CB 3.32Å; N594-R599 PolarHBondContact OD1-NH1 2.94Å; N594-M631 HydrophobicContact CB-CE 4.1Å
595	T	86.1	Confident	87.6	Confident	57 Å²	57	39 Å²	39	35%	0.35	20%	0.196	S	C	.	.			trans	-141.2	155.3	169	76.9	0	0	0	0	109.7	M593 S597 N598 R599	M593-T595 PolarHBondContact O-N 2.99Å; T595-S597 VanDerWaalsContact C-N 3.32Å; T595-S597 PolarHBondContact O-N 3.46Å; T595-N598 PolarHBondContact O-N 2.86Å; T595-N598 WeakPolarHBondContact OG1-CB 3.28Å; T595-N598 PolarHBondContact OG1-N 2.93Å; T595-N598 PolarHBondContact OG1-ND2 2.92Å; T595-R599 WeakPolarHBondContact O-CG 3.35Å; T595-R599 PolarHBondContact O-N 3.21Å
596	K	83.9	Confident	87.7	Confident	141 Å²	141	38.7 Å²	38.7	61%	0.613	19%	0.193	S	C	*	.	H	α-helix	trans	-58.2	-38.5	-175.7	-168.3	173	-177.2	175.6	0	113.7	R600	K596-R600 PolarHBondContact O-N 3.37Å
597	S	83.8	Confident	87.7	Confident	43 Å²	43	40.1 Å²	40.1	30%	0.301	20%	0.199	S	C	.	.	H	α-helix	trans	-67.7	-42.2	174.4	179.7	0	0	0	0	111.5	T595 R599 R600 K601	T595-S597 VanDerWaalsContact C-N 3.32Å; T595-S597 PolarHBondContact O-N 3.46Å; S597-R599 VanDerWaalsContact C-N 3.34Å; S597-R599 PolarHBondContact O-N 3.39Å; S597-R600 PolarHBondContact O-N 3.1Å; S597-K601 WeakPolarHBondContact O-CG 3.33Å; S597-K601 PolarHBondContact O-N 3.28Å
598	N	88.1	Confident	87.7	Confident	11 Å²	11	42.5 Å²	42.5	6%	0.059	22%	0.217	C	C	.	.	H	α-helix	trans	-66.7	-34	177.9	-63	-18.3	0	0	0	112.4	V566 F589 M593 T595 K601 L602	V566-N598 HydrophobicContact CG1-CB 4.42Å; V566-N598 HydrophobicContact CG2-CB 4.33Å; F589-N598 HydrophobicContact CE2-CB 4.41Å; F589-N598 HydrophobicContact CZ-CB 4.26Å; M593-N598 VanDerWaalsContact O-CB 3.25Å; M593-N598 WeakPolarHBondContact O-CB 3.31Å; M593-N598 PolarHBondContact O-ND2 3.35Å; T595-N598 PolarHBondContact O-N 2.86Å; T595-N598 WeakPolarHBondContact OG1-CB 3.28Å; T595-N598 PolarHBondContact OG1-N 2.93Å; T595-N598 PolarHBondContact OG1-ND2 2.92Å; N598-K601 PolarHBondContact O-N 3.42Å; N598-L602 WeakPolarHBondContact O-CB 3.45Å; N598-L602 PolarHBondContact O-N 3.46Å
599	R	89.5	Confident	87.7	Confident	47 Å²	47	39.9 Å²	39.9	18%	0.177	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-45.5	173.7	-67.8	-164.5	-50.8	-106.8	10.2	111.7	F589 N594 T595 S597 K601 L602 V603 M631 D633 V634	F589-R599 HydrophobicContact CE1-CG 4.1Å; F589-R599 HydrophobicContact CZ-CG 4.3Å; N594-R599 PolarHBondContact OD1-NH1 2.94Å; T595-R599 WeakPolarHBondContact O-CG 3.35Å; T595-R599 PolarHBondContact O-N 3.21Å; S597-R599 VanDerWaalsContact C-N 3.34Å; S597-R599 PolarHBondContact O-N 3.39Å; R599-K601 VanDerWaalsContact C-N 3.35Å; R599-K601 PolarHBondContact O-N 3.01Å; R599-L602 WeakPolarHBondContact O-CB 3.38Å; R599-L602 PolarHBondContact O-N 3.39Å; R599-L602 VanDerWaalsContact O-N 3.16Å; R599-V603 WeakPolarHBondContact O-CG2 3.11Å; R599-V603 PolarHBondContact O-N 2.9Å; R599-M631 WeakPolarHBondContact CD-SD 3.31Å; R599-M631 HydrophobicContact CG-SD 3.95Å; R599-D633 WeakPolarHBondContact CD-OD1 3.46Å; R599-D633 IonicContact CZ-OD1 3.5Å; R599-D633 IonicContact CZ-OD2 2.92Å; R599-D633 VanDerWaalsContact CZ-OD2 3.23Å; R599-D633 VanDerWaalsContact NE-CG 3.31Å; R599-D633 IonicContact NE-OD1 3.34Å; R599-D633 PolarHBondContact NE-OD1 2.82Å; R599-D633 IonicContact NE-OD2 2.74Å; R599-D633 PolarHBondContact NE-OD2 3.44Å; R599-D633 IonicContact NH2-OD1 3.93Å; R599-D633 IonicContact NH2-OD2 2.58Å; R599-D633 PolarHBondContact NH2-OD2 2.9Å; R599-V634 HydrophobicContact CB-CG2 3.86Å; R599-V634 HydrophobicContact CG-CG2 3.95Å
600	R	88	Confident	87.5	Confident	64 Å²	64	43 Å²	43	24%	0.242	22%	0.223	C	C	.	.	H	α-helix	trans	-57.1	-44.1	171	-75.7	176.1	160.4	-159.1	-15.7	112.6	E548 K596 S597 V603 R604	E548-R600 IonicContact OE1-CZ 2.72Å; E548-R600 IonicContact OE1-NH1 3.06Å; E548-R600 PolarHBondContact OE1-NH1 3.25Å; E548-R600 IonicContact OE1-NH2 3.46Å; E548-R600 PolarHBondContact OE1-NH2 3.06Å; E548-R600 IonicContact OE2-CZ 3.22Å; E548-R600 IonicContact OE2-NH1 3.89Å; E548-R600 PolarHBondContact OE2-NH1 2.83Å; E548-R600 IonicContact OE2-NH2 3.93Å; K596-R600 PolarHBondContact O-N 3.37Å; S597-R600 PolarHBondContact O-N 3.1Å; R600-V603 PolarHBondContact O-N 2.88Å; R600-R604 WeakPolarHBondContact O-CG 3.33Å; R600-R604 PolarHBondContact O-N 3.07Å
601	K	88.8	Confident	87.2	Confident	49 Å²	49	47 Å²	47	21%	0.213	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-40.7	175.1	-72	-179.3	176.9	-170.6	0	112.6	V566 I570 S597 N598 R599 R604 A605	V566-K601 HydrophobicContact CG1-CD 4.48Å; I570-K601 HydrophobicContact CD1-CB 4.25Å; S597-K601 WeakPolarHBondContact O-CG 3.33Å; S597-K601 PolarHBondContact O-N 3.28Å; N598-K601 PolarHBondContact O-N 3.42Å; R599-K601 VanDerWaalsContact C-N 3.35Å; R599-K601 PolarHBondContact O-N 3.01Å; K601-R604 PolarHBondContact O-N 3.08Å; K601-A605 WeakPolarHBondContact O-CB 3.48Å; K601-A605 PolarHBondContact O-N 3.1Å
602	L	91	Very high	87.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.8	-46.9	174.8	-179.8	59.7	0	0	0	111	F569 L573 F589 N598 R599 R604 A605 L606 L623 L627 V634	F569-L602 HydrophobicContact CE1-CD1 4.21Å; L573-L602 HydrophobicContact CD2-CD1 4.24Å; F589-L602 HydrophobicContact CD1-CD2 3.95Å; F589-L602 HydrophobicContact CD2-CD2 4.29Å; F589-L602 HydrophobicContact CE1-CD2 3.62Å; F589-L602 HydrophobicContact CE2-CB 4.18Å; F589-L602 HydrophobicContact CE2-CD2 3.99Å; F589-L602 HydrophobicContact CG-CD2 4.28Å; F589-L602 HydrophobicContact CZ-CB 3.93Å; F589-L602 HydrophobicContact CZ-CD2 3.64Å; F589-L602 HydrophobicContact CZ-CG 4.39Å; N598-L602 WeakPolarHBondContact O-CB 3.45Å; N598-L602 PolarHBondContact O-N 3.46Å; R599-L602 WeakPolarHBondContact O-CB 3.38Å; R599-L602 PolarHBondContact O-N 3.39Å; R599-L602 VanDerWaalsContact O-N 3.16Å; L602-R604 PolarHBondContact O-N 2.82Å; L602-A605 PolarHBondContact O-N 3.27Å; L602-L606 HydrophobicContact CD1-CD1 4.01Å; L602-L606 HydrophobicContact CD1-CD2 4.41Å; L602-L606 HydrophobicContact CD1-CG 3.96Å; L602-L606 HydrophobicContact CD2-CD1 4.47Å; L602-L606 HydrophobicContact CG-CD1 3.79Å; L602-L606 HydrophobicContact CG-CG 4.21Å; L602-L606 WeakPolarHBondContact O-CB 3.36Å; L602-L606 VanDerWaalsContact O-CG 3.24Å; L602-L606 WeakPolarHBondContact O-CG 3.15Å; L602-L606 PolarHBondContact O-N 3.4Å; L602-L623 HydrophobicContact CD1-CD2 4.44Å; L602-L627 HydrophobicContact CD2-CD1 3.72Å; L602-V634 HydrophobicContact CD2-CG1 4.48Å
603	V	91.9	Very high	87.4	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.024	24%	0.235	C	C	.	.	H	α-helix	trans	-58.5	-47.2	176.2	173.7	0	0	0	0	111.6	R599 R600 A605 L606 F607 V634 D637 L638 M641	R599-V603 WeakPolarHBondContact O-CG2 3.11Å; R599-V603 PolarHBondContact O-N 2.9Å; R600-V603 PolarHBondContact O-N 2.88Å; V603-A605 VanDerWaalsContact C-N 3.33Å; V603-A605 PolarHBondContact O-N 2.77Å; V603-L606 PolarHBondContact O-N 3.49Å; V603-F607 WeakPolarHBondContact O-CB 3.46Å; V603-F607 PolarHBondContact O-N 3.06Å; V603-V634 HydrophobicContact CG2-CB 4.31Å; V603-V634 HydrophobicContact CG2-CG1 4.03Å; V603-D637 HydrophobicContact CG1-CB 4.02Å; V603-D637 HydrophobicContact CG2-CB 4.27Å; V603-L638 HydrophobicContact CG1-CB 4.16Å; V603-M641 HydrophobicContact CG1-SD 3.85Å
604	R	89.1	Confident	87.6	Confident	42 Å²	42	50 Å²	50	16%	0.158	25%	0.246	C	C	.	.	H	α-helix	trans	-56.8	-43.9	174.5	-72.5	178.5	-179.7	143.8	11.7	112	L545 E548 R600 K601 L602 T608	L545-R604 PolarHBondContact O-NE 2.99Å; L545-R604 PolarHBondContact O-NH2 3.3Å; E548-R604 IonicContact OE2-NH2 3.62Å; E548-R604 PolarHBondContact OE2-NH2 2.94Å; R600-R604 WeakPolarHBondContact O-CG 3.33Å; R600-R604 PolarHBondContact O-N 3.07Å; K601-R604 PolarHBondContact O-N 3.08Å; L602-R604 PolarHBondContact O-N 2.82Å; R604-T608 WeakPolarHBondContact O-CB 3.34Å; R604-T608 PolarHBondContact O-N 3.16Å; R604-T608 PolarHBondContact O-OG1 2.79Å
605	A	90.3	Very high	87.8	Confident	26 Å²	26	52.2 Å²	52.2	22%	0.215	26%	0.258	C	S	.	.	H	α-helix	trans	-68.1	-38.2	178	0	0	0	0	0	113.1	I570 K601 L602 V603	I570-A605 HydrophobicContact CD1-CB 4.3Å; I570-A605 HydrophobicContact CG1-CB 4.24Å; I570-A605 HydrophobicContact CG2-CB 3.81Å; K601-A605 WeakPolarHBondContact O-CB 3.48Å; K601-A605 PolarHBondContact O-N 3.1Å; L602-A605 PolarHBondContact O-N 3.27Å; V603-A605 VanDerWaalsContact C-N 3.33Å; V603-A605 PolarHBondContact O-N 2.77Å
606	L	91.7	Very high	88.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-69.6	-36.2	177	-69.7	171.4	0	0	0	112.2	L573 L602 V603 V609 Y620 L623 V624 V634 L638 F667	L573-L606 HydrophobicContact CD2-CD2 3.87Å; L602-L606 HydrophobicContact CD1-CD1 4.01Å; L602-L606 HydrophobicContact CD1-CD2 4.41Å; L602-L606 HydrophobicContact CD1-CG 3.96Å; L602-L606 HydrophobicContact CD2-CD1 4.47Å; L602-L606 HydrophobicContact CG-CD1 3.79Å; L602-L606 HydrophobicContact CG-CG 4.21Å; L602-L606 WeakPolarHBondContact O-CB 3.36Å; L602-L606 VanDerWaalsContact O-CG 3.24Å; L602-L606 WeakPolarHBondContact O-CG 3.15Å; L602-L606 PolarHBondContact O-N 3.4Å; V603-L606 PolarHBondContact O-N 3.49Å; L606-V609 WeakPolarHBondContact O-CG2 3.35Å; L606-Y620 HydrophobicContact CD2-CD1 4.14Å; L606-Y620 HydrophobicContact CD2-CD2 3.58Å; L606-Y620 HydrophobicContact CD2-CE2 4.13Å; L606-Y620 HydrophobicContact CD2-CG 3.57Å; L606-L623 HydrophobicContact CD2-CD2 4.29Å; L606-V624 HydrophobicContact CD1-CG2 3.69Å; L606-V634 HydrophobicContact CD1-CG1 4.48Å; L606-L638 HydrophobicContact CB-CD1 4.48Å; L606-L638 HydrophobicContact CB-CD2 4.48Å; L606-F667 VanDerWaalsContact O-CE1 3.28Å; L606-F667 WeakPolarHBondContact O-CE1 3.44Å
607	F	91.3	Very high	88.5	Confident	30 Å²	30	42.9 Å²	42.9	13%	0.132	21%	0.213	C	C	.	.	H	α-helix	trans	-70.5	-36.2	176.7	-179.3	-98.7	0	0	0	112.8	V603 V609 L638 M641 L642 D645 K663	V603-F607 WeakPolarHBondContact O-CB 3.46Å; V603-F607 PolarHBondContact O-N 3.06Å; F607-V609 PolarHBondContact O-N 3.11Å; F607-L638 HydrophobicContact CB-CD1 4.07Å; F607-L638 HydrophobicContact CD2-CD1 4.44Å; F607-M641 HydrophobicContact CB-CE 4.18Å; F607-M641 HydrophobicContact CD1-CE 3.63Å; F607-M641 HydrophobicContact CD2-CB 3.78Å; F607-M641 HydrophobicContact CD2-CE 4.12Å; F607-M641 HydrophobicContact CE1-CE 3.98Å; F607-M641 HydrophobicContact CE2-CB 3.83Å; F607-M641 HydrophobicContact CE2-CE 4.44Å; F607-M641 HydrophobicContact CG-CB 4.5Å; F607-M641 HydrophobicContact CG-CE 3.71Å; F607-M641 HydrophobicContact CG-SD 4.42Å; F607-M641 HydrophobicContact CZ-CE 4.37Å; F607-L642 HydrophobicContact CD2-CD2 4.1Å; F607-L642 HydrophobicContact CD2-CG 4.39Å; F607-L642 HydrophobicContact CE2-CD2 4.07Å; F607-D645 HydrophobicContact CE2-CB 4.06Å; F607-D645 HydrophobicContact CZ-CB 3.92Å; F607-K663 PolarHBondContact O-NZ 3.29Å
608	T	88.8	Confident	88.9	Confident	100 Å²	100	42.2 Å²	42.2	61%	0.613	21%	0.207	S	C	*	.			trans	-86	42.6	-173.7	-42.5	0	0	0	0	112.6	R604	R604-T608 WeakPolarHBondContact O-CB 3.34Å; R604-T608 PolarHBondContact O-N 3.16Å; R604-T608 PolarHBondContact O-OG1 2.79Å
609	V	86.9	Confident	89.2	Confident	9 Å²	9	43.5 Å²	43.5	6%	0.055	21%	0.212	C	C	.	.			trans	-68.2	131.6	175.7	-162.2	0	0	0	0	110.1	L606 F607 R613 L616 L617 Y620 K663 F667	L606-V609 WeakPolarHBondContact O-CG2 3.35Å; F607-V609 PolarHBondContact O-N 3.11Å; V609-R613 HydrophobicContact CG1-CB 4.48Å; V609-L616 HydrophobicContact CG1-CB 4.31Å; V609-L616 HydrophobicContact CG1-CD1 4.36Å; V609-L617 HydrophobicContact CB-CD2 4.22Å; V609-L617 HydrophobicContact CG1-CD2 4.22Å; V609-L617 HydrophobicContact CG2-CD2 3.81Å; V609-Y620 HydrophobicContact CG1-CE2 4.48Å; V609-Y620 HydrophobicContact CG2-CD2 3.8Å; V609-Y620 HydrophobicContact CG2-CE2 3.88Å; V609-K663 HydrophobicContact CB-CD 4.46Å; V609-F667 HydrophobicContact CG2-CE1 4.46Å
610	P	85.1	Confident	89.5	Confident	68 Å²	68	41.8 Å²	41.8	44%	0.442	21%	0.206	S	C	.	.			trans	-57.8	137	172	-24.7	34.5	0	0	0	111.9	Q612 R613	P610-Q612 PolarHBondContact O-N 2.97Å; P610-Q612 VanDerWaalsContact O-N 3.09Å; P610-R613 HydrophobicContact CB-CB 4.4Å; P610-R613 HydrophobicContact CB-CG 4.45Å; P610-R613 PolarHBondContact O-N 2.86Å
611	R	80.8	Confident	89.8	Confident	83 Å²	83	38.7 Å²	38.7	31%	0.313	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.9	-178.7	61.1	-169.7	173.2	143	-12.1	113.7	L614 E659	R611-L614 WeakPolarHBondContact O-CG 3.36Å; R611-E659 HydrophobicContact CB-CB 4.19Å; R611-E659 VanDerWaalsContact CD-OE2 3.23Å; R611-E659 WeakPolarHBondContact CD-OE2 3.34Å; R611-E659 IonicContact CZ-OE2 3.65Å; R611-E659 IonicContact NE-OE2 3.15Å; R611-E659 IonicContact NH1-OE2 2.66Å; R611-E659 PolarHBondContact NH1-OE2 2.63Å
612	Q	83.6	Confident	90.1	Very high	119 Å²	119	36.5 Å²	36.5	56%	0.556	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-8.8	178	-50.5	88.6	-18.9	0	0	114.1	P610	P610-Q612 PolarHBondContact O-N 2.97Å; P610-Q612 VanDerWaalsContact O-N 3.09Å
613	R	87.8	Confident	90.2	Very high	83 Å²	83	36.5 Å²	36.5	31%	0.313	18%	0.184	S	C	.	.			trans	-112.5	49	-176.2	-70.1	-62.5	-54.8	-83.4	1.4	113	P574 V609 P610 D615 L616	P574-R613 PolarHBondContact O-NH2 2.68Å; V609-R613 HydrophobicContact CG1-CB 4.48Å; P610-R613 HydrophobicContact CB-CB 4.4Å; P610-R613 HydrophobicContact CB-CG 4.45Å; P610-R613 PolarHBondContact O-N 2.86Å; R613-D615 WeakPolarHBondContact CA-OD1 3.48Å; R613-D615 WeakPolarHBondContact CD-OD1 3.37Å; R613-D615 IonicContact CZ-OD1 3.73Å; R613-D615 IonicContact CZ-OD2 2.79Å; R613-D615 IonicContact NE-OD1 2.89Å; R613-D615 PolarHBondContact NE-OD1 3.26Å; R613-D615 IonicContact NE-OD2 2.97Å; R613-D615 PolarHBondContact NE-OD2 2.95Å; R613-D615 VanDerWaalsContact NE-OD2 3.14Å; R613-D615 IonicContact NH2-OD1 3.22Å; R613-D615 IonicContact NH2-OD2 3.63Å; R613-D615 PolarHBondContact NH2-OD2 3.15Å; R613-D615 PolarHBondContact O-N 2.91Å; R613-L616 HydrophobicContact CB-CD1 3.87Å; R613-L616 HydrophobicContact CB-CG 4.33Å; R613-L616 HydrophobicContact CG-CD1 4.49Å; R613-L616 PolarHBondContact O-N 3.07Å
614	L	88.1	Confident	90.3	Very high	47 Å²	47	36.3 Å²	36.3	25%	0.246	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-65	-13.4	176.5	-56.5	-176.5	0	0	0	113.5	R611 L616 L617 K663	R611-L614 WeakPolarHBondContact O-CG 3.36Å; L614-L616 PolarHBondContact O-N 2.92Å; L614-L617 HydrophobicContact CB-CD1 4.43Å; L614-L617 HydrophobicContact CD2-CD1 3.95Å; L614-K663 HydrophobicContact CD2-CB 3.81Å; L614-K663 HydrophobicContact CD2-CG 3.91Å
615	D	88.8	Confident	90.5	Very high	74 Å²	74	34.5 Å²	34.5	40%	0.396	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-64.7	-22.9	172.4	62.1	-66	0	0	0	113.4	R613 P618 F619	R613-D615 WeakPolarHBondContact CA-OD1 3.48Å; R613-D615 WeakPolarHBondContact CD-OD1 3.37Å; R613-D615 IonicContact CZ-OD1 3.73Å; R613-D615 IonicContact CZ-OD2 2.79Å; R613-D615 IonicContact NE-OD1 2.89Å; R613-D615 PolarHBondContact NE-OD1 3.26Å; R613-D615 IonicContact NE-OD2 2.97Å; R613-D615 PolarHBondContact NE-OD2 2.95Å; R613-D615 VanDerWaalsContact NE-OD2 3.14Å; R613-D615 IonicContact NH2-OD1 3.22Å; R613-D615 IonicContact NH2-OD2 3.63Å; R613-D615 PolarHBondContact NH2-OD2 3.15Å; R613-D615 PolarHBondContact O-N 2.91Å; D615-P618 WeakPolarHBondContact O-CD 3.44Å; D615-F619 WeakPolarHBondContact O-CD2 3.5Å
616	L	92	Very high	90.6	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-79.9	-21.9	-178.9	-66.9	174.1	0	0	0	113.5	P574 V577 V609 R613 L614 F619 Y620	P574-L616 HydrophobicContact CB-CD1 4.05Å; V577-L616 HydrophobicContact CG1-CD2 4Å; V609-L616 HydrophobicContact CG1-CB 4.31Å; V609-L616 HydrophobicContact CG1-CD1 4.36Å; R613-L616 HydrophobicContact CB-CD1 3.87Å; R613-L616 HydrophobicContact CB-CG 4.33Å; R613-L616 HydrophobicContact CG-CD1 4.49Å; R613-L616 PolarHBondContact O-N 3.07Å; L614-L616 PolarHBondContact O-N 2.92Å; L616-F619 PolarHBondContact O-N 3.22Å; L616-Y620 HydrophobicContact CB-CD1 4.25Å; L616-Y620 HydrophobicContact CB-CD2 4.44Å; L616-Y620 HydrophobicContact CB-CE1 4.06Å; L616-Y620 HydrophobicContact CB-CE2 4.28Å; L616-Y620 HydrophobicContact CB-CG 4.44Å; L616-Y620 HydrophobicContact CD1-CE1 4.47Å; L616-Y620 HydrophobicContact CD2-CE1 4.18Å; L616-Y620 HydrophobicContact CG-CE1 4.48Å; L616-Y620 WeakPolarHBondContact O-CB 3.47Å; L616-Y620 WeakPolarHBondContact O-CD1 3.41Å; L616-Y620 PolarHBondContact O-N 2.77Å
617	L	93.3	Very high	90.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.9	-40.3	-170.7	-57.6	178.5	0	0	0	114.6	V609 L614 S621 R666 F667 E670	V609-L617 HydrophobicContact CB-CD2 4.22Å; V609-L617 HydrophobicContact CG1-CD2 4.22Å; V609-L617 HydrophobicContact CG2-CD2 3.81Å; L614-L617 HydrophobicContact CB-CD1 4.43Å; L614-L617 HydrophobicContact CD2-CD1 3.95Å; L617-S621 WeakPolarHBondContact O-CB 3.45Å; L617-S621 PolarHBondContact O-N 2.74Å; L617-S621 PolarHBondContact O-OG 3.43Å; L617-R666 HydrophobicContact CD1-CB 3.99Å; L617-R666 HydrophobicContact CD1-CG 3.77Å; L617-F667 HydrophobicContact CD1-CB 4.31Å; L617-F667 HydrophobicContact CD2-CB 4.15Å; L617-F667 HydrophobicContact CD2-CD1 3.92Å; L617-F667 HydrophobicContact CD2-CD2 4.23Å; L617-F667 HydrophobicContact CD2-CE1 4.35Å; L617-F667 HydrophobicContact CD2-CG 3.86Å; L617-E670 HydrophobicContact CB-CG 4.21Å
618	P	92.9	Very high	90.5	Very high	28 Å²	28	35.1 Å²	35.1	18%	0.182	18%	0.176	C	C	.	.	H	α-helix	trans	-65.9	-40.6	175.6	-19.5	32.6	0	0	0	112.2	F468 D615 S621 R622 E670	F468-P618 HydrophobicContact CE1-CB 3.77Å; F468-P618 HydrophobicContact CZ-CB 4Å; D615-P618 WeakPolarHBondContact O-CD 3.44Å; P618-S621 PolarHBondContact O-N 2.91Å; P618-R622 PolarHBondContact O-N 2.96Å; P618-E670 HydrophobicContact CG-CG 4.23Å
619	F	94.5	Very high	90.4	Very high	38 Å²	38	32.8 Å²	32.8	17%	0.167	16%	0.163	C	C	.	.	H	α-helix	trans	-68.8	-42.7	178.1	-58.1	-70.4	0	0	0	111.6	F468 V577 I582 D615 L616 S621 R622 L623	F468-F619 AromaticContact CE2-CD1 3.84Å; F468-F619 HydrophobicContact CE2-CD1 3.84Å; F468-F619 AromaticContact CE2-CE1 3.74Å; F468-F619 HydrophobicContact CE2-CE1 3.74Å; F468-F619 AromaticContact CZ-CD1 3.9Å; F468-F619 HydrophobicContact CZ-CD1 3.9Å; F468-F619 HydrophobicContact CZ-CE1 4.1Å; V577-F619 VanDerWaalsContact O-CZ 3.28Å; V577-F619 WeakPolarHBondContact O-CZ 3.39Å; I582-F619 HydrophobicContact CB-CB 4.47Å; I582-F619 HydrophobicContact CD1-CB 4.43Å; I582-F619 HydrophobicContact CG1-CB 4.2Å; I582-F619 WeakPolarHBondContact CG1-O 3.45Å; I582-F619 HydrophobicContact CG2-CD1 4.24Å; D615-F619 WeakPolarHBondContact O-CD2 3.5Å; L616-F619 PolarHBondContact O-N 3.22Å; F619-S621 VanDerWaalsContact C-N 3.29Å; F619-S621 PolarHBondContact O-N 3.12Å; F619-R622 WeakPolarHBondContact O-CB 3.43Å; F619-R622 PolarHBondContact O-N 2.95Å; F619-L623 PolarHBondContact O-N 3.06Å
620	Y	94.9	Very high	90.3	Very high	11 Å²	11	32.6 Å²	32.6	4%	0.043	16%	0.162	C	C	.	.	H	α-helix	trans	-63.8	-37	176.3	-76.9	15.7	0	0	0	111.1	L573 L606 V609 L616 L623 V624	L573-Y620 HydrophobicContact CD2-CD1 4.44Å; L573-Y620 HydrophobicContact CD2-CE1 3.83Å; L573-Y620 HydrophobicContact CD2-CE2 4.41Å; L573-Y620 HydrophobicContact CG-CE1 3.86Å; L606-Y620 HydrophobicContact CD2-CD1 4.14Å; L606-Y620 HydrophobicContact CD2-CD2 3.58Å; L606-Y620 HydrophobicContact CD2-CE2 4.13Å; L606-Y620 HydrophobicContact CD2-CG 3.57Å; V609-Y620 HydrophobicContact CG1-CE2 4.48Å; V609-Y620 HydrophobicContact CG2-CD2 3.8Å; V609-Y620 HydrophobicContact CG2-CE2 3.88Å; L616-Y620 HydrophobicContact CB-CD1 4.25Å; L616-Y620 HydrophobicContact CB-CD2 4.44Å; L616-Y620 HydrophobicContact CB-CE1 4.06Å; L616-Y620 HydrophobicContact CB-CE2 4.28Å; L616-Y620 HydrophobicContact CB-CG 4.44Å; L616-Y620 HydrophobicContact CD1-CE1 4.47Å; L616-Y620 HydrophobicContact CD2-CE1 4.18Å; L616-Y620 HydrophobicContact CG-CE1 4.48Å; L616-Y620 WeakPolarHBondContact O-CB 3.47Å; L616-Y620 WeakPolarHBondContact O-CD1 3.41Å; L616-Y620 PolarHBondContact O-N 2.77Å; Y620-L623 PolarHBondContact O-N 2.78Å; Y620-V624 WeakPolarHBondContact O-CG2 3.49Å; Y620-V624 PolarHBondContact O-N 2.74Å; Y620-V624 VanDerWaalsContact O-N 3.14Å
621	S	95	Very high	90.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67	-40	172.4	-54.9	0	0	0	0	112.4	L617 P618 F619 V624 A625 F667 E670	L617-S621 WeakPolarHBondContact O-CB 3.45Å; L617-S621 PolarHBondContact O-N 2.74Å; L617-S621 PolarHBondContact O-OG 3.43Å; P618-S621 PolarHBondContact O-N 2.91Å; F619-S621 VanDerWaalsContact C-N 3.29Å; F619-S621 PolarHBondContact O-N 3.12Å; S621-V624 PolarHBondContact O-N 3.25Å; S621-A625 WeakPolarHBondContact O-CB 3.42Å; S621-A625 PolarHBondContact O-N 3.47Å; S621-F667 WeakPolarHBondContact OG-CE2 3.48Å; S621-E670 WeakPolarHBondContact OG-CB 3.36Å
622	R	94.4	Very high	90.6	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.008	13%	0.132	C	C	.	.	H	α-helix	trans	-63	-40.2	173.6	-171.3	171.6	165.7	100.9	3.1	112.3	N467 F468 N471 L472 D583 P618 F619 A625 T626 F674	N467-R622 PolarHBondContact O-NH1 3.34Å; F468-R622 HydrophobicContact CZ-CB 4.11Å; F468-R622 PolarHBondContact O-NH1 2.9Å; N471-R622 VanDerWaalsContact O-CZ 3.3Å; N471-R622 PolarHBondContact O-NH1 3.02Å; N471-R622 PolarHBondContact O-NH2 3.45Å; L472-R622 HydrophobicContact CD2-CG 3.83Å; D583-R622 IonicContact OD1-CZ 3.89Å; D583-R622 IonicContact OD1-NE 3.8Å; D583-R622 PolarHBondContact OD1-NE 2.98Å; D583-R622 IonicContact OD1-NH2 3.79Å; D583-R622 PolarHBondContact OD1-NH2 3.2Å; D583-R622 IonicContact OD2-CZ 2.96Å; D583-R622 IonicContact OD2-NE 3.9Å; D583-R622 IonicContact OD2-NH2 2.76Å; D583-R622 PolarHBondContact OD2-NH2 2.83Å; P618-R622 PolarHBondContact O-N 2.96Å; F619-R622 WeakPolarHBondContact O-CB 3.43Å; F619-R622 PolarHBondContact O-N 2.95Å; R622-A625 PolarHBondContact O-N 3.45Å; R622-T626 WeakPolarHBondContact O-CB 3.26Å; R622-T626 PolarHBondContact O-N 3.2Å; R622-T626 PolarHBondContact O-OG1 3.44Å; R622-F674 HydrophobicContact CB-CE1 4.02Å; R622-F674 HydrophobicContact CB-CE2 4Å; R622-F674 HydrophobicContact CB-CZ 3.47Å; R622-F674 VanDerWaalsContact CB-CZ 3.47Å; R622-F674 HydrophobicContact CG-CE1 4.02Å; R622-F674 HydrophobicContact CG-CZ 3.88Å
623	L	93.6	Very high	90.9	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-59.7	-48.2	175.5	178.3	55.9	0	0	0	111.1	L573 I582 A586 L602 L606 F619 Y620 T626 L627	L573-L623 HydrophobicContact CD1-CD2 3.87Å; L573-L623 HydrophobicContact CD2-CD2 4.37Å; I582-L623 HydrophobicContact CD1-CB 4.12Å; I582-L623 HydrophobicContact CD1-CD2 4.05Å; I582-L623 HydrophobicContact CG1-CB 3.88Å; A586-L623 HydrophobicContact CB-CD1 3.52Å; L602-L623 HydrophobicContact CD1-CD2 4.44Å; L606-L623 HydrophobicContact CD2-CD2 4.29Å; F619-L623 PolarHBondContact O-N 3.06Å; Y620-L623 PolarHBondContact O-N 2.78Å; L623-T626 PolarHBondContact O-N 2.92Å; L623-L627 HydrophobicContact CD1-CD1 3.76Å; L623-L627 HydrophobicContact CD1-CG 4.1Å; L623-L627 HydrophobicContact CG-CD1 4.02Å; L623-L627 WeakPolarHBondContact O-CB 3.22Å; L623-L627 VanDerWaalsContact O-CG 3.3Å; L623-L627 WeakPolarHBondContact O-CG 3.22Å; L623-L627 PolarHBondContact O-N 2.68Å
624	V	93.8	Very high	91	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59.8	-48.6	176.3	173.2	0	0	0	0	110.9	L606 Y620 S621 T626 L627 H628 V634 A635 L638 L671 M676	L606-V624 HydrophobicContact CD1-CG2 3.69Å; Y620-V624 WeakPolarHBondContact O-CG2 3.49Å; Y620-V624 PolarHBondContact O-N 2.74Å; Y620-V624 VanDerWaalsContact O-N 3.14Å; S621-V624 PolarHBondContact O-N 3.25Å; V624-T626 VanDerWaalsContact C-N 3.31Å; V624-T626 PolarHBondContact O-N 3.28Å; V624-L627 PolarHBondContact O-N 2.97Å; V624-H628 WeakPolarHBondContact O-CB 3.45Å; V624-H628 PolarHBondContact O-N 3.21Å; V624-V634 HydrophobicContact CG2-CG1 4.37Å; V624-A635 HydrophobicContact CG1-CB 3.58Å; V624-L638 HydrophobicContact CG2-CD2 3.7Å; V624-L671 HydrophobicContact CB-CD2 4.39Å; V624-L671 HydrophobicContact CG1-CD2 4.27Å; V624-M676 HydrophobicContact CG1-CG 4.46Å
625	A	93.3	Very high	91.1	Very high	4 Å²	4	16.3 Å²	16.3	3%	0.033	9%	0.089	C	C	.	.	H	α-helix	trans	-63.3	-34.2	179.1	0	0	0	0	0	113.4	L472 S621 R622 P629 F674 M676	L472-A625 HydrophobicContact CD1-CB 4Å; S621-A625 WeakPolarHBondContact O-CB 3.42Å; S621-A625 PolarHBondContact O-N 3.47Å; R622-A625 PolarHBondContact O-N 3.45Å; A625-P629 WeakPolarHBondContact O-CD 3.37Å; A625-F674 HydrophobicContact CB-CB 3.89Å; A625-F674 HydrophobicContact CB-CD1 3.64Å; A625-F674 HydrophobicContact CB-CE1 4.42Å; A625-F674 HydrophobicContact CB-CG 3.89Å; A625-M676 HydrophobicContact CB-CG 4.15Å; A625-M676 HydrophobicContact CB-SD 4.31Å
626	T	91.6	Very high	91.2	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.006	9%	0.094	C	C	.	.	H	α-helix	trans	-73.7	-34.9	176.8	-52.4	0	0	0	0	111.9	L475 A586 R622 L623 V624 P629	L475-T626 HydrophobicContact CD1-CG2 4.18Å; L475-T626 VanDerWaalsContact CD1-O 3.24Å; L475-T626 WeakPolarHBondContact CD1-O 3.5Å; L475-T626 HydrophobicContact CD2-CG2 4.3Å; L475-T626 HydrophobicContact CG-CG2 4.05Å; A586-T626 HydrophobicContact CB-CG2 3.75Å; R622-T626 WeakPolarHBondContact O-CB 3.26Å; R622-T626 PolarHBondContact O-N 3.2Å; R622-T626 PolarHBondContact O-OG1 3.44Å; L623-T626 PolarHBondContact O-N 2.92Å; V624-T626 VanDerWaalsContact C-N 3.31Å; V624-T626 PolarHBondContact O-N 3.28Å; T626-P629 WeakPolarHBondContact O-CD 3.49Å
627	L	91	Very high	91.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-78.5	-32.6	177.8	-70.3	173	0	0	0	113.1	L475 A586 F589 C590 L602 L623 V624 P629 C630 M631	L475-L627 HydrophobicContact CD1-CD2 4.06Å; A586-L627 HydrophobicContact CB-CD2 4.29Å; A586-L627 HydrophobicContact CB-CG 4.42Å; F589-L627 HydrophobicContact CD1-CD1 4.13Å; F589-L627 HydrophobicContact CD1-CD2 4.19Å; C590-L627 HydrophobicContact CB-CD2 4.15Å; L602-L627 HydrophobicContact CD2-CD1 3.72Å; L623-L627 HydrophobicContact CD1-CD1 3.76Å; L623-L627 HydrophobicContact CD1-CG 4.1Å; L623-L627 HydrophobicContact CG-CD1 4.02Å; L623-L627 WeakPolarHBondContact O-CB 3.22Å; L623-L627 VanDerWaalsContact O-CG 3.3Å; L623-L627 WeakPolarHBondContact O-CG 3.22Å; L623-L627 PolarHBondContact O-N 2.68Å; V624-L627 PolarHBondContact O-N 2.97Å; L627-P629 VanDerWaalsContact C-CD 3.41Å; L627-P629 VanDerWaalsContact O-N 3.15Å; L627-C630 PolarHBondContact O-N 2.88Å; L627-M631 HydrophobicContact CB-CG 3.93Å; L627-M631 HydrophobicContact CB-SD 4.19Å; L627-M631 HydrophobicContact CD1-SD 4.38Å; L627-M631 HydrophobicContact CD2-CE 3.96Å; L627-M631 HydrophobicContact CD2-SD 4.06Å; L627-M631 HydrophobicContact CG-SD 4.45Å; L627-M631 PolarHBondContact O-N 3.46Å
628	H	91.1	Very high	91.1	Very high	68 Å²	68	19.8 Å²	19.8	32%	0.315	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-43.4	-174.7	174.4	-101.2	0	0	0	115.5	V624 C630 M631 S632 M676	V624-H628 WeakPolarHBondContact O-CB 3.45Å; V624-H628 PolarHBondContact O-N 3.21Å; H628-C630 PolarHBondContact O-N 2.86Å; H628-C630 VanDerWaalsContact O-N 3.14Å; H628-M631 WeakPolarHBondContact CA-O 3.42Å; H628-M631 CarbonylContact O-C 3.59Å; H628-M631 PolarHBondContact O-N 2.85Å; H628-S632 PolarHBondContact O-N 2.74Å; H628-M676 HydrophobicContact CB-CE 4.5Å; H628-M676 HydrophobicContact CB-SD 3.78Å
629	P	86.3	Confident	91	Very high	52 Å²	52	19.1 Å²	19.1	34%	0.338	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.1	178.1	-24.2	35.4	0	0	0	115	K476 A625 T626 L627	K476-P629 WeakPolarHBondContact CE-O 3.46Å; K476-P629 PolarHBondContact NZ-O 3.39Å; A625-P629 WeakPolarHBondContact O-CD 3.37Å; T626-P629 WeakPolarHBondContact O-CD 3.49Å; L627-P629 VanDerWaalsContact C-CD 3.41Å; L627-P629 VanDerWaalsContact O-N 3.15Å
630	C	84.2	Confident	90.8	Very high	4 Å²	4	18.9 Å²	18.9	3%	0.027	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-23.5	179.9	-67.5	0	0	0	0	113.2	F484 L627 H628	F484-C630 HydrophobicContact CB-CB 4.05Å; F484-C630 HydrophobicContact CD1-CB 4.37Å; F484-C630 HydrophobicContact CG-CB 4.49Å; L627-C630 PolarHBondContact O-N 2.88Å; H628-C630 PolarHBondContact O-N 2.86Å; H628-C630 VanDerWaalsContact O-N 3.14Å
631	M	85.9	Confident	90.6	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	10%	0.104	C	C	.	.			trans	-152.2	97.6	178.7	58.6	-164	78.1	0	0	109.9	F589 C590 N594 R599 L627 H628 V634	F589-M631 HydrophobicContact CD1-SD 4.22Å; F589-M631 HydrophobicContact CE1-SD 3.91Å; C590-M631 HydrophobicContact CB-CE 4.28Å; N594-M631 HydrophobicContact CB-CE 4.1Å; R599-M631 WeakPolarHBondContact CD-SD 3.31Å; R599-M631 HydrophobicContact CG-SD 3.95Å; L627-M631 HydrophobicContact CB-CG 3.93Å; L627-M631 HydrophobicContact CB-SD 4.19Å; L627-M631 HydrophobicContact CD1-SD 4.38Å; L627-M631 HydrophobicContact CD2-CE 3.96Å; L627-M631 HydrophobicContact CD2-SD 4.06Å; L627-M631 HydrophobicContact CG-SD 4.45Å; L627-M631 PolarHBondContact O-N 3.46Å; H628-M631 WeakPolarHBondContact CA-O 3.42Å; H628-M631 CarbonylContact O-C 3.59Å; H628-M631 PolarHBondContact O-N 2.85Å; M631-V634 HydrophobicContact CB-CG2 4.48Å; M631-V634 HydrophobicContact CG-CB 4.5Å; M631-V634 HydrophobicContact CG-CG2 3.87Å; M631-V634 HydrophobicContact SD-CG2 3.99Å
632	S	87.6	Confident	90.4	Very high	18 Å²	18	18.8 Å²	18.8	13%	0.126	10%	0.104	C	C	.	.	S	Bend	trans	-77.7	-26.6	-177	63.7	0	0	0	0	112.8	H628 V634 A635 E636	H628-S632 PolarHBondContact O-N 2.74Å; S632-V634 PolarHBondContact O-N 3.04Å; S632-V634 VanDerWaalsContact O-N 3.13Å; S632-A635 PolarHBondContact O-N 3.12Å; S632-E636 WeakPolarHBondContact CB-OE1 3.35Å; S632-E636 PolarHBondContact O-N 3.48Å; S632-E636 PolarHBondContact OG-OE1 2.68Å
633	D	88.3	Confident	90.2	Very high	33 Å²	33	22 Å²	22	18%	0.176	12%	0.118	C	C	.	.	H	α-helix	trans	-54.5	-33.1	179.4	62.6	-10.9	0	0	0	113.6	R599 A635 E636 D637	R599-D633 WeakPolarHBondContact CD-OD1 3.46Å; R599-D633 IonicContact CZ-OD1 3.5Å; R599-D633 IonicContact CZ-OD2 2.92Å; R599-D633 VanDerWaalsContact CZ-OD2 3.23Å; R599-D633 VanDerWaalsContact NE-CG 3.31Å; R599-D633 IonicContact NE-OD1 3.34Å; R599-D633 PolarHBondContact NE-OD1 2.82Å; R599-D633 IonicContact NE-OD2 2.74Å; R599-D633 PolarHBondContact NE-OD2 3.44Å; R599-D633 IonicContact NH2-OD1 3.93Å; R599-D633 IonicContact NH2-OD2 2.58Å; R599-D633 PolarHBondContact NH2-OD2 2.9Å; D633-A635 VanDerWaalsContact C-N 3.31Å; D633-A635 PolarHBondContact O-N 3.1Å; D633-E636 PolarHBondContact O-N 3.1Å; D633-D637 VanDerWaalsContact O-CB 3.32Å; D633-D637 WeakPolarHBondContact O-CB 3.39Å; D633-D637 PolarHBondContact O-N 3.08Å
634	V	90.8	Very high	90	Very high	1 Å²	1	23 Å²	23	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-62.3	-35.1	174.3	177.7	0	0	0	0	112.9	R599 L602 V603 L606 V624 M631 S632 L638	R599-V634 HydrophobicContact CB-CG2 3.86Å; R599-V634 HydrophobicContact CG-CG2 3.95Å; L602-V634 HydrophobicContact CD2-CG1 4.48Å; V603-V634 HydrophobicContact CG2-CB 4.31Å; V603-V634 HydrophobicContact CG2-CG1 4.03Å; L606-V634 HydrophobicContact CD1-CG1 4.48Å; V624-V634 HydrophobicContact CG2-CG1 4.37Å; M631-V634 HydrophobicContact CB-CG2 4.48Å; M631-V634 HydrophobicContact CG-CB 4.5Å; M631-V634 HydrophobicContact CG-CG2 3.87Å; M631-V634 HydrophobicContact SD-CG2 3.99Å; S632-V634 PolarHBondContact O-N 3.04Å; S632-V634 VanDerWaalsContact O-N 3.13Å; V634-L638 VanDerWaalsContact O-CB 3.3Å; V634-L638 WeakPolarHBondContact O-CB 3.38Å
635	A	89.7	Confident	89.7	Confident	5 Å²	5	24.4 Å²	24.4	4%	0.041	14%	0.136	C	C	.	.	H	α-helix	trans	-83.3	-41.2	177.3	0	0	0	0	0	111.5	V624 S632 D633 C639 M676	V624-A635 HydrophobicContact CG1-CB 3.58Å; S632-A635 PolarHBondContact O-N 3.12Å; D633-A635 VanDerWaalsContact C-N 3.31Å; D633-A635 PolarHBondContact O-N 3.1Å; A635-C639 WeakPolarHBondContact O-CB 3.04Å; A635-C639 PolarHBondContact O-N 3.41Å; A635-C639 PolarHBondContact O-SG 3.26Å; A635-M676 HydrophobicContact CB-SD 4.12Å
636	E	90.8	Very high	89.6	Confident	104 Å²	104	24.7 Å²	24.7	49%	0.486	14%	0.136	S	C	.	.	H	α-helix	trans	-62.4	-51.9	180	-67.1	173.2	-113.8	0	0	111.6	S632 D633 L638 C639 S640	S632-E636 WeakPolarHBondContact CB-OE1 3.35Å; S632-E636 PolarHBondContact O-N 3.48Å; S632-E636 PolarHBondContact OG-OE1 2.68Å; D633-E636 PolarHBondContact O-N 3.1Å; E636-L638 PolarHBondContact O-N 3.34Å; E636-C639 PolarHBondContact O-N 3.29Å; E636-S640 PolarHBondContact O-N 3.09Å
637	D	90.8	Very high	89.5	Confident	46 Å²	46	29.6 Å²	29.6	25%	0.246	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-45.6	178.4	-75.9	-13	0	0	0	111	V603 D633 S640 M641	V603-D637 HydrophobicContact CG1-CB 4.02Å; V603-D637 HydrophobicContact CG2-CB 4.27Å; D633-D637 VanDerWaalsContact O-CB 3.32Å; D633-D637 WeakPolarHBondContact O-CB 3.39Å; D633-D637 PolarHBondContact O-N 3.08Å; D637-S640 PolarHBondContact O-N 3Å; D637-M641 WeakPolarHBondContact O-CG 3.22Å; D637-M641 PolarHBondContact O-N 3.06Å
638	L	92.2	Very high	89.3	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.3	-42.5	-178.9	-179.2	64.1	0	0	0	112.2	V603 L606 F607 V624 V634 E636 S640 M641 L642 F667 L671	V603-L638 HydrophobicContact CG1-CB 4.16Å; L606-L638 HydrophobicContact CB-CD1 4.48Å; L606-L638 HydrophobicContact CB-CD2 4.48Å; F607-L638 HydrophobicContact CB-CD1 4.07Å; F607-L638 HydrophobicContact CD2-CD1 4.44Å; V624-L638 HydrophobicContact CG2-CD2 3.7Å; V634-L638 VanDerWaalsContact O-CB 3.3Å; V634-L638 WeakPolarHBondContact O-CB 3.38Å; E636-L638 PolarHBondContact O-N 3.34Å; L638-S640 VanDerWaalsContact C-N 3.32Å; L638-S640 PolarHBondContact O-N 2.94Å; L638-M641 PolarHBondContact O-N 2.97Å; L638-L642 HydrophobicContact CD1-CD1 4.3Å; L638-L642 HydrophobicContact CD1-CG 4.48Å; L638-L642 HydrophobicContact CG-CD1 4.12Å; L638-L642 WeakPolarHBondContact O-CG 3.3Å; L638-L642 PolarHBondContact O-N 3.33Å; L638-F667 HydrophobicContact CD1-CE1 4.15Å; L638-F667 HydrophobicContact CD1-CZ 4.36Å; L638-F667 HydrophobicContact CD2-CE1 4.39Å; L638-F667 HydrophobicContact CD2-CE2 4.36Å; L638-F667 HydrophobicContact CD2-CZ 3.8Å; L638-L671 HydrophobicContact CD2-CD1 4.24Å; L638-L671 HydrophobicContact CG-CD1 4.49Å
639	C	91.3	Very high	89.1	Confident	14 Å²	14	31.3 Å²	31.3	10%	0.095	16%	0.162	C	C	.	.	H	α-helix	trans	-66	-36.3	176.9	-68.8	0	0	0	0	111.5	A635 E636 L642 K643 F677	A635-C639 WeakPolarHBondContact O-CB 3.04Å; A635-C639 PolarHBondContact O-N 3.41Å; A635-C639 PolarHBondContact O-SG 3.26Å; E636-C639 PolarHBondContact O-N 3.29Å; C639-L642 PolarHBondContact O-N 3.46Å; C639-K643 WeakPolarHBondContact O-CG 3.47Å; C639-K643 PolarHBondContact O-N 3.04Å; C639-F677 HydrophobicContact CB-CD2 4.13Å
640	S	90.6	Very high	89	Confident	32 Å²	32	30.1 Å²	30.1	22%	0.224	15%	0.152	C	C	.	.	H	α-helix	trans	-63.3	-49	173.2	-174.9	0	0	0	0	111.9	E636 D637 L638 L642 K643 G644	E636-S640 PolarHBondContact O-N 3.09Å; D637-S640 PolarHBondContact O-N 3Å; L638-S640 VanDerWaalsContact C-N 3.32Å; L638-S640 PolarHBondContact O-N 2.94Å; S640-L642 VanDerWaalsContact C-N 3.31Å; S640-L642 PolarHBondContact O-N 2.72Å; S640-K643 PolarHBondContact O-N 2.75Å; S640-K643 VanDerWaalsContact O-N 3.15Å; S640-G644 PolarHBondContact O-N 3.25Å
641	M	90.1	Very high	89	Confident	9 Å²	9	34.9 Å²	34.9	4%	0.044	17%	0.17	C	C	.	.	H	α-helix	trans	-57.5	-41.7	176.4	-70	-176.4	75.3	0	0	112.4	V603 F607 D637 L638 G644 D645	V603-M641 HydrophobicContact CG1-SD 3.85Å; F607-M641 HydrophobicContact CB-CE 4.18Å; F607-M641 HydrophobicContact CD1-CE 3.63Å; F607-M641 HydrophobicContact CD2-CB 3.78Å; F607-M641 HydrophobicContact CD2-CE 4.12Å; F607-M641 HydrophobicContact CE1-CE 3.98Å; F607-M641 HydrophobicContact CE2-CB 3.83Å; F607-M641 HydrophobicContact CE2-CE 4.44Å; F607-M641 HydrophobicContact CG-CB 4.5Å; F607-M641 HydrophobicContact CG-CE 3.71Å; F607-M641 HydrophobicContact CG-SD 4.42Å; F607-M641 HydrophobicContact CZ-CE 4.37Å; D637-M641 WeakPolarHBondContact O-CG 3.22Å; D637-M641 PolarHBondContact O-N 3.06Å; L638-M641 PolarHBondContact O-N 2.97Å; M641-G644 PolarHBondContact O-N 3.09Å; M641-D645 WeakPolarHBondContact O-CB 3.4Å; M641-D645 PolarHBondContact O-N 2.89Å
642	L	92.1	Very high	88.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-69.4	-35.7	177.3	-70	168.9	0	0	0	113	F607 L638 C639 S640 F646 T664 F667 I668 L671	F607-L642 HydrophobicContact CD2-CD2 4.1Å; F607-L642 HydrophobicContact CD2-CG 4.39Å; F607-L642 HydrophobicContact CE2-CD2 4.07Å; L638-L642 HydrophobicContact CD1-CD1 4.3Å; L638-L642 HydrophobicContact CD1-CG 4.48Å; L638-L642 HydrophobicContact CG-CD1 4.12Å; L638-L642 WeakPolarHBondContact O-CG 3.3Å; L638-L642 PolarHBondContact O-N 3.33Å; C639-L642 PolarHBondContact O-N 3.46Å; S640-L642 VanDerWaalsContact C-N 3.31Å; S640-L642 PolarHBondContact O-N 2.72Å; L642-F646 WeakPolarHBondContact O-CB 3.5Å; L642-F646 PolarHBondContact O-N 2.73Å; L642-T664 HydrophobicContact CD2-CG2 3.99Å; L642-F667 HydrophobicContact CD1-CB 4.34Å; L642-F667 HydrophobicContact CD1-CD1 3.89Å; L642-F667 HydrophobicContact CD1-CD2 4.46Å; L642-F667 HydrophobicContact CD1-CE1 4.31Å; L642-F667 HydrophobicContact CD1-CG 3.97Å; L642-F667 HydrophobicContact CD2-CB 4.31Å; L642-F667 HydrophobicContact CD2-CD1 3.86Å; L642-F667 HydrophobicContact CD2-CG 4.36Å; L642-F667 HydrophobicContact CG-CD1 4.48Å; L642-I668 HydrophobicContact CB-CD1 4.46Å; L642-I668 HydrophobicContact CB-CG1 4.11Å; L642-L671 HydrophobicContact CD1-CD1 3.42Å; L642-L671 VanDerWaalsContact CD1-CD1 3.42Å
643	K	90.4	Very high	87.9	Confident	69 Å²	69	44.1 Å²	44.1	30%	0.3	21%	0.207	S	C	.	.	H	α-helix	trans	-63.3	-41.2	171.9	-74.7	-176.9	-173.4	-167.9	0	111.4	C639 S640 R647 F677 D681	C639-K643 WeakPolarHBondContact O-CG 3.47Å; C639-K643 PolarHBondContact O-N 3.04Å; S640-K643 PolarHBondContact O-N 2.75Å; S640-K643 VanDerWaalsContact O-N 3.15Å; K643-R647 WeakPolarHBondContact O-CG 3.27Å; K643-R647 PolarHBondContact O-N 3.05Å; K643-R647 VanDerWaalsContact O-N 3.11Å; K643-F677 HydrophobicContact CD-CE2 4.42Å; K643-F677 HydrophobicContact CD-CZ 4.39Å; K643-F677 HydrophobicContact CG-CE2 3.73Å; K643-F677 HydrophobicContact CG-CZ 3.74Å; K643-D681 WeakPolarHBondContact CE-OD1 3.44Å; K643-D681 IonicContact NZ-OD1 2.7Å; K643-D681 PolarHBondContact NZ-OD1 2.86Å; K643-D681 IonicContact NZ-OD2 2.9Å; K643-D681 PolarHBondContact NZ-OD2 3.09Å
644	G	88	Confident	87.1	Confident	22 Å²	22	44.5 Å²	44.5	23%	0.227	21%	0.209	C	C	.	.	H	α-helix	trans	-62.9	-51.7	175.1	0	0	0	0	0	113	S640 M641 F646 R647 F648	S640-G644 PolarHBondContact O-N 3.25Å; M641-G644 PolarHBondContact O-N 3.09Å; G644-F646 VanDerWaalsContact C-N 3.33Å; G644-F646 PolarHBondContact O-N 3.43Å; G644-R647 PolarHBondContact O-N 2.96Å; G644-F648 PolarHBondContact O-N 3.28Å
645	D	88.4	Confident	85.9	Confident	30 Å²	30	49.7 Å²	49.7	16%	0.16	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-38.6	179.9	-167.1	50.4	0	0	0	112.2	F607 M641 F648 H649 T664	F607-D645 HydrophobicContact CE2-CB 4.06Å; F607-D645 HydrophobicContact CZ-CB 3.92Å; M641-D645 WeakPolarHBondContact O-CB 3.4Å; M641-D645 PolarHBondContact O-N 2.89Å; D645-F648 PolarHBondContact O-N 3.4Å; D645-H649 WeakPolarHBondContact O-CB 3.49Å; D645-H649 VanDerWaalsContact O-CG 3.26Å; D645-H649 PolarHBondContact O-N 2.7Å; D645-H649 IonicContact OD1-CE1 3.84Å; D645-H649 IonicContact OD1-NE2 3.18Å; D645-H649 IonicContact OD2-NE2 2.73Å; D645-T664 HydrophobicContact CB-CG2 4.07Å; D645-T664 WeakPolarHBondContact OD2-CB 3.37Å; D645-T664 WeakPolarHBondContact OD2-CG2 3.22Å; D645-T664 PolarHBondContact OD2-OG1 3.29Å
646	F	91.5	Very high	84.9	Confident	9 Å²	9	55.7 Å²	55.7	4%	0.039	26%	0.263	C	S	.	.	H	α-helix	trans	-62.2	-47.1	172.9	179.4	-96	0	0	0	112.8	L642 G644 F648 H649 I650 T664 V665 I668 C685 L689 M700	L642-F646 WeakPolarHBondContact O-CB 3.5Å; L642-F646 PolarHBondContact O-N 2.73Å; G644-F646 VanDerWaalsContact C-N 3.33Å; G644-F646 PolarHBondContact O-N 3.43Å; F646-F648 VanDerWaalsContact C-N 3.35Å; F646-F648 PolarHBondContact O-N 3.49Å; F646-H649 PolarHBondContact O-N 3.47Å; F646-I650 HydrophobicContact CD1-CD1 4.19Å; F646-I650 HydrophobicContact CE1-CD1 3.43Å; F646-I650 VanDerWaalsContact CE1-CD1 3.43Å; F646-I650 HydrophobicContact CE1-CG1 4.4Å; F646-I650 HydrophobicContact CE2-CD1 4.33Å; F646-I650 HydrophobicContact CZ-CD1 3.53Å; F646-I650 HydrophobicContact CZ-CG1 4.39Å; F646-I650 PolarHBondContact O-N 3.16Å; F646-I650 VanDerWaalsContact O-N 3.1Å; F646-T664 HydrophobicContact CB-CG2 4.37Å; F646-V665 HydrophobicContact CD2-CG2 3.91Å; F646-V665 HydrophobicContact CE2-CG2 3.89Å; F646-I668 HydrophobicContact CB-CD1 4Å; F646-I668 HydrophobicContact CD2-CD1 4.12Å; F646-I668 HydrophobicContact CG-CD1 4.2Å; F646-C685 HydrophobicContact CE1-CB 3.73Å; F646-C685 WeakPolarHBondContact CE1-SG 3.36Å; F646-C685 HydrophobicContact CE2-CB 4.08Å; F646-C685 HydrophobicContact CZ-CB 3.47Å; F646-C685 VanDerWaalsContact CZ-CB 3.47Å; F646-C685 WeakPolarHBondContact CZ-O 3.31Å; F646-L689 HydrophobicContact CE2-CD1 4.08Å; F646-L689 HydrophobicContact CE2-CD2 4.45Å; F646-L689 HydrophobicContact CE2-CG 4.36Å; F646-L689 HydrophobicContact CZ-CD1 4.15Å; F646-L689 HydrophobicContact CZ-CD2 4.36Å; F646-L689 HydrophobicContact CZ-CG 4.06Å; F646-M700 HydrophobicContact CD2-CE 4.27Å; F646-M700 HydrophobicContact CE2-CE 4.09Å
647	R	88.3	Confident	84.1	Confident	104 Å²	104	54 Å²	54	39%	0.392	26%	0.258	S	S	.	.	H	α-helix	trans	-60.9	-43.2	175.4	-74.3	176.5	177.7	-173.1	-0.6	111.4	K643 G644 H649 I650 R651	K643-R647 WeakPolarHBondContact O-CG 3.27Å; K643-R647 PolarHBondContact O-N 3.05Å; K643-R647 VanDerWaalsContact O-N 3.11Å; G644-R647 PolarHBondContact O-N 2.96Å; R647-H649 VanDerWaalsContact C-N 3.34Å; R647-H649 PolarHBondContact O-N 3.49Å; R647-I650 PolarHBondContact O-N 2.8Å; R647-R651 WeakPolarHBondContact O-CG 3.34Å; R647-R651 PolarHBondContact O-N 3.39Å
648	F	87.4	Confident	83.8	Confident	94 Å²	94	53.7 Å²	53.7	41%	0.412	26%	0.256	S	S	.	.	H	α-helix	trans	-59.9	-42.3	174.7	175.1	-106.2	0	0	0	112.1	G644 D645 F646 I650 R651 K652	G644-F648 PolarHBondContact O-N 3.28Å; D645-F648 PolarHBondContact O-N 3.4Å; F646-F648 VanDerWaalsContact C-N 3.35Å; F646-F648 PolarHBondContact O-N 3.49Å; F648-I650 PolarHBondContact O-N 3.4Å; F648-R651 PolarHBondContact O-N 3.41Å; F648-K652 HydrophobicContact CE1-CD 4.05Å; F648-K652 HydrophobicContact CZ-CD 3.8Å; F648-K652 VanDerWaalsContact O-CB 3.27Å; F648-K652 WeakPolarHBondContact O-CB 3.26Å; F648-K652 PolarHBondContact O-N 2.91Å
649	H	85.9	Confident	83.4	Confident	11 Å²	11	58.1 Å²	58.1	5%	0.051	28%	0.277	C	S	.	.	H	α-helix	trans	-66.8	-30.7	178.1	-77.6	-9.6	0	0	0	114.8	D645 F646 R647 K661 M700	D645-H649 WeakPolarHBondContact O-CB 3.49Å; D645-H649 VanDerWaalsContact O-CG 3.26Å; D645-H649 PolarHBondContact O-N 2.7Å; D645-H649 IonicContact OD1-CE1 3.84Å; D645-H649 IonicContact OD1-NE2 3.18Å; D645-H649 IonicContact OD2-NE2 2.73Å; F646-H649 PolarHBondContact O-N 3.47Å; R647-H649 VanDerWaalsContact C-N 3.34Å; R647-H649 PolarHBondContact O-N 3.49Å; H649-K661 HydrophobicContact CB-CD 4.47Å; H649-K661 HydrophobicContact CB-CG 4Å; H649-K661 VanDerWaalsContact O-CE 3.23Å; H649-K661 WeakPolarHBondContact O-CE 3.41Å; H649-K661 PolarHBondContact O-NZ 3.13Å; H649-M700 HydrophobicContact CB-CE 4.31Å
650	I	84.8	Confident	83.2	Confident	26 Å²	26	59.3 Å²	59.3	13%	0.133	28%	0.284	C	S	.	.	H	α-helix	trans	-74.6	-44.5	171.4	-70.3	-177.8	0	0	0	111.3	F646 R647 F648 K652 M688 L689	F646-I650 HydrophobicContact CD1-CD1 4.19Å; F646-I650 HydrophobicContact CE1-CD1 3.43Å; F646-I650 VanDerWaalsContact CE1-CD1 3.43Å; F646-I650 HydrophobicContact CE1-CG1 4.4Å; F646-I650 HydrophobicContact CE2-CD1 4.33Å; F646-I650 HydrophobicContact CZ-CD1 3.53Å; F646-I650 HydrophobicContact CZ-CG1 4.39Å; F646-I650 PolarHBondContact O-N 3.16Å; F646-I650 VanDerWaalsContact O-N 3.1Å; R647-I650 PolarHBondContact O-N 2.8Å; F648-I650 PolarHBondContact O-N 3.4Å; I650-K652 VanDerWaalsContact C-N 3.27Å; I650-K652 PolarHBondContact O-N 3.04Å; I650-M688 HydrophobicContact CD1-CB 3.85Å; I650-L689 HydrophobicContact CD1-CD2 3.97Å; I650-L689 HydrophobicContact CD1-CG 4.44Å; I650-L689 HydrophobicContact CG1-CD2 4.08Å
651	R	83.8	Confident	83.1	Confident	105 Å²	105	57.9 Å²	57.9	40%	0.396	27%	0.273	S	S	.	.	H	α-helix	trans	-59.6	-38.5	176.3	-72.2	172.5	173.9	-177.6	-5.8	111.7	E535 E539 R647 F648 K653	E535-R651 IonicContact OE1-CZ 3.84Å; E535-R651 IonicContact OE1-NH2 3.55Å; E535-R651 PolarHBondContact OE1-NH2 3.28Å; E535-R651 IonicContact OE2-NH2 2.75Å; E535-R651 PolarHBondContact OE2-NH2 3.36Å; E535-R651 VanDerWaalsContact OE2-NH2 3.11Å; E539-R651 IonicContact OE1-NH1 2.84Å; E539-R651 PolarHBondContact OE1-NH1 3.26Å; E539-R651 IonicContact OE2-CZ 2.71Å; E539-R651 IonicContact OE2-NH1 2.6Å; E539-R651 PolarHBondContact OE2-NH1 3.14Å; E539-R651 IonicContact OE2-NH2 3.85Å; R647-R651 WeakPolarHBondContact O-CG 3.34Å; R647-R651 PolarHBondContact O-N 3.39Å; F648-R651 PolarHBondContact O-N 3.41Å; R651-K653 PolarHBondContact O-N 3.3Å
652	K	80.9	Confident	83.2	Confident	78 Å²	78	58.6 Å²	58.6	34%	0.339	28%	0.277	S	S	.	.	S	Bend	trans	-89.8	86.3	-176.9	-161.9	-170.6	176.4	-108.4	0	111.5	F648 I650 D654 K661	F648-K652 HydrophobicContact CE1-CD 4.05Å; F648-K652 HydrophobicContact CZ-CD 3.8Å; F648-K652 VanDerWaalsContact O-CB 3.27Å; F648-K652 WeakPolarHBondContact O-CB 3.26Å; F648-K652 PolarHBondContact O-N 2.91Å; I650-K652 VanDerWaalsContact C-N 3.27Å; I650-K652 PolarHBondContact O-N 3.04Å; K652-D654 WeakPolarHBondContact CD-OD1 3.46Å; K652-D654 WeakPolarHBondContact CE-OD1 3.3Å; K652-D654 VanDerWaalsContact CG-OD1 3.3Å; K652-D654 WeakPolarHBondContact CG-OD1 3.41Å; K652-D654 IonicContact NZ-OD1 2.83Å; K652-D654 PolarHBondContact NZ-OD1 3.19Å; K652-D654 IonicContact NZ-OD2 3.94Å; K652-D654 PolarHBondContact NZ-OD2 2.91Å; K652-D654 PolarHBondContact O-N 2.87Å; K652-K661 PolarHBondContact O-NZ 3.28Å
653	K	70.8	Confident	83.2	Confident	135 Å²	135	59.2 Å²	59.2	59%	0.587	28%	0.28	S	S	*	.			trans	-69	17.3	-172.7	-55	-160.2	-179.5	-162	0	117.1	R651 D692 H696	R651-K653 PolarHBondContact O-N 3.3Å; K653-D692 WeakPolarHBondContact CE-OD2 3.22Å; K653-D692 IonicContact NZ-OD2 2.7Å; K653-D692 PolarHBondContact NZ-OD2 2.89Å; K653-H696 PolarHBondContact O-CE1 2.85Å; K653-H696 VanDerWaalsContact O-CE1 3.26Å
654	D	71.4	Confident	83.3	Confident	41 Å²	41	56 Å²	56	22%	0.219	27%	0.266	C	S	.	.			trans	-82.4	147.2	178.2	73.2	-42.5	0	0	0	112.9	K652 K661	K652-D654 WeakPolarHBondContact CD-OD1 3.46Å; K652-D654 WeakPolarHBondContact CE-OD1 3.3Å; K652-D654 VanDerWaalsContact CG-OD1 3.3Å; K652-D654 WeakPolarHBondContact CG-OD1 3.41Å; K652-D654 IonicContact NZ-OD1 2.83Å; K652-D654 PolarHBondContact NZ-OD1 3.19Å; K652-D654 IonicContact NZ-OD2 3.94Å; K652-D654 PolarHBondContact NZ-OD2 2.91Å; K652-D654 PolarHBondContact O-N 2.87Å; D654-K661 PolarHBondContact O-NZ 2.98Å
655	Q	65.7	Low	83.5	Confident	109 Å²	109	55 Å²	55	51%	0.509	26%	0.255	S	S	.	.	S	Bend	trans	-89.7	-8.1	179.4	-61.4	-176.5	10	0	0	113.1	N657 I658 H695	Q655-N657 VanDerWaalsContact C-N 3.32Å; Q655-N657 PolarHBondContact O-N 2.82Å; Q655-I658 PolarHBondContact O-N 3.48Å; Q655-H695 PolarHBondContact NE2-CD2 2.95Å
656	I	67.8	Low	83.8	Confident	131 Å²	131	57.4 Å²	57.4	67%	0.672	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-38	-169.1	-55.7	175.3	0	0	0	111.7
657	N	74.3	Confident	83.9	Confident	68 Å²	68	57 Å²	57	36%	0.364	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	40	-175	-66	5.3	0	0	0	113.2	Q655 E659 T660 K661	Q655-N657 VanDerWaalsContact C-N 3.32Å; Q655-N657 PolarHBondContact O-N 2.82Å; N657-E659 VanDerWaalsContact C-N 3.26Å; N657-E659 PolarHBondContact O-N 3.03Å; N657-T660 PolarHBondContact O-N 3.42Å; N657-T660 VanDerWaalsContact O-N 3.11Å; N657-K661 PolarHBondContact O-N 3.01Å; N657-K661 VanDerWaalsContact O-N 3.15Å
658	I	83.9	Confident	84.3	Confident	41 Å²	41	52.1 Å²	52.1	21%	0.21	24%	0.242	C	C	.	.	H	α-helix	trans	-58.2	-34.9	-177.2	-172.4	54.1	0	0	0	113.5	Q655 T660 K661 N662 H696 E699	Q655-I658 PolarHBondContact O-N 3.48Å; I658-T660 VanDerWaalsContact C-N 3.33Å; I658-T660 PolarHBondContact O-N 3Å; I658-K661 HydrophobicContact CD1-CB 4.26Å; I658-K661 WeakPolarHBondContact O-CB 3.33Å; I658-K661 PolarHBondContact O-N 2.68Å; I658-N662 PolarHBondContact O-N 2.65Å; I658-H696 HydrophobicContact CD1-CB 3.86Å; I658-E699 HydrophobicContact CD1-CB 4.19Å
659	E	84.9	Confident	84.6	Confident	93 Å²	93	47.6 Å²	47.6	44%	0.435	22%	0.222	S	C	.	.	H	α-helix	trans	-61.1	-40.9	176.1	-57.6	179.5	136.8	0	0	112.2	R611 N657 N662 K663	R611-E659 HydrophobicContact CB-CB 4.19Å; R611-E659 VanDerWaalsContact CD-OE2 3.23Å; R611-E659 WeakPolarHBondContact CD-OE2 3.34Å; R611-E659 IonicContact CZ-OE2 3.65Å; R611-E659 IonicContact NE-OE2 3.15Å; R611-E659 IonicContact NH1-OE2 2.66Å; R611-E659 PolarHBondContact NH1-OE2 2.63Å; N657-E659 VanDerWaalsContact C-N 3.26Å; N657-E659 PolarHBondContact O-N 3.03Å; E659-N662 PolarHBondContact O-N 3.41Å; E659-K663 WeakPolarHBondContact O-CB 3.3Å; E659-K663 PolarHBondContact O-N 2.93Å
660	T	86.6	Confident	85	Confident	39 Å²	39	47.7 Å²	47.7	24%	0.239	22%	0.223	C	C	.	.	H	α-helix	trans	-68	-40.9	176.6	-46.3	0	0	0	0	111	N657 I658 N662 K663 T664	N657-T660 PolarHBondContact O-N 3.42Å; N657-T660 VanDerWaalsContact O-N 3.11Å; I658-T660 VanDerWaalsContact C-N 3.33Å; I658-T660 PolarHBondContact O-N 3Å; T660-N662 VanDerWaalsContact C-N 3.34Å; T660-N662 PolarHBondContact O-N 2.86Å; T660-K663 WeakPolarHBondContact O-CB 3.39Å; T660-K663 PolarHBondContact O-N 3.45Å; T660-T664 PolarHBondContact O-N 2.91Å
661	K	89	Confident	85.5	Confident	1 Å²	1	46.4 Å²	46.4	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-57.8	-46.9	173.8	-67.1	-175.1	167.6	-179.3	0	111.3	H649 K652 D654 N657 I658 T664 V665 H696 M700	H649-K661 HydrophobicContact CB-CD 4.47Å; H649-K661 HydrophobicContact CB-CG 4Å; H649-K661 VanDerWaalsContact O-CE 3.23Å; H649-K661 WeakPolarHBondContact O-CE 3.41Å; H649-K661 PolarHBondContact O-NZ 3.13Å; K652-K661 PolarHBondContact O-NZ 3.28Å; D654-K661 PolarHBondContact O-NZ 2.98Å; N657-K661 PolarHBondContact O-N 3.01Å; N657-K661 VanDerWaalsContact O-N 3.15Å; I658-K661 HydrophobicContact CD1-CB 4.26Å; I658-K661 WeakPolarHBondContact O-CB 3.33Å; I658-K661 PolarHBondContact O-N 2.68Å; K661-T664 PolarHBondContact O-N 3.12Å; K661-V665 WeakPolarHBondContact O-CG2 3.38Å; K661-V665 PolarHBondContact O-N 2.94Å; K661-H696 PolarHBondContact NZ-CD2 2.79Å; K661-H696 PolarHBondContact NZ-NE2 2.59Å; K661-H696 VanDerWaalsContact NZ-NE2 3.17Å; K661-M700 HydrophobicContact CB-CE 4.21Å; K661-M700 HydrophobicContact CB-CG 4.03Å; K661-M700 HydrophobicContact CB-SD 3.82Å; K661-M700 HydrophobicContact CD-SD 3.92Å; K661-M700 HydrophobicContact CG-SD 4.25Å
662	N	90.4	Very high	85.9	Confident	25 Å²	25	41.5 Å²	41.5	13%	0.134	20%	0.198	C	C	.	.	H	α-helix	trans	-70.8	-33.1	179.3	-68.5	-8.4	0	0	0	112.7	I658 E659 T660 R666 T703	I658-N662 PolarHBondContact O-N 2.65Å; E659-N662 PolarHBondContact O-N 3.41Å; T660-N662 VanDerWaalsContact C-N 3.34Å; T660-N662 PolarHBondContact O-N 2.86Å; N662-R666 VanDerWaalsContact O-CB 3.3Å; N662-R666 WeakPolarHBondContact O-CB 3.48Å; N662-R666 PolarHBondContact O-N 3.35Å; N662-T703 HydrophobicContact CB-CG2 4.23Å
663	K	92.6	Very high	86.5	Confident	13 Å²	13	38.7 Å²	38.7	6%	0.057	19%	0.186	C	C	.	.	H	α-helix	trans	-54.4	-54.1	170.8	-178.7	-142.3	67.6	167.3	0	111.1	F607 V609 L614 E659 T660 R666 F667	F607-K663 PolarHBondContact O-NZ 3.29Å; V609-K663 HydrophobicContact CB-CD 4.46Å; L614-K663 HydrophobicContact CD2-CB 3.81Å; L614-K663 HydrophobicContact CD2-CG 3.91Å; E659-K663 WeakPolarHBondContact O-CB 3.3Å; E659-K663 PolarHBondContact O-N 2.93Å; T660-K663 WeakPolarHBondContact O-CB 3.39Å; T660-K663 PolarHBondContact O-N 3.45Å; K663-R666 PolarHBondContact O-N 2.92Å; K663-F667 WeakPolarHBondContact O-CB 3.32Å; K663-F667 PolarHBondContact O-N 2.75Å
664	T	92.1	Very high	87.6	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.7	-40.9	-175	-65.8	0	0	0	0	111.6	L642 D645 F646 T660 K661 F667 I668	L642-T664 HydrophobicContact CD2-CG2 3.99Å; D645-T664 HydrophobicContact CB-CG2 4.07Å; D645-T664 WeakPolarHBondContact OD2-CB 3.37Å; D645-T664 WeakPolarHBondContact OD2-CG2 3.22Å; D645-T664 PolarHBondContact OD2-OG1 3.29Å; F646-T664 HydrophobicContact CB-CG2 4.37Å; T660-T664 PolarHBondContact O-N 2.91Å; K661-T664 PolarHBondContact O-N 3.12Å; T664-F667 PolarHBondContact O-N 2.82Å; T664-I668 HydrophobicContact CG2-CD1 4.41Å; T664-I668 WeakPolarHBondContact O-CG1 3.46Å; T664-I668 PolarHBondContact O-N 3.15Å; T664-I668 VanDerWaalsContact O-N 3.08Å
665	V	93.3	Very high	88.6	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.006	18%	0.179	C	C	.	.	H	α-helix	trans	-66.7	-42.3	176.1	175.5	0	0	0	0	112.6	F646 K661 F667 I668 G669 M700 L704	F646-V665 HydrophobicContact CD2-CG2 3.91Å; F646-V665 HydrophobicContact CE2-CG2 3.89Å; K661-V665 WeakPolarHBondContact O-CG2 3.38Å; K661-V665 PolarHBondContact O-N 2.94Å; V665-F667 VanDerWaalsContact C-N 3.34Å; V665-F667 PolarHBondContact O-N 3.45Å; V665-I668 PolarHBondContact O-N 3.48Å; V665-G669 PolarHBondContact O-N 3.01Å; V665-M700 WeakPolarHBondContact CG1-O 3.49Å; V665-M700 HydrophobicContact CG2-CB 4.19Å; V665-M700 HydrophobicContact CG2-CE 3.55Å; V665-M700 HydrophobicContact CG2-CG 4.21Å; V665-L704 HydrophobicContact CG1-CB 3.55Å; V665-L704 HydrophobicContact CG1-CD1 3.96Å; V665-L704 HydrophobicContact CG1-CG 4.2Å
666	R	94	Very high	89.8	Confident	82 Å²	82	34.5 Å²	34.5	31%	0.309	17%	0.165	S	C	.	.	H	α-helix	trans	-62.5	-40.4	173.8	178.6	172	-80.5	-163.8	-0.6	111.4	L617 N662 K663 I668 G669 E670 T703 T707	L617-R666 HydrophobicContact CD1-CB 3.99Å; L617-R666 HydrophobicContact CD1-CG 3.77Å; N662-R666 VanDerWaalsContact O-CB 3.3Å; N662-R666 WeakPolarHBondContact O-CB 3.48Å; N662-R666 PolarHBondContact O-N 3.35Å; K663-R666 PolarHBondContact O-N 2.92Å; R666-I668 PolarHBondContact O-N 3.4Å; R666-G669 PolarHBondContact O-N 2.98Å; R666-G669 VanDerWaalsContact O-N 3.12Å; R666-E670 PolarHBondContact O-N 2.78Å; R666-T703 HydrophobicContact CB-CG2 4.23Å; R666-T707 HydrophobicContact CG-CG2 3.94Å; R666-T707 WeakPolarHBondContact O-CG2 3.39Å
667	F	95.1	Very high	90.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.2	-39.6	179.1	-157.4	177	0	0	0	112	L606 V609 L617 S621 L638 L642 K663 T664 V665 G669 E670 L671	L606-F667 VanDerWaalsContact O-CE1 3.28Å; L606-F667 WeakPolarHBondContact O-CE1 3.44Å; V609-F667 HydrophobicContact CG2-CE1 4.46Å; L617-F667 HydrophobicContact CD1-CB 4.31Å; L617-F667 HydrophobicContact CD2-CB 4.15Å; L617-F667 HydrophobicContact CD2-CD1 3.92Å; L617-F667 HydrophobicContact CD2-CD2 4.23Å; L617-F667 HydrophobicContact CD2-CE1 4.35Å; L617-F667 HydrophobicContact CD2-CG 3.86Å; S621-F667 WeakPolarHBondContact OG-CE2 3.48Å; L638-F667 HydrophobicContact CD1-CE1 4.15Å; L638-F667 HydrophobicContact CD1-CZ 4.36Å; L638-F667 HydrophobicContact CD2-CE1 4.39Å; L638-F667 HydrophobicContact CD2-CE2 4.36Å; L638-F667 HydrophobicContact CD2-CZ 3.8Å; L642-F667 HydrophobicContact CD1-CB 4.34Å; L642-F667 HydrophobicContact CD1-CD1 3.89Å; L642-F667 HydrophobicContact CD1-CD2 4.46Å; L642-F667 HydrophobicContact CD1-CE1 4.31Å; L642-F667 HydrophobicContact CD1-CG 3.97Å; L642-F667 HydrophobicContact CD2-CB 4.31Å; L642-F667 HydrophobicContact CD2-CD1 3.86Å; L642-F667 HydrophobicContact CD2-CG 4.36Å; L642-F667 HydrophobicContact CG-CD1 4.48Å; K663-F667 WeakPolarHBondContact O-CB 3.32Å; K663-F667 PolarHBondContact O-N 2.75Å; T664-F667 PolarHBondContact O-N 2.82Å; V665-F667 VanDerWaalsContact C-N 3.34Å; V665-F667 PolarHBondContact O-N 3.45Å; F667-G669 VanDerWaalsContact C-N 3.32Å; F667-G669 PolarHBondContact O-N 2.79Å; F667-E670 PolarHBondContact O-N 3.17Å; F667-L671 HydrophobicContact CD2-CD1 3.94Å; F667-L671 HydrophobicContact CD2-CG 4.03Å; F667-L671 HydrophobicContact CE2-CD1 4.01Å; F667-L671 HydrophobicContact CE2-CD2 4.41Å; F667-L671 HydrophobicContact CE2-CG 4.09Å; F667-L671 WeakPolarHBondContact O-CG 3.44Å; F667-L671 PolarHBondContact O-N 2.79Å
668	I	95	Very high	91.5	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-58	-44.2	170.3	-70.8	167.3	0	0	0	110.9	L642 F646 T664 V665 R666 L671 S672 F677 T682	L642-I668 HydrophobicContact CB-CD1 4.46Å; L642-I668 HydrophobicContact CB-CG1 4.11Å; F646-I668 HydrophobicContact CB-CD1 4Å; F646-I668 HydrophobicContact CD2-CD1 4.12Å; F646-I668 HydrophobicContact CG-CD1 4.2Å; T664-I668 HydrophobicContact CG2-CD1 4.41Å; T664-I668 WeakPolarHBondContact O-CG1 3.46Å; T664-I668 PolarHBondContact O-N 3.15Å; T664-I668 VanDerWaalsContact O-N 3.08Å; V665-I668 PolarHBondContact O-N 3.48Å; R666-I668 PolarHBondContact O-N 3.4Å; I668-L671 PolarHBondContact O-N 3.12Å; I668-S672 WeakPolarHBondContact O-CB 2.94Å; I668-S672 PolarHBondContact O-N 3.26Å; I668-S672 PolarHBondContact O-OG 3.29Å; I668-F677 HydrophobicContact CD1-CE2 4.48Å; I668-F677 HydrophobicContact CD1-CZ 4.25Å; I668-F677 HydrophobicContact CG1-CD2 4.48Å; I668-F677 HydrophobicContact CG1-CE2 4Å; I668-F677 HydrophobicContact CG1-CZ 4.11Å; I668-F677 HydrophobicContact CG2-CD1 3.75Å; I668-F677 HydrophobicContact CG2-CD2 4.38Å; I668-F677 HydrophobicContact CG2-CE1 3.52Å; I668-F677 HydrophobicContact CG2-CE2 4.21Å; I668-F677 HydrophobicContact CG2-CG 4.16Å; I668-F677 HydrophobicContact CG2-CZ 3.77Å; I668-T682 HydrophobicContact CG2-CG2 4.33Å
669	G	94.3	Very high	91.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.7	-38.6	177.3	0	0	0	0	0	114.2	V665 R666 F667 S672 K673 C708	V665-G669 PolarHBondContact O-N 3.01Å; R666-G669 PolarHBondContact O-N 2.98Å; R666-G669 VanDerWaalsContact O-N 3.12Å; F667-G669 VanDerWaalsContact C-N 3.32Å; F667-G669 PolarHBondContact O-N 2.79Å; G669-S672 WeakPolarHBondContact O-CB 3.45Å; G669-S672 PolarHBondContact O-N 3.06Å; G669-K673 WeakPolarHBondContact O-CE 3.29Å; G669-K673 PolarHBondContact O-N 3.19Å; G669-C708 WeakPolarHBondContact O-CB 3.49Å
670	E	95.2	Very high	91.8	Very high	12 Å²	12	27.5 Å²	27.5	6%	0.056	14%	0.138	C	C	.	.	H	α-helix	trans	-66.5	-47.1	174.2	-67.7	-56	146.8	0	0	112.3	Y469 L617 P618 S621 R666 F667 S672 K673 F674 T707	Y469-E670 PolarHBondContact OH-OE2 3.42Å; L617-E670 HydrophobicContact CB-CG 4.21Å; P618-E670 HydrophobicContact CG-CG 4.23Å; S621-E670 WeakPolarHBondContact OG-CB 3.36Å; R666-E670 PolarHBondContact O-N 2.78Å; F667-E670 PolarHBondContact O-N 3.17Å; E670-S672 PolarHBondContact O-N 3.47Å; E670-K673 VanDerWaalsContact CD-CE 3.5Å; E670-K673 PolarHBondContact O-N 3.43Å; E670-K673 VanDerWaalsContact O-N 3.16Å; E670-K673 IonicContact OE1-NZ 3.61Å; E670-K673 PolarHBondContact OE1-NZ 3.26Å; E670-K673 WeakPolarHBondContact OE2-CE 3.46Å; E670-K673 IonicContact OE2-NZ 3.23Å; E670-K673 PolarHBondContact OE2-NZ 3.14Å; E670-F674 WeakPolarHBondContact O-CD2 3.26Å; E670-F674 PolarHBondContact O-N 3.29Å; E670-T707 HydrophobicContact CG-CG2 4.17Å; E670-T707 WeakPolarHBondContact OE1-CG2 3.26Å
671	L	93.7	Very high	91.8	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.7	-28.6	176.2	-69.9	168.6	0	0	0	112.7	V624 L638 L642 F667 I668 F674 K675 M676 F677	V624-L671 HydrophobicContact CB-CD2 4.39Å; V624-L671 HydrophobicContact CG1-CD2 4.27Å; L638-L671 HydrophobicContact CD2-CD1 4.24Å; L638-L671 HydrophobicContact CG-CD1 4.49Å; L642-L671 HydrophobicContact CD1-CD1 3.42Å; L642-L671 VanDerWaalsContact CD1-CD1 3.42Å; F667-L671 HydrophobicContact CD2-CD1 3.94Å; F667-L671 HydrophobicContact CD2-CG 4.03Å; F667-L671 HydrophobicContact CE2-CD1 4.01Å; F667-L671 HydrophobicContact CE2-CD2 4.41Å; F667-L671 HydrophobicContact CE2-CG 4.09Å; F667-L671 WeakPolarHBondContact O-CG 3.44Å; F667-L671 PolarHBondContact O-N 2.79Å; I668-L671 PolarHBondContact O-N 3.12Å; L671-F674 CarbonylContact O-C 3.41Å; L671-F674 PolarHBondContact O-N 2.96Å; L671-K675 PolarHBondContact O-N 3.13Å; L671-M676 HydrophobicContact CB-CB 4.34Å; L671-M676 HydrophobicContact CD2-CB 4.08Å; L671-M676 HydrophobicContact CD2-CG 4.41Å; L671-M676 PolarHBondContact O-N 2.73Å; L671-F677 HydrophobicContact CB-CB 3.96Å; L671-F677 PolarHBondContact O-N 2.64Å; L671-F677 VanDerWaalsContact O-N 3.17Å
672	S	93.9	Very high	91.9	Very high	1 Å²	1	28 Å²	28	1%	0.007	14%	0.139	C	C	.	.	H	α-helix	trans	-65.8	-41.3	173.1	-58.4	0	0	0	0	112	I668 G669 E670 F674 K675 T682 F711	I668-S672 WeakPolarHBondContact O-CB 2.94Å; I668-S672 PolarHBondContact O-N 3.26Å; I668-S672 PolarHBondContact O-OG 3.29Å; G669-S672 WeakPolarHBondContact O-CB 3.45Å; G669-S672 PolarHBondContact O-N 3.06Å; E670-S672 PolarHBondContact O-N 3.47Å; S672-F674 VanDerWaalsContact C-N 3.34Å; S672-F674 PolarHBondContact O-N 3.32Å; S672-K675 PolarHBondContact O-N 3.37Å; S672-T682 WeakPolarHBondContact OG-CG2 3.33Å; S672-T682 PolarHBondContact OG-OG1 2.87Å; S672-F711 VanDerWaalsContact O-CE1 3.28Å; S672-F711 WeakPolarHBondContact O-CE1 3.31Å; S672-F711 WeakPolarHBondContact O-CZ 3.07Å
673	K	93.7	Very high	91.8	Very high	20 Å²	20	27.4 Å²	27.4	9%	0.087	14%	0.136	C	C	.	.	H	α-helix	trans	-64.4	-37.6	175.9	-74.7	178.1	-67.4	-173.4	0	112.1	W460 Y469 G669 E670 K675 T707 C708 F711	W460-K673 HydrophobicContact CH2-CB 3.97Å; W460-K673 HydrophobicContact CH2-CG 4.34Å; W460-K673 HydrophobicContact CZ3-CB 4.17Å; W460-K673 HydrophobicContact CZ3-CD 4.2Å; W460-K673 HydrophobicContact CZ3-CG 4.14Å; Y469-K673 HydrophobicContact CD1-CB 3.69Å; Y469-K673 HydrophobicContact CE1-CB 3.68Å; Y469-K673 HydrophobicContact CE1-CD 4.03Å; Y469-K673 HydrophobicContact CE1-CG 4.48Å; Y469-K673 HydrophobicContact CE2-CD 4.31Å; Y469-K673 HydrophobicContact CG-CB 4.35Å; Y469-K673 WeakPolarHBondContact OH-CE 3.48Å; Y469-K673 PolarHBondContact OH-NZ 3.13Å; G669-K673 WeakPolarHBondContact O-CE 3.29Å; G669-K673 PolarHBondContact O-N 3.19Å; E670-K673 VanDerWaalsContact CD-CE 3.5Å; E670-K673 PolarHBondContact O-N 3.43Å; E670-K673 VanDerWaalsContact O-N 3.16Å; E670-K673 IonicContact OE1-NZ 3.61Å; E670-K673 PolarHBondContact OE1-NZ 3.26Å; E670-K673 WeakPolarHBondContact OE2-CE 3.46Å; E670-K673 IonicContact OE2-NZ 3.23Å; E670-K673 PolarHBondContact OE2-NZ 3.14Å; K673-K675 PolarHBondContact O-N 2.93Å; K673-T707 WeakPolarHBondContact CD-O 3.46Å; K673-T707 WeakPolarHBondContact CE-O 3.32Å; K673-T707 PolarHBondContact NZ-O 2.89Å; K673-C708 HydrophobicContact CD-CB 4.44Å; K673-C708 HydrophobicContact CG-CB 4.12Å; K673-F711 HydrophobicContact CG-CB 4.02Å; K673-F711 HydrophobicContact CG-CD1 4.23Å; K673-F711 HydrophobicContact CG-CD2 4.21Å; K673-F711 HydrophobicContact CG-CG 3.91Å
674	F	93.6	Very high	91.6	Very high	11 Å²	11	31.7 Å²	31.7	5%	0.048	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	2.7	171.2	-77.1	-71.8	0	0	0	114.7	F468 Y469 L472 R622 A625 E670 L671 S672 M676	F468-F674 HydrophobicContact CD1-CE2 4.49Å; F468-F674 AromaticContact CD1-CZ 3.93Å; F468-F674 HydrophobicContact CD1-CZ 3.93Å; F468-F674 AromaticContact CE1-CE2 3.96Å; F468-F674 HydrophobicContact CE1-CE2 3.96Å; F468-F674 AromaticContact CE1-CZ 3.65Å; F468-F674 HydrophobicContact CE1-CZ 3.65Å; F468-F674 HydrophobicContact CZ-CZ 4.4Å; F468-F674 WeakPolarHBondContact O-CE1 3.36Å; F468-F674 WeakPolarHBondContact O-CZ 3.21Å; Y469-F674 HydrophobicContact CD1-CD1 4.19Å; Y469-F674 AromaticContact CD1-CD2 3.74Å; Y469-F674 HydrophobicContact CD1-CD2 3.74Å; Y469-F674 AromaticContact CD1-CE1 3.88Å; Y469-F674 HydrophobicContact CD1-CE1 3.88Å; Y469-F674 AromaticContact CD1-CE2 3.4Å; Y469-F674 HydrophobicContact CD1-CE2 3.4Å; Y469-F674 HydrophobicContact CD1-CG 4.13Å; Y469-F674 AromaticContact CD1-CZ 3.45Å; Y469-F674 HydrophobicContact CD1-CZ 3.45Å; Y469-F674 VanDerWaalsContact CD1-CZ 3.45Å; Y469-F674 AromaticContact CE1-CD2 3.98Å; Y469-F674 HydrophobicContact CE1-CD2 3.98Å; Y469-F674 AromaticContact CE1-CE2 3.5Å; Y469-F674 HydrophobicContact CE1-CE2 3.5Å; Y469-F674 VanDerWaalsContact CE1-CE2 3.5Å; Y469-F674 AromaticContact CE1-CZ 3.92Å; Y469-F674 HydrophobicContact CE1-CZ 3.92Å; Y469-F674 HydrophobicContact CG-CZ 4.31Å; L472-F674 HydrophobicContact CD2-CD1 4.38Å; L472-F674 HydrophobicContact CD2-CE1 3.94Å; R622-F674 HydrophobicContact CB-CE1 4.02Å; R622-F674 HydrophobicContact CB-CE2 4Å; R622-F674 HydrophobicContact CB-CZ 3.47Å; R622-F674 VanDerWaalsContact CB-CZ 3.47Å; R622-F674 HydrophobicContact CG-CE1 4.02Å; R622-F674 HydrophobicContact CG-CZ 3.88Å; A625-F674 HydrophobicContact CB-CB 3.89Å; A625-F674 HydrophobicContact CB-CD1 3.64Å; A625-F674 HydrophobicContact CB-CE1 4.42Å; A625-F674 HydrophobicContact CB-CG 3.89Å; E670-F674 WeakPolarHBondContact O-CD2 3.26Å; E670-F674 PolarHBondContact O-N 3.29Å; L671-F674 CarbonylContact O-C 3.41Å; L671-F674 PolarHBondContact O-N 2.96Å; S672-F674 VanDerWaalsContact C-N 3.34Å; S672-F674 PolarHBondContact O-N 3.32Å; F674-M676 HydrophobicContact CB-CG 4.14Å; F674-M676 PolarHBondContact O-N 3.38Å
675	K	91.4	Very high	91.6	Very high	140 Å²	140	32 Å²	32	61%	0.609	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	18.2	-179.4	-49	167.2	-171.5	167.5	0	114.2	L671 S672 K673	L671-K675 PolarHBondContact O-N 3.13Å; S672-K675 PolarHBondContact O-N 3.37Å; K673-K675 PolarHBondContact O-N 2.93Å
676	M	90.6	Very high	91.6	Very high	45 Å²	45	32.1 Å²	32.1	22%	0.222	16%	0.158	C	C	.	.	S	Bend	trans	-82.9	-32.1	174.9	-61.1	-67.3	93.5	0	0	111.6	V624 A625 H628 A635 L671 F674	V624-M676 HydrophobicContact CG1-CG 4.46Å; A625-M676 HydrophobicContact CB-CG 4.15Å; A625-M676 HydrophobicContact CB-SD 4.31Å; H628-M676 HydrophobicContact CB-CE 4.5Å; H628-M676 HydrophobicContact CB-SD 3.78Å; A635-M676 HydrophobicContact CB-SD 4.12Å; L671-M676 HydrophobicContact CB-CB 4.34Å; L671-M676 HydrophobicContact CD2-CB 4.08Å; L671-M676 HydrophobicContact CD2-CG 4.41Å; L671-M676 PolarHBondContact O-N 2.73Å; F674-M676 HydrophobicContact CB-CG 4.14Å; F674-M676 PolarHBondContact O-N 3.38Å
677	F	90	Very high	91.4	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.018	17%	0.168	C	C	.	.	S	Bend	trans	-103.1	135	170	-155.8	-87.4	0	0	0	108.6	C639 K643 I668 L671 D681	C639-F677 HydrophobicContact CB-CD2 4.13Å; K643-F677 HydrophobicContact CD-CE2 4.42Å; K643-F677 HydrophobicContact CD-CZ 4.39Å; K643-F677 HydrophobicContact CG-CE2 3.73Å; K643-F677 HydrophobicContact CG-CZ 3.74Å; I668-F677 HydrophobicContact CD1-CE2 4.48Å; I668-F677 HydrophobicContact CD1-CZ 4.25Å; I668-F677 HydrophobicContact CG1-CD2 4.48Å; I668-F677 HydrophobicContact CG1-CE2 4Å; I668-F677 HydrophobicContact CG1-CZ 4.11Å; I668-F677 HydrophobicContact CG2-CD1 3.75Å; I668-F677 HydrophobicContact CG2-CD2 4.38Å; I668-F677 HydrophobicContact CG2-CE1 3.52Å; I668-F677 HydrophobicContact CG2-CE2 4.21Å; I668-F677 HydrophobicContact CG2-CG 4.16Å; I668-F677 HydrophobicContact CG2-CZ 3.77Å; L671-F677 HydrophobicContact CB-CB 3.96Å; L671-F677 PolarHBondContact O-N 2.64Å; L671-F677 VanDerWaalsContact O-N 3.17Å; F677-D681 HydrophobicContact CD1-CB 3.81Å; F677-D681 HydrophobicContact CE1-CB 3.32Å; F677-D681 HydrophobicContact CZ-CB 4.05Å
678	S	89.1	Confident	91.1	Very high	51 Å²	51	35.9 Å²	35.9	36%	0.357	18%	0.178	S	C	.	.			trans	-75.3	140.5	-172.9	88.8	0	0	0	0	111.6	T680 D681 T682	S678-T680 PolarHBondContact O-N 3.26Å; S678-D681 WeakPolarHBondContact CB-OD2 3.36Å; S678-D681 WeakPolarHBondContact O-CB 3.13Å; S678-D681 PolarHBondContact O-N 3.47Å; S678-D681 WeakPolarHBondContact OG-CB 3.38Å; S678-D681 PolarHBondContact OG-N 3.05Å; S678-D681 VanDerWaalsContact OG-N 3.07Å; S678-D681 PolarHBondContact OG-OD2 3.3Å; S678-T682 PolarHBondContact O-N 3.05Å; S678-T682 PolarHBondContact O-OG1 3.23Å
679	K	87.4	Confident	90.9	Very high	43 Å²	43	35.9 Å²	35.9	19%	0.187	18%	0.178	C	C	.	.	H	α-helix	trans	-57.4	-33.5	177.5	-60.6	176	-172	159.4	0	112.1	T682 L683 F711 L712 S715 D717	K679-T682 PolarHBondContact O-N 3.18Å; K679-L683 WeakPolarHBondContact O-CB 3.44Å; K679-L683 VanDerWaalsContact O-CG 3.25Å; K679-L683 WeakPolarHBondContact O-CG 3.33Å; K679-L683 PolarHBondContact O-N 2.93Å; K679-F711 HydrophobicContact CG-CE1 4.34Å; K679-L712 HydrophobicContact CB-CD2 3.83Å; K679-L712 HydrophobicContact CD-CD2 4.41Å; K679-L712 HydrophobicContact CG-CD2 3.85Å; K679-S715 PolarHBondContact NZ-OG 2.81Å; K679-D717 WeakPolarHBondContact CD-OD2 3.3Å; K679-D717 IonicContact NZ-OD1 2.69Å; K679-D717 PolarHBondContact NZ-OD1 2.89Å; K679-D717 IonicContact NZ-OD2 3.75Å; K679-D717 PolarHBondContact NZ-OD2 3.28Å
680	T	87.1	Confident	90.7	Very high	89 Å²	89	36.1 Å²	36.1	55%	0.546	18%	0.179	S	C	.	.	H	α-helix	trans	-64.3	-45.1	175.8	-55.5	0	0	0	0	111.3	S678 L683 H684	S678-T680 PolarHBondContact O-N 3.26Å; T680-L683 PolarHBondContact O-N 3.48Å; T680-H684 WeakPolarHBondContact O-CB 3.47Å; T680-H684 PolarHBondContact O-N 3.11Å
681	D	86.6	Confident	90.3	Very high	51 Å²	51	38.4 Å²	38.4	27%	0.273	20%	0.197	S	C	.	.	H	α-helix	trans	-61.8	-44	172.5	-68.4	-66.6	0	0	0	111.3	K643 F677 S678 L683 H684 C685	K643-D681 WeakPolarHBondContact CE-OD1 3.44Å; K643-D681 IonicContact NZ-OD1 2.7Å; K643-D681 PolarHBondContact NZ-OD1 2.86Å; K643-D681 IonicContact NZ-OD2 2.9Å; K643-D681 PolarHBondContact NZ-OD2 3.09Å; F677-D681 HydrophobicContact CD1-CB 3.81Å; F677-D681 HydrophobicContact CE1-CB 3.32Å; F677-D681 HydrophobicContact CZ-CB 4.05Å; S678-D681 WeakPolarHBondContact CB-OD2 3.36Å; S678-D681 WeakPolarHBondContact O-CB 3.13Å; S678-D681 PolarHBondContact O-N 3.47Å; S678-D681 WeakPolarHBondContact OG-CB 3.38Å; S678-D681 PolarHBondContact OG-N 3.05Å; S678-D681 VanDerWaalsContact OG-N 3.07Å; S678-D681 PolarHBondContact OG-OD2 3.3Å; D681-L683 VanDerWaalsContact C-N 3.33Å; D681-L683 PolarHBondContact O-N 3.28Å; D681-H684 WeakPolarHBondContact O-CB 3.42Å; D681-H684 PolarHBondContact O-N 2.88Å; D681-H684 VanDerWaalsContact O-N 3.16Å; D681-C685 PolarHBondContact O-N 2.88Å; D681-C685 PolarHBondContact O-SG 3.29Å
682	T	90.6	Very high	89.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-39.7	-179.9	-37.2	0	0	0	0	112	I668 S672 S678 K679 C685 L686 L704 L712	I668-T682 HydrophobicContact CG2-CG2 4.33Å; S672-T682 WeakPolarHBondContact OG-CG2 3.33Å; S672-T682 PolarHBondContact OG-OG1 2.87Å; S678-T682 PolarHBondContact O-N 3.05Å; S678-T682 PolarHBondContact O-OG1 3.23Å; K679-T682 PolarHBondContact O-N 3.18Å; T682-C685 WeakPolarHBondContact O-CB 3.33Å; T682-C685 PolarHBondContact O-N 3.09Å; T682-L686 PolarHBondContact O-N 2.94Å; T682-L704 HydrophobicContact CG2-CD1 3.89Å; T682-L704 HydrophobicContact CG2-CD2 4.34Å; T682-L704 HydrophobicContact CG2-CG 4.41Å; T682-L712 HydrophobicContact CG2-CD1 3.92Å
683	L	89	Confident	89.5	Confident	12 Å²	12	40.3 Å²	40.3	6%	0.063	21%	0.207	C	C	.	.	H	α-helix	trans	-72.4	-32.3	175	-69.4	169	0	0	0	112.4	K679 T680 D681 L686 K687 L712 R721 L725	K679-L683 WeakPolarHBondContact O-CB 3.44Å; K679-L683 VanDerWaalsContact O-CG 3.25Å; K679-L683 WeakPolarHBondContact O-CG 3.33Å; K679-L683 PolarHBondContact O-N 2.93Å; T680-L683 PolarHBondContact O-N 3.48Å; D681-L683 VanDerWaalsContact C-N 3.33Å; D681-L683 PolarHBondContact O-N 3.28Å; L683-L686 PolarHBondContact O-N 3.26Å; L683-K687 PolarHBondContact O-N 2.89Å; L683-L712 HydrophobicContact CD2-CD1 4.26Å; L683-R721 HydrophobicContact CD1-CB 3.83Å; L683-L725 HydrophobicContact CB-CD1 4.3Å; L683-L725 HydrophobicContact CD2-CD1 3.92Å
684	H	89.1	Confident	88.9	Confident	102 Å²	102	42.2 Å²	42.2	47%	0.472	22%	0.22	S	C	.	.	H	α-helix	trans	-65.7	-44	170.7	177.8	91.8	0	0	0	111.1	T680 D681 L686 K687 M688	T680-H684 WeakPolarHBondContact O-CB 3.47Å; T680-H684 PolarHBondContact O-N 3.11Å; D681-H684 WeakPolarHBondContact O-CB 3.42Å; D681-H684 PolarHBondContact O-N 2.88Å; D681-H684 VanDerWaalsContact O-N 3.16Å; H684-L686 VanDerWaalsContact C-N 3.29Å; H684-L686 PolarHBondContact O-N 2.84Å; H684-K687 PolarHBondContact O-N 2.84Å; H684-K687 VanDerWaalsContact O-N 3.17Å; H684-M688 WeakPolarHBondContact O-CG 3.48Å; H684-M688 PolarHBondContact O-N 3.22Å
685	C	91.3	Very high	88.4	Confident	8 Å²	8	46 Å²	46	5%	0.054	24%	0.238	C	C	.	.	H	α-helix	trans	-54.4	-44.6	170.5	-74	0	0	0	0	111.5	F646 D681 T682 M688 L689 L704	F646-C685 HydrophobicContact CE1-CB 3.73Å; F646-C685 WeakPolarHBondContact CE1-SG 3.36Å; F646-C685 HydrophobicContact CE2-CB 4.08Å; F646-C685 HydrophobicContact CZ-CB 3.47Å; F646-C685 VanDerWaalsContact CZ-CB 3.47Å; F646-C685 WeakPolarHBondContact CZ-O 3.31Å; D681-C685 PolarHBondContact O-N 2.88Å; D681-C685 PolarHBondContact O-SG 3.29Å; T682-C685 WeakPolarHBondContact O-CB 3.33Å; T682-C685 PolarHBondContact O-N 3.09Å; C685-M688 PolarHBondContact O-N 3.47Å; C685-L689 WeakPolarHBondContact O-CG 3.12Å; C685-L689 PolarHBondContact O-N 3.01Å; C685-L704 HydrophobicContact CB-CD2 4.38Å
686	L	92.1	Very high	88.2	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-45.5	175.2	-175.8	60.4	0	0	0	112.2	T682 L683 H684 M688 L689 L690 A701 L704 L705 L725	T682-L686 PolarHBondContact O-N 2.94Å; L683-L686 PolarHBondContact O-N 3.26Å; H684-L686 VanDerWaalsContact C-N 3.29Å; H684-L686 PolarHBondContact O-N 2.84Å; L686-M688 VanDerWaalsContact C-N 3.28Å; L686-M688 PolarHBondContact O-N 2.77Å; L686-L689 PolarHBondContact O-N 2.89Å; L686-L689 VanDerWaalsContact O-N 3.09Å; L686-L690 HydrophobicContact CD1-CD1 4.32Å; L686-L690 HydrophobicContact CD1-CG 4.33Å; L686-L690 HydrophobicContact CG-CD1 4.08Å; L686-L690 HydrophobicContact CG-CG 4.47Å; L686-L690 WeakPolarHBondContact O-CG 3.16Å; L686-L690 PolarHBondContact O-N 3.16Å; L686-A701 HydrophobicContact CD1-CB 4.03Å; L686-L704 HydrophobicContact CB-CD2 4.13Å; L686-L705 HydrophobicContact CD1-CD1 4.33Å; L686-L705 HydrophobicContact CD1-CG 4.3Å; L686-L705 HydrophobicContact CD2-CD2 3.84Å; L686-L705 HydrophobicContact CD2-CG 4.43Å; L686-L725 HydrophobicContact CB-CD1 4.28Å; L686-L725 HydrophobicContact CD2-CB 3.95Å; L686-L725 HydrophobicContact CD2-CD1 3.9Å; L686-L725 HydrophobicContact CG-CB 4.49Å; L686-L725 HydrophobicContact CG-CD1 4.18Å
687	K	91.2	Very high	88.2	Confident	117 Å²	117	37.6 Å²	37.6	51%	0.509	20%	0.2	S	C	.	.	H	α-helix	trans	-57	-41.5	175.9	-172.6	-176.7	177.2	-174.1	0	111.7	L683 H684 L689 L690 S691 L725	L683-K687 PolarHBondContact O-N 2.89Å; H684-K687 PolarHBondContact O-N 2.84Å; H684-K687 VanDerWaalsContact O-N 3.17Å; K687-L689 VanDerWaalsContact C-N 3.28Å; K687-L689 PolarHBondContact O-N 3.43Å; K687-L690 PolarHBondContact O-N 3.02Å; K687-S691 PolarHBondContact O-N 3.26Å; K687-S691 VanDerWaalsContact O-N 3.14Å; K687-L725 HydrophobicContact CB-CD2 4.32Å
688	M	89.3	Confident	88.3	Confident	45 Å²	45	37.4 Å²	37.4	22%	0.222	20%	0.199	C	C	.	.	H	α-helix	trans	-69.1	-20.1	178.6	-69.9	-61.4	-68.4	0	0	114.2	I650 H684 C685 L686 S691	I650-M688 HydrophobicContact CD1-CB 3.85Å; H684-M688 WeakPolarHBondContact O-CG 3.48Å; H684-M688 PolarHBondContact O-N 3.22Å; C685-M688 PolarHBondContact O-N 3.47Å; L686-M688 VanDerWaalsContact C-N 3.28Å; L686-M688 PolarHBondContact O-N 2.77Å; M688-S691 PolarHBondContact O-OG 3.39Å; M688-S691 VanDerWaalsContact O-OG 3.12Å
689	L	90.8	Very high	88.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-90.1	-22.4	172.1	-64.7	169.2	0	0	0	112.7	F646 I650 C685 L686 K687 H697 M700 A701	F646-L689 HydrophobicContact CE2-CD1 4.08Å; F646-L689 HydrophobicContact CE2-CD2 4.45Å; F646-L689 HydrophobicContact CE2-CG 4.36Å; F646-L689 HydrophobicContact CZ-CD1 4.15Å; F646-L689 HydrophobicContact CZ-CD2 4.36Å; F646-L689 HydrophobicContact CZ-CG 4.06Å; I650-L689 HydrophobicContact CD1-CD2 3.97Å; I650-L689 HydrophobicContact CD1-CG 4.44Å; I650-L689 HydrophobicContact CG1-CD2 4.08Å; C685-L689 WeakPolarHBondContact O-CG 3.12Å; C685-L689 PolarHBondContact O-N 3.01Å; L686-L689 PolarHBondContact O-N 2.89Å; L686-L689 VanDerWaalsContact O-N 3.09Å; K687-L689 VanDerWaalsContact C-N 3.28Å; K687-L689 PolarHBondContact O-N 3.43Å; L689-H697 HydrophobicContact CD2-CB 4Å; L689-M700 HydrophobicContact CD1-CB 3.82Å; L689-M700 HydrophobicContact CD2-CB 3.93Å; L689-M700 HydrophobicContact CD2-CE 3.92Å; L689-M700 HydrophobicContact CD2-SD 4.02Å; L689-A701 HydrophobicContact CB-CB 4.11Å; L689-A701 HydrophobicContact CD1-CB 4.33Å
690	L	88.6	Confident	88.6	Confident	5 Å²	5	34.1 Å²	34.1	3%	0.026	18%	0.179	C	C	.	.	H	α-helix	trans	-86.5	-15.8	177.4	-67.1	178.2	0	0	0	113.5	L686 K687 F693 L725 M729 K732	L686-L690 HydrophobicContact CD1-CD1 4.32Å; L686-L690 HydrophobicContact CD1-CG 4.33Å; L686-L690 HydrophobicContact CG-CD1 4.08Å; L686-L690 HydrophobicContact CG-CG 4.47Å; L686-L690 WeakPolarHBondContact O-CG 3.16Å; L686-L690 PolarHBondContact O-N 3.16Å; K687-L690 PolarHBondContact O-N 3.02Å; L690-F693 HydrophobicContact CD2-CD2 3.67Å; L690-F693 HydrophobicContact CD2-CE2 3.55Å; L690-F693 HydrophobicContact CD2-CZ 4.37Å; L690-L725 HydrophobicContact CD1-CB 3.97Å; L690-L725 HydrophobicContact CD1-CD2 4.14Å; L690-L725 WeakPolarHBondContact CD1-O 3.38Å; L690-M729 HydrophobicContact CD1-CB 4.46Å; L690-M729 HydrophobicContact CD2-CB 3.82Å; L690-M729 HydrophobicContact CD2-CG 3.9Å; L690-K732 VanDerWaalsContact O-CD 3.31Å; L690-K732 WeakPolarHBondContact O-CD 3.39Å; L690-K732 WeakPolarHBondContact O-CE 3.15Å; L690-K732 PolarHBondContact O-NZ 3.01Å
691	S	86.9	Confident	88.9	Confident	60 Å²	60	29.9 Å²	29.9	42%	0.42	15%	0.153	S	C	.	.	H	α-helix	trans	-66.2	-68.4	171.6	54.2	0	0	0	0	110.3	K687 M688 F693 K732	K687-S691 PolarHBondContact O-N 3.26Å; K687-S691 VanDerWaalsContact O-N 3.14Å; M688-S691 PolarHBondContact O-OG 3.39Å; M688-S691 VanDerWaalsContact O-OG 3.12Å; S691-F693 PolarHBondContact O-N 3.48Å; S691-K732 PolarHBondContact O-NZ 2.67Å
692	D	84.8	Confident	89.3	Confident	40 Å²	40	27.4 Å²	27.4	21%	0.214	14%	0.14	C	C	.	.	S	Bend	trans	-88.2	73.3	172.5	-174.7	-7.3	0	0	0	110.7	K653 T694 H697	K653-D692 WeakPolarHBondContact CE-OD2 3.22Å; K653-D692 IonicContact NZ-OD2 2.7Å; K653-D692 PolarHBondContact NZ-OD2 2.89Å; D692-T694 PolarHBondContact O-N 2.61Å; D692-T694 WeakPolarHBondContact OD1-CB 3.37Å; D692-T694 VanDerWaalsContact OD1-CG2 3.23Å; D692-T694 WeakPolarHBondContact OD1-CG2 3.27Å; D692-T694 PolarHBondContact OD1-OG1 2.98Å; D692-H697 VanDerWaalsContact O-CB 3.31Å; D692-H697 WeakPolarHBondContact O-CB 3.23Å; D692-H697 PolarHBondContact O-ND1 2.93Å; D692-H697 IonicContact OD2-CE1 2.78Å; D692-H697 IonicContact OD2-ND1 2.61Å
693	F	86.8	Confident	89.5	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.009	15%	0.145	C	C	.	.			trans	-76.4	48.9	-173.2	-164	-124.6	0	0	0	113.8	L690 S691 I698 M729 K732 L738 V746	L690-F693 HydrophobicContact CD2-CD2 3.67Å; L690-F693 HydrophobicContact CD2-CE2 3.55Å; L690-F693 HydrophobicContact CD2-CZ 4.37Å; S691-F693 PolarHBondContact O-N 3.48Å; F693-I698 HydrophobicContact CD1-CG1 4.31Å; F693-I698 HydrophobicContact CD2-CG1 4.02Å; F693-I698 HydrophobicContact CE1-CG1 4.32Å; F693-I698 HydrophobicContact CE2-CB 4.31Å; F693-I698 HydrophobicContact CE2-CG1 4Å; F693-I698 HydrophobicContact CE2-CG2 4.13Å; F693-I698 HydrophobicContact CG-CG1 4.19Å; F693-I698 HydrophobicContact CZ-CG1 4.16Å; F693-I698 HydrophobicContact CZ-CG2 3.96Å; F693-I698 WeakPolarHBondContact O-CD1 3.08Å; F693-I698 WeakPolarHBondContact O-CG1 3.27Å; F693-M729 HydrophobicContact CE2-CG 4.09Å; F693-M729 HydrophobicContact CZ-CG 3.7Å; F693-K732 HydrophobicContact CB-CD 4.01Å; F693-K732 HydrophobicContact CD1-CB 3.76Å; F693-K732 HydrophobicContact CD1-CD 4.44Å; F693-K732 HydrophobicContact CE1-CB 4.1Å; F693-K732 HydrophobicContact CG-CB 4.49Å; F693-K732 HydrophobicContact CG-CD 4.37Å; F693-L738 HydrophobicContact CD1-CD1 4.4Å; F693-L738 HydrophobicContact CE1-CD1 3.85Å; F693-V746 HydrophobicContact CZ-CG2 3.85Å
694	T	81.6	Confident	89.7	Confident	60 Å²	60	27.9 Å²	27.9	37%	0.368	14%	0.143	S	C	.	.			trans	-106.4	128.5	-174.6	59.1	0	0	0	0	112.8	D692 H696 H697	D692-T694 PolarHBondContact O-N 2.61Å; D692-T694 WeakPolarHBondContact OD1-CB 3.37Å; D692-T694 VanDerWaalsContact OD1-CG2 3.23Å; D692-T694 WeakPolarHBondContact OD1-CG2 3.27Å; D692-T694 PolarHBondContact OD1-OG1 2.98Å; T694-H696 PolarHBondContact O-N 2.64Å; T694-H697 PolarHBondContact O-N 2.85Å
695	H	83.2	Confident	89.9	Confident	89 Å²	89	23 Å²	23	41%	0.412	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	33.8	-86.8	173.2	-60.7	-51.5	0	0	0	116.4	Q655 H697 I698 E699 Y742	Q655-H695 PolarHBondContact NE2-CD2 2.95Å; H695-H697 PolarHBondContact O-N 2.76Å; H695-I698 VanDerWaalsContact O-CB 3.3Å; H695-I698 WeakPolarHBondContact O-CB 3.41Å; H695-I698 PolarHBondContact O-N 3.2Å; H695-I698 VanDerWaalsContact O-N 3.11Å; H695-E699 PolarHBondContact O-N 3.21Å; H695-Y742 AromaticContact ND1-CE2 3.32Å; H695-Y742 VanDerWaalsContact ND1-CE2 3.32Å; H695-Y742 WeakPolarHBondContact ND1-CE2 3.33Å; H695-Y742 AromaticContact ND1-CZ 3.71Å; H695-Y742 WeakPolarHBondContact O-CE1 3.32Å
696	H	86.6	Confident	90	Very high	9 Å²	9	26.3 Å²	26.3	4%	0.042	14%	0.135	C	C	.	.	H	α-helix	trans	-68.1	-31.9	-176.5	62.5	-89.2	0	0	0	113.4	K653 I658 K661 T694 I698 E699 M700	K653-H696 PolarHBondContact O-CE1 2.85Å; K653-H696 VanDerWaalsContact O-CE1 3.26Å; I658-H696 HydrophobicContact CD1-CB 3.86Å; K661-H696 PolarHBondContact NZ-CD2 2.79Å; K661-H696 PolarHBondContact NZ-NE2 2.59Å; K661-H696 VanDerWaalsContact NZ-NE2 3.17Å; T694-H696 PolarHBondContact O-N 2.64Å; H696-I698 VanDerWaalsContact C-N 3.27Å; H696-I698 PolarHBondContact O-N 2.77Å; H696-E699 PolarHBondContact O-N 3.39Å; H696-M700 VanDerWaalsContact O-CG 3.27Å; H696-M700 WeakPolarHBondContact O-CG 3.41Å; H696-M700 PolarHBondContact O-N 3.1Å
697	H	89.6	Confident	90	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-68.9	-27.5	171.9	-63.6	149.3	0	0	0	112.1	L689 D692 T694 H695 A701	L689-H697 HydrophobicContact CD2-CB 4Å; D692-H697 VanDerWaalsContact O-CB 3.31Å; D692-H697 WeakPolarHBondContact O-CB 3.23Å; D692-H697 PolarHBondContact O-ND1 2.93Å; D692-H697 IonicContact OD2-CE1 2.78Å; D692-H697 IonicContact OD2-ND1 2.61Å; T694-H697 PolarHBondContact O-N 2.85Å; H695-H697 PolarHBondContact O-N 2.76Å; H697-A701 VanDerWaalsContact O-CB 3.26Å; H697-A701 WeakPolarHBondContact O-CB 3.43Å; H697-A701 PolarHBondContact O-N 3.34Å
698	I	91.8	Very high	90.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-67.1	-47.6	172.9	-49.9	171.1	0	0	0	109.8	F693 H695 H696 M700 A701 C702 L738 Y742 V746	F693-I698 HydrophobicContact CD1-CG1 4.31Å; F693-I698 HydrophobicContact CD2-CG1 4.02Å; F693-I698 HydrophobicContact CE1-CG1 4.32Å; F693-I698 HydrophobicContact CE2-CB 4.31Å; F693-I698 HydrophobicContact CE2-CG1 4Å; F693-I698 HydrophobicContact CE2-CG2 4.13Å; F693-I698 HydrophobicContact CG-CG1 4.19Å; F693-I698 HydrophobicContact CZ-CG1 4.16Å; F693-I698 HydrophobicContact CZ-CG2 3.96Å; F693-I698 WeakPolarHBondContact O-CD1 3.08Å; F693-I698 WeakPolarHBondContact O-CG1 3.27Å; H695-I698 VanDerWaalsContact O-CB 3.3Å; H695-I698 WeakPolarHBondContact O-CB 3.41Å; H695-I698 PolarHBondContact O-N 3.2Å; H695-I698 VanDerWaalsContact O-N 3.11Å; H696-I698 VanDerWaalsContact C-N 3.27Å; H696-I698 PolarHBondContact O-N 2.77Å; I698-M700 VanDerWaalsContact C-N 3.34Å; I698-M700 PolarHBondContact O-N 3.07Å; I698-A701 PolarHBondContact O-N 3.44Å; I698-C702 WeakPolarHBondContact O-CB 3.41Å; I698-C702 PolarHBondContact O-N 3.02Å; I698-C702 PolarHBondContact O-SG 3.04Å; I698-L738 HydrophobicContact CD1-CD1 4.08Å; I698-L738 HydrophobicContact CD1-CD2 3.89Å; I698-Y742 HydrophobicContact CB-CD1 4Å; I698-Y742 HydrophobicContact CD1-CD1 4.09Å; I698-Y742 HydrophobicContact CD1-CG 4.05Å; I698-Y742 HydrophobicContact CG2-CD1 3.96Å; I698-V746 HydrophobicContact CG2-CG2 3.62Å
699	E	91.4	Very high	90.2	Very high	24 Å²	24	19 Å²	19	11%	0.112	10%	0.103	C	C	.	.	H	α-helix	trans	-62.8	-39.9	176.9	-54.9	-158.7	-165.4	0	0	111.9	I658 H695 H696 T703 R741 Y742 M745	I658-E699 HydrophobicContact CD1-CB 4.19Å; H695-E699 PolarHBondContact O-N 3.21Å; H696-E699 PolarHBondContact O-N 3.39Å; E699-T703 VanDerWaalsContact O-CB 3.26Å; E699-T703 WeakPolarHBondContact O-CB 3.4Å; E699-T703 PolarHBondContact O-N 3.38Å; E699-T703 PolarHBondContact O-OG1 2.78Å; E699-R741 VanDerWaalsContact CD-NH2 3.27Å; E699-R741 IonicContact OE1-CZ 2.65Å; E699-R741 IonicContact OE1-NH1 3.11Å; E699-R741 PolarHBondContact OE1-NH1 2.84Å; E699-R741 IonicContact OE1-NH2 3.74Å; E699-R741 PolarHBondContact OE1-NH2 2.69Å; E699-R741 IonicContact OE2-NH2 2.82Å; E699-R741 PolarHBondContact OE2-NH2 3.38Å; E699-Y742 HydrophobicContact CG-CD1 4.44Å; E699-Y742 HydrophobicContact CG-CE1 3.74Å; E699-M745 HydrophobicContact CB-SD 4.21Å; E699-M745 HydrophobicContact CG-CE 4.04Å; E699-M745 HydrophobicContact CG-SD 3.98Å
700	M	92.5	Very high	90.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.6	-47.3	173.7	-71.3	170.7	77.6	0	0	111.8	F646 H649 K661 V665 L689 H696 I698 C702 T703 L704	F646-M700 HydrophobicContact CD2-CE 4.27Å; F646-M700 HydrophobicContact CE2-CE 4.09Å; H649-M700 HydrophobicContact CB-CE 4.31Å; K661-M700 HydrophobicContact CB-CE 4.21Å; K661-M700 HydrophobicContact CB-CG 4.03Å; K661-M700 HydrophobicContact CB-SD 3.82Å; K661-M700 HydrophobicContact CD-SD 3.92Å; K661-M700 HydrophobicContact CG-SD 4.25Å; V665-M700 WeakPolarHBondContact CG1-O 3.49Å; V665-M700 HydrophobicContact CG2-CB 4.19Å; V665-M700 HydrophobicContact CG2-CE 3.55Å; V665-M700 HydrophobicContact CG2-CG 4.21Å; L689-M700 HydrophobicContact CD1-CB 3.82Å; L689-M700 HydrophobicContact CD2-CB 3.93Å; L689-M700 HydrophobicContact CD2-CE 3.92Å; L689-M700 HydrophobicContact CD2-SD 4.02Å; H696-M700 VanDerWaalsContact O-CG 3.27Å; H696-M700 WeakPolarHBondContact O-CG 3.41Å; H696-M700 PolarHBondContact O-N 3.1Å; I698-M700 VanDerWaalsContact C-N 3.34Å; I698-M700 PolarHBondContact O-N 3.07Å; M700-C702 PolarHBondContact O-N 2.81Å; M700-T703 PolarHBondContact O-N 3.29Å; M700-L704 PolarHBondContact O-N 3.36Å
701	A	93.8	Very high	90.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63	-42.9	-179.8	0	0	0	0	0	111.7	L686 L689 H697 I698 L704 L705	L686-A701 HydrophobicContact CD1-CB 4.03Å; L689-A701 HydrophobicContact CB-CB 4.11Å; L689-A701 HydrophobicContact CD1-CB 4.33Å; H697-A701 VanDerWaalsContact O-CB 3.26Å; H697-A701 WeakPolarHBondContact O-CB 3.43Å; H697-A701 PolarHBondContact O-N 3.34Å; I698-A701 PolarHBondContact O-N 3.44Å; A701-L704 PolarHBondContact O-N 2.95Å; A701-L705 WeakPolarHBondContact O-CG 3.37Å; A701-L705 PolarHBondContact O-N 3.47Å; A701-L705 VanDerWaalsContact O-N 3.09Å
702	C	94.1	Very high	90.3	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.1	-44.6	175.2	-60.9	0	0	0	0	111.1	I698 M700 L704 L705 E706 M745 A749	I698-C702 WeakPolarHBondContact O-CB 3.41Å; I698-C702 PolarHBondContact O-N 3.02Å; I698-C702 PolarHBondContact O-SG 3.04Å; M700-C702 PolarHBondContact O-N 2.81Å; C702-L704 VanDerWaalsContact C-N 3.28Å; C702-L704 PolarHBondContact O-N 3.28Å; C702-L705 PolarHBondContact O-N 3.26Å; C702-L705 VanDerWaalsContact O-N 3.14Å; C702-E706 WeakPolarHBondContact O-CB 3.37Å; C702-E706 WeakPolarHBondContact O-CG 3.28Å; C702-E706 PolarHBondContact O-N 2.84Å; C702-M745 HydrophobicContact CB-CG 3.64Å; C702-M745 HydrophobicContact CB-SD 3.85Å; C702-A749 HydrophobicContact CB-CB 3.98Å
703	T	94.2	Very high	90.4	Very high	17 Å²	17	17 Å²	17	10%	0.104	8%	0.083	C	C	.	.	H	α-helix	trans	-57.6	-39.3	175.7	-60.1	0	0	0	0	112	N662 R666 E699 M700 T707	N662-T703 HydrophobicContact CB-CG2 4.23Å; R666-T703 HydrophobicContact CB-CG2 4.23Å; E699-T703 VanDerWaalsContact O-CB 3.26Å; E699-T703 WeakPolarHBondContact O-CB 3.4Å; E699-T703 PolarHBondContact O-N 3.38Å; E699-T703 PolarHBondContact O-OG1 2.78Å; M700-T703 PolarHBondContact O-N 3.29Å; T703-T707 WeakPolarHBondContact O-CB 3.46Å; T703-T707 PolarHBondContact O-N 3.33Å; T703-T707 PolarHBondContact O-OG1 3.08Å
704	L	94.6	Very high	90.3	Very high	4 Å²	4	18.8 Å²	18.8	2%	0.021	9%	0.09	C	C	.	.	H	α-helix	trans	-65.5	-46	176.4	-170.7	54.6	0	0	0	111.5	V665 T682 C685 L686 M700 A701 C702 T707 C708	V665-L704 HydrophobicContact CG1-CB 3.55Å; V665-L704 HydrophobicContact CG1-CD1 3.96Å; V665-L704 HydrophobicContact CG1-CG 4.2Å; T682-L704 HydrophobicContact CG2-CD1 3.89Å; T682-L704 HydrophobicContact CG2-CD2 4.34Å; T682-L704 HydrophobicContact CG2-CG 4.41Å; C685-L704 HydrophobicContact CB-CD2 4.38Å; L686-L704 HydrophobicContact CB-CD2 4.13Å; M700-L704 PolarHBondContact O-N 3.36Å; A701-L704 PolarHBondContact O-N 2.95Å; C702-L704 VanDerWaalsContact C-N 3.28Å; C702-L704 PolarHBondContact O-N 3.28Å; L704-T707 PolarHBondContact O-N 2.67Å; L704-C708 PolarHBondContact O-N 3.41Å; L704-C708 PolarHBondContact O-SG 2.88Å; L704-C708 VanDerWaalsContact O-SG 3.39Å
705	L	93.9	Very high	90.3	Very high	1 Å²	1	16 Å²	16	1%	0.005	7%	0.073	C	C	.	.	I	π-helix	trans	-68.7	-37.5	-179.5	-71.1	172.7	0	0	0	112.8	L686 A701 C702 T707 G709 L726 M729 A749 Y752	L686-L705 HydrophobicContact CD1-CD1 4.33Å; L686-L705 HydrophobicContact CD1-CG 4.3Å; L686-L705 HydrophobicContact CD2-CD2 3.84Å; L686-L705 HydrophobicContact CD2-CG 4.43Å; A701-L705 WeakPolarHBondContact O-CG 3.37Å; A701-L705 PolarHBondContact O-N 3.47Å; A701-L705 VanDerWaalsContact O-N 3.09Å; C702-L705 PolarHBondContact O-N 3.26Å; C702-L705 VanDerWaalsContact O-N 3.14Å; L705-T707 VanDerWaalsContact C-N 3.3Å; L705-T707 PolarHBondContact O-N 3.4Å; L705-G709 WeakPolarHBondContact O-CA 3.41Å; L705-G709 PolarHBondContact O-N 2.59Å; L705-L726 HydrophobicContact CD1-CD2 3.75Å; L705-L726 HydrophobicContact CD2-CD2 4.02Å; L705-M729 HydrophobicContact CD1-CE 3.69Å; L705-M729 HydrophobicContact CD1-SD 3.6Å; L705-A749 HydrophobicContact CB-CB 4.14Å; L705-A749 HydrophobicContact CD1-CB 4.42Å; L705-Y752 WeakPolarHBondContact O-CD1 3.43Å; L705-Y752 WeakPolarHBondContact O-CE1 3.28Å
706	E	92.8	Very high	89.9	Confident	77 Å²	77	16 Å²	16	36%	0.36	8%	0.081	S	C	.	.	I	π-helix	trans	-64.6	-32.6	169.7	-72.3	175.2	-174.9	0	0	112.3	C702 Y752	C702-E706 WeakPolarHBondContact O-CB 3.37Å; C702-E706 WeakPolarHBondContact O-CG 3.28Å; C702-E706 PolarHBondContact O-N 2.84Å; E706-Y752 WeakPolarHBondContact O-CE1 3.32Å; E706-Y752 PolarHBondContact O-OH 3.46Å
707	T	92.6	Very high	89.4	Confident	9 Å²	9	20.4 Å²	20.4	6%	0.055	10%	0.104	C	C	.	.	I	π-helix	trans	-82.5	-43.7	-177.6	-55.4	0	0	0	0	112.8	R666 E670 K673 T703 L704 L705	R666-T707 HydrophobicContact CG-CG2 3.94Å; R666-T707 WeakPolarHBondContact O-CG2 3.39Å; E670-T707 HydrophobicContact CG-CG2 4.17Å; E670-T707 WeakPolarHBondContact OE1-CG2 3.26Å; K673-T707 WeakPolarHBondContact CD-O 3.46Å; K673-T707 WeakPolarHBondContact CE-O 3.32Å; K673-T707 PolarHBondContact NZ-O 2.89Å; T703-T707 WeakPolarHBondContact O-CB 3.46Å; T703-T707 PolarHBondContact O-N 3.33Å; T703-T707 PolarHBondContact O-OG1 3.08Å; L704-T707 PolarHBondContact O-N 2.67Å; L705-T707 VanDerWaalsContact C-N 3.3Å; L705-T707 PolarHBondContact O-N 3.4Å
708	C	92.9	Very high	89	Confident	2 Å²	2	20.4 Å²	20.4	1%	0.014	11%	0.105	C	C	.	.	I	π-helix	trans	-141.3	2.8	-175.6	67.6	0	0	0	0	115.1	G669 K673 L704 R710 F711 L712	G669-C708 WeakPolarHBondContact O-CB 3.49Å; K673-C708 HydrophobicContact CD-CB 4.44Å; K673-C708 HydrophobicContact CG-CB 4.12Å; L704-C708 PolarHBondContact O-N 3.41Å; L704-C708 PolarHBondContact O-SG 2.88Å; L704-C708 VanDerWaalsContact O-SG 3.39Å; C708-R710 VanDerWaalsContact C-N 3.35Å; C708-R710 PolarHBondContact O-N 2.79Å; C708-F711 WeakPolarHBondContact O-CB 3.38Å; C708-F711 PolarHBondContact O-N 3.2Å; C708-L712 WeakPolarHBondContact O-CG 3.33Å; C708-L712 PolarHBondContact O-N 3.35Å
709	G	90.2	Very high	88.5	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.109	C	C	.	.	I	π-helix	trans	-62.6	-37.6	-177.5	0	0	0	0	0	113.4	L705 L712 F713 C753	L705-G709 WeakPolarHBondContact O-CA 3.41Å; L705-G709 PolarHBondContact O-N 2.59Å; G709-L712 PolarHBondContact O-N 3.01Å; G709-F713 VanDerWaalsContact O-CB 3.24Å; G709-F713 WeakPolarHBondContact O-CB 3.37Å; G709-F713 PolarHBondContact O-N 3.33Å; G709-C753 VanDerWaalsContact C-SG 3.51Å; G709-C753 VanDerWaalsContact CA-SG 3.54Å
710	R	89.1	Confident	87.8	Confident	50 Å²	50	22.6 Å²	22.6	19%	0.189	12%	0.116	C	C	.	.	H	α-helix	trans	-56.9	-50.8	166.8	-83.9	-178.8	172.3	163.9	5.9	112	E461 C708 L712 F713 R714 Y752	E461-R710 WeakPolarHBondContact OE1-CD 3.49Å; E461-R710 IonicContact OE1-CZ 3.09Å; E461-R710 IonicContact OE1-NE 3.87Å; E461-R710 IonicContact OE1-NH1 2.7Å; E461-R710 PolarHBondContact OE1-NH1 3Å; E461-R710 IonicContact OE2-NH1 3.98Å; E461-R710 PolarHBondContact OE2-NH1 3.23Å; C708-R710 VanDerWaalsContact C-N 3.35Å; C708-R710 PolarHBondContact O-N 2.79Å; R710-L712 VanDerWaalsContact C-N 3.3Å; R710-L712 PolarHBondContact O-N 2.84Å; R710-F713 PolarHBondContact O-N 3.49Å; R710-R714 VanDerWaalsContact O-CB 3.32Å; R710-R714 WeakPolarHBondContact O-CB 3.39Å; R710-R714 VanDerWaalsContact O-CG 3.24Å; R710-R714 WeakPolarHBondContact O-CG 3.34Å; R710-R714 PolarHBondContact O-N 2.85Å; R710-Y752 HydrophobicContact CB-CE1 4.22Å; R710-Y752 HydrophobicContact CG-CD1 3.91Å; R710-Y752 HydrophobicContact CG-CE1 3.74Å; R710-Y752 HydrophobicContact CG-CG 4.43Å; R710-Y752 VanDerWaalsContact CG-O 3.24Å; R710-Y752 WeakPolarHBondContact CG-O 3.36Å; R710-Y752 PolarHBondContact NE-O 3.36Å; R710-Y752 PolarHBondContact NH2-O 3.01Å
711	F	90.4	Very high	87.1	Confident	8 Å²	8	26.7 Å²	26.7	4%	0.035	13%	0.132	C	C	.	.	H	α-helix	trans	-59.1	-39.9	179.5	169.1	-92.7	0	0	0	112.3	I459 W460 S672 K673 K679 C708 S715	I459-F711 HydrophobicContact CG2-CD2 3.53Å; I459-F711 HydrophobicContact CG2-CE2 3.96Å; I459-F711 HydrophobicContact CG2-CG 4.43Å; W460-F711 AromaticContact CH2-CD2 3.51Å; W460-F711 HydrophobicContact CH2-CD2 3.51Å; W460-F711 AromaticContact CH2-CE2 3.6Å; W460-F711 HydrophobicContact CH2-CE2 3.6Å; W460-F711 HydrophobicContact CZ2-CD2 4.01Å; W460-F711 AromaticContact CZ2-CE2 3.84Å; W460-F711 HydrophobicContact CZ2-CE2 3.84Å; W460-F711 AromaticContact CZ3-CD2 3.85Å; W460-F711 HydrophobicContact CZ3-CD2 3.85Å; W460-F711 HydrophobicContact CZ3-CE2 4.4Å; S672-F711 VanDerWaalsContact O-CE1 3.28Å; S672-F711 WeakPolarHBondContact O-CE1 3.31Å; S672-F711 WeakPolarHBondContact O-CZ 3.07Å; K673-F711 HydrophobicContact CG-CB 4.02Å; K673-F711 HydrophobicContact CG-CD1 4.23Å; K673-F711 HydrophobicContact CG-CD2 4.21Å; K673-F711 HydrophobicContact CG-CG 3.91Å; K679-F711 HydrophobicContact CG-CE1 4.34Å; C708-F711 WeakPolarHBondContact O-CB 3.38Å; C708-F711 PolarHBondContact O-N 3.2Å; F711-S715 WeakPolarHBondContact O-CB 3.39Å; F711-S715 PolarHBondContact O-N 3.48Å; F711-S715 VanDerWaalsContact O-N 3.09Å; F711-S715 PolarHBondContact O-OG 3.1Å
712	L	89.3	Confident	86.6	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-70.7	-42.8	176.2	-66.7	171.5	0	0	0	112.5	K679 T682 L683 C708 G709 R710 S718 H719 T722	K679-L712 HydrophobicContact CB-CD2 3.83Å; K679-L712 HydrophobicContact CD-CD2 4.41Å; K679-L712 HydrophobicContact CG-CD2 3.85Å; T682-L712 HydrophobicContact CG2-CD1 3.92Å; L683-L712 HydrophobicContact CD2-CD1 4.26Å; C708-L712 WeakPolarHBondContact O-CG 3.33Å; C708-L712 PolarHBondContact O-N 3.35Å; G709-L712 PolarHBondContact O-N 3.01Å; R710-L712 VanDerWaalsContact C-N 3.3Å; R710-L712 PolarHBondContact O-N 2.84Å; L712-S718 CarbonylContact O-C 3.6Å; L712-S718 WeakPolarHBondContact O-CB 3.18Å; L712-S718 PolarHBondContact O-OG 3.19Å; L712-H719 PolarHBondContact O-N 3.36Å; L712-T722 HydrophobicContact CB-CG2 4.12Å; L712-T722 PolarHBondContact O-OG1 3.48Å
713	F	86.6	Confident	85.9	Confident	1 Å²	1	27.7 Å²	27.7	0%	0.004	14%	0.139	C	C	.	.	H	α-helix	trans	-70.3	-30.5	178.7	-171.8	-101.5	0	0	0	112.5	G709 R710 H719 T722 L726 C753 N754	G709-F713 VanDerWaalsContact O-CB 3.24Å; G709-F713 WeakPolarHBondContact O-CB 3.37Å; G709-F713 PolarHBondContact O-N 3.33Å; R710-F713 PolarHBondContact O-N 3.49Å; F713-H719 AromaticContact CE1-CE1 3.99Å; F713-H719 AromaticContact CE2-CE1 3.69Å; F713-H719 AromaticContact CE2-ND1 3.93Å; F713-H719 AromaticContact CZ-CE1 3.55Å; F713-H719 WeakPolarHBondContact O-CB 3.3Å; F713-H719 PolarHBondContact O-ND1 3.29Å; F713-T722 HydrophobicContact CB-CG2 3.96Å; F713-T722 HydrophobicContact CD2-CG2 4.23Å; F713-L726 HydrophobicContact CD2-CD1 3.75Å; F713-L726 HydrophobicContact CE2-CD1 4.17Å; F713-L726 HydrophobicContact CG-CD1 4.45Å; F713-C753 WeakPolarHBondContact CD1-O 3.32Å; F713-N754 HydrophobicContact CD1-CB 4.34Å; F713-N754 HydrophobicContact CE1-CB 3.76Å; F713-N754 WeakPolarHBondContact CE1-OD1 3.42Å; F713-N754 HydrophobicContact CE2-CB 4.27Å; F713-N754 HydrophobicContact CZ-CB 3.72Å; F713-N754 VanDerWaalsContact CZ-CG 3.44Å; F713-N754 WeakPolarHBondContact CZ-OD1 3.31Å
714	R	85.1	Confident	85.3	Confident	41 Å²	41	30 Å²	30	16%	0.155	15%	0.152	C	C	.	.	H	α-helix	trans	-90.9	-10	178.1	-60.3	-162.8	-172.1	177.2	7.8	115	L455 G458 W460 R710	L455-R714 HydrophobicContact CD1-CB 3.89Å; L455-R714 HydrophobicContact CD1-CG 3.71Å; L455-R714 HydrophobicContact CD2-CG 3.95Å; L455-R714 HydrophobicContact CG-CG 4.33Å; G458-R714 WeakPolarHBondContact O-CD 3.41Å; G458-R714 PolarHBondContact O-NH1 3.19Å; W460-R714 PolarHBondContact O-NH1 3.4Å; R710-R714 VanDerWaalsContact O-CB 3.32Å; R710-R714 WeakPolarHBondContact O-CB 3.39Å; R710-R714 VanDerWaalsContact O-CG 3.24Å; R710-R714 WeakPolarHBondContact O-CG 3.34Å; R710-R714 PolarHBondContact O-N 2.85Å
715	S	82.4	Confident	84.8	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.007	16%	0.155	C	C	.	.	S	Bend	trans	-84.3	120.3	173.8	-74.6	0	0	0	0	109.9	K679 F711 D717 S718 H719	K679-S715 PolarHBondContact NZ-OG 2.81Å; F711-S715 WeakPolarHBondContact O-CB 3.39Å; F711-S715 PolarHBondContact O-N 3.48Å; F711-S715 VanDerWaalsContact O-N 3.09Å; F711-S715 PolarHBondContact O-OG 3.1Å; S715-D717 VanDerWaalsContact C-N 3.3Å; S715-D717 WeakPolarHBondContact CB-OD1 3.47Å; S715-D717 PolarHBondContact O-N 3.1Å; S715-S718 VanDerWaalsContact CB-OG 3.27Å; S715-S718 WeakPolarHBondContact CB-OG 3.21Å; S715-S718 CarbonylContact O-C 3.49Å; S715-S718 PolarHBondContact O-N 3.15Å; S715-S718 PolarHBondContact O-OG 2.78Å; S715-H719 PolarHBondContact O-N 3.42Å
716	P	73.9	Confident	84.5	Confident	89 Å²	89	30.5 Å²	30.5	58%	0.578	16%	0.155	S	C	*	.	H	α-helix	trans	-56.3	-38.9	-172	-28.5	35.6	0	0	0	114.8	H387 S718	H387-P716 PolarHBondContact CE1-O 3.35Å; P716-S718 VanDerWaalsContact C-N 3.27Å; P716-S718 PolarHBondContact O-N 2.73Å
717	D	75.9	Confident	84.2	Confident	101 Å²	101	30.5 Å²	30.5	54%	0.54	16%	0.155	S	C	.	.	H	α-helix	trans	-67.5	-19.9	178.7	57.7	-41.7	0	0	0	114.3	K679 S715	K679-D717 WeakPolarHBondContact CD-OD2 3.3Å; K679-D717 IonicContact NZ-OD1 2.69Å; K679-D717 PolarHBondContact NZ-OD1 2.89Å; K679-D717 IonicContact NZ-OD2 3.75Å; K679-D717 PolarHBondContact NZ-OD2 3.28Å; S715-D717 VanDerWaalsContact C-N 3.3Å; S715-D717 WeakPolarHBondContact CB-OD1 3.47Å; S715-D717 PolarHBondContact O-N 3.1Å
718	S	81.8	Confident	83.8	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.007	17%	0.17	C	C	.	.	H	α-helix	trans	-116.3	-11.1	176.2	51.2	0	0	0	0	114.6	L712 S715 P716 L720 R721 T722	L712-S718 CarbonylContact O-C 3.6Å; L712-S718 WeakPolarHBondContact O-CB 3.18Å; L712-S718 PolarHBondContact O-OG 3.19Å; S715-S718 VanDerWaalsContact CB-OG 3.27Å; S715-S718 WeakPolarHBondContact CB-OG 3.21Å; S715-S718 CarbonylContact O-C 3.49Å; S715-S718 PolarHBondContact O-N 3.15Å; S715-S718 PolarHBondContact O-OG 2.78Å; P716-S718 VanDerWaalsContact C-N 3.27Å; P716-S718 PolarHBondContact O-N 2.73Å; S718-L720 PolarHBondContact O-N 3.47Å; S718-R721 PolarHBondContact O-N 2.64Å; S718-T722 WeakPolarHBondContact O-CB 3.4Å; S718-T722 PolarHBondContact O-N 3.23Å; S718-T722 PolarHBondContact O-OG1 2.92Å
719	H	81.3	Confident	83.6	Confident	19 Å²	19	33.6 Å²	33.6	9%	0.088	17%	0.169	C	C	.	.	H	α-helix	trans	-50.3	-58	-174.6	171.7	74.9	0	0	0	112.7	Y453 L712 F713 S715 R721 T722 S723	Y453-H719 AromaticContact CD2-CE1 3.37Å; Y453-H719 WeakPolarHBondContact CD2-CE1 3.27Å; Y453-H719 AromaticContact CD2-NE2 3.22Å; Y453-H719 WeakPolarHBondContact CD2-NE2 3.37Å; Y453-H719 AromaticContact CE2-CE1 3.7Å; Y453-H719 AromaticContact CE2-NE2 3.49Å; Y453-H719 WeakPolarHBondContact CE2-NE2 3Å; Y453-H719 AromaticContact CG-CE1 3.78Å; L712-H719 PolarHBondContact O-N 3.36Å; F713-H719 AromaticContact CE1-CE1 3.99Å; F713-H719 AromaticContact CE2-CE1 3.69Å; F713-H719 AromaticContact CE2-ND1 3.93Å; F713-H719 AromaticContact CZ-CE1 3.55Å; F713-H719 WeakPolarHBondContact O-CB 3.3Å; F713-H719 PolarHBondContact O-ND1 3.29Å; S715-H719 PolarHBondContact O-N 3.42Å; H719-R721 PolarHBondContact O-N 2.62Å; H719-T722 WeakPolarHBondContact O-CB 3.37Å; H719-T722 PolarHBondContact O-N 3.46Å; H719-T722 VanDerWaalsContact O-N 3.15Å; H719-S723 PolarHBondContact O-N 2.92Å
720	L	76.2	Confident	83.4	Confident	52 Å²	52	35 Å²	35	27%	0.272	18%	0.176	S	C	.	.	H	α-helix	trans	-61.5	-44.5	-175.1	-179.4	61.9	0	0	0	112.1	P450 S718 T722 S723 V724	P450-L720 HydrophobicContact CB-CD1 4.42Å; S718-L720 PolarHBondContact O-N 3.47Å; L720-T722 VanDerWaalsContact C-N 3.33Å; L720-T722 PolarHBondContact O-N 2.86Å; L720-S723 PolarHBondContact O-N 3.04Å; L720-V724 WeakPolarHBondContact O-CG2 3.49Å; L720-V724 PolarHBondContact O-N 3.34Å; L720-V724 VanDerWaalsContact O-N 3.1Å
721	R	77.5	Confident	83.3	Confident	86 Å²	86	40.1 Å²	40.1	33%	0.325	20%	0.195	S	C	.	.	H	α-helix	trans	-63.7	-39.9	176.7	-65.1	-179.8	-179.4	177.8	-0.6	111.4	S388 K389 L683 S718 H719 L725	S388-R721 PolarHBondContact O-NE 3.11Å; S388-R721 VanDerWaalsContact O-NE 3.1Å; S388-R721 PolarHBondContact O-NH2 2.97Å; K389-R721 PolarHBondContact O-NH2 3.42Å; L683-R721 HydrophobicContact CD1-CB 3.83Å; S718-R721 PolarHBondContact O-N 2.64Å; H719-R721 PolarHBondContact O-N 2.62Å; R721-L725 WeakPolarHBondContact O-CG 3.22Å; R721-L725 PolarHBondContact O-N 2.84Å; R721-L725 VanDerWaalsContact O-N 3.16Å
722	T	83.8	Confident	83.1	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.7	-42.9	176.7	-48.3	0	0	0	0	111	L712 F713 S718 H719 L720 V724 L725 L726	L712-T722 HydrophobicContact CB-CG2 4.12Å; L712-T722 PolarHBondContact O-OG1 3.48Å; F713-T722 HydrophobicContact CB-CG2 3.96Å; F713-T722 HydrophobicContact CD2-CG2 4.23Å; S718-T722 WeakPolarHBondContact O-CB 3.4Å; S718-T722 PolarHBondContact O-N 3.23Å; S718-T722 PolarHBondContact O-OG1 2.92Å; H719-T722 WeakPolarHBondContact O-CB 3.37Å; H719-T722 PolarHBondContact O-N 3.46Å; H719-T722 VanDerWaalsContact O-N 3.15Å; L720-T722 VanDerWaalsContact C-N 3.33Å; L720-T722 PolarHBondContact O-N 2.86Å; T722-V724 PolarHBondContact O-N 2.65Å; T722-L725 PolarHBondContact O-N 2.97Å; T722-L726 HydrophobicContact CG2-CD1 4.05Å; T722-L726 HydrophobicContact CG2-CG 4.36Å; T722-L726 WeakPolarHBondContact O-CB 3.45Å; T722-L726 VanDerWaalsContact O-CG 3.28Å; T722-L726 WeakPolarHBondContact O-CG 3.44Å; T722-L726 PolarHBondContact O-N 3.31Å
723	S	80.3	Confident	83	Confident	20 Å²	20	43 Å²	43	14%	0.14	21%	0.208	C	C	.	.	H	α-helix	trans	-59.7	-45.5	177	-163.2	0	0	0	0	112.1	H719 L720 L725 L726 E727	H719-S723 PolarHBondContact O-N 2.92Å; L720-S723 PolarHBondContact O-N 3.04Å; S723-L725 PolarHBondContact O-N 3.39Å; S723-L726 PolarHBondContact O-N 3.5Å; S723-E727 PolarHBondContact O-N 2.92Å
724	V	81.2	Confident	83	Confident	65 Å²	65	49.6 Å²	49.6	39%	0.394	24%	0.239	S	C	.	.	H	α-helix	trans	-62.4	-42.2	177.6	172.7	0	0	0	0	111.8	L720 T722 E727 Q728	L720-V724 WeakPolarHBondContact O-CG2 3.49Å; L720-V724 PolarHBondContact O-N 3.34Å; L720-V724 VanDerWaalsContact O-N 3.1Å; T722-V724 PolarHBondContact O-N 2.65Å; V724-E727 PolarHBondContact O-N 3.22Å; V724-Q728 WeakPolarHBondContact O-CG 3.37Å; V724-Q728 PolarHBondContact O-N 3.2Å
725	L	84.9	Confident	83	Confident	16 Å²	16	51.2 Å²	51.2	8%	0.084	26%	0.26	C	S	.	.	H	α-helix	trans	-69	-36	176.8	-65.3	176	0	0	0	112.3	L683 L686 K687 L690 R721 T722 S723 Q728 M729	L683-L725 HydrophobicContact CB-CD1 4.3Å; L683-L725 HydrophobicContact CD2-CD1 3.92Å; L686-L725 HydrophobicContact CB-CD1 4.28Å; L686-L725 HydrophobicContact CD2-CB 3.95Å; L686-L725 HydrophobicContact CD2-CD1 3.9Å; L686-L725 HydrophobicContact CG-CB 4.49Å; L686-L725 HydrophobicContact CG-CD1 4.18Å; K687-L725 HydrophobicContact CB-CD2 4.32Å; L690-L725 HydrophobicContact CD1-CB 3.97Å; L690-L725 HydrophobicContact CD1-CD2 4.14Å; L690-L725 WeakPolarHBondContact CD1-O 3.38Å; R721-L725 WeakPolarHBondContact O-CG 3.22Å; R721-L725 PolarHBondContact O-N 2.84Å; R721-L725 VanDerWaalsContact O-N 3.16Å; T722-L725 PolarHBondContact O-N 2.97Å; S723-L725 PolarHBondContact O-N 3.39Å; L725-Q728 PolarHBondContact O-N 2.84Å; L725-M729 WeakPolarHBondContact O-CB 3.35Å; L725-M729 PolarHBondContact O-N 2.85Å
726	L	87.4	Confident	82.8	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-65.2	-38.8	173.2	-74.7	172.3	0	0	0	112.2	L705 F713 T722 S723 M729 M730 Y750 C753	L705-L726 HydrophobicContact CD1-CD2 3.75Å; L705-L726 HydrophobicContact CD2-CD2 4.02Å; F713-L726 HydrophobicContact CD2-CD1 3.75Å; F713-L726 HydrophobicContact CE2-CD1 4.17Å; F713-L726 HydrophobicContact CG-CD1 4.45Å; T722-L726 HydrophobicContact CG2-CD1 4.05Å; T722-L726 HydrophobicContact CG2-CG 4.36Å; T722-L726 WeakPolarHBondContact O-CB 3.45Å; T722-L726 VanDerWaalsContact O-CG 3.28Å; T722-L726 WeakPolarHBondContact O-CG 3.44Å; T722-L726 PolarHBondContact O-N 3.31Å; S723-L726 PolarHBondContact O-N 3.5Å; L726-M729 HydrophobicContact CD2-CE 3.79Å; L726-M730 PolarHBondContact O-N 2.69Å; L726-M730 VanDerWaalsContact O-N 3.09Å; L726-Y750 HydrophobicContact CB-CD2 3.92Å; L726-Y750 HydrophobicContact CB-CE2 3.87Å; L726-Y750 HydrophobicContact CD2-CD2 4.21Å; L726-C753 HydrophobicContact CD1-CB 3.74Å; L726-C753 HydrophobicContact CD2-CB 4.22Å
727	E	84.6	Confident	83	Confident	77 Å²	77	59.6 Å²	59.6	36%	0.36	29%	0.291	S	S	.	.	H	α-helix	trans	-64.8	-46.8	171.1	-80.4	-175.2	-128.2	0	0	112.1	S723 V724 M729 M730 R731	S723-E727 PolarHBondContact O-N 2.92Å; V724-E727 PolarHBondContact O-N 3.22Å; E727-M729 VanDerWaalsContact C-N 3.27Å; E727-M729 PolarHBondContact O-N 2.77Å; E727-M730 PolarHBondContact O-N 2.83Å; E727-M730 VanDerWaalsContact O-N 3.1Å; E727-R731 WeakPolarHBondContact O-CG 3.49Å; E727-R731 PolarHBondContact O-N 3.09Å; E727-R731 IonicContact OE2-CZ 3.33Å; E727-R731 IonicContact OE2-NE 3.76Å; E727-R731 IonicContact OE2-NH2 3.14Å; E727-R731 PolarHBondContact OE2-NH2 2.89Å
728	Q	85.3	Confident	83.5	Confident	76 Å²	76	56.3 Å²	56.3	36%	0.355	27%	0.273	S	S	.	.	H	α-helix	trans	-57.9	-41.6	176.5	-75	177.1	1.4	0	0	111.4	V724 L725 M730 R731 K732	V724-Q728 WeakPolarHBondContact O-CG 3.37Å; V724-Q728 PolarHBondContact O-N 3.2Å; L725-Q728 PolarHBondContact O-N 2.84Å; Q728-M730 PolarHBondContact O-N 3.05Å; Q728-R731 PolarHBondContact O-N 3.35Å; Q728-K732 WeakPolarHBondContact O-CB 3.39Å; Q728-K732 WeakPolarHBondContact O-CG 3.41Å; Q728-K732 PolarHBondContact O-N 3.09Å
729	M	88.3	Confident	83.7	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.2	-45.2	173.7	-171.7	-179.9	64.9	0	0	111.9	L690 F693 L705 L725 L726 E727 K732 K733 V746	L690-M729 HydrophobicContact CD1-CB 4.46Å; L690-M729 HydrophobicContact CD2-CB 3.82Å; L690-M729 HydrophobicContact CD2-CG 3.9Å; F693-M729 HydrophobicContact CE2-CG 4.09Å; F693-M729 HydrophobicContact CZ-CG 3.7Å; L705-M729 HydrophobicContact CD1-CE 3.69Å; L705-M729 HydrophobicContact CD1-SD 3.6Å; L725-M729 WeakPolarHBondContact O-CB 3.35Å; L725-M729 PolarHBondContact O-N 2.85Å; L726-M729 HydrophobicContact CD2-CE 3.79Å; E727-M729 VanDerWaalsContact C-N 3.27Å; E727-M729 PolarHBondContact O-N 2.77Å; M729-K732 PolarHBondContact O-N 2.92Å; M729-K733 WeakPolarHBondContact O-CB 3.46Å; M729-K733 PolarHBondContact O-N 3.35Å; M729-V746 HydrophobicContact CE-CG1 3.96Å; M729-V746 HydrophobicContact CG-CG1 3.78Å; M729-V746 HydrophobicContact SD-CG1 4.06Å
730	M	86.9	Confident	84	Confident	30 Å²	30	63 Å²	63	15%	0.148	32%	0.319	C	S	.	.	H	α-helix	trans	-69	-37.1	177.8	-75.5	-70	-86.5	0	0	113.3	L726 E727 Q728 K733 Q734 V746 Y750	L726-M730 PolarHBondContact O-N 2.69Å; L726-M730 VanDerWaalsContact O-N 3.09Å; E727-M730 PolarHBondContact O-N 2.83Å; E727-M730 VanDerWaalsContact O-N 3.1Å; Q728-M730 PolarHBondContact O-N 3.05Å; M730-K733 WeakPolarHBondContact O-CB 3.34Å; M730-K733 PolarHBondContact O-N 3.26Å; M730-K733 HydrophobicContact SD-CD 4.23Å; M730-Q734 WeakPolarHBondContact O-CG 3.5Å; M730-Q734 PolarHBondContact O-N 2.84Å; M730-Q734 VanDerWaalsContact O-N 3.13Å; M730-V746 HydrophobicContact SD-CG1 4.25Å; M730-Y750 HydrophobicContact CE-CD1 4.46Å; M730-Y750 HydrophobicContact CE-CG 4.48Å; M730-Y750 HydrophobicContact CG-CD2 3.42Å; M730-Y750 VanDerWaalsContact CG-CD2 3.42Å; M730-Y750 HydrophobicContact CG-CE2 3.77Å; M730-Y750 HydrophobicContact CG-CG 3.93Å; M730-Y750 HydrophobicContact SD-CD2 4.27Å; M730-Y750 HydrophobicContact SD-CG 4.18Å
731	R	87	Confident	84.7	Confident	156 Å²	156	66.6 Å²	66.6	59%	0.589	33%	0.329	S	S	*	.	H	α-helix	trans	-63.8	-45.9	173	-66.5	175.5	-159.4	-162.4	7.5	110.8	E727 Q728 K733 Q734 A735	E727-R731 WeakPolarHBondContact O-CG 3.49Å; E727-R731 PolarHBondContact O-N 3.09Å; E727-R731 IonicContact OE2-CZ 3.33Å; E727-R731 IonicContact OE2-NE 3.76Å; E727-R731 IonicContact OE2-NH2 3.14Å; E727-R731 PolarHBondContact OE2-NH2 2.89Å; Q728-R731 PolarHBondContact O-N 3.35Å; R731-K733 PolarHBondContact O-N 2.73Å; R731-Q734 PolarHBondContact O-N 3.42Å; R731-A735 WeakPolarHBondContact O-CB 3.42Å; R731-A735 PolarHBondContact O-N 3.46Å
732	K	84.6	Confident	85.3	Confident	47 Å²	47	63.5 Å²	63.5	20%	0.204	32%	0.317	C	S	.	.	H	α-helix	trans	-63.2	-37.9	174.8	-72.6	-165.5	174.6	-146.9	0	112.5	L690 S691 F693 Q728 M729 Q734 A735 Q736	L690-K732 VanDerWaalsContact O-CD 3.31Å; L690-K732 WeakPolarHBondContact O-CD 3.39Å; L690-K732 WeakPolarHBondContact O-CE 3.15Å; L690-K732 PolarHBondContact O-NZ 3.01Å; S691-K732 PolarHBondContact O-NZ 2.67Å; F693-K732 HydrophobicContact CB-CD 4.01Å; F693-K732 HydrophobicContact CD1-CB 3.76Å; F693-K732 HydrophobicContact CD1-CD 4.44Å; F693-K732 HydrophobicContact CE1-CB 4.1Å; F693-K732 HydrophobicContact CG-CB 4.49Å; F693-K732 HydrophobicContact CG-CD 4.37Å; Q728-K732 WeakPolarHBondContact O-CB 3.39Å; Q728-K732 WeakPolarHBondContact O-CG 3.41Å; Q728-K732 PolarHBondContact O-N 3.09Å; M729-K732 PolarHBondContact O-N 2.92Å; K732-Q734 VanDerWaalsContact C-N 3.31Å; K732-Q734 PolarHBondContact O-N 2.89Å; K732-A735 PolarHBondContact O-N 3.39Å; K732-Q736 WeakPolarHBondContact O-CB 3.36Å; K732-Q736 PolarHBondContact O-N 2.69Å
733	K	88.8	Confident	85.6	Confident	24 Å²	24	65.2 Å²	65.2	10%	0.104	33%	0.328	C	S	.	.	H	α-helix	trans	-58.4	-40.1	173.1	-162.8	-154.6	76	178.4	0	112.7	M729 M730 R731 L738 V743 V746 E747	M729-K733 WeakPolarHBondContact O-CB 3.46Å; M729-K733 PolarHBondContact O-N 3.35Å; M730-K733 WeakPolarHBondContact O-CB 3.34Å; M730-K733 PolarHBondContact O-N 3.26Å; M730-K733 HydrophobicContact SD-CD 4.23Å; R731-K733 PolarHBondContact O-N 2.73Å; K733-L738 HydrophobicContact CB-CD1 4.47Å; K733-L738 HydrophobicContact CG-CD1 4.15Å; K733-V743 HydrophobicContact CD-CG1 4.04Å; K733-V743 HydrophobicContact CG-CG2 4.44Å; K733-V746 HydrophobicContact CB-CG1 4.05Å; K733-V746 HydrophobicContact CD-CB 4.02Å; K733-V746 HydrophobicContact CD-CG1 3.75Å; K733-V746 HydrophobicContact CG-CB 4.18Å; K733-V746 HydrophobicContact CG-CG1 3.93Å; K733-E747 HydrophobicContact CD-CG 4.27Å; K733-E747 VanDerWaalsContact NZ-CG 3.34Å; K733-E747 IonicContact NZ-OE1 3.11Å; K733-E747 PolarHBondContact NZ-OE1 2.84Å
734	Q	85.7	Confident	86.1	Confident	140 Å²	140	67.6 Å²	67.6	65%	0.654	34%	0.342	S	S	*	.	H	α-helix	trans	-72.6	-40.6	176.8	-70.1	172.9	-6.3	0	0	112.2	M730 R731 K732	M730-Q734 WeakPolarHBondContact O-CG 3.5Å; M730-Q734 PolarHBondContact O-N 2.84Å; M730-Q734 VanDerWaalsContact O-N 3.13Å; R731-Q734 PolarHBondContact O-N 3.42Å; K732-Q734 VanDerWaalsContact C-N 3.31Å; K732-Q734 PolarHBondContact O-N 2.89Å
735	A	84.4	Confident	86.6	Confident	74 Å²	74	66.2 Å²	66.2	61%	0.612	33%	0.331	S	S	*	.	H	α-helix	trans	-76.9	-34.8	-174.3	0	0	0	0	0	114.7	R731 K732	R731-A735 WeakPolarHBondContact O-CB 3.42Å; R731-A735 PolarHBondContact O-N 3.46Å; K732-A735 PolarHBondContact O-N 3.39Å
736	Q	79.7	Confident	86.9	Confident	90 Å²	90	65.4 Å²	65.4	42%	0.421	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	9	-168.3	-66.3	-165.7	-22.9	0	0	115.7	K732 L738	K732-Q736 WeakPolarHBondContact O-CB 3.36Å; K732-Q736 PolarHBondContact O-N 2.69Å; Q736-L738 VanDerWaalsContact C-N 3.29Å; Q736-L738 HydrophobicContact CB-CD2 4.04Å; Q736-L738 HydrophobicContact CB-CG 4.36Å; Q736-L738 PolarHBondContact O-N 2.86Å
737	H	76.8	Confident	87.1	Confident	176 Å²	176	68.4 Å²	68.4	82%	0.815	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.5	48.9	177.4	-70.6	-68.8	0	0	0	114
738	L	86.4	Confident	87.4	Confident	32 Å²	32	69.2 Å²	69.2	17%	0.168	35%	0.348	C	S	.	.			trans	-63.3	151.9	-176.1	-58.2	176.2	0	0	0	112.4	F693 I698 K733 Q736 V743	F693-L738 HydrophobicContact CD1-CD1 4.4Å; F693-L738 HydrophobicContact CE1-CD1 3.85Å; I698-L738 HydrophobicContact CD1-CD1 4.08Å; I698-L738 HydrophobicContact CD1-CD2 3.89Å; K733-L738 HydrophobicContact CB-CD1 4.47Å; K733-L738 HydrophobicContact CG-CD1 4.15Å; Q736-L738 VanDerWaalsContact C-N 3.29Å; Q736-L738 HydrophobicContact CB-CD2 4.04Å; Q736-L738 HydrophobicContact CB-CG 4.36Å; Q736-L738 PolarHBondContact O-N 2.86Å; L738-V743 HydrophobicContact CB-CG2 3.98Å; L738-V743 WeakPolarHBondContact O-CG2 3.48Å
739	D	86	Confident	87.7	Confident	98 Å²	98	65.6 Å²	65.6	52%	0.524	33%	0.331	S	S	.	.			trans	-58.9	148.4	170.6	168.8	56.3	0	0	0	111.6	R741 Y742 V743	D739-R741 PolarHBondContact O-N 3.12Å; D739-R741 VanDerWaalsContact O-N 3.13Å; D739-R741 WeakPolarHBondContact OD2-CB 3.24Å; D739-R741 PolarHBondContact OD2-N 3.14Å; D739-Y742 HydrophobicContact CB-CD2 4.1Å; D739-Y742 PolarHBondContact O-N 2.66Å; D739-V743 PolarHBondContact O-N 3.33Å
740	A	88	Confident	87.8	Confident	64 Å²	64	67.6 Å²	67.6	53%	0.529	34%	0.339	S	S	.	.	H	α-helix	trans	-54.7	-36.2	-173	0	0	0	0	0	112.8	Y742 V743 T744	A740-Y742 VanDerWaalsContact C-N 3.34Å; A740-Y742 PolarHBondContact O-N 2.89Å; A740-V743 PolarHBondContact O-N 3.39Å; A740-T744 PolarHBondContact O-N 3.5Å; A740-T744 PolarHBondContact O-OG1 3.48Å
741	R	91.5	Very high	87.8	Confident	127 Å²	127	71.9 Å²	71.9	48%	0.479	35%	0.354	S	S	.	.	H	α-helix	trans	-59.1	-43.6	175.1	178.9	174.7	169.4	-103	-7.1	112	E699 D739 M745	E699-R741 VanDerWaalsContact CD-NH2 3.27Å; E699-R741 IonicContact OE1-CZ 2.65Å; E699-R741 IonicContact OE1-NH1 3.11Å; E699-R741 PolarHBondContact OE1-NH1 2.84Å; E699-R741 IonicContact OE1-NH2 3.74Å; E699-R741 PolarHBondContact OE1-NH2 2.69Å; E699-R741 IonicContact OE2-NH2 2.82Å; E699-R741 PolarHBondContact OE2-NH2 3.38Å; D739-R741 PolarHBondContact O-N 3.12Å; D739-R741 VanDerWaalsContact O-N 3.13Å; D739-R741 WeakPolarHBondContact OD2-CB 3.24Å; D739-R741 PolarHBondContact OD2-N 3.14Å; R741-M745 WeakPolarHBondContact O-CB 3.38Å; R741-M745 PolarHBondContact O-N 3.16Å
742	Y	90.3	Very high	87.8	Confident	21 Å²	21	67.7 Å²	67.7	8%	0.082	34%	0.339	C	S	.	.	H	α-helix	trans	-74.6	-37.3	178.6	-64.3	-65.5	0	0	0	112	H695 I698 E699 D739 A740 T744 M745 V746	H695-Y742 AromaticContact ND1-CE2 3.32Å; H695-Y742 VanDerWaalsContact ND1-CE2 3.32Å; H695-Y742 WeakPolarHBondContact ND1-CE2 3.33Å; H695-Y742 AromaticContact ND1-CZ 3.71Å; H695-Y742 WeakPolarHBondContact O-CE1 3.32Å; I698-Y742 HydrophobicContact CB-CD1 4Å; I698-Y742 HydrophobicContact CD1-CD1 4.09Å; I698-Y742 HydrophobicContact CD1-CG 4.05Å; I698-Y742 HydrophobicContact CG2-CD1 3.96Å; E699-Y742 HydrophobicContact CG-CD1 4.44Å; E699-Y742 HydrophobicContact CG-CE1 3.74Å; D739-Y742 HydrophobicContact CB-CD2 4.1Å; D739-Y742 PolarHBondContact O-N 2.66Å; A740-Y742 VanDerWaalsContact C-N 3.34Å; A740-Y742 PolarHBondContact O-N 2.89Å; Y742-T744 PolarHBondContact O-N 3.26Å; Y742-M745 PolarHBondContact O-N 3.08Å; Y742-V746 WeakPolarHBondContact O-CB 3.47Å; Y742-V746 VanDerWaalsContact O-CG2 3.28Å; Y742-V746 WeakPolarHBondContact O-CG2 3.11Å; Y742-V746 PolarHBondContact O-N 2.62Å
743	V	89.8	Confident	87.9	Confident	35 Å²	35	65.5 Å²	65.5	21%	0.212	33%	0.329	C	S	.	.	H	α-helix	trans	-56.8	-50.2	173.4	174.5	0	0	0	0	110.7	K733 L738 D739 A740 V746 E747	K733-V743 HydrophobicContact CD-CG1 4.04Å; K733-V743 HydrophobicContact CG-CG2 4.44Å; L738-V743 HydrophobicContact CB-CG2 3.98Å; L738-V743 WeakPolarHBondContact O-CG2 3.48Å; D739-V743 PolarHBondContact O-N 3.33Å; A740-V743 PolarHBondContact O-N 3.39Å; V743-V746 PolarHBondContact O-N 3.1Å; V743-E747 WeakPolarHBondContact O-CG 3.45Å; V743-E747 PolarHBondContact O-N 3.5Å
744	T	90.9	Very high	87.6	Confident	71 Å²	71	65.9 Å²	65.9	44%	0.436	33%	0.332	S	S	.	.	H	α-helix	trans	-64.4	-40	178.1	-55.7	0	0	0	0	112.3	A740 Y742 E747 N748	A740-T744 PolarHBondContact O-N 3.5Å; A740-T744 PolarHBondContact O-OG1 3.48Å; Y742-T744 PolarHBondContact O-N 3.26Å; T744-E747 PolarHBondContact O-N 2.9Å; T744-N748 WeakPolarHBondContact O-CB 3.49Å; T744-N748 PolarHBondContact O-N 3.31Å; T744-N748 PolarHBondContact O-ND2 3.4Å
745	M	91.1	Very high	87	Confident	35 Å²	35	61.7 Å²	61.7	17%	0.172	32%	0.317	C	S	.	.	H	α-helix	trans	-63.8	-43	178.2	-167.8	-174	-71.5	0	0	111.9	E699 C702 R741 Y742 N748 A749	E699-M745 HydrophobicContact CB-SD 4.21Å; E699-M745 HydrophobicContact CG-CE 4.04Å; E699-M745 HydrophobicContact CG-SD 3.98Å; C702-M745 HydrophobicContact CB-CG 3.64Å; C702-M745 HydrophobicContact CB-SD 3.85Å; R741-M745 WeakPolarHBondContact O-CB 3.38Å; R741-M745 PolarHBondContact O-N 3.16Å; Y742-M745 PolarHBondContact O-N 3.08Å; M745-N748 PolarHBondContact O-N 3.39Å; M745-A749 WeakPolarHBondContact O-CB 3.32Å; M745-A749 PolarHBondContact O-N 3.13Å
746	V	91.5	Very high	86.2	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-66.2	-40.3	176.7	170.9	0	0	0	0	111.9	F693 I698 M729 M730 K733 Y742 V743 Y750	F693-V746 HydrophobicContact CZ-CG2 3.85Å; I698-V746 HydrophobicContact CG2-CG2 3.62Å; M729-V746 HydrophobicContact CE-CG1 3.96Å; M729-V746 HydrophobicContact CG-CG1 3.78Å; M729-V746 HydrophobicContact SD-CG1 4.06Å; M730-V746 HydrophobicContact SD-CG1 4.25Å; K733-V746 HydrophobicContact CB-CG1 4.05Å; K733-V746 HydrophobicContact CD-CB 4.02Å; K733-V746 HydrophobicContact CD-CG1 3.75Å; K733-V746 HydrophobicContact CG-CB 4.18Å; K733-V746 HydrophobicContact CG-CG1 3.93Å; Y742-V746 WeakPolarHBondContact O-CB 3.47Å; Y742-V746 VanDerWaalsContact O-CG2 3.28Å; Y742-V746 WeakPolarHBondContact O-CG2 3.11Å; Y742-V746 PolarHBondContact O-N 2.62Å; V743-V746 PolarHBondContact O-N 3.1Å; V746-Y750 VanDerWaalsContact O-CB 3.29Å; V746-Y750 WeakPolarHBondContact O-CB 3.11Å; V746-Y750 PolarHBondContact O-N 3.09Å
747	E	90.5	Very high	85	Confident	63 Å²	63	64.4 Å²	64.4	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-46.2	174	-75.4	169.5	-178.4	0	0	111.9	K733 V743 T744 A749 Y750 Y751	K733-E747 HydrophobicContact CD-CG 4.27Å; K733-E747 VanDerWaalsContact NZ-CG 3.34Å; K733-E747 IonicContact NZ-OE1 3.11Å; K733-E747 PolarHBondContact NZ-OE1 2.84Å; V743-E747 WeakPolarHBondContact O-CG 3.45Å; V743-E747 PolarHBondContact O-N 3.5Å; T744-E747 PolarHBondContact O-N 2.9Å; E747-A749 PolarHBondContact O-N 3.36Å; E747-Y750 PolarHBondContact O-N 2.93Å; E747-Y751 HydrophobicContact CB-CD2 4.33Å; E747-Y751 HydrophobicContact CB-CE2 4.28Å; E747-Y751 WeakPolarHBondContact O-CD2 3.48Å; E747-Y751 PolarHBondContact O-N 3.4Å
748	N	91.4	Very high	83.7	Confident	94 Å²	94	63.1 Å²	63.1	50%	0.503	33%	0.334	S	S	.	.	H	α-helix	trans	-60.1	-47.3	177	-73.4	-15.7	0	0	0	111.4	T744 M745 Y750 Y752	T744-N748 WeakPolarHBondContact O-CB 3.49Å; T744-N748 PolarHBondContact O-N 3.31Å; T744-N748 PolarHBondContact O-ND2 3.4Å; M745-N748 PolarHBondContact O-N 3.39Å; N748-Y750 VanDerWaalsContact C-N 3.34Å; N748-Y750 PolarHBondContact O-N 2.93Å; N748-Y752 WeakPolarHBondContact O-CB 3.42Å; N748-Y752 PolarHBondContact O-N 3.2Å
749	A	91.1	Very high	81.4	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-62.5	-39.5	176.9	0	0	0	0	0	112.3	C702 L705 M745 E747 C753	C702-A749 HydrophobicContact CB-CB 3.98Å; L705-A749 HydrophobicContact CB-CB 4.14Å; L705-A749 HydrophobicContact CD1-CB 4.42Å; M745-A749 WeakPolarHBondContact O-CB 3.32Å; M745-A749 PolarHBondContact O-N 3.13Å; E747-A749 PolarHBondContact O-N 3.36Å; A749-C753 PolarHBondContact O-N 2.9Å; A749-C753 VanDerWaalsContact O-N 3.14Å; A749-C753 PolarHBondContact O-SG 2.99Å
750	Y	90.6	Very high	79.6	Confident	43 Å²	43	72.7 Å²	72.7	17%	0.169	37%	0.373	C	S	.	.	H	α-helix	trans	-65	-54.2	176.9	-178.4	-85.6	0	0	0	112.1	L726 M730 V746 E747 N748 Y752 C753 N754	L726-Y750 HydrophobicContact CB-CD2 3.92Å; L726-Y750 HydrophobicContact CB-CE2 3.87Å; L726-Y750 HydrophobicContact CD2-CD2 4.21Å; M730-Y750 HydrophobicContact CE-CD1 4.46Å; M730-Y750 HydrophobicContact CE-CG 4.48Å; M730-Y750 HydrophobicContact CG-CD2 3.42Å; M730-Y750 VanDerWaalsContact CG-CD2 3.42Å; M730-Y750 HydrophobicContact CG-CE2 3.77Å; M730-Y750 HydrophobicContact CG-CG 3.93Å; M730-Y750 HydrophobicContact SD-CD2 4.27Å; M730-Y750 HydrophobicContact SD-CG 4.18Å; V746-Y750 VanDerWaalsContact O-CB 3.29Å; V746-Y750 WeakPolarHBondContact O-CB 3.11Å; V746-Y750 PolarHBondContact O-N 3.09Å; E747-Y750 PolarHBondContact O-N 2.93Å; N748-Y750 VanDerWaalsContact C-N 3.34Å; N748-Y750 PolarHBondContact O-N 2.93Å; Y750-Y752 VanDerWaalsContact C-N 3.29Å; Y750-Y752 PolarHBondContact O-N 3.39Å; Y750-C753 PolarHBondContact O-N 3.45Å; Y750-C753 VanDerWaalsContact O-N 3.12Å; Y750-N754 PolarHBondContact O-N 3.38Å
751	Y	87.6	Confident	77.3	Confident	120 Å²	120	74.2 Å²	74.2	47%	0.471	39%	0.386	S	S	.	.	H	α-helix	trans	-73	-20.3	-179	-66.1	-57.5	0	0	0	113.4	E747 N754 P755	E747-Y751 HydrophobicContact CB-CD2 4.33Å; E747-Y751 HydrophobicContact CB-CE2 4.28Å; E747-Y751 WeakPolarHBondContact O-CD2 3.48Å; E747-Y751 PolarHBondContact O-N 3.4Å; Y751-N754 CarbonylContact O-C 3.55Å; Y751-P755 WeakPolarHBondContact O-CA 3.24Å
752	Y	86.9	Confident	75.1	Confident	68 Å²	68	74.2 Å²	74.2	27%	0.267	40%	0.4	S	S	.	.	H	α-helix	trans	-61.9	-55.9	163.3	-179.4	-102.8	0	0	0	109.5	E461 L705 E706 R710 N748 Y750	E461-Y752 PolarHBondContact OE1-OH 3.32Å; L705-Y752 WeakPolarHBondContact O-CD1 3.43Å; L705-Y752 WeakPolarHBondContact O-CE1 3.28Å; E706-Y752 WeakPolarHBondContact O-CE1 3.32Å; E706-Y752 PolarHBondContact O-OH 3.46Å; R710-Y752 HydrophobicContact CB-CE1 4.22Å; R710-Y752 HydrophobicContact CG-CD1 3.91Å; R710-Y752 HydrophobicContact CG-CE1 3.74Å; R710-Y752 HydrophobicContact CG-CG 4.43Å; R710-Y752 VanDerWaalsContact CG-O 3.24Å; R710-Y752 WeakPolarHBondContact CG-O 3.36Å; R710-Y752 PolarHBondContact NE-O 3.36Å; R710-Y752 PolarHBondContact NH2-O 3.01Å; N748-Y752 WeakPolarHBondContact O-CB 3.42Å; N748-Y752 PolarHBondContact O-N 3.2Å; Y750-Y752 VanDerWaalsContact C-N 3.29Å; Y750-Y752 PolarHBondContact O-N 3.39Å
753	C	87.2	Confident	73.3	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	43%	0.431	C	S	.	.	H	α-helix	trans	-62.5	-48.2	-178.8	-62.4	0	0	0	0	113.4	G709 F713 L726 A749 Y750 P755	G709-C753 VanDerWaalsContact C-SG 3.51Å; G709-C753 VanDerWaalsContact CA-SG 3.54Å; F713-C753 WeakPolarHBondContact CD1-O 3.32Å; L726-C753 HydrophobicContact CD1-CB 3.74Å; L726-C753 HydrophobicContact CD2-CB 4.22Å; A749-C753 PolarHBondContact O-N 2.9Å; A749-C753 VanDerWaalsContact O-N 3.14Å; A749-C753 PolarHBondContact O-SG 2.99Å; Y750-C753 PolarHBondContact O-N 3.45Å; Y750-C753 VanDerWaalsContact O-N 3.12Å; C753-P755 WeakPolarHBondContact O-CD 3.21Å
754	N	82.3	Confident	72	Confident	32 Å²	32	87.6 Å²	87.6	17%	0.171	46%	0.455	C	S	.	.	S	Bend	trans	-123	82.1	-177.6	-172.4	25.7	0	0	0	110.5	F713 Y750 Y751	F713-N754 HydrophobicContact CD1-CB 4.34Å; F713-N754 HydrophobicContact CE1-CB 3.76Å; F713-N754 WeakPolarHBondContact CE1-OD1 3.42Å; F713-N754 HydrophobicContact CE2-CB 4.27Å; F713-N754 HydrophobicContact CZ-CB 3.72Å; F713-N754 VanDerWaalsContact CZ-CG 3.44Å; F713-N754 WeakPolarHBondContact CZ-OD1 3.31Å; Y750-N754 PolarHBondContact O-N 3.38Å; Y751-N754 CarbonylContact O-C 3.55Å
755	P	73.8	Confident	70.8	Confident	53 Å²	53	91.9 Å²	91.9	34%	0.344	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-68.3	142.6	177	28.7	-34.3	0	0	0	110.6	Y751 C753	Y751-P755 WeakPolarHBondContact O-CA 3.24Å; C753-P755 WeakPolarHBondContact O-CD 3.21Å
756	P	66.7	Low	70.4	Confident	90 Å²	90	94.9 Å²	94.9	58%	0.584	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-61.4	144.3	-178.4	25.5	-34.4	0	0	0	111.8	I758	P756-I758 PolarHBondContact O-N 2.92Å
757	P	54.1	Low	70.3	Confident	131 Å²	131	98.2 Å²	98.2	85%	0.851	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-66.3	118	-174.8	26	-34.1	0	0	0	111.5
758	I	49.9	Very low	70.3	Confident	149 Å²	149	100.8 Å²	100.8	76%	0.764	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-83.3	124	169.7	-57.4	174	0	0	0	107.8	P756 K760	P756-I758 PolarHBondContact O-N 2.92Å; I758-K760 PolarHBondContact O-N 3.47Å
759	E	39.1	Very low	70.2	Confident	196 Å²	196	99.6 Å²	99.6	92%	0.916	51%	0.514	S	S	*	.			trans	-61.1	101.1	177.6	-68.1	-171.5	163.3	0	0	111.6
760	K	46.4	Very low	70.3	Confident	134 Å²	134	102 Å²	102	58%	0.583	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-88.7	126.9	172.5	-70.8	177.7	178.4	171.4	0	110.1	E456 I758 V762	E456-K760 WeakPolarHBondContact OE2-CD 3.27Å; E456-K760 WeakPolarHBondContact OE2-CE 3.42Å; E456-K760 IonicContact OE2-NZ 2.74Å; E456-K760 PolarHBondContact OE2-NZ 2.93Å; I758-K760 PolarHBondContact O-N 3.47Å; K760-V762 PolarHBondContact O-N 3.04Å
761	A	41	Very low	70.3	Confident	97 Å²	97	103.8 Å²	103.8	80%	0.802	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-66.1	119.4	176.7	0	0	0	0	0	111.7	K763	A761-K763 PolarHBondContact O-N 2.96Å
762	V	44.2	Very low	70.6	Confident	127 Å²	127	102 Å²	102	77%	0.77	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-55.6	124.3	-177	-176.4	0	0	0	0	112.1	K760 K764	K760-V762 PolarHBondContact O-N 3.04Å; V762-K764 PolarHBondContact O-N 3.32Å
763	K	52.8	Low	71	Confident	172 Å²	172	98.8 Å²	98.8	75%	0.748	52%	0.516	S	S	*	.			trans	-77.3	89.9	175.2	-66.7	170.2	-169.7	144.1	0	110.1	A761 K765	A761-K763 PolarHBondContact O-N 2.96Å; K763-K765 PolarHBondContact O-N 3.02Å
764	K	62	Low	71.3	Confident	164 Å²	164	101.2 Å²	101.2	71%	0.713	53%	0.525	S	S	*	.			trans	-49.6	124.8	171.5	-62	-169.4	177.3	-167.5	0	110.6	V762 R766	V762-K764 PolarHBondContact O-N 3.32Å; K764-R766 WeakPolarHBondContact O-CG 3.37Å
765	K	67.6	Low	71.9	Confident	162 Å²	162	104.5 Å²	104.5	70%	0.704	54%	0.538	S	S	*	.			trans	-60.2	137.6	171.4	-66.5	154.6	-178.8	150.7	0	108.8	E436 K763	E436-K765 IonicContact OE1-NZ 2.73Å; E436-K765 PolarHBondContact OE1-NZ 3.38Å; E436-K765 IonicContact OE2-NZ 3.56Å; K763-K765 PolarHBondContact O-N 3.02Å
766	R	81.1	Confident	72.9	Confident	97 Å²	97	102 Å²	102	37%	0.366	52%	0.521	S	S	.	.			trans	-136.9	155.9	-175.8	-50.7	-167.2	-163.6	-134.1	-9.2	112.8	K764 Q770 E771 Y806	K764-R766 WeakPolarHBondContact O-CG 3.37Å; R766-Q770 HydrophobicContact CB-CB 4.24Å; R766-E771 HydrophobicContact CB-CG 4.21Å; R766-E771 WeakPolarHBondContact CD-OE1 3.24Å; R766-E771 IonicContact NE-OE1 2.82Å; R766-E771 PolarHBondContact NE-OE1 2.91Å; R766-Y806 WeakPolarHBondContact CD-OH 3.4Å; R766-Y806 PolarHBondContact NH1-OH 3.25Å
767	P	89.3	Confident	74.2	Confident	70 Å²	70	97.9 Å²	97.9	46%	0.455	49%	0.494	S	S	.	.			trans	-58.6	152.2	171.3	-25.1	34.3	0	0	0	114	L769 Q770 E771	P767-L769 PolarHBondContact O-N 3.47Å; P767-Q770 HydrophobicContact CB-CG 4.28Å; P767-Q770 HydrophobicContact CG-CG 4.29Å; P767-Q770 WeakPolarHBondContact O-CB 3.4Å; P767-Q770 PolarHBondContact O-N 3.11Å; P767-E771 PolarHBondContact O-N 2.79Å
768	P	90.8	Very high	76.1	Confident	117 Å²	117	93.3 Å²	93.3	76%	0.76	46%	0.46	S	S	*	.	H	α-helix	trans	-57.9	-42.2	-177.5	-27.3	35.8	0	0	0	114.8	Q770 E771 Y772	P768-Q770 VanDerWaalsContact C-N 3.29Å; P768-Q770 PolarHBondContact O-N 2.91Å; P768-E771 PolarHBondContact O-N 3.26Å; P768-Y772 WeakPolarHBondContact O-CB 3.15Å; P768-Y772 PolarHBondContact O-N 2.68Å
769	L	89.9	Confident	78.1	Confident	70 Å²	70	93.9 Å²	93.9	37%	0.366	46%	0.457	S	S	.	.	H	α-helix	trans	-63.1	-35.3	176.7	-75.3	172.8	0	0	0	112.2	P767 Y772 I773 P797 V803	P767-L769 PolarHBondContact O-N 3.47Å; L769-Y772 PolarHBondContact O-N 2.9Å; L769-I773 WeakPolarHBondContact O-CG1 3.29Å; L769-I773 PolarHBondContact O-N 3.44Å; L769-P797 HydrophobicContact CD1-CG 4.35Å; L769-V803 HydrophobicContact CD1-CG2 4.04Å
770	Q	92.3	Very high	80.7	Confident	51 Å²	51	87.4 Å²	87.4	24%	0.238	43%	0.429	C	S	.	.	H	α-helix	trans	-66.1	-45	175.7	-70.1	-166.4	7.9	0	0	111.4	R766 P767 P768 Y772 I773 R774 Y806	R766-Q770 HydrophobicContact CB-CB 4.24Å; P767-Q770 HydrophobicContact CB-CG 4.28Å; P767-Q770 HydrophobicContact CG-CG 4.29Å; P767-Q770 WeakPolarHBondContact O-CB 3.4Å; P767-Q770 PolarHBondContact O-N 3.11Å; P768-Q770 VanDerWaalsContact C-N 3.29Å; P768-Q770 PolarHBondContact O-N 2.91Å; Q770-Y772 VanDerWaalsContact C-N 3.33Å; Q770-Y772 PolarHBondContact O-N 3.03Å; Q770-I773 PolarHBondContact O-N 2.89Å; Q770-R774 VanDerWaalsContact O-CG 3.28Å; Q770-R774 WeakPolarHBondContact O-CG 3.46Å; Q770-R774 PolarHBondContact O-N 3.48Å; Q770-Y806 HydrophobicContact CB-CD1 4.06Å; Q770-Y806 HydrophobicContact CB-CE1 3.5Å; Q770-Y806 VanDerWaalsContact CB-CE1 3.5Å; Q770-Y806 HydrophobicContact CB-CE2 4.18Å; Q770-Y806 HydrophobicContact CG-CD1 3.74Å; Q770-Y806 HydrophobicContact CG-CD2 3.9Å; Q770-Y806 HydrophobicContact CG-CE1 3.66Å; Q770-Y806 HydrophobicContact CG-CE2 3.84Å; Q770-Y806 HydrophobicContact CG-CG 3.84Å
771	E	91.3	Very high	82.9	Confident	79 Å²	79	81.5 Å²	81.5	37%	0.369	40%	0.404	S	S	.	.	H	α-helix	trans	-67.4	-31.9	174.6	-74.7	-57.4	147.2	0	0	112.8	R766 P767 P768 R774 K775	R766-E771 HydrophobicContact CB-CG 4.21Å; R766-E771 WeakPolarHBondContact CD-OE1 3.24Å; R766-E771 IonicContact NE-OE1 2.82Å; R766-E771 PolarHBondContact NE-OE1 2.91Å; P767-E771 PolarHBondContact O-N 2.79Å; P768-E771 PolarHBondContact O-N 3.26Å; E771-R774 PolarHBondContact O-N 3.04Å; E771-K775 WeakPolarHBondContact O-CB 3.41Å; E771-K775 PolarHBondContact O-N 2.76Å
772	Y	94.6	Very high	85.4	Confident	83 Å²	83	78.6 Å²	78.6	33%	0.325	38%	0.378	S	S	.	.	H	α-helix	trans	-64	-47.9	173.1	-177.9	-123.7	0	0	0	111.9	P768 L769 Q770 R774 K775 L776 Q792 L796	P768-Y772 WeakPolarHBondContact O-CB 3.15Å; P768-Y772 PolarHBondContact O-N 2.68Å; L769-Y772 PolarHBondContact O-N 2.9Å; Q770-Y772 VanDerWaalsContact C-N 3.33Å; Q770-Y772 PolarHBondContact O-N 3.03Å; Y772-R774 PolarHBondContact O-N 3.47Å; Y772-K775 WeakPolarHBondContact O-CB 3.4Å; Y772-K775 PolarHBondContact O-N 3.03Å; Y772-L776 HydrophobicContact CD1-CD1 4.22Å; Y772-L776 HydrophobicContact CD2-CG 4.36Å; Y772-L776 HydrophobicContact CE1-CD1 3.75Å; Y772-L776 HydrophobicContact CE1-CG 4.49Å; Y772-L776 HydrophobicContact CE2-CD1 4.14Å; Y772-L776 HydrophobicContact CE2-CD2 4.13Å; Y772-L776 HydrophobicContact CE2-CG 4.04Å; Y772-L776 WeakPolarHBondContact O-CG 3.32Å; Y772-L776 PolarHBondContact O-N 3.34Å; Y772-Q792 WeakPolarHBondContact OH-CB 3.49Å; Y772-Q792 WeakPolarHBondContact OH-CG 3.38Å; Y772-Q792 PolarHBondContact OH-OE1 3.16Å; Y772-L796 HydrophobicContact CD1-CD2 4.16Å; Y772-L796 HydrophobicContact CE1-CD2 4.16Å
773	I	94.8	Very high	87.7	Confident	1 Å²	1	80.3 Å²	80.3	1%	0.005	38%	0.375	C	S	.	.	H	α-helix	trans	-60.4	-44	174.4	-69.7	163.9	0	0	0	111	L769 Q770 K775 L776 L777 L796 V803 Y806 L807 C810	L769-I773 WeakPolarHBondContact O-CG1 3.29Å; L769-I773 PolarHBondContact O-N 3.44Å; Q770-I773 PolarHBondContact O-N 2.89Å; I773-K775 VanDerWaalsContact C-N 3.35Å; I773-K775 PolarHBondContact O-N 2.97Å; I773-L776 PolarHBondContact O-N 3.36Å; I773-L777 HydrophobicContact CG2-CD1 3.96Å; I773-L777 PolarHBondContact O-N 2.79Å; I773-L796 HydrophobicContact CD1-CD1 4.26Å; I773-L796 HydrophobicContact CG1-CD1 4.07Å; I773-L796 HydrophobicContact CG1-CD2 4.34Å; I773-V803 HydrophobicContact CD1-CG1 3.83Å; I773-Y806 HydrophobicContact CB-CD1 4.45Å; I773-Y806 HydrophobicContact CB-CE1 4.47Å; I773-Y806 HydrophobicContact CD1-CD1 4.24Å; I773-Y806 HydrophobicContact CG2-CD1 4.3Å; I773-Y806 HydrophobicContact CG2-CE1 4.45Å; I773-L807 HydrophobicContact CD1-CB 4.35Å; I773-L807 HydrophobicContact CG2-CB 4.35Å; I773-L807 HydrophobicContact CG2-CG 4.48Å; I773-C810 HydrophobicContact CG2-CB 4.33Å
774	R	94.3	Very high	89.6	Confident	50 Å²	50	78.6 Å²	78.6	19%	0.189	38%	0.378	C	S	.	.	H	α-helix	trans	-60.5	-41.3	175	-71.1	-170.2	71.2	75.1	6.7	112.2	Q770 E771 Y772 Y778 Y806 N816	Q770-R774 VanDerWaalsContact O-CG 3.28Å; Q770-R774 WeakPolarHBondContact O-CG 3.46Å; Q770-R774 PolarHBondContact O-N 3.48Å; E771-R774 PolarHBondContact O-N 3.04Å; Y772-R774 PolarHBondContact O-N 3.47Å; R774-Y778 HydrophobicContact CB-CD2 3.86Å; R774-Y778 HydrophobicContact CB-CE2 4.09Å; R774-Y778 HydrophobicContact CG-CD2 4.14Å; R774-Y778 HydrophobicContact CG-CE2 3.86Å; R774-Y778 VanDerWaalsContact O-CB 3.27Å; R774-Y778 WeakPolarHBondContact O-CB 3.43Å; R774-Y778 VanDerWaalsContact O-CD2 3.26Å; R774-Y778 WeakPolarHBondContact O-CD2 3.28Å; R774-Y778 PolarHBondContact O-N 3.36Å; R774-Y806 WeakPolarHBondContact CD-OH 3.38Å; R774-Y806 HydrophobicContact CG-CE1 4.3Å; R774-Y806 WeakPolarHBondContact CG-OH 3.12Å; R774-N816 PolarHBondContact NH2-OD1 3.17Å; R774-N816 VanDerWaalsContact NH2-OD1 3.12Å
775	K	94.4	Very high	91.2	Very high	102 Å²	102	72.7 Å²	72.7	44%	0.443	36%	0.356	S	S	.	.	H	α-helix	trans	-63.4	-50.4	176.1	179.5	-177.9	176.2	-171.4	0	110.5	E771 Y772 I773 L777 K779 D780	E771-K775 WeakPolarHBondContact O-CB 3.41Å; E771-K775 PolarHBondContact O-N 2.76Å; Y772-K775 WeakPolarHBondContact O-CB 3.4Å; Y772-K775 PolarHBondContact O-N 3.03Å; I773-K775 VanDerWaalsContact C-N 3.35Å; I773-K775 PolarHBondContact O-N 2.97Å; K775-L777 PolarHBondContact O-N 2.81Å; K775-K779 HydrophobicContact CG-CB 4.47Å; K775-K779 HydrophobicContact CG-CD 4.44Å; K775-K779 WeakPolarHBondContact O-CA 3.37Å; K775-K779 WeakPolarHBondContact O-CB 3.37Å; K775-K779 PolarHBondContact O-N 2.84Å; K775-D780 VanDerWaalsContact CE-OD1 3.27Å; K775-D780 WeakPolarHBondContact CE-OD1 3.34Å; K775-D780 WeakPolarHBondContact CE-OD2 3.44Å; K775-D780 WeakPolarHBondContact CG-OD1 3.41Å; K775-D780 IonicContact NZ-OD2 3.98Å; K775-D780 PolarHBondContact O-N 3.36Å
776	L	95.2	Very high	92.4	Very high	0 Å²	0	66 Å²	66	0%	0	33%	0.329	C	S	.	.	I	π-helix	trans	-57.6	-49	-179.8	-72.3	-177.8	0	0	0	112.3	Y772 I773 L781 V789 Q792 M793	Y772-L776 HydrophobicContact CD1-CD1 4.22Å; Y772-L776 HydrophobicContact CD2-CG 4.36Å; Y772-L776 HydrophobicContact CE1-CD1 3.75Å; Y772-L776 HydrophobicContact CE1-CG 4.49Å; Y772-L776 HydrophobicContact CE2-CD1 4.14Å; Y772-L776 HydrophobicContact CE2-CD2 4.13Å; Y772-L776 HydrophobicContact CE2-CG 4.04Å; Y772-L776 WeakPolarHBondContact O-CG 3.32Å; Y772-L776 PolarHBondContact O-N 3.34Å; I773-L776 PolarHBondContact O-N 3.36Å; L776-L781 VanDerWaalsContact O-CB 3.26Å; L776-L781 WeakPolarHBondContact O-CB 3.44Å; L776-L781 PolarHBondContact O-N 2.79Å; L776-L781 VanDerWaalsContact O-N 3.07Å; L776-V789 HydrophobicContact CB-CG1 4.25Å; L776-Q792 HydrophobicContact CD1-CB 3.99Å; L776-Q792 HydrophobicContact CD2-CB 4.37Å; L776-M793 HydrophobicContact CB-CE 3.6Å; L776-M793 HydrophobicContact CD1-CE 3.94Å; L776-M793 HydrophobicContact CD1-SD 3.75Å; L776-M793 HydrophobicContact CG-CE 4.46Å
777	L	94.1	Very high	92.9	Very high	3 Å²	3	67.4 Å²	67.4	2%	0.016	34%	0.34	C	S	.	.	I	π-helix	trans	-77.3	-41.9	-176.6	-70.3	173.8	0	0	0	114.1	I773 K775 L781 M793 C810 M811 L828	I773-L777 HydrophobicContact CG2-CD1 3.96Å; I773-L777 PolarHBondContact O-N 2.79Å; K775-L777 PolarHBondContact O-N 2.81Å; L777-L781 HydrophobicContact CD2-CD2 4.44Å; L777-M793 HydrophobicContact CD1-CE 4.39Å; L777-M793 HydrophobicContact CD2-CE 3.61Å; L777-M793 HydrophobicContact CG-CE 3.62Å; L777-C810 HydrophobicContact CD1-CB 3.61Å; L777-M811 HydrophobicContact CD1-CG 4.11Å; L777-M811 HydrophobicContact CD2-CE 3.93Å; L777-M811 HydrophobicContact CD2-CG 4.43Å; L777-L828 HydrophobicContact CD2-CD2 3.71Å
778	Y	93.8	Very high	93.2	Very high	35 Å²	35	70.9 Å²	70.9	14%	0.137	35%	0.348	C	S	.	.	I	π-helix	trans	-103.3	-12.4	-167.6	-48.5	-45.3	0	0	0	114.7	R774 C810 N816 V817	R774-Y778 HydrophobicContact CB-CD2 3.86Å; R774-Y778 HydrophobicContact CB-CE2 4.09Å; R774-Y778 HydrophobicContact CG-CD2 4.14Å; R774-Y778 HydrophobicContact CG-CE2 3.86Å; R774-Y778 VanDerWaalsContact O-CB 3.27Å; R774-Y778 WeakPolarHBondContact O-CB 3.43Å; R774-Y778 VanDerWaalsContact O-CD2 3.26Å; R774-Y778 WeakPolarHBondContact O-CD2 3.28Å; R774-Y778 PolarHBondContact O-N 3.36Å; Y778-C810 WeakPolarHBondContact OH-CA 3.44Å; Y778-C810 WeakPolarHBondContact OH-CB 3.25Å; Y778-C810 PolarHBondContact OH-O 3.2Å; Y778-C810 PolarHBondContact OH-SG 3.39Å; Y778-N816 HydrophobicContact CD1-CB 3.47Å; Y778-N816 VanDerWaalsContact CD1-CB 3.47Å; Y778-N816 HydrophobicContact CD2-CB 4.06Å; Y778-N816 HydrophobicContact CE1-CB 3.31Å; Y778-N816 HydrophobicContact CE2-CB 3.92Å; Y778-N816 HydrophobicContact CG-CB 3.84Å; Y778-V817 HydrophobicContact CD1-CG2 3.61Å; Y778-V817 HydrophobicContact CE1-CG2 3.99Å
779	K	91.2	Very high	93.5	Very high	161 Å²	161	65.4 Å²	65.4	70%	0.7	31%	0.312	S	S	*	.	I	π-helix	trans	-122.1	-51.3	-179.7	-60	179.5	-179.7	173.6	0	112.4	K775	K775-K779 HydrophobicContact CG-CB 4.47Å; K775-K779 HydrophobicContact CG-CD 4.44Å; K775-K779 WeakPolarHBondContact O-CA 3.37Å; K775-K779 WeakPolarHBondContact O-CB 3.37Å; K775-K779 PolarHBondContact O-N 2.84Å
780	D	93	Very high	93.7	Very high	60 Å²	60	63.9 Å²	63.9	32%	0.321	30%	0.304	S	S	.	.	I	π-helix	trans	-86.8	-22.2	-169.4	-65	12.9	0	0	0	112.9	K775 T785	K775-D780 VanDerWaalsContact CE-OD1 3.27Å; K775-D780 WeakPolarHBondContact CE-OD1 3.34Å; K775-D780 WeakPolarHBondContact CE-OD2 3.44Å; K775-D780 WeakPolarHBondContact CG-OD1 3.41Å; K775-D780 IonicContact NZ-OD2 3.98Å; K775-D780 PolarHBondContact O-N 3.36Å; D780-T785 WeakPolarHBondContact O-CB 3.44Å; D780-T785 PolarHBondContact O-OG1 3.18Å
781	L	94.2	Very high	93.8	Very high	11 Å²	11	68.1 Å²	68.1	6%	0.058	32%	0.318	C	S	.	.			trans	-75.6	123.3	-179	-178	62.8	0	0	0	113	L776 L777 T786 V789 C824 V825 L828	L776-L781 VanDerWaalsContact O-CB 3.26Å; L776-L781 WeakPolarHBondContact O-CB 3.44Å; L776-L781 PolarHBondContact O-N 2.79Å; L776-L781 VanDerWaalsContact O-N 3.07Å; L777-L781 HydrophobicContact CD2-CD2 4.44Å; L781-T786 HydrophobicContact CD1-CG2 3.99Å; L781-V789 HydrophobicContact CB-CG2 4.37Å; L781-V789 HydrophobicContact CD1-CB 4.18Å; L781-V789 HydrophobicContact CD1-CG1 4.3Å; L781-V789 HydrophobicContact CD1-CG2 4.21Å; L781-C824 HydrophobicContact CD1-CB 4.19Å; L781-C824 HydrophobicContact CD2-CB 4.32Å; L781-C824 HydrophobicContact CG-CB 4.03Å; L781-V825 HydrophobicContact CD2-CB 4.46Å; L781-V825 HydrophobicContact CD2-CG2 3.66Å; L781-L828 HydrophobicContact CD1-CD2 4.31Å; L781-L828 HydrophobicContact CD2-CD2 3.93Å
782	S	92.9	Very high	94	Very high	36 Å²	36	66.7 Å²	66.7	25%	0.252	31%	0.311	S	S	.	.	S	Bend	trans	-155.2	168.8	178	75	0	0	0	0	109.8	V784 T785 T786	S782-V784 PolarHBondContact O-N 2.79Å; S782-V784 WeakPolarHBondContact OG-CG2 3.49Å; S782-V784 PolarHBondContact OG-N 2.81Å; S782-T785 PolarHBondContact N-OG1 3.35Å; S782-T785 PolarHBondContact O-N 3.43Å; S782-T785 PolarHBondContact O-OG1 3.45Å; S782-T785 PolarHBondContact OG-N 3.39Å; S782-T785 PolarHBondContact OG-OG1 2.93Å; S782-T786 PolarHBondContact O-N 3.15Å; S782-T786 VanDerWaalsContact O-N 3.13Å
783	K	91.9	Very high	94	Very high	162 Å²	162	62.8 Å²	62.8	70%	0.704	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-21.2	179.9	-169.7	171	-179.8	175.7	0	114.6	C824	K783-C824 PolarHBondContact N-SG 3.48Å; K783-C824 VanDerWaalsContact N-SG 3.42Å
784	V	94	Very high	94	Very high	136 Å²	136	68 Å²	68	82%	0.824	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-7.2	177.9	-60.4	0	0	0	0	114.1	S782	S782-V784 PolarHBondContact O-N 2.79Å; S782-V784 WeakPolarHBondContact OG-CG2 3.49Å; S782-V784 PolarHBondContact OG-N 2.81Å
785	T	94.4	Very high	93.9	Very high	40 Å²	40	74.2 Å²	74.2	25%	0.245	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-3.9	-178.9	50.7	0	0	0	0	113.9	D780 S782 E787 K788 V789	D780-T785 WeakPolarHBondContact O-CB 3.44Å; D780-T785 PolarHBondContact O-OG1 3.18Å; S782-T785 PolarHBondContact N-OG1 3.35Å; S782-T785 PolarHBondContact O-N 3.43Å; S782-T785 PolarHBondContact O-OG1 3.45Å; S782-T785 PolarHBondContact OG-N 3.39Å; S782-T785 PolarHBondContact OG-OG1 2.93Å; T785-E787 PolarHBondContact O-N 2.92Å; T785-K788 WeakPolarHBondContact O-CA 3.45Å; T785-K788 WeakPolarHBondContact O-CB 3.46Å; T785-K788 PolarHBondContact O-N 2.62Å; T785-V789 PolarHBondContact O-N 3.27Å
786	T	92.6	Very high	93.9	Very high	23 Å²	23	70 Å²	70	14%	0.141	33%	0.326	C	S	.	.	H	α-helix	trans	-43.1	-53.6	178.7	37.8	0	0	0	0	113.5	L781 S782 K788 V789 L790 C824	L781-T786 HydrophobicContact CD1-CG2 3.99Å; S782-T786 PolarHBondContact O-N 3.15Å; S782-T786 VanDerWaalsContact O-N 3.13Å; T786-K788 VanDerWaalsContact C-N 3.32Å; T786-K788 PolarHBondContact O-N 3.07Å; T786-V789 PolarHBondContact O-N 2.89Å; T786-L790 WeakPolarHBondContact O-CB 3.33Å; T786-L790 PolarHBondContact O-N 2.91Å; T786-C824 HydrophobicContact CG2-CB 4.18Å
787	E	92.8	Very high	93.7	Very high	125 Å²	125	71.5 Å²	71.5	58%	0.584	34%	0.336	S	S	*	.	H	α-helix	trans	-65.5	-32.5	179.8	-60.7	-172.1	175.2	0	0	113.8	T785 R791	T785-E787 PolarHBondContact O-N 2.92Å; E787-R791 WeakPolarHBondContact O-CB 3.49Å; E787-R791 WeakPolarHBondContact O-CG 3.43Å; E787-R791 PolarHBondContact O-N 3.03Å; E787-R791 PolarHBondContact O-NE 2.97Å; E787-R791 VanDerWaalsContact O-NE 3.1Å; E787-R791 IonicContact OE2-CZ 3.07Å; E787-R791 IonicContact OE2-NH1 2.78Å; E787-R791 IonicContact OE2-NH2 2.68Å; E787-R791 PolarHBondContact OE2-NH2 3.04Å
788	K	94.9	Very high	93.6	Very high	143 Å²	143	72.8 Å²	72.8	62%	0.622	34%	0.341	S	S	*	.	H	α-helix	trans	-73.3	-36.1	178	-174.6	178.9	177.6	179.5	0	110.3	T785 T786 Q792	T785-K788 WeakPolarHBondContact O-CA 3.45Å; T785-K788 WeakPolarHBondContact O-CB 3.46Å; T785-K788 PolarHBondContact O-N 2.62Å; T786-K788 VanDerWaalsContact C-N 3.32Å; T786-K788 PolarHBondContact O-N 3.07Å; K788-Q792 WeakPolarHBondContact O-CG 3.31Å; K788-Q792 PolarHBondContact O-N 2.94Å; K788-Q792 PolarHBondContact O-NE2 2.93Å
789	V	96.6	Very high	93.4	Very high	2 Å²	2	79.1 Å²	79.1	1%	0.012	37%	0.372	C	S	.	.	H	α-helix	trans	-69.7	-46.2	172.7	177.3	0	0	0	0	110.2	L776 L781 T785 T786 R791 Q792 M793 L828	L776-V789 HydrophobicContact CB-CG1 4.25Å; L781-V789 HydrophobicContact CB-CG2 4.37Å; L781-V789 HydrophobicContact CD1-CB 4.18Å; L781-V789 HydrophobicContact CD1-CG1 4.3Å; L781-V789 HydrophobicContact CD1-CG2 4.21Å; T785-V789 PolarHBondContact O-N 3.27Å; T786-V789 PolarHBondContact O-N 2.89Å; V789-R791 PolarHBondContact O-N 2.95Å; V789-Q792 CarbonylContact O-C 3.19Å; V789-Q792 WeakPolarHBondContact O-CA 3.08Å; V789-Q792 WeakPolarHBondContact O-CB 3.34Å; V789-Q792 PolarHBondContact O-N 3.42Å; V789-M793 HydrophobicContact CG1-CE 3.99Å; V789-M793 HydrophobicContact CG1-CG 4.11Å; V789-M793 WeakPolarHBondContact O-CG 3.46Å; V789-M793 PolarHBondContact O-N 3.44Å; V789-L828 HydrophobicContact CG1-CD1 4.07Å; V789-L828 HydrophobicContact CG1-CD2 3.77Å
790	L	94.9	Very high	93.4	Very high	38 Å²	38	75.9 Å²	75.9	20%	0.199	36%	0.359	C	S	.	.	H	α-helix	trans	-58.7	-44.3	177.6	-180	58.3	0	0	0	112.5	T786 Q792 M793 R794 L828 G831 L832	T786-L790 WeakPolarHBondContact O-CB 3.33Å; T786-L790 PolarHBondContact O-N 2.91Å; L790-Q792 PolarHBondContact O-N 3.41Å; L790-M793 PolarHBondContact O-N 2.95Å; L790-R794 HydrophobicContact CD1-CG 4.19Å; L790-R794 WeakPolarHBondContact O-CB 3.14Å; L790-R794 WeakPolarHBondContact O-CG 3.49Å; L790-R794 PolarHBondContact O-N 3.41Å; L790-L828 HydrophobicContact CB-CD1 3.72Å; L790-L828 HydrophobicContact CD1-CD1 4.03Å; L790-L828 HydrophobicContact CG-CD1 4.46Å; L790-G831 WeakPolarHBondContact CD1-O 2.87Å; L790-L832 HydrophobicContact CD1-CB 4.07Å; L790-L832 HydrophobicContact CD1-CD1 4.41Å
791	R	94.8	Very high	93.3	Very high	141 Å²	141	78.1 Å²	78.1	53%	0.532	38%	0.377	S	S	.	.	H	α-helix	trans	-65	-16.4	174.4	-79.3	179.2	-77.3	-145.6	-5.4	114.3	E787 V789 K795	E787-R791 WeakPolarHBondContact O-CB 3.49Å; E787-R791 WeakPolarHBondContact O-CG 3.43Å; E787-R791 PolarHBondContact O-N 3.03Å; E787-R791 PolarHBondContact O-NE 2.97Å; E787-R791 VanDerWaalsContact O-NE 3.1Å; E787-R791 IonicContact OE2-CZ 3.07Å; E787-R791 IonicContact OE2-NH1 2.78Å; E787-R791 IonicContact OE2-NH2 2.68Å; E787-R791 PolarHBondContact OE2-NH2 3.04Å; V789-R791 PolarHBondContact O-N 2.95Å; R791-K795 WeakPolarHBondContact O-CG 3.49Å
792	Q	95.4	Very high	93.1	Very high	49 Å²	49	85.4 Å²	85.4	23%	0.229	41%	0.41	C	S	.	.	H	α-helix	trans	-92.1	-43.4	171.5	-73.8	171.2	104	0	0	111.5	Y772 L776 K788 V789 L790 R794 K795	Y772-Q792 WeakPolarHBondContact OH-CB 3.49Å; Y772-Q792 WeakPolarHBondContact OH-CG 3.38Å; Y772-Q792 PolarHBondContact OH-OE1 3.16Å; L776-Q792 HydrophobicContact CD1-CB 3.99Å; L776-Q792 HydrophobicContact CD2-CB 4.37Å; K788-Q792 WeakPolarHBondContact O-CG 3.31Å; K788-Q792 PolarHBondContact O-N 2.94Å; K788-Q792 PolarHBondContact O-NE2 2.93Å; V789-Q792 CarbonylContact O-C 3.19Å; V789-Q792 WeakPolarHBondContact O-CA 3.08Å; V789-Q792 WeakPolarHBondContact O-CB 3.34Å; V789-Q792 PolarHBondContact O-N 3.42Å; L790-Q792 PolarHBondContact O-N 3.41Å; Q792-R794 VanDerWaalsContact C-N 3.31Å; Q792-R794 PolarHBondContact O-N 3.04Å; Q792-K795 WeakPolarHBondContact O-CB 3.42Å; Q792-K795 PolarHBondContact O-N 2.96Å
793	M	93.7	Very high	93.1	Very high	0 Å²	0	84.5 Å²	84.5	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-57.7	-43	175.8	-65.9	-52.1	-168.3	0	0	111.8	L776 L777 V789 L790 K795 L796 W798 L807 L828 L832	L776-M793 HydrophobicContact CB-CE 3.6Å; L776-M793 HydrophobicContact CD1-CE 3.94Å; L776-M793 HydrophobicContact CD1-SD 3.75Å; L776-M793 HydrophobicContact CG-CE 4.46Å; L777-M793 HydrophobicContact CD1-CE 4.39Å; L777-M793 HydrophobicContact CD2-CE 3.61Å; L777-M793 HydrophobicContact CG-CE 3.62Å; V789-M793 HydrophobicContact CG1-CE 3.99Å; V789-M793 HydrophobicContact CG1-CG 4.11Å; V789-M793 WeakPolarHBondContact O-CG 3.46Å; V789-M793 PolarHBondContact O-N 3.44Å; L790-M793 PolarHBondContact O-N 2.95Å; M793-K795 PolarHBondContact O-N 3.4Å; M793-L796 WeakPolarHBondContact O-CB 3.37Å; M793-L796 PolarHBondContact O-N 2.8Å; M793-L796 VanDerWaalsContact O-N 3.11Å; M793-L796 HydrophobicContact SD-CD1 3.7Å; M793-W798 VanDerWaalsContact O-CZ2 3.27Å; M793-W798 WeakPolarHBondContact O-CZ2 3.38Å; M793-W798 PolarHBondContact O-NE1 2.89Å; M793-L807 HydrophobicContact CE-CD1 4.43Å; M793-L807 HydrophobicContact SD-CD1 3.79Å; M793-L828 HydrophobicContact CE-CD2 4.36Å; M793-L828 HydrophobicContact CG-CD1 4.31Å; M793-L828 HydrophobicContact CG-CD2 4.44Å; M793-L832 HydrophobicContact CB-CD1 4.4Å
794	R	94.1	Very high	93.1	Very high	112 Å²	112	78.2 Å²	78.2	42%	0.423	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-9.4	174.4	-74.2	178.7	60.5	-163.2	-4.8	115	L790 Q792 L832 Y835	L790-R794 HydrophobicContact CD1-CG 4.19Å; L790-R794 WeakPolarHBondContact O-CB 3.14Å; L790-R794 WeakPolarHBondContact O-CG 3.49Å; L790-R794 PolarHBondContact O-N 3.41Å; Q792-R794 VanDerWaalsContact C-N 3.31Å; Q792-R794 PolarHBondContact O-N 3.04Å; R794-L832 HydrophobicContact CG-CD1 4.19Å; R794-Y835 HydrophobicContact CG-CD2 4.03Å; R794-Y835 HydrophobicContact CG-CE2 4.49Å; R794-Y835 HydrophobicContact CG-CG 4.41Å; R794-Y835 VanDerWaalsContact CZ-CE1 3.44Å; R794-Y835 PolarHBondContact NH1-OH 3.37Å
795	K	93.8	Very high	93.1	Very high	179 Å²	179	73.5 Å²	73.5	78%	0.778	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	3.9	178.6	-62.8	-176.8	178.3	-167.7	0	114	R791 Q792 M793	R791-K795 WeakPolarHBondContact O-CG 3.49Å; Q792-K795 WeakPolarHBondContact O-CB 3.42Å; Q792-K795 PolarHBondContact O-N 2.96Å; M793-K795 PolarHBondContact O-N 3.4Å
796	L	93.8	Very high	93.1	Very high	13 Å²	13	73 Å²	73	7%	0.068	35%	0.349	C	S	.	.	S	Bend	trans	-67.5	154.8	171.7	-66.4	173	0	0	0	110.8	Y772 I773 M793 W798 L807	Y772-L796 HydrophobicContact CD1-CD2 4.16Å; Y772-L796 HydrophobicContact CE1-CD2 4.16Å; I773-L796 HydrophobicContact CD1-CD1 4.26Å; I773-L796 HydrophobicContact CG1-CD1 4.07Å; I773-L796 HydrophobicContact CG1-CD2 4.34Å; M793-L796 WeakPolarHBondContact O-CB 3.37Å; M793-L796 PolarHBondContact O-N 2.8Å; M793-L796 VanDerWaalsContact O-N 3.11Å; M793-L796 HydrophobicContact SD-CD1 3.7Å; L796-W798 VanDerWaalsContact C-N 3.28Å; L796-W798 HydrophobicContact CB-CZ2 4.41Å; L796-W798 HydrophobicContact CD1-CZ2 4.27Å; L796-W798 PolarHBondContact O-N 3.49Å; L796-L807 HydrophobicContact CD1-CD1 3.47Å; L796-L807 VanDerWaalsContact CD1-CD1 3.47Å
797	P	92	Very high	93.2	Very high	33 Å²	33	72 Å²	72	21%	0.214	34%	0.342	C	S	.	.			trans	-73.3	81.3	175.2	31.3	-35.8	0	0	0	110.3	L769 Q799 E800 V803	L769-P797 HydrophobicContact CD1-CG 4.35Å; P797-Q799 PolarHBondContact O-N 3.17Å; P797-Q799 VanDerWaalsContact O-N 3.09Å; P797-E800 HydrophobicContact CB-CB 4.46Å; P797-E800 HydrophobicContact CB-CG 4.08Å; P797-E800 HydrophobicContact CG-CG 4.38Å; P797-E800 WeakPolarHBondContact O-CB 3.14Å; P797-E800 PolarHBondContact O-N 3.09Å; P797-V803 HydrophobicContact CG-CB 4.45Å; P797-V803 HydrophobicContact CG-CG1 4.22Å; P797-V803 HydrophobicContact CG-CG2 4.23Å
798	W	91.7	Very high	93.3	Very high	30 Å²	30	67 Å²	67	11%	0.114	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-12	-179	-67.9	104.3	0	0	0	114.4	M793 L796 E800 K804 L807 L832 Q836 V839	M793-W798 VanDerWaalsContact O-CZ2 3.27Å; M793-W798 WeakPolarHBondContact O-CZ2 3.38Å; M793-W798 PolarHBondContact O-NE1 2.89Å; L796-W798 VanDerWaalsContact C-N 3.28Å; L796-W798 HydrophobicContact CB-CZ2 4.41Å; L796-W798 HydrophobicContact CD1-CZ2 4.27Å; L796-W798 PolarHBondContact O-N 3.49Å; W798-E800 VanDerWaalsContact C-N 3.34Å; W798-K804 HydrophobicContact CE3-CB 4.39Å; W798-K804 HydrophobicContact CE3-CD 4.15Å; W798-K804 HydrophobicContact CE3-CG 4.04Å; W798-K804 HydrophobicContact CZ3-CG 4.17Å; W798-L807 HydrophobicContact CH2-CD1 3.6Å; W798-L807 HydrophobicContact CH2-CD2 3.8Å; W798-L807 HydrophobicContact CH2-CG 4.27Å; W798-L807 HydrophobicContact CZ2-CD1 4.25Å; W798-L807 HydrophobicContact CZ3-CD1 4.37Å; W798-L807 HydrophobicContact CZ3-CD2 4.2Å; W798-L832 HydrophobicContact CH2-CD1 4.43Å; W798-L832 HydrophobicContact CH2-CD2 3.88Å; W798-L832 HydrophobicContact CZ2-CD1 3.88Å; W798-L832 HydrophobicContact CZ2-CD2 4.11Å; W798-Q836 HydrophobicContact CD2-CG 3.68Å; W798-Q836 HydrophobicContact CE3-CG 3.98Å; W798-Q836 HydrophobicContact CG-CG 3.93Å; W798-Q836 HydrophobicContact CZ2-CG 4.48Å; W798-Q836 HydrophobicContact CZ3-CG 4.49Å; W798-V839 HydrophobicContact CE3-CG2 4.17Å; W798-V839 HydrophobicContact CH2-CG2 4.31Å; W798-V839 HydrophobicContact CZ3-CG1 4.5Å; W798-V839 HydrophobicContact CZ3-CG2 3.61Å
799	Q	89.9	Confident	93.4	Very high	168 Å²	168	62.9 Å²	62.9	79%	0.785	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-18.8	172.1	-58.8	76.8	12.7	0	0	112.8	P797 P801	P797-Q799 PolarHBondContact O-N 3.17Å; P797-Q799 VanDerWaalsContact O-N 3.09Å; Q799-P801 WeakPolarHBondContact O-CD 3.01Å
800	E	90.8	Very high	93.3	Very high	93 Å²	93	63 Å²	63	44%	0.435	31%	0.309	S	S	.	.			trans	-88.5	110.1	178.6	-69.6	175.6	-166.1	0	0	110.2	P797 W798 E802 V803 K804	P797-E800 HydrophobicContact CB-CB 4.46Å; P797-E800 HydrophobicContact CB-CG 4.08Å; P797-E800 HydrophobicContact CG-CG 4.38Å; P797-E800 WeakPolarHBondContact O-CB 3.14Å; P797-E800 PolarHBondContact O-N 3.09Å; W798-E800 VanDerWaalsContact C-N 3.34Å; E800-E802 VanDerWaalsContact C-N 3.26Å; E800-E802 PolarHBondContact O-N 3.34Å; E800-V803 HydrophobicContact CB-CB 4.14Å; E800-V803 HydrophobicContact CB-CG2 3.92Å; E800-V803 PolarHBondContact O-N 3.06Å; E800-V803 VanDerWaalsContact O-N 3.17Å; E800-V803 WeakPolarHBondContact OE2-CG2 3.48Å; E800-K804 PolarHBondContact O-N 2.9Å; E800-K804 VanDerWaalsContact O-N 3.1Å
801	P	90.2	Very high	93.4	Very high	106 Å²	106	61.3 Å²	61.3	69%	0.688	30%	0.3	S	S	*	.	H	α-helix	trans	-64.7	-30.6	-174.3	25.5	-34.2	0	0	0	112.5	Q799 G805	Q799-P801 WeakPolarHBondContact O-CD 3.01Å; P801-G805 PolarHBondContact O-N 2.79Å
802	E	90.8	Very high	93.5	Very high	164 Å²	164	56 Å²	56	77%	0.766	28%	0.282	S	S	*	.	H	α-helix	trans	-63.5	-43.2	175.2	-64.1	-170	-171.2	0	0	112.4	E800 Y806	E800-E802 VanDerWaalsContact C-N 3.26Å; E800-E802 PolarHBondContact O-N 3.34Å; E802-Y806 WeakPolarHBondContact O-CB 3.45Å; E802-Y806 PolarHBondContact O-N 2.83Å
803	V	91.8	Very high	93.5	Very high	17 Å²	17	55.9 Å²	55.9	10%	0.103	28%	0.283	C	S	.	.	H	α-helix	trans	-70	-42.4	-179.5	-179.9	0	0	0	0	110.3	L769 I773 P797 E800 Y806 L807	L769-V803 HydrophobicContact CD1-CG2 4.04Å; I773-V803 HydrophobicContact CD1-CG1 3.83Å; P797-V803 HydrophobicContact CG-CB 4.45Å; P797-V803 HydrophobicContact CG-CG1 4.22Å; P797-V803 HydrophobicContact CG-CG2 4.23Å; E800-V803 HydrophobicContact CB-CB 4.14Å; E800-V803 HydrophobicContact CB-CG2 3.92Å; E800-V803 PolarHBondContact O-N 3.06Å; E800-V803 VanDerWaalsContact O-N 3.17Å; E800-V803 WeakPolarHBondContact OE2-CG2 3.48Å; V803-Y806 PolarHBondContact O-N 3.03Å; V803-L807 PolarHBondContact O-N 3Å
804	K	92.7	Very high	93.7	Very high	31 Å²	31	55.9 Å²	55.9	14%	0.135	28%	0.283	C	S	.	.	H	α-helix	trans	-62.1	-50.9	175.7	-173.5	162.9	-177.6	158.9	0	111.7	W798 E800 Y806 L807 I808 D838 V839	W798-K804 HydrophobicContact CE3-CB 4.39Å; W798-K804 HydrophobicContact CE3-CD 4.15Å; W798-K804 HydrophobicContact CE3-CG 4.04Å; W798-K804 HydrophobicContact CZ3-CG 4.17Å; E800-K804 PolarHBondContact O-N 2.9Å; E800-K804 VanDerWaalsContact O-N 3.1Å; K804-Y806 VanDerWaalsContact C-N 3.35Å; K804-Y806 PolarHBondContact O-N 3.19Å; K804-L807 PolarHBondContact O-N 2.99Å; K804-I808 HydrophobicContact CG-CD1 4.11Å; K804-I808 WeakPolarHBondContact O-CG1 3.16Å; K804-I808 PolarHBondContact O-N 3.29Å; K804-D838 WeakPolarHBondContact CE-OD1 3.38Å; K804-D838 WeakPolarHBondContact CE-OD2 3.5Å; K804-D838 IonicContact NZ-OD1 2.84Å; K804-D838 PolarHBondContact NZ-OD1 3.43Å; K804-D838 IonicContact NZ-OD2 2.67Å; K804-D838 PolarHBondContact NZ-OD2 3.07Å; K804-V839 HydrophobicContact CD-CG2 4.47Å; K804-V839 HydrophobicContact CG-CG2 4.29Å
805	G	93.4	Very high	93.7	Very high	37 Å²	37	53.4 Å²	53.4	38%	0.381	27%	0.274	S	S	.	.	H	α-helix	trans	-61.6	-38.3	176.2	0	0	0	0	0	113.2	P801 I808 C809	P801-G805 PolarHBondContact O-N 2.79Å; G805-I808 PolarHBondContact O-N 3.14Å; G805-C809 WeakPolarHBondContact O-CB 3.48Å; G805-C809 PolarHBondContact O-N 3.21Å
806	Y	95	Very high	93.7	Very high	30 Å²	30	47.5 Å²	47.5	12%	0.118	25%	0.251	C	S	.	.	H	α-helix	trans	-67.9	-35.5	175.9	-171.5	-95.7	0	0	0	113.1	R766 Q770 I773 R774 E802 V803 K804 C810	R766-Y806 WeakPolarHBondContact CD-OH 3.4Å; R766-Y806 PolarHBondContact NH1-OH 3.25Å; Q770-Y806 HydrophobicContact CB-CD1 4.06Å; Q770-Y806 HydrophobicContact CB-CE1 3.5Å; Q770-Y806 VanDerWaalsContact CB-CE1 3.5Å; Q770-Y806 HydrophobicContact CB-CE2 4.18Å; Q770-Y806 HydrophobicContact CG-CD1 3.74Å; Q770-Y806 HydrophobicContact CG-CD2 3.9Å; Q770-Y806 HydrophobicContact CG-CE1 3.66Å; Q770-Y806 HydrophobicContact CG-CE2 3.84Å; Q770-Y806 HydrophobicContact CG-CG 3.84Å; I773-Y806 HydrophobicContact CB-CD1 4.45Å; I773-Y806 HydrophobicContact CB-CE1 4.47Å; I773-Y806 HydrophobicContact CD1-CD1 4.24Å; I773-Y806 HydrophobicContact CG2-CD1 4.3Å; I773-Y806 HydrophobicContact CG2-CE1 4.45Å; R774-Y806 WeakPolarHBondContact CD-OH 3.38Å; R774-Y806 HydrophobicContact CG-CE1 4.3Å; R774-Y806 WeakPolarHBondContact CG-OH 3.12Å; E802-Y806 WeakPolarHBondContact O-CB 3.45Å; E802-Y806 PolarHBondContact O-N 2.83Å; V803-Y806 PolarHBondContact O-N 3.03Å; K804-Y806 VanDerWaalsContact C-N 3.35Å; K804-Y806 PolarHBondContact O-N 3.19Å; Y806-C810 WeakPolarHBondContact CE1-SG 3.42Å; Y806-C810 WeakPolarHBondContact O-CB 3.28Å; Y806-C810 PolarHBondContact O-N 3.49Å; Y806-C810 PolarHBondContact O-SG 3.3Å
807	L	94.5	Very high	93.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.2	-46.1	174.3	-179.5	146.5	0	0	0	111.7	I773 M793 L796 W798 V803 K804 C809 C810 M811 V839	I773-L807 HydrophobicContact CD1-CB 4.35Å; I773-L807 HydrophobicContact CG2-CB 4.35Å; I773-L807 HydrophobicContact CG2-CG 4.48Å; M793-L807 HydrophobicContact CE-CD1 4.43Å; M793-L807 HydrophobicContact SD-CD1 3.79Å; L796-L807 HydrophobicContact CD1-CD1 3.47Å; L796-L807 VanDerWaalsContact CD1-CD1 3.47Å; W798-L807 HydrophobicContact CH2-CD1 3.6Å; W798-L807 HydrophobicContact CH2-CD2 3.8Å; W798-L807 HydrophobicContact CH2-CG 4.27Å; W798-L807 HydrophobicContact CZ2-CD1 4.25Å; W798-L807 HydrophobicContact CZ3-CD1 4.37Å; W798-L807 HydrophobicContact CZ3-CD2 4.2Å; V803-L807 PolarHBondContact O-N 3Å; K804-L807 PolarHBondContact O-N 2.99Å; L807-C809 VanDerWaalsContact C-N 3.34Å; L807-C809 PolarHBondContact O-N 3.33Å; L807-C810 PolarHBondContact O-N 3.46Å; L807-C810 VanDerWaalsContact O-N 3.12Å; L807-M811 HydrophobicContact CD2-CE 3.76Å; L807-M811 HydrophobicContact CD2-CG 4.47Å; L807-M811 HydrophobicContact CD2-SD 3.83Å; L807-M811 HydrophobicContact CG-CE 4.32Å; L807-M811 PolarHBondContact O-N 3.31Å; L807-V839 HydrophobicContact CD2-CG1 3.8Å
808	I	95.6	Very high	93.8	Very high	20 Å²	20	53.9 Å²	53.9	10%	0.103	28%	0.276	C	S	.	.	H	α-helix	trans	-55.7	-51.2	173.7	-70.8	161.3	0	0	0	109.6	K804 G805 C810 M811 I812 V839 H842 V843	K804-I808 HydrophobicContact CG-CD1 4.11Å; K804-I808 WeakPolarHBondContact O-CG1 3.16Å; K804-I808 PolarHBondContact O-N 3.29Å; G805-I808 PolarHBondContact O-N 3.14Å; I808-C810 VanDerWaalsContact C-N 3.3Å; I808-C810 PolarHBondContact O-N 2.94Å; I808-M811 PolarHBondContact O-N 3.28Å; I808-I812 HydrophobicContact CG2-CD1 3.69Å; I808-I812 WeakPolarHBondContact O-CG1 3.46Å; I808-I812 PolarHBondContact O-N 2.71Å; I808-V839 HydrophobicContact CG1-CG1 4Å; I808-H842 HydrophobicContact CD1-CB 4Å; I808-H842 HydrophobicContact CG1-CB 4.42Å; I808-H842 HydrophobicContact CG2-CB 3.91Å; I808-V843 HydrophobicContact CB-CG2 4.29Å; I808-V843 HydrophobicContact CG1-CG2 4.3Å; I808-V843 HydrophobicContact CG2-CG2 4.02Å
809	C	95.8	Very high	93.9	Very high	58 Å²	58	57.1 Å²	57.1	39%	0.392	29%	0.289	S	S	.	.	H	α-helix	trans	-54.7	-43.3	174.8	-180	0	0	0	0	112.1	G805 L807 M811 I812 N813	G805-C809 WeakPolarHBondContact O-CB 3.48Å; G805-C809 PolarHBondContact O-N 3.21Å; L807-C809 VanDerWaalsContact C-N 3.34Å; L807-C809 PolarHBondContact O-N 3.33Å; C809-M811 PolarHBondContact O-N 2.78Å; C809-I812 PolarHBondContact O-N 3.29Å; C809-N813 VanDerWaalsContact O-CB 3.31Å; C809-N813 WeakPolarHBondContact O-CB 3.44Å; C809-N813 PolarHBondContact O-N 3.18Å; C809-N813 PolarHBondContact O-ND2 3.49Å; C809-N813 PolarHBondContact SG-ND2 2.99Å
810	C	95.8	Very high	94	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.034	29%	0.286	C	S	.	.	H	α-helix	trans	-67.7	-30.1	176.8	-74.4	0	0	0	0	114.2	I773 L777 Y778 Y806 L807 I808	I773-C810 HydrophobicContact CG2-CB 4.33Å; L777-C810 HydrophobicContact CD1-CB 3.61Å; Y778-C810 WeakPolarHBondContact OH-CA 3.44Å; Y778-C810 WeakPolarHBondContact OH-CB 3.25Å; Y778-C810 PolarHBondContact OH-O 3.2Å; Y778-C810 PolarHBondContact OH-SG 3.39Å; Y806-C810 WeakPolarHBondContact CE1-SG 3.42Å; Y806-C810 WeakPolarHBondContact O-CB 3.28Å; Y806-C810 PolarHBondContact O-N 3.49Å; Y806-C810 PolarHBondContact O-SG 3.3Å; L807-C810 PolarHBondContact O-N 3.46Å; L807-C810 VanDerWaalsContact O-N 3.12Å; I808-C810 VanDerWaalsContact C-N 3.3Å; I808-C810 PolarHBondContact O-N 2.94Å
811	M	96.4	Very high	94.2	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-76	-36.8	174.7	-70.5	-176.9	173	0	0	112.1	L777 L807 I808 C809 V825 L828 L829 L832 V843 F872	L777-M811 HydrophobicContact CD1-CG 4.11Å; L777-M811 HydrophobicContact CD2-CE 3.93Å; L777-M811 HydrophobicContact CD2-CG 4.43Å; L807-M811 HydrophobicContact CD2-CE 3.76Å; L807-M811 HydrophobicContact CD2-CG 4.47Å; L807-M811 HydrophobicContact CD2-SD 3.83Å; L807-M811 HydrophobicContact CG-CE 4.32Å; L807-M811 PolarHBondContact O-N 3.31Å; I808-M811 PolarHBondContact O-N 3.28Å; C809-M811 PolarHBondContact O-N 2.78Å; M811-V825 HydrophobicContact CG-CG1 4.25Å; M811-L828 HydrophobicContact CE-CD2 4.2Å; M811-L829 HydrophobicContact SD-CD1 3.92Å; M811-L832 HydrophobicContact CE-CD2 4.37Å; M811-V843 HydrophobicContact CB-CG1 3.87Å; M811-V843 HydrophobicContact CB-CG2 3.72Å; M811-V843 HydrophobicContact SD-CG2 4.18Å; M811-F872 VanDerWaalsContact O-CE1 3.31Å; M811-F872 WeakPolarHBondContact O-CE1 3.31Å
812	I	96.6	Very high	94.5	Very high	29 Å²	29	47.3 Å²	47.3	15%	0.149	24%	0.241	C	C	.	.	H	α-helix	trans	-65.7	-38.7	172.6	-62.2	158.6	0	0	0	111.1	I808 C809 I814 G846 V847 D850	I808-I812 HydrophobicContact CG2-CD1 3.69Å; I808-I812 WeakPolarHBondContact O-CG1 3.46Å; I808-I812 PolarHBondContact O-N 2.71Å; C809-I812 PolarHBondContact O-N 3.29Å; I812-I814 PolarHBondContact O-N 2.91Å; I812-G846 WeakPolarHBondContact CG2-O 3.38Å; I812-V847 HydrophobicContact CG1-CG2 4.46Å; I812-D850 HydrophobicContact CG2-CB 4.48Å
813	N	96.1	Very high	94.8	Very high	48 Å²	48	41.4 Å²	41.4	26%	0.257	21%	0.213	S	C	.	.			trans	-71.9	41.2	175.6	-82.5	-104.8	0	0	0	113	C809 W815 N816	C809-N813 VanDerWaalsContact O-CB 3.31Å; C809-N813 WeakPolarHBondContact O-CB 3.44Å; C809-N813 PolarHBondContact O-N 3.18Å; C809-N813 PolarHBondContact O-ND2 3.49Å; C809-N813 PolarHBondContact SG-ND2 2.99Å; N813-W815 HydrophobicContact CB-CH2 4.37Å; N813-W815 HydrophobicContact CB-CZ2 4.14Å; N813-W815 PolarHBondContact O-N 2.9Å; N813-W815 WeakPolarHBondContact OD1-CZ2 3.48Å; N813-N816 PolarHBondContact O-N 3.44Å; N813-N816 VanDerWaalsContact O-N 3.1Å; N813-N816 PolarHBondContact O-ND2 2.76Å
814	I	96.5	Very high	95	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-58.3	-24.8	-165.9	-170.3	62.4	0	0	0	114.5	I812 N816 V817 I822 V825 F872	I812-I814 PolarHBondContact O-N 2.91Å; I814-N816 PolarHBondContact O-N 3.18Å; I814-V817 HydrophobicContact CD1-CB 4.21Å; I814-V817 HydrophobicContact CD1-CG2 3.96Å; I814-V817 VanDerWaalsContact O-CB 3.3Å; I814-V817 WeakPolarHBondContact O-CB 3.44Å; I814-V817 PolarHBondContact O-N 2.97Å; I814-I822 HydrophobicContact CD1-CG1 4.35Å; I814-I822 HydrophobicContact CD1-CG2 4.25Å; I814-I822 HydrophobicContact CG1-CB 4.49Å; I814-I822 HydrophobicContact CG1-CD1 4.28Å; I814-I822 HydrophobicContact CG1-CG1 3.99Å; I814-I822 HydrophobicContact CG1-CG2 3.94Å; I814-V825 HydrophobicContact CD1-CB 3.92Å; I814-V825 HydrophobicContact CD1-CG1 4.06Å; I814-V825 HydrophobicContact CD1-CG2 3.67Å; I814-F872 HydrophobicContact CB-CB 4.41Å; I814-F872 HydrophobicContact CB-CD1 3.78Å; I814-F872 HydrophobicContact CB-CE1 4.33Å; I814-F872 HydrophobicContact CB-CG 4.23Å; I814-F872 HydrophobicContact CD1-CD1 4.14Å; I814-F872 HydrophobicContact CD1-CD2 4.24Å; I814-F872 HydrophobicContact CD1-CE1 4.24Å; I814-F872 HydrophobicContact CD1-CE2 4.34Å; I814-F872 HydrophobicContact CD1-CG 4.16Å; I814-F872 HydrophobicContact CD1-CZ 4.35Å; I814-F872 HydrophobicContact CG1-CB 3.92Å; I814-F872 HydrophobicContact CG1-CD1 3.75Å; I814-F872 HydrophobicContact CG1-CD2 4.25Å; I814-F872 HydrophobicContact CG1-CE1 4.32Å; I814-F872 HydrophobicContact CG1-CG 3.72Å; I814-F872 HydrophobicContact CG2-CB 4.06Å; I814-F872 HydrophobicContact CG2-CD1 4.01Å; I814-F872 HydrophobicContact CG2-CG 4.36Å
815	W	95.3	Very high	95.2	Very high	59 Å²	59	39.3 Å²	39.3	22%	0.223	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-63.6	-7.2	175.8	62.3	78.8	0	0	0	115	N813 V817 R865	N813-W815 HydrophobicContact CB-CH2 4.37Å; N813-W815 HydrophobicContact CB-CZ2 4.14Å; N813-W815 PolarHBondContact O-N 2.9Å; N813-W815 WeakPolarHBondContact OD1-CZ2 3.48Å; W815-V817 VanDerWaalsContact C-N 3.29Å; W815-R865 HydrophobicContact CB-CB 4.23Å; W815-R865 HydrophobicContact CB-CG 4.08Å; W815-R865 HydrophobicContact CD2-CB 3.81Å; W815-R865 HydrophobicContact CD2-CG 3.67Å; W815-R865 HydrophobicContact CE3-CB 3.68Å; W815-R865 HydrophobicContact CE3-CG 4.08Å; W815-R865 HydrophobicContact CG-CB 4.06Å; W815-R865 HydrophobicContact CG-CG 3.65Å; W815-R865 HydrophobicContact CZ3-CB 4.28Å
816	N	94.1	Very high	95.4	Very high	55 Å²	55	37.5 Å²	37.5	29%	0.294	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-77.6	-15.3	167.8	-70.7	-102.2	0	0	0	112.1	R774 Y778 N813 I814	R774-N816 PolarHBondContact NH2-OD1 3.17Å; R774-N816 VanDerWaalsContact NH2-OD1 3.12Å; Y778-N816 HydrophobicContact CD1-CB 3.47Å; Y778-N816 VanDerWaalsContact CD1-CB 3.47Å; Y778-N816 HydrophobicContact CD2-CB 4.06Å; Y778-N816 HydrophobicContact CE1-CB 3.31Å; Y778-N816 HydrophobicContact CE2-CB 3.92Å; Y778-N816 HydrophobicContact CG-CB 3.84Å; N813-N816 PolarHBondContact O-N 3.44Å; N813-N816 VanDerWaalsContact O-N 3.1Å; N813-N816 PolarHBondContact O-ND2 2.76Å; I814-N816 PolarHBondContact O-N 3.18Å
817	V	94.3	Very high	95.5	Very high	13 Å²	13	39 Å²	39	8%	0.079	19%	0.194	C	C	.	.	S	Bend	trans	-90	144.4	175.1	-178	0	0	0	0	109.4	Y778 I814 W815 Y819 V825	Y778-V817 HydrophobicContact CD1-CG2 3.61Å; Y778-V817 HydrophobicContact CE1-CG2 3.99Å; I814-V817 HydrophobicContact CD1-CB 4.21Å; I814-V817 HydrophobicContact CD1-CG2 3.96Å; I814-V817 VanDerWaalsContact O-CB 3.3Å; I814-V817 WeakPolarHBondContact O-CB 3.44Å; I814-V817 PolarHBondContact O-N 2.97Å; W815-V817 VanDerWaalsContact C-N 3.29Å; V817-Y819 PolarHBondContact O-N 3.01Å; V817-V825 HydrophobicContact CG1-CG2 4.25Å; V817-V825 HydrophobicContact CG2-CG2 3.99Å
818	K	93	Very high	95.6	Very high	167 Å²	167	39.1 Å²	39.1	73%	0.726	20%	0.195	S	C	*	.			trans	-59.6	134.7	172.2	-64.9	-178.7	180	179.4	0	109.7	N820 S821 I822	K818-N820 VanDerWaalsContact C-N 3.28Å; K818-N820 PolarHBondContact O-N 2.97Å; K818-N820 VanDerWaalsContact O-N 3.12Å; K818-S821 WeakPolarHBondContact O-CA 3.36Å; K818-S821 WeakPolarHBondContact O-CB 3.43Å; K818-S821 PolarHBondContact O-N 3.22Å; K818-I822 PolarHBondContact O-N 3.5Å
819	Y	93.3	Very high	95.6	Very high	99 Å²	99	38.1 Å²	38.1	39%	0.388	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-47.5	-47.1	-175.9	-170	-106.4	0	0	0	113.7	V817 S821 I822 I867 K871	V817-Y819 PolarHBondContact O-N 3.01Å; Y819-S821 PolarHBondContact O-N 3.47Å; Y819-S821 VanDerWaalsContact O-N 3.14Å; Y819-I822 HydrophobicContact CD2-CD1 3.87Å; Y819-I822 HydrophobicContact CE2-CD1 4.45Å; Y819-I822 WeakPolarHBondContact O-CB 3.28Å; Y819-I822 WeakPolarHBondContact O-CG1 3.4Å; Y819-I822 PolarHBondContact O-N 3.19Å; Y819-I867 HydrophobicContact CE2-CG2 3.96Å; Y819-K871 HydrophobicContact CD2-CG 4.3Å; Y819-K871 HydrophobicContact CE2-CB 3.71Å; Y819-K871 HydrophobicContact CE2-CD 4.37Å; Y819-K871 HydrophobicContact CE2-CG 3.61Å
820	N	93	Very high	95.6	Very high	136 Å²	136	36.9 Å²	36.9	73%	0.727	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-69	-10.2	179.7	-58.2	14.2	0	0	0	114.2	K818 H823	K818-N820 VanDerWaalsContact C-N 3.28Å; K818-N820 PolarHBondContact O-N 2.97Å; K818-N820 VanDerWaalsContact O-N 3.12Å; N820-H823 PolarHBondContact O-CD2 3.2Å
821	S	94.1	Very high	95.6	Very high	25 Å²	25	37.8 Å²	37.8	18%	0.175	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-103.3	-3.2	176.4	-63.3	0	0	0	0	113.4	K818 Y819 H823 C824	K818-S821 WeakPolarHBondContact O-CA 3.36Å; K818-S821 WeakPolarHBondContact O-CB 3.43Å; K818-S821 PolarHBondContact O-N 3.22Å; Y819-S821 PolarHBondContact O-N 3.47Å; Y819-S821 VanDerWaalsContact O-N 3.14Å; S821-H823 PolarHBondContact O-N 3.19Å; S821-C824 WeakPolarHBondContact O-CA 3.41Å; S821-C824 VanDerWaalsContact O-CB 3.23Å; S821-C824 WeakPolarHBondContact O-CB 3.44Å; S821-C824 PolarHBondContact O-N 2.98Å
822	I	96.8	Very high	95.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-57	-40.2	-178.6	-69.1	177	0	0	0	111.3	I814 K818 Y819 C824 V825 A826 K871 F872 E875	I814-I822 HydrophobicContact CD1-CG1 4.35Å; I814-I822 HydrophobicContact CD1-CG2 4.25Å; I814-I822 HydrophobicContact CG1-CB 4.49Å; I814-I822 HydrophobicContact CG1-CD1 4.28Å; I814-I822 HydrophobicContact CG1-CG1 3.99Å; I814-I822 HydrophobicContact CG1-CG2 3.94Å; K818-I822 PolarHBondContact O-N 3.5Å; Y819-I822 HydrophobicContact CD2-CD1 3.87Å; Y819-I822 HydrophobicContact CE2-CD1 4.45Å; Y819-I822 WeakPolarHBondContact O-CB 3.28Å; Y819-I822 WeakPolarHBondContact O-CG1 3.4Å; Y819-I822 PolarHBondContact O-N 3.19Å; I822-C824 PolarHBondContact O-N 2.91Å; I822-C824 VanDerWaalsContact O-N 3.15Å; I822-V825 WeakPolarHBondContact O-CB 3.44Å; I822-V825 PolarHBondContact O-N 3.03Å; I822-A826 PolarHBondContact O-N 2.86Å; I822-K871 HydrophobicContact CB-CG 4.47Å; I822-K871 HydrophobicContact CD1-CB 4.37Å; I822-K871 HydrophobicContact CD1-CG 4.04Å; I822-K871 HydrophobicContact CG2-CG 4.26Å; I822-F872 HydrophobicContact CG2-CB 3.69Å; I822-F872 HydrophobicContact CG2-CD2 3.74Å; I822-F872 HydrophobicContact CG2-CG 4.02Å; I822-E875 HydrophobicContact CG2-CG 4.35Å
823	H	96.3	Very high	95.4	Very high	40 Å²	40	38 Å²	38	19%	0.185	20%	0.197	C	C	.	.	H	α-helix	trans	-60.3	-24.8	176	89.6	83.8	0	0	0	113.3	N820 S821 V825 N827 E875 Y879	N820-H823 PolarHBondContact O-CD2 3.2Å; S821-H823 PolarHBondContact O-N 3.19Å; H823-V825 VanDerWaalsContact C-N 3.32Å; H823-N827 WeakPolarHBondContact O-CB 3.47Å; H823-N827 PolarHBondContact O-N 3.16Å; H823-N827 VanDerWaalsContact O-N 3.1Å; H823-E875 HydrophobicContact CB-CB 4.41Å; H823-E875 HydrophobicContact CB-CG 3.85Å; H823-Y879 HydrophobicContact CB-CE2 4.07Å; H823-Y879 AromaticContact ND1-CZ 3.99Å; H823-Y879 PolarHBondContact ND1-OH 3.24Å; H823-Y879 VanDerWaalsContact ND1-OH 3.08Å; H823-Y879 WeakPolarHBondContact O-CE2 3.47Å
824	C	96.9	Very high	95.2	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-73.3	-24.7	175	-63.7	0	0	0	0	112.3	L781 K783 T786 S821 I822 L828	L781-C824 HydrophobicContact CD1-CB 4.19Å; L781-C824 HydrophobicContact CD2-CB 4.32Å; L781-C824 HydrophobicContact CG-CB 4.03Å; K783-C824 PolarHBondContact N-SG 3.48Å; K783-C824 VanDerWaalsContact N-SG 3.42Å; T786-C824 HydrophobicContact CG2-CB 4.18Å; S821-C824 WeakPolarHBondContact O-CA 3.41Å; S821-C824 VanDerWaalsContact O-CB 3.23Å; S821-C824 WeakPolarHBondContact O-CB 3.44Å; S821-C824 PolarHBondContact O-N 2.98Å; I822-C824 PolarHBondContact O-N 2.91Å; I822-C824 VanDerWaalsContact O-N 3.15Å; C824-L828 VanDerWaalsContact O-CB 3.24Å; C824-L828 WeakPolarHBondContact O-CB 3.21Å; C824-L828 PolarHBondContact O-N 3.32Å
825	V	97.2	Very high	95	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-74.9	-42.3	173.5	-175	0	0	0	0	110.4	L781 M811 I814 V817 I822 H823 N827 L828 L829 F872	L781-V825 HydrophobicContact CD2-CB 4.46Å; L781-V825 HydrophobicContact CD2-CG2 3.66Å; M811-V825 HydrophobicContact CG-CG1 4.25Å; I814-V825 HydrophobicContact CD1-CB 3.92Å; I814-V825 HydrophobicContact CD1-CG1 4.06Å; I814-V825 HydrophobicContact CD1-CG2 3.67Å; V817-V825 HydrophobicContact CG1-CG2 4.25Å; V817-V825 HydrophobicContact CG2-CG2 3.99Å; I822-V825 WeakPolarHBondContact O-CB 3.44Å; I822-V825 PolarHBondContact O-N 3.03Å; H823-V825 VanDerWaalsContact C-N 3.32Å; V825-N827 VanDerWaalsContact C-N 3.33Å; V825-N827 PolarHBondContact O-N 3.24Å; V825-L828 WeakPolarHBondContact O-CB 3.31Å; V825-L828 PolarHBondContact O-N 3.46Å; V825-L829 WeakPolarHBondContact O-CB 3.27Å; V825-L829 PolarHBondContact O-N 2.91Å; V825-F872 HydrophobicContact CB-CE2 3.99Å; V825-F872 HydrophobicContact CB-CZ 4.31Å; V825-F872 HydrophobicContact CG1-CE2 3.91Å; V825-F872 HydrophobicContact CG1-CZ 3.71Å
826	A	96.9	Very high	94.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.5	-43.9	174.6	0	0	0	0	0	111.3	I822 L829 A830 F872 E875 L876 Y879	I822-A826 PolarHBondContact O-N 2.86Å; A826-L829 PolarHBondContact O-N 2.72Å; A826-A830 WeakPolarHBondContact O-CB 3.44Å; A826-A830 PolarHBondContact O-N 2.93Å; A826-F872 HydrophobicContact CB-CE2 4.1Å; A826-E875 HydrophobicContact CB-CB 3.84Å; A826-L876 HydrophobicContact CB-CD2 4.25Å; A826-Y879 HydrophobicContact CB-CD2 3.65Å; A826-Y879 HydrophobicContact CB-CE2 4.42Å; A826-Y879 HydrophobicContact CB-CG 4.11Å
827	N	97.2	Very high	94.7	Very high	61 Å²	61	48.9 Å²	48.9	33%	0.326	26%	0.256	S	S	.	.	H	α-helix	trans	-62.5	-41.5	173.1	-165.2	26.7	0	0	0	113.2	H823 V825 L829 G831 Y879	H823-N827 WeakPolarHBondContact O-CB 3.47Å; H823-N827 PolarHBondContact O-N 3.16Å; H823-N827 VanDerWaalsContact O-N 3.1Å; V825-N827 VanDerWaalsContact C-N 3.33Å; V825-N827 PolarHBondContact O-N 3.24Å; N827-L829 VanDerWaalsContact C-N 3.34Å; N827-G831 PolarHBondContact O-N 3.17Å; N827-Y879 HydrophobicContact CB-CD1 3.77Å; N827-Y879 HydrophobicContact CB-CE1 3.43Å; N827-Y879 VanDerWaalsContact CB-CE1 3.43Å; N827-Y879 HydrophobicContact CB-CE2 4.41Å; N827-Y879 HydrophobicContact CB-CG 4.4Å; N827-Y879 VanDerWaalsContact CG-CE1 3.44Å; N827-Y879 WeakPolarHBondContact OD1-CE1 3.34Å
828	L	96.5	Very high	94.7	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-40.2	176.4	175	64.3	0	0	0	111.5	L777 L781 V789 L790 M793 M811 C824 V825 G831 L832	L777-L828 HydrophobicContact CD2-CD2 3.71Å; L781-L828 HydrophobicContact CD1-CD2 4.31Å; L781-L828 HydrophobicContact CD2-CD2 3.93Å; V789-L828 HydrophobicContact CG1-CD1 4.07Å; V789-L828 HydrophobicContact CG1-CD2 3.77Å; L790-L828 HydrophobicContact CB-CD1 3.72Å; L790-L828 HydrophobicContact CD1-CD1 4.03Å; L790-L828 HydrophobicContact CG-CD1 4.46Å; M793-L828 HydrophobicContact CE-CD2 4.36Å; M793-L828 HydrophobicContact CG-CD1 4.31Å; M793-L828 HydrophobicContact CG-CD2 4.44Å; M811-L828 HydrophobicContact CE-CD2 4.2Å; C824-L828 VanDerWaalsContact O-CB 3.24Å; C824-L828 WeakPolarHBondContact O-CB 3.21Å; C824-L828 PolarHBondContact O-N 3.32Å; V825-L828 WeakPolarHBondContact O-CB 3.31Å; V825-L828 PolarHBondContact O-N 3.46Å; L828-G831 PolarHBondContact O-N 2.91Å; L828-L832 VanDerWaalsContact O-CB 3.28Å; L828-L832 WeakPolarHBondContact O-CB 3.49Å; L828-L832 PolarHBondContact O-N 3.06Å; L828-L832 VanDerWaalsContact O-N 3.12Å
829	L	96.4	Very high	94.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-68.2	-45.8	178	-171.3	61.6	0	0	0	111.4	M811 V825 A826 N827 G831 L832 V833 V839 V843 L876 M881	M811-L829 HydrophobicContact SD-CD1 3.92Å; V825-L829 WeakPolarHBondContact O-CB 3.27Å; V825-L829 PolarHBondContact O-N 2.91Å; A826-L829 PolarHBondContact O-N 2.72Å; N827-L829 VanDerWaalsContact C-N 3.34Å; L829-G831 VanDerWaalsContact C-N 3.27Å; L829-G831 PolarHBondContact O-N 3.32Å; L829-L832 WeakPolarHBondContact O-CA 3.3Å; L829-L832 WeakPolarHBondContact O-CB 3.44Å; L829-L832 PolarHBondContact O-N 3.18Å; L829-V833 HydrophobicContact CD1-CG1 4.38Å; L829-V833 HydrophobicContact CG-CG1 4.45Å; L829-V833 PolarHBondContact O-N 2.82Å; L829-V839 HydrophobicContact CD1-CG1 4.14Å; L829-V843 HydrophobicContact CD2-CB 4.01Å; L829-V843 HydrophobicContact CD2-CG1 3.81Å; L829-L876 HydrophobicContact CD2-CD2 3.82Å; L829-M881 HydrophobicContact CD2-CE 4.39Å; L829-M881 HydrophobicContact CG-CE 4.29Å; L829-M881 HydrophobicContact CG-SD 4.49Å
830	A	95.6	Very high	94.8	Very high	32 Å²	32	38.6 Å²	38.6	26%	0.264	22%	0.215	S	C	.	.	H	α-helix	trans	-58.3	-37.3	174.7	0	0	0	0	0	112.7	A826 L832 V833 M881	A826-A830 WeakPolarHBondContact O-CB 3.44Å; A826-A830 PolarHBondContact O-N 2.93Å; A830-L832 VanDerWaalsContact C-N 3.31Å; A830-V833 WeakPolarHBondContact O-CG2 3.33Å; A830-M881 VanDerWaalsContact CA-SD 3.58Å; A830-M881 HydrophobicContact CB-CG 4.46Å; A830-M881 HydrophobicContact CB-SD 3.87Å
831	G	94.1	Very high	94.9	Very high	24 Å²	24	36.3 Å²	36.3	25%	0.247	20%	0.202	C	C	.	.	H	α-helix	trans	-75.1	-14.9	172.5	0	0	0	0	0	115.1	L790 N827 L828 L829	L790-G831 WeakPolarHBondContact CD1-O 2.87Å; N827-G831 PolarHBondContact O-N 3.17Å; L828-G831 PolarHBondContact O-N 2.91Å; L829-G831 VanDerWaalsContact C-N 3.27Å; L829-G831 PolarHBondContact O-N 3.32Å
832	L	94.6	Very high	95.1	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-96.1	-35.7	-177.4	-178.3	62.7	0	0	0	112.7	L790 M793 R794 W798 M811 L828 L829 A830 A834 Y835 Q836 V839	L790-L832 HydrophobicContact CD1-CB 4.07Å; L790-L832 HydrophobicContact CD1-CD1 4.41Å; M793-L832 HydrophobicContact CB-CD1 4.4Å; R794-L832 HydrophobicContact CG-CD1 4.19Å; W798-L832 HydrophobicContact CH2-CD1 4.43Å; W798-L832 HydrophobicContact CH2-CD2 3.88Å; W798-L832 HydrophobicContact CZ2-CD1 3.88Å; W798-L832 HydrophobicContact CZ2-CD2 4.11Å; M811-L832 HydrophobicContact CE-CD2 4.37Å; L828-L832 VanDerWaalsContact O-CB 3.28Å; L828-L832 WeakPolarHBondContact O-CB 3.49Å; L828-L832 PolarHBondContact O-N 3.06Å; L828-L832 VanDerWaalsContact O-N 3.12Å; L829-L832 WeakPolarHBondContact O-CA 3.3Å; L829-L832 WeakPolarHBondContact O-CB 3.44Å; L829-L832 PolarHBondContact O-N 3.18Å; A830-L832 VanDerWaalsContact C-N 3.31Å; L832-A834 PolarHBondContact O-N 3.09Å; L832-Y835 PolarHBondContact O-N 3.39Å; L832-Q836 PolarHBondContact O-N 2.94Å; L832-V839 HydrophobicContact CD2-CG1 4.23Å
833	V	94.5	Very high	95.1	Very high	34 Å²	34	39.6 Å²	39.6	21%	0.206	22%	0.215	C	C	.	.	H	α-helix	trans	-62.6	-25.7	-178.1	-69.6	0	0	0	0	114.1	L829 A830 Y835 Q836 E837 G840 M881	L829-V833 HydrophobicContact CD1-CG1 4.38Å; L829-V833 HydrophobicContact CG-CG1 4.45Å; L829-V833 PolarHBondContact O-N 2.82Å; A830-V833 WeakPolarHBondContact O-CG2 3.33Å; V833-Y835 PolarHBondContact O-N 2.67Å; V833-Q836 CarbonylContact O-C 3.5Å; V833-Q836 PolarHBondContact O-N 3.14Å; V833-E837 WeakPolarHBondContact O-CA 3.11Å; V833-E837 PolarHBondContact O-N 3.29Å; V833-G840 VanDerWaalsContact CG1-CA 3.49Å; V833-M881 HydrophobicContact CB-CE 4.48Å; V833-M881 HydrophobicContact CG1-CE 3.73Å; V833-M881 HydrophobicContact CG2-CE 4.08Å; V833-M881 HydrophobicContact CG2-SD 4.09Å
834	A	91.9	Very high	95.2	Very high	79 Å²	79	38.4 Å²	38.4	65%	0.653	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-4.8	168.5	0	0	0	0	0	114.6	L832	L832-A834 PolarHBondContact O-N 3.09Å
835	Y	93.1	Very high	95.2	Very high	123 Å²	123	42.4 Å²	42.4	48%	0.482	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-131.7	-20.4	175.4	-54.4	-79.3	0	0	0	113.7	R794 L832 V833	R794-Y835 HydrophobicContact CG-CD2 4.03Å; R794-Y835 HydrophobicContact CG-CE2 4.49Å; R794-Y835 HydrophobicContact CG-CG 4.41Å; R794-Y835 VanDerWaalsContact CZ-CE1 3.44Å; R794-Y835 PolarHBondContact NH1-OH 3.37Å; L832-Y835 PolarHBondContact O-N 3.39Å; V833-Y835 PolarHBondContact O-N 2.67Å
836	Q	91.6	Very high	95.2	Very high	45 Å²	45	43.2 Å²	43.2	21%	0.21	24%	0.24	C	C	.	.			trans	-150.9	75.7	-176.3	-70.5	-64.8	-71.7	0	0	109.3	W798 L832 V833 V839	W798-Q836 HydrophobicContact CD2-CG 3.68Å; W798-Q836 HydrophobicContact CE3-CG 3.98Å; W798-Q836 HydrophobicContact CG-CG 3.93Å; W798-Q836 HydrophobicContact CZ2-CG 4.48Å; W798-Q836 HydrophobicContact CZ3-CG 4.49Å; L832-Q836 PolarHBondContact O-N 2.94Å; V833-Q836 CarbonylContact O-C 3.5Å; V833-Q836 PolarHBondContact O-N 3.14Å; Q836-V839 HydrophobicContact CB-CB 4.35Å; Q836-V839 HydrophobicContact CB-CG2 3.82Å; Q836-V839 WeakPolarHBondContact O-CB 3.44Å; Q836-V839 PolarHBondContact O-N 2.67Å
837	E	92.2	Very high	95.2	Very high	143 Å²	143	43.2 Å²	43.2	67%	0.668	24%	0.24	S	C	*	.	H	α-helix	trans	-63.3	-42.5	-171.8	-176.3	172	-163	0	0	113.5	V833 V839 G840 I841	V833-E837 WeakPolarHBondContact O-CA 3.11Å; V833-E837 PolarHBondContact O-N 3.29Å; E837-V839 VanDerWaalsContact C-N 3.27Å; E837-V839 PolarHBondContact O-N 2.78Å; E837-G840 WeakPolarHBondContact O-CA 3.47Å; E837-G840 PolarHBondContact O-N 3.06Å; E837-I841 PolarHBondContact O-N 2.79Å
838	D	93.1	Very high	95.3	Very high	61 Å²	61	42.6 Å²	42.6	33%	0.326	24%	0.237	S	C	.	.	H	α-helix	trans	-60	-31.5	-179.7	64.5	-22.4	0	0	0	113.8	K804 G840 I841 H842	K804-D838 WeakPolarHBondContact CE-OD1 3.38Å; K804-D838 WeakPolarHBondContact CE-OD2 3.5Å; K804-D838 IonicContact NZ-OD1 2.84Å; K804-D838 PolarHBondContact NZ-OD1 3.43Å; K804-D838 IonicContact NZ-OD2 2.67Å; K804-D838 PolarHBondContact NZ-OD2 3.07Å; D838-G840 PolarHBondContact O-N 2.87Å; D838-I841 PolarHBondContact O-N 2.93Å; D838-H842 PolarHBondContact O-CD2 3.05Å; D838-H842 PolarHBondContact O-N 2.87Å
839	V	94.4	Very high	95.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-34.5	171.4	179.7	0	0	0	0	111.3	W798 K804 L807 I808 L829 L832 Q836 E837 V843	W798-V839 HydrophobicContact CE3-CG2 4.17Å; W798-V839 HydrophobicContact CH2-CG2 4.31Å; W798-V839 HydrophobicContact CZ3-CG1 4.5Å; W798-V839 HydrophobicContact CZ3-CG2 3.61Å; K804-V839 HydrophobicContact CD-CG2 4.47Å; K804-V839 HydrophobicContact CG-CG2 4.29Å; L807-V839 HydrophobicContact CD2-CG1 3.8Å; I808-V839 HydrophobicContact CG1-CG1 4Å; L829-V839 HydrophobicContact CD1-CG1 4.14Å; L832-V839 HydrophobicContact CD2-CG1 4.23Å; Q836-V839 HydrophobicContact CB-CB 4.35Å; Q836-V839 HydrophobicContact CB-CG2 3.82Å; Q836-V839 WeakPolarHBondContact O-CB 3.44Å; Q836-V839 PolarHBondContact O-N 2.67Å; E837-V839 VanDerWaalsContact C-N 3.27Å; E837-V839 PolarHBondContact O-N 2.78Å; V839-V843 WeakPolarHBondContact O-CB 3.2Å; V839-V843 WeakPolarHBondContact O-CG2 3.45Å; V839-V843 PolarHBondContact O-N 3.31Å
840	G	94.4	Very high	95.3	Very high	2 Å²	2	49.2 Å²	49.2	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-65.1	-51.5	174.5	0	0	0	0	0	112.2	V833 E837 D838 V843 V844	V833-G840 VanDerWaalsContact CG1-CA 3.49Å; E837-G840 WeakPolarHBondContact O-CA 3.47Å; E837-G840 PolarHBondContact O-N 3.06Å; D838-G840 PolarHBondContact O-N 2.87Å; G840-V843 PolarHBondContact O-N 3.29Å; G840-V844 WeakPolarHBondContact O-CG2 3.32Å; G840-V844 PolarHBondContact O-N 3.15Å
841	I	95.8	Very high	95.4	Very high	89 Å²	89	48.3 Å²	48.3	46%	0.456	26%	0.259	S	S	.	.	H	α-helix	trans	-57.8	-55.2	-179.2	-58.9	172.4	0	0	0	109.8	E837 D838 V843 V844 D845	E837-I841 PolarHBondContact O-N 2.79Å; D838-I841 PolarHBondContact O-N 2.93Å; I841-V843 VanDerWaalsContact C-N 3.28Å; I841-V843 PolarHBondContact O-N 3.48Å; I841-V844 WeakPolarHBondContact O-CB 3.49Å; I841-V844 PolarHBondContact O-N 3.29Å; I841-D845 WeakPolarHBondContact CG2-OD2 3.49Å; I841-D845 PolarHBondContact O-N 3.44Å
842	H	97.1	Very high	95.5	Very high	93 Å²	93	51.4 Å²	51.4	43%	0.431	26%	0.263	S	S	.	.	H	α-helix	trans	-62.8	-28.9	-178.4	-63.8	-38.6	0	0	0	114.4	I808 D838 G846	I808-H842 HydrophobicContact CD1-CB 4Å; I808-H842 HydrophobicContact CG1-CB 4.42Å; I808-H842 HydrophobicContact CG2-CB 3.91Å; D838-H842 PolarHBondContact O-CD2 3.05Å; D838-H842 PolarHBondContact O-N 2.87Å; H842-G846 PolarHBondContact O-N 3.33Å; H842-G846 VanDerWaalsContact O-N 3.09Å
843	V	97.8	Very high	95.6	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-75.9	-36.7	173.6	171.3	0	0	0	0	111.6	I808 M811 L829 V839 G840 I841 V847 F872	I808-V843 HydrophobicContact CB-CG2 4.29Å; I808-V843 HydrophobicContact CG1-CG2 4.3Å; I808-V843 HydrophobicContact CG2-CG2 4.02Å; M811-V843 HydrophobicContact CB-CG1 3.87Å; M811-V843 HydrophobicContact CB-CG2 3.72Å; M811-V843 HydrophobicContact SD-CG2 4.18Å; L829-V843 HydrophobicContact CD2-CB 4.01Å; L829-V843 HydrophobicContact CD2-CG1 3.81Å; V839-V843 WeakPolarHBondContact O-CB 3.2Å; V839-V843 WeakPolarHBondContact O-CG2 3.45Å; V839-V843 PolarHBondContact O-N 3.31Å; G840-V843 PolarHBondContact O-N 3.29Å; I841-V843 VanDerWaalsContact C-N 3.28Å; I841-V843 PolarHBondContact O-N 3.48Å; V843-V847 HydrophobicContact CG1-CG2 4.48Å; V843-V847 WeakPolarHBondContact O-CB 3.44Å; V843-V847 WeakPolarHBondContact O-CG2 3.42Å; V843-V847 PolarHBondContact O-N 3.37Å; V843-V847 VanDerWaalsContact O-N 3.11Å; V843-F872 HydrophobicContact CG1-CE1 3.94Å; V843-F872 HydrophobicContact CG1-CZ 4.11Å
844	V	97.4	Very high	95.6	Very high	15 Å²	15	54.1 Å²	54.1	9%	0.091	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-51.6	172.9	166.1	0	0	0	0	110.5	G840 I841 G846 V847 L848 L876 M881 V882	G840-V844 WeakPolarHBondContact O-CG2 3.32Å; G840-V844 PolarHBondContact O-N 3.15Å; I841-V844 WeakPolarHBondContact O-CB 3.49Å; I841-V844 PolarHBondContact O-N 3.29Å; V844-G846 PolarHBondContact O-N 3Å; V844-V847 PolarHBondContact O-N 3.34Å; V844-L848 HydrophobicContact CG1-CD1 3.97Å; V844-L848 WeakPolarHBondContact O-CG 3.35Å; V844-L848 PolarHBondContact O-N 3.47Å; V844-L876 HydrophobicContact CG2-CD1 4.37Å; V844-M881 HydrophobicContact CG2-CB 4.49Å; V844-V882 HydrophobicContact CB-CG1 4.25Å; V844-V882 HydrophobicContact CG1-CG1 3.47Å; V844-V882 VanDerWaalsContact CG1-CG1 3.47Å; V844-V882 HydrophobicContact CG2-CG1 3.66Å
845	D	97.4	Very high	95.7	Very high	87 Å²	87	50.4 Å²	50.4	47%	0.465	25%	0.248	S	C	.	.	H	α-helix	trans	-60	-48.5	-179.1	-63.7	-28.3	0	0	0	111.2	I841 V847 L848 E849	I841-D845 WeakPolarHBondContact CG2-OD2 3.49Å; I841-D845 PolarHBondContact O-N 3.44Å; D845-V847 VanDerWaalsContact C-N 3.29Å; D845-V847 PolarHBondContact O-N 2.83Å; D845-L848 PolarHBondContact O-N 2.69Å; D845-L848 VanDerWaalsContact O-N 3.16Å; D845-E849 WeakPolarHBondContact O-CB 3.46Å; D845-E849 PolarHBondContact O-N 3.47Å
846	G	97.3	Very high	95.8	Very high	18 Å²	18	48.3 Å²	48.3	19%	0.186	24%	0.243	C	C	.	.	H	α-helix	trans	-64.7	-28.2	179.4	0	0	0	0	0	114.4	I812 H842 V844 D850	I812-G846 WeakPolarHBondContact CG2-O 3.38Å; H842-G846 PolarHBondContact O-N 3.33Å; H842-G846 VanDerWaalsContact O-N 3.09Å; V844-G846 PolarHBondContact O-N 3Å; G846-D850 WeakPolarHBondContact O-CB 3.35Å; G846-D850 PolarHBondContact O-N 3.42Å
847	V	97.8	Very high	95.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-77	-36.3	173.4	168.3	0	0	0	0	111.5	I812 V843 V844 D845 E849 I851 F872 L873	I812-V847 HydrophobicContact CG1-CG2 4.46Å; V843-V847 HydrophobicContact CG1-CG2 4.48Å; V843-V847 WeakPolarHBondContact O-CB 3.44Å; V843-V847 WeakPolarHBondContact O-CG2 3.42Å; V843-V847 PolarHBondContact O-N 3.37Å; V843-V847 VanDerWaalsContact O-N 3.11Å; V844-V847 PolarHBondContact O-N 3.34Å; D845-V847 VanDerWaalsContact C-N 3.29Å; D845-V847 PolarHBondContact O-N 2.83Å; V847-E849 VanDerWaalsContact C-N 3.33Å; V847-I851 HydrophobicContact CG1-CD1 4.05Å; V847-I851 WeakPolarHBondContact O-CB 3.44Å; V847-I851 WeakPolarHBondContact O-CD1 3.47Å; V847-I851 WeakPolarHBondContact O-CG1 3.43Å; V847-I851 PolarHBondContact O-N 2.91Å; V847-I851 VanDerWaalsContact O-N 3.14Å; V847-F872 HydrophobicContact CG1-CD1 4.38Å; V847-F872 HydrophobicContact CG2-CD1 3.61Å; V847-F872 HydrophobicContact CG2-CE1 3.76Å; V847-L873 HydrophobicContact CG1-CB 4.29Å
848	L	97.6	Very high	95.8	Very high	48 Å²	48	43.4 Å²	43.4	25%	0.251	23%	0.225	S	C	.	.	H	α-helix	trans	-65.7	-38.5	173.1	-69.6	170.2	0	0	0	111.4	V844 D845 I851 R852 L873 V886	V844-L848 HydrophobicContact CG1-CD1 3.97Å; V844-L848 WeakPolarHBondContact O-CG 3.35Å; V844-L848 PolarHBondContact O-N 3.47Å; D845-L848 PolarHBondContact O-N 2.69Å; D845-L848 VanDerWaalsContact O-N 3.16Å; L848-I851 PolarHBondContact O-N 3.34Å; L848-R852 PolarHBondContact O-N 3.13Å; L848-L873 HydrophobicContact CD2-CD1 3.83Å; L848-L873 HydrophobicContact CD2-CD2 3.85Å; L848-L873 HydrophobicContact CG-CD1 4.46Å; L848-V886 HydrophobicContact CD1-CG1 3.88Å; L848-V886 HydrophobicContact CD2-CG1 3.75Å; L848-V886 HydrophobicContact CG-CG1 4.4Å
849	E	97.8	Very high	95.7	Very high	105 Å²	105	44.6 Å²	44.6	49%	0.491	23%	0.228	S	C	.	.	H	α-helix	trans	-68.4	-46.7	175.4	-178.5	53.2	-154.2	0	0	112.6	D845 V847 I851 R852 L853	D845-E849 WeakPolarHBondContact O-CB 3.46Å; D845-E849 PolarHBondContact O-N 3.47Å; V847-E849 VanDerWaalsContact C-N 3.33Å; E849-I851 PolarHBondContact O-N 3.11Å; E849-R852 WeakPolarHBondContact O-CA 3.45Å; E849-R852 PolarHBondContact O-N 3.25Å; E849-L853 WeakPolarHBondContact O-CB 3.5Å; E849-L853 PolarHBondContact O-N 2.82Å
850	D	96.5	Very high	95.4	Very high	36 Å²	36	49.4 Å²	49.4	19%	0.193	26%	0.259	C	S	.	.	H	α-helix	trans	-58.5	-31.8	174.2	-178.7	78.9	0	0	0	112.3	I812 G846 G854 S869	I812-D850 HydrophobicContact CG2-CB 4.48Å; G846-D850 WeakPolarHBondContact O-CB 3.35Å; G846-D850 PolarHBondContact O-N 3.42Å; D850-G854 WeakPolarHBondContact O-CA 3.43Å; D850-G854 PolarHBondContact O-N 3.24Å; D850-S869 VanDerWaalsContact OD2-CB 3.28Å; D850-S869 WeakPolarHBondContact OD2-CB 3.49Å; D850-S869 PolarHBondContact OD2-OG 3.09Å
851	I	96.8	Very high	95.2	Very high	12 Å²	12	56.5 Å²	56.5	6%	0.062	29%	0.29	C	S	.	.	H	α-helix	trans	-71.1	-39.9	173.1	-70.6	167.3	0	0	0	111.9	V847 L848 E849 M855 L873 T890 F894	V847-I851 HydrophobicContact CG1-CD1 4.05Å; V847-I851 WeakPolarHBondContact O-CB 3.44Å; V847-I851 WeakPolarHBondContact O-CD1 3.47Å; V847-I851 WeakPolarHBondContact O-CG1 3.43Å; V847-I851 PolarHBondContact O-N 2.91Å; V847-I851 VanDerWaalsContact O-N 3.14Å; L848-I851 PolarHBondContact O-N 3.34Å; E849-I851 PolarHBondContact O-N 3.11Å; I851-M855 PolarHBondContact O-N 3.38Å; I851-L873 HydrophobicContact CD1-CB 4.02Å; I851-L873 HydrophobicContact CD1-CD2 3.88Å; I851-T890 HydrophobicContact CG2-CG2 3.87Å; I851-F894 HydrophobicContact CG2-CE1 3.58Å; I851-F894 HydrophobicContact CG2-CZ 3.91Å
852	R	96.7	Very high	95.1	Very high	90 Å²	90	55 Å²	55	34%	0.34	28%	0.28	S	S	.	.	H	α-helix	trans	-67.6	-59	176.4	173.3	54.4	56.7	72.6	-2.7	111.4	L848 E849 G854 M855 E856 S893	L848-R852 PolarHBondContact O-N 3.13Å; E849-R852 WeakPolarHBondContact O-CA 3.45Å; E849-R852 PolarHBondContact O-N 3.25Å; R852-G854 PolarHBondContact O-N 3.39Å; R852-M855 WeakPolarHBondContact O-CA 3.38Å; R852-M855 WeakPolarHBondContact O-CB 3.3Å; R852-M855 PolarHBondContact O-N 2.92Å; R852-E856 WeakPolarHBondContact CD-OE1 3.41Å; R852-E856 WeakPolarHBondContact CG-OE1 3.26Å; R852-E856 PolarHBondContact O-N 2.85Å; R852-S893 PolarHBondContact NH2-OG 3.35Å
853	L	95.7	Very high	94.9	Very high	79 Å²	79	52.5 Å²	52.5	41%	0.414	27%	0.27	S	S	.	.	H	α-helix	trans	-55.1	-34.5	175.1	-178.7	64.8	0	0	0	111.5	E849 M855 E856 V857	E849-L853 WeakPolarHBondContact O-CB 3.5Å; E849-L853 PolarHBondContact O-N 2.82Å; L853-M855 VanDerWaalsContact C-N 3.26Å; L853-M855 PolarHBondContact O-N 2.78Å; L853-E856 PolarHBondContact O-N 3.1Å; L853-E856 VanDerWaalsContact O-N 3.13Å; L853-V857 HydrophobicContact CD1-CG2 3.86Å; L853-V857 HydrophobicContact CG-CG2 4.12Å; L853-V857 WeakPolarHBondContact O-CG2 3.36Å; L853-V857 PolarHBondContact O-N 2.93Å
854	G	94.6	Very high	94.6	Very high	12 Å²	12	60.6 Å²	60.6	12%	0.124	31%	0.308	C	S	.	.	H	α-helix	trans	-60.4	-28	173	0	0	0	0	0	114.4	D850 R852 N858 R866	D850-G854 WeakPolarHBondContact O-CA 3.43Å; D850-G854 PolarHBondContact O-N 3.24Å; R852-G854 PolarHBondContact O-N 3.39Å; G854-N858 PolarHBondContact O-N 2.78Å; G854-R866 PolarHBondContact O-NE 3.12Å; G854-R866 PolarHBondContact O-NH2 2.8Å
855	M	94.6	Very high	94.5	Very high	1 Å²	1	64.6 Å²	64.6	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-84	-24.9	172.7	-68.6	-176.5	-71.3	0	0	113.6	I851 R852 L853 F894 F897	I851-M855 PolarHBondContact O-N 3.38Å; R852-M855 WeakPolarHBondContact O-CA 3.38Å; R852-M855 WeakPolarHBondContact O-CB 3.3Å; R852-M855 PolarHBondContact O-N 2.92Å; L853-M855 VanDerWaalsContact C-N 3.26Å; L853-M855 PolarHBondContact O-N 2.78Å; M855-F894 HydrophobicContact CE-CD1 4.48Å; M855-F894 HydrophobicContact SD-CD1 3.76Å; M855-F894 HydrophobicContact SD-CE1 4.41Å; M855-F897 HydrophobicContact CB-CD1 3.9Å; M855-F897 HydrophobicContact CB-CE1 4.09Å; M855-F897 HydrophobicContact CE-CB 4.27Å; M855-F897 HydrophobicContact CE-CD1 3.95Å; M855-F897 HydrophobicContact CE-CG 4.27Å; M855-F897 HydrophobicContact SD-CB 4.46Å; M855-F897 HydrophobicContact SD-CD1 4.21Å
856	E	95	Very high	94.5	Very high	78 Å²	78	61 Å²	61	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-80.8	-49	179.6	-64.5	164.3	-175.9	0	0	111	R852 L853 F897 L908	R852-E856 WeakPolarHBondContact CD-OE1 3.41Å; R852-E856 WeakPolarHBondContact CG-OE1 3.26Å; R852-E856 PolarHBondContact O-N 2.85Å; L853-E856 PolarHBondContact O-N 3.1Å; L853-E856 VanDerWaalsContact O-N 3.13Å; E856-F897 HydrophobicContact CG-CE1 3.6Å; E856-F897 HydrophobicContact CG-CZ 3.64Å; E856-F897 VanDerWaalsContact OE1-CZ 3.29Å; E856-F897 WeakPolarHBondContact OE1-CZ 3.34Å; E856-L908 WeakPolarHBondContact O-CD2 3.35Å
857	V	94.2	Very high	94.5	Very high	63 Å²	63	61.4 Å²	61.4	38%	0.382	30%	0.299	S	S	.	.	H	α-helix	trans	-68.6	-39.8	175.9	176.1	0	0	0	0	111	L853 Q859 F862	L853-V857 HydrophobicContact CD1-CG2 3.86Å; L853-V857 HydrophobicContact CG-CG2 4.12Å; L853-V857 WeakPolarHBondContact O-CG2 3.36Å; L853-V857 PolarHBondContact O-N 2.93Å; V857-Q859 HydrophobicContact CG1-CB 4.43Å; V857-Q859 HydrophobicContact CG1-CG 4.06Å; V857-Q859 WeakPolarHBondContact O-CG 3.45Å; V857-Q859 PolarHBondContact O-N 3.23Å; V857-F862 HydrophobicContact CG1-CD2 4.08Å; V857-F862 HydrophobicContact CG1-CE2 4.01Å
858	N	90.8	Very high	94.5	Very high	22 Å²	22	62 Å²	62	12%	0.118	30%	0.303	C	S	.	.			trans	50.5	7.7	173.3	-150.4	28.2	0	0	0	118.8	G854 R866 L908 H913	G854-N858 PolarHBondContact O-N 2.78Å; N858-R866 VanDerWaalsContact OD1-CZ 3.27Å; N858-R866 PolarHBondContact OD1-NH1 3.34Å; N858-R866 PolarHBondContact OD1-NH2 2.99Å; N858-L908 PolarHBondContact ND2-O 3.49Å; N858-H913 PolarHBondContact ND2-CE1 3.43Å; N858-H913 VanDerWaalsContact ND2-CE1 3.34Å; N858-H913 PolarHBondContact ND2-NE2 3.18Å; N858-H913 PolarHBondContact OD1-CE1 2.64Å; N858-H913 PolarHBondContact OD1-NE2 3.44Å
859	Q	89.6	Confident	94.5	Very high	86 Å²	86	59.8 Å²	59.8	40%	0.402	29%	0.291	S	S	.	.			trans	-70.2	132.3	-173	-65.1	-176.3	11.6	0	0	113	V857 K861 F862	V857-Q859 HydrophobicContact CG1-CB 4.43Å; V857-Q859 HydrophobicContact CG1-CG 4.06Å; V857-Q859 WeakPolarHBondContact O-CG 3.45Å; V857-Q859 PolarHBondContact O-N 3.23Å; Q859-K861 HydrophobicContact CB-CG 4.3Å; Q859-K861 PolarHBondContact O-N 2.92Å; Q859-F862 HydrophobicContact CB-CD2 4.14Å; Q859-F862 HydrophobicContact CB-CE2 4.46Å; Q859-F862 PolarHBondContact O-N 3.4Å
860	P	88.9	Confident	94.4	Very high	101 Å²	101	54.8 Å²	54.8	66%	0.656	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-55.2	-29.4	-176.7	-30	35.7	0	0	0	115.5	F862 N863	P860-F862 PolarHBondContact O-N 3.49Å; P860-F862 VanDerWaalsContact O-N 3.09Å; P860-N863 VanDerWaalsContact O-CB 3.26Å; P860-N863 WeakPolarHBondContact O-CB 3.4Å; P860-N863 PolarHBondContact O-N 3.12Å; P860-N863 PolarHBondContact O-ND2 2.91Å
861	K	89.9	Confident	94.5	Very high	152 Å²	152	54.6 Å²	54.6	66%	0.661	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-61.3	-16.2	177.7	77.8	-164.2	-167.5	-159.7	0	114.1	Q859	Q859-K861 HydrophobicContact CB-CG 4.3Å; Q859-K861 PolarHBondContact O-N 2.92Å
862	F	92.9	Very high	94.6	Very high	57 Å²	57	54 Å²	54	25%	0.25	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-103.3	4.2	177.1	-57.9	-48	0	0	0	113.9	V857 Q859 P860 Q864 R865 R866	V857-F862 HydrophobicContact CG1-CD2 4.08Å; V857-F862 HydrophobicContact CG1-CE2 4.01Å; Q859-F862 HydrophobicContact CB-CD2 4.14Å; Q859-F862 HydrophobicContact CB-CE2 4.46Å; Q859-F862 PolarHBondContact O-N 3.4Å; P860-F862 PolarHBondContact O-N 3.49Å; P860-F862 VanDerWaalsContact O-N 3.09Å; F862-Q864 VanDerWaalsContact C-N 3.35Å; F862-Q864 PolarHBondContact O-N 3.24Å; F862-R865 WeakPolarHBondContact O-CA 3.49Å; F862-R865 VanDerWaalsContact O-CB 3.31Å; F862-R865 WeakPolarHBondContact O-CB 3.47Å; F862-R865 PolarHBondContact O-N 2.9Å; F862-R866 WeakPolarHBondContact O-CG 3.34Å; F862-R866 PolarHBondContact O-N 2.7Å
863	N	93.1	Very high	94.7	Very high	41 Å²	41	49.7 Å²	49.7	22%	0.219	25%	0.246	C	C	.	.	H	α-helix	trans	-57.4	-41	-175.4	-77.2	-5.6	0	0	0	113.6	P860 R865 R866 I867 F915	P860-N863 VanDerWaalsContact O-CB 3.26Å; P860-N863 WeakPolarHBondContact O-CB 3.4Å; P860-N863 PolarHBondContact O-N 3.12Å; P860-N863 PolarHBondContact O-ND2 2.91Å; N863-R865 VanDerWaalsContact C-N 3.26Å; N863-R865 PolarHBondContact O-N 3.03Å; N863-R866 PolarHBondContact O-N 2.96Å; N863-R866 PolarHBondContact OD1-NH1 3.13Å; N863-I867 WeakPolarHBondContact O-CG1 3.17Å; N863-I867 PolarHBondContact O-N 3.4Å; N863-I867 VanDerWaalsContact O-N 3.08Å; N863-F915 HydrophobicContact CB-CD2 4.26Å; N863-F915 HydrophobicContact CB-CE2 3.47Å; N863-F915 VanDerWaalsContact CB-CE2 3.47Å; N863-F915 HydrophobicContact CB-CZ 3.66Å; N863-F915 WeakPolarHBondContact O-CZ 3.31Å
864	Q	92.6	Very high	94.8	Very high	169 Å²	169	46 Å²	46	79%	0.79	23%	0.227	S	C	*	.	H	α-helix	trans	-63.9	-30.8	175.4	-64.9	-176.6	10.1	0	0	113.1	F862 S868	F862-Q864 VanDerWaalsContact C-N 3.35Å; F862-Q864 PolarHBondContact O-N 3.24Å; Q864-S868 PolarHBondContact O-N 3.28Å; Q864-S868 PolarHBondContact O-OG 3.1Å
865	R	95.2	Very high	94.9	Very high	100 Å²	100	46.4 Å²	46.4	38%	0.377	23%	0.225	S	C	.	.	H	α-helix	trans	-69.2	-53.8	175.4	-53.6	-172.4	-178	-174.8	3.4	110.7	W815 F862 N863 I867 S868 S869	W815-R865 HydrophobicContact CB-CB 4.23Å; W815-R865 HydrophobicContact CB-CG 4.08Å; W815-R865 HydrophobicContact CD2-CB 3.81Å; W815-R865 HydrophobicContact CD2-CG 3.67Å; W815-R865 HydrophobicContact CE3-CB 3.68Å; W815-R865 HydrophobicContact CE3-CG 4.08Å; W815-R865 HydrophobicContact CG-CB 4.06Å; W815-R865 HydrophobicContact CG-CG 3.65Å; W815-R865 HydrophobicContact CZ3-CB 4.28Å; F862-R865 WeakPolarHBondContact O-CA 3.49Å; F862-R865 VanDerWaalsContact O-CB 3.31Å; F862-R865 WeakPolarHBondContact O-CB 3.47Å; F862-R865 PolarHBondContact O-N 2.9Å; N863-R865 VanDerWaalsContact C-N 3.26Å; N863-R865 PolarHBondContact O-N 3.03Å; R865-I867 VanDerWaalsContact C-N 3.3Å; R865-I867 PolarHBondContact O-N 3.48Å; R865-S868 CarbonylContact O-C 3.58Å; R865-S868 WeakPolarHBondContact O-CA 3.48Å; R865-S868 VanDerWaalsContact O-CB 3.3Å; R865-S868 WeakPolarHBondContact O-CB 3.32Å; R865-S868 PolarHBondContact O-N 2.89Å; R865-S869 PolarHBondContact O-N 2.91Å; R865-S869 PolarHBondContact O-OG 2.61Å
866	R	96.3	Very high	95.1	Very high	10 Å²	10	46.3 Å²	46.3	4%	0.038	23%	0.225	C	C	.	.	H	α-helix	trans	-55.9	-41.2	-179.8	-61.2	162.9	72.1	-175.1	16.3	112.5	G854 N858 F862 N863 S869 A870 F915 L919	G854-R866 PolarHBondContact O-NE 3.12Å; G854-R866 PolarHBondContact O-NH2 2.8Å; N858-R866 VanDerWaalsContact OD1-CZ 3.27Å; N858-R866 PolarHBondContact OD1-NH1 3.34Å; N858-R866 PolarHBondContact OD1-NH2 2.99Å; F862-R866 WeakPolarHBondContact O-CG 3.34Å; F862-R866 PolarHBondContact O-N 2.7Å; N863-R866 PolarHBondContact O-N 2.96Å; N863-R866 PolarHBondContact OD1-NH1 3.13Å; R866-S869 PolarHBondContact O-N 3.4Å; R866-A870 WeakPolarHBondContact O-CB 3.41Å; R866-A870 PolarHBondContact O-N 3.13Å; R866-F915 HydrophobicContact CB-CE1 3.75Å; R866-F915 HydrophobicContact CB-CZ 4.04Å; R866-F915 HydrophobicContact CG-CE1 4.41Å; R866-F915 VanDerWaalsContact CZ-CE1 3.47Å; R866-F915 VanDerWaalsContact NH1-CD1 3.26Å; R866-L919 HydrophobicContact CB-CD2 4.12Å
867	I	97.6	Very high	95.2	Very high	27 Å²	27	45 Å²	45	14%	0.138	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-40.3	172.6	-66.9	-68.9	0	0	0	111.3	Y819 N863 R865 K871 F915 R918 L919 T922	Y819-I867 HydrophobicContact CE2-CG2 3.96Å; N863-I867 WeakPolarHBondContact O-CG1 3.17Å; N863-I867 PolarHBondContact O-N 3.4Å; N863-I867 VanDerWaalsContact O-N 3.08Å; R865-I867 VanDerWaalsContact C-N 3.3Å; R865-I867 PolarHBondContact O-N 3.48Å; I867-K871 VanDerWaalsContact O-CB 3.22Å; I867-K871 WeakPolarHBondContact O-CB 3.31Å; I867-K871 PolarHBondContact O-N 2.56Å; I867-F915 HydrophobicContact CD1-CE2 4.18Å; I867-F915 HydrophobicContact CD1-CZ 3.96Å; I867-F915 HydrophobicContact CG1-CE2 4.09Å; I867-F915 HydrophobicContact CG1-CZ 3.75Å; I867-R918 HydrophobicContact CD1-CB 4.22Å; I867-L919 HydrophobicContact CD1-CD2 4.26Å; I867-T922 VanDerWaalsContact CD1-OG1 3.3Å; I867-T922 WeakPolarHBondContact CD1-OG1 3.45Å; I867-T922 HydrophobicContact CG2-CG2 4.06Å
868	S	97.5	Very high	95.4	Very high	14 Å²	14	43.8 Å²	43.8	10%	0.098	21%	0.209	C	C	.	.	H	α-helix	trans	-67.3	-40.6	177.9	-55.5	0	0	0	0	112.1	Q864 R865 K871 F872	Q864-S868 PolarHBondContact O-N 3.28Å; Q864-S868 PolarHBondContact O-OG 3.1Å; R865-S868 CarbonylContact O-C 3.58Å; R865-S868 WeakPolarHBondContact O-CA 3.48Å; R865-S868 VanDerWaalsContact O-CB 3.3Å; R865-S868 WeakPolarHBondContact O-CB 3.32Å; R865-S868 PolarHBondContact O-N 2.89Å; S868-K871 PolarHBondContact O-N 3.34Å; S868-F872 WeakPolarHBondContact O-CB 3.38Å; S868-F872 PolarHBondContact O-N 3.39Å
869	S	97.6	Very high	95.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.9	-44.2	176.3	-47.3	0	0	0	0	111.6	D850 R865 R866 F872 L873	D850-S869 VanDerWaalsContact OD2-CB 3.28Å; D850-S869 WeakPolarHBondContact OD2-CB 3.49Å; D850-S869 PolarHBondContact OD2-OG 3.09Å; R865-S869 PolarHBondContact O-N 2.91Å; R865-S869 PolarHBondContact O-OG 2.61Å; R866-S869 PolarHBondContact O-N 3.4Å; S869-F872 PolarHBondContact O-N 2.88Å; S869-L873 PolarHBondContact O-N 3.25Å
870	A	97.6	Very high	95.9	Very high	0 Å²	0	53 Å²	53	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.5	-41.1	173.8	0	0	0	0	0	112.6	R866 F872 L873 G874 F894 L919 T922	R866-A870 WeakPolarHBondContact O-CB 3.41Å; R866-A870 PolarHBondContact O-N 3.13Å; A870-F872 VanDerWaalsContact C-N 3.33Å; A870-F872 PolarHBondContact O-N 3.23Å; A870-L873 PolarHBondContact O-N 3.44Å; A870-G874 PolarHBondContact O-N 2.75Å; A870-F894 HydrophobicContact CB-CZ 4.37Å; A870-L919 HydrophobicContact CB-CD2 3.9Å; A870-T922 HydrophobicContact CB-CG2 4.35Å
871	K	97.9	Very high	96.3	Very high	32 Å²	32	50 Å²	50	14%	0.139	22%	0.217	C	C	.	.	H	α-helix	trans	-58.8	-45.3	171.1	176.9	55.2	167.5	164	0	111	Y819 I822 I867 S868 G874 E875 T922 T926	Y819-K871 HydrophobicContact CD2-CG 4.3Å; Y819-K871 HydrophobicContact CE2-CB 3.71Å; Y819-K871 HydrophobicContact CE2-CD 4.37Å; Y819-K871 HydrophobicContact CE2-CG 3.61Å; I822-K871 HydrophobicContact CB-CG 4.47Å; I822-K871 HydrophobicContact CD1-CB 4.37Å; I822-K871 HydrophobicContact CD1-CG 4.04Å; I822-K871 HydrophobicContact CG2-CG 4.26Å; I867-K871 VanDerWaalsContact O-CB 3.22Å; I867-K871 WeakPolarHBondContact O-CB 3.31Å; I867-K871 PolarHBondContact O-N 2.56Å; S868-K871 PolarHBondContact O-N 3.34Å; K871-G874 PolarHBondContact O-N 2.91Å; K871-E875 HydrophobicContact CD-CG 4.46Å; K871-E875 WeakPolarHBondContact CE-OE1 3.28Å; K871-E875 IonicContact NZ-OE1 3.21Å; K871-E875 PolarHBondContact NZ-OE1 3.38Å; K871-E875 PolarHBondContact O-N 3.42Å; K871-T922 HydrophobicContact CB-CG2 4.05Å; K871-T926 HydrophobicContact CD-CG2 3.88Å; K871-T926 WeakPolarHBondContact CD-OG1 3.35Å; K871-T926 VanDerWaalsContact NZ-CG2 3.33Å; K871-T926 PolarHBondContact NZ-OG1 3.35Å
872	F	98.4	Very high	96.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65	-41.7	-179	-171.4	-149.4	0	0	0	112.5	M811 I814 I822 V825 A826 V843 V847 S868 S869 A870 G874 E875 L876	M811-F872 VanDerWaalsContact O-CE1 3.31Å; M811-F872 WeakPolarHBondContact O-CE1 3.31Å; I814-F872 HydrophobicContact CB-CB 4.41Å; I814-F872 HydrophobicContact CB-CD1 3.78Å; I814-F872 HydrophobicContact CB-CE1 4.33Å; I814-F872 HydrophobicContact CB-CG 4.23Å; I814-F872 HydrophobicContact CD1-CD1 4.14Å; I814-F872 HydrophobicContact CD1-CD2 4.24Å; I814-F872 HydrophobicContact CD1-CE1 4.24Å; I814-F872 HydrophobicContact CD1-CE2 4.34Å; I814-F872 HydrophobicContact CD1-CG 4.16Å; I814-F872 HydrophobicContact CD1-CZ 4.35Å; I814-F872 HydrophobicContact CG1-CB 3.92Å; I814-F872 HydrophobicContact CG1-CD1 3.75Å; I814-F872 HydrophobicContact CG1-CD2 4.25Å; I814-F872 HydrophobicContact CG1-CE1 4.32Å; I814-F872 HydrophobicContact CG1-CG 3.72Å; I814-F872 HydrophobicContact CG2-CB 4.06Å; I814-F872 HydrophobicContact CG2-CD1 4.01Å; I814-F872 HydrophobicContact CG2-CG 4.36Å; I822-F872 HydrophobicContact CG2-CB 3.69Å; I822-F872 HydrophobicContact CG2-CD2 3.74Å; I822-F872 HydrophobicContact CG2-CG 4.02Å; V825-F872 HydrophobicContact CB-CE2 3.99Å; V825-F872 HydrophobicContact CB-CZ 4.31Å; V825-F872 HydrophobicContact CG1-CE2 3.91Å; V825-F872 HydrophobicContact CG1-CZ 3.71Å; A826-F872 HydrophobicContact CB-CE2 4.1Å; V843-F872 HydrophobicContact CG1-CE1 3.94Å; V843-F872 HydrophobicContact CG1-CZ 4.11Å; V847-F872 HydrophobicContact CG1-CD1 4.38Å; V847-F872 HydrophobicContact CG2-CD1 3.61Å; V847-F872 HydrophobicContact CG2-CE1 3.76Å; S868-F872 WeakPolarHBondContact O-CB 3.38Å; S868-F872 PolarHBondContact O-N 3.39Å; S869-F872 PolarHBondContact O-N 2.88Å; A870-F872 VanDerWaalsContact C-N 3.33Å; A870-F872 PolarHBondContact O-N 3.23Å; F872-G874 VanDerWaalsContact C-N 3.29Å; F872-G874 PolarHBondContact O-N 3.27Å; F872-E875 CarbonylContact O-C 3.55Å; F872-E875 PolarHBondContact O-N 2.87Å; F872-E875 VanDerWaalsContact O-N 3.08Å; F872-L876 HydrophobicContact CD1-CD1 4.3Å; F872-L876 HydrophobicContact CD2-CD1 4.38Å; F872-L876 HydrophobicContact CD2-CG 4.08Å; F872-L876 HydrophobicContact CE1-CD1 4.23Å; F872-L876 HydrophobicContact CE2-CD1 4.3Å; F872-L876 HydrophobicContact CE2-CD2 3.9Å; F872-L876 HydrophobicContact CE2-CG 3.93Å; F872-L876 HydrophobicContact CG-CD1 4.37Å; F872-L876 HydrophobicContact CZ-CD1 4.22Å; F872-L876 HydrophobicContact CZ-CD2 4.07Å; F872-L876 HydrophobicContact CZ-CG 4.27Å; F872-L876 WeakPolarHBondContact O-CG 3.23Å; F872-L876 PolarHBondContact O-N 2.9Å
873	L	98.3	Very high	96.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.5	-40.9	173.1	-178.7	64.4	0	0	0	112.4	V847 L848 I851 S869 A870 L876 Y877 V882 V886 T890 L923	V847-L873 HydrophobicContact CG1-CB 4.29Å; L848-L873 HydrophobicContact CD2-CD1 3.83Å; L848-L873 HydrophobicContact CD2-CD2 3.85Å; L848-L873 HydrophobicContact CG-CD1 4.46Å; I851-L873 HydrophobicContact CD1-CB 4.02Å; I851-L873 HydrophobicContact CD1-CD2 3.88Å; S869-L873 PolarHBondContact O-N 3.25Å; A870-L873 PolarHBondContact O-N 3.44Å; L873-L876 PolarHBondContact O-N 2.97Å; L873-Y877 PolarHBondContact O-N 2.92Å; L873-Y877 VanDerWaalsContact O-N 3.11Å; L873-V882 HydrophobicContact CD1-CG2 4.24Å; L873-V886 HydrophobicContact CD1-CG1 4.17Å; L873-T890 HydrophobicContact CD2-CG2 3.74Å; L873-L923 HydrophobicContact CD2-CD2 4.44Å
874	G	97.8	Very high	96.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-39.2	174.2	0	0	0	0	0	113	A870 K871 F872 Y877 N878 T926	A870-G874 PolarHBondContact O-N 2.75Å; K871-G874 PolarHBondContact O-N 2.91Å; F872-G874 VanDerWaalsContact C-N 3.29Å; F872-G874 PolarHBondContact O-N 3.27Å; G874-Y877 WeakPolarHBondContact O-CB 3.31Å; G874-Y877 PolarHBondContact O-N 2.69Å; G874-N878 PolarHBondContact O-N 2.88Å; G874-N878 PolarHBondContact O-ND2 3.33Å; G874-N878 PolarHBondContact O-OD1 3.37Å; G874-T926 VanDerWaalsContact C-CG2 3.45Å
875	E	97.9	Very high	97.1	Very high	21 Å²	21	40.5 Å²	40.5	10%	0.098	18%	0.183	C	C	.	.	H	α-helix	trans	-71.1	-33	174	-60.1	-60.4	171.4	0	0	112.6	I822 H823 A826 K871 F872 Y877 N878 Y879 T926	I822-E875 HydrophobicContact CG2-CG 4.35Å; H823-E875 HydrophobicContact CB-CB 4.41Å; H823-E875 HydrophobicContact CB-CG 3.85Å; A826-E875 HydrophobicContact CB-CB 3.84Å; K871-E875 HydrophobicContact CD-CG 4.46Å; K871-E875 WeakPolarHBondContact CE-OE1 3.28Å; K871-E875 IonicContact NZ-OE1 3.21Å; K871-E875 PolarHBondContact NZ-OE1 3.38Å; K871-E875 PolarHBondContact O-N 3.42Å; F872-E875 CarbonylContact O-C 3.55Å; F872-E875 PolarHBondContact O-N 2.87Å; F872-E875 VanDerWaalsContact O-N 3.08Å; E875-Y877 VanDerWaalsContact C-N 3.27Å; E875-Y877 PolarHBondContact O-N 3.24Å; E875-N878 WeakPolarHBondContact O-CB 3.24Å; E875-N878 PolarHBondContact O-N 3.35Å; E875-N878 VanDerWaalsContact O-N 3.11Å; E875-N878 PolarHBondContact OE2-ND2 3.42Å; E875-Y879 WeakPolarHBondContact O-CD2 3.5Å; E875-Y879 PolarHBondContact O-N 3.06Å; E875-T926 HydrophobicContact CG-CG2 4.14Å
876	L	97.9	Very high	97.2	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.9	-38.2	172.5	-72.2	169.6	0	0	0	110.7	A826 L829 V844 F872 L873 R880 M881 V882	A826-L876 HydrophobicContact CB-CD2 4.25Å; L829-L876 HydrophobicContact CD2-CD2 3.82Å; V844-L876 HydrophobicContact CG2-CD1 4.37Å; F872-L876 HydrophobicContact CD1-CD1 4.3Å; F872-L876 HydrophobicContact CD2-CD1 4.38Å; F872-L876 HydrophobicContact CD2-CG 4.08Å; F872-L876 HydrophobicContact CE1-CD1 4.23Å; F872-L876 HydrophobicContact CE2-CD1 4.3Å; F872-L876 HydrophobicContact CE2-CD2 3.9Å; F872-L876 HydrophobicContact CE2-CG 3.93Å; F872-L876 HydrophobicContact CG-CD1 4.37Å; F872-L876 HydrophobicContact CZ-CD1 4.22Å; F872-L876 HydrophobicContact CZ-CD2 4.07Å; F872-L876 HydrophobicContact CZ-CG 4.27Å; F872-L876 WeakPolarHBondContact O-CG 3.23Å; F872-L876 PolarHBondContact O-N 2.9Å; L873-L876 PolarHBondContact O-N 2.97Å; L876-R880 PolarHBondContact O-N 3.49Å; L876-M881 HydrophobicContact CB-CB 4.01Å; L876-M881 HydrophobicContact CD2-CB 3.72Å; L876-M881 HydrophobicContact CD2-CG 3.76Å; L876-M881 HydrophobicContact CG-CB 4.47Å; L876-M881 WeakPolarHBondContact O-CA 3.46Å; L876-M881 WeakPolarHBondContact O-CB 3.45Å; L876-M881 PolarHBondContact O-N 3.19Å; L876-V882 HydrophobicContact CB-CG2 4.24Å; L876-V882 PolarHBondContact O-N 2.72Å
877	Y	97.9	Very high	97.2	Very high	49 Å²	49	36.5 Å²	36.5	19%	0.192	17%	0.171	C	C	.	.	H	α-helix	trans	-64.1	-47.7	168.9	171.6	-92.4	0	0	0	112	L873 G874 E875 Y879 R880 V882 V887 C927 Y930 F931	L873-Y877 PolarHBondContact O-N 2.92Å; L873-Y877 VanDerWaalsContact O-N 3.11Å; G874-Y877 WeakPolarHBondContact O-CB 3.31Å; G874-Y877 PolarHBondContact O-N 2.69Å; E875-Y877 VanDerWaalsContact C-N 3.27Å; E875-Y877 PolarHBondContact O-N 3.24Å; Y877-Y879 PolarHBondContact O-N 2.99Å; Y877-R880 PolarHBondContact O-N 3.14Å; Y877-V882 WeakPolarHBondContact CD2-O 3.37Å; Y877-V887 HydrophobicContact CD2-CG2 3.92Å; Y877-V887 HydrophobicContact CG-CG2 3.9Å; Y877-C927 HydrophobicContact CD1-CB 3.63Å; Y877-C927 HydrophobicContact CE1-CB 4.24Å; Y877-C927 HydrophobicContact CG-CB 4.44Å; Y877-Y930 HydrophobicContact CE1-CD2 4.05Å; Y877-Y930 HydrophobicContact CE1-CG 4.31Å; Y877-F931 AromaticContact CE1-CE1 3.96Å; Y877-F931 HydrophobicContact CE1-CE1 3.96Å; Y877-F931 HydrophobicContact CE1-CZ 4.3Å; Y877-F931 HydrophobicContact CE2-CE1 4.04Å; Y877-F931 HydrophobicContact CE2-CZ 4.48Å; Y877-F931 AromaticContact CZ-CE1 3.57Å; Y877-F931 WeakPolarHBondContact OH-CE1 3.36Å
878	N	97.1	Very high	97.2	Very high	39 Å²	39	35.8 Å²	35.8	21%	0.209	17%	0.167	C	C	.	.	H	α-helix	trans	-57.8	-35.3	-178.9	-64.7	-15	0	0	0	112.8	G874 E875 T926 C927 Y930	G874-N878 PolarHBondContact O-N 2.88Å; G874-N878 PolarHBondContact O-ND2 3.33Å; G874-N878 PolarHBondContact O-OD1 3.37Å; E875-N878 WeakPolarHBondContact O-CB 3.24Å; E875-N878 PolarHBondContact O-N 3.35Å; E875-N878 VanDerWaalsContact O-N 3.11Å; E875-N878 PolarHBondContact OE2-ND2 3.42Å; N878-T926 PolarHBondContact ND2-O 3.43Å; N878-C927 WeakPolarHBondContact OD1-CB 3.33Å; N878-Y930 WeakPolarHBondContact OD1-CD2 3.18Å; N878-Y930 WeakPolarHBondContact OD1-CE2 3.36Å
879	Y	96.6	Very high	97.2	Very high	70 Å²	70	43.4 Å²	43.4	28%	0.275	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	16.3	176.5	-72.6	-86.3	0	0	0	113.9	H823 A826 N827 E875 Y877 M881	H823-Y879 HydrophobicContact CB-CE2 4.07Å; H823-Y879 AromaticContact ND1-CZ 3.99Å; H823-Y879 PolarHBondContact ND1-OH 3.24Å; H823-Y879 VanDerWaalsContact ND1-OH 3.08Å; H823-Y879 WeakPolarHBondContact O-CE2 3.47Å; A826-Y879 HydrophobicContact CB-CD2 3.65Å; A826-Y879 HydrophobicContact CB-CE2 4.42Å; A826-Y879 HydrophobicContact CB-CG 4.11Å; N827-Y879 HydrophobicContact CB-CD1 3.77Å; N827-Y879 HydrophobicContact CB-CE1 3.43Å; N827-Y879 VanDerWaalsContact CB-CE1 3.43Å; N827-Y879 HydrophobicContact CB-CE2 4.41Å; N827-Y879 HydrophobicContact CB-CG 4.4Å; N827-Y879 VanDerWaalsContact CG-CE1 3.44Å; N827-Y879 WeakPolarHBondContact OD1-CE1 3.34Å; E875-Y879 WeakPolarHBondContact O-CD2 3.5Å; E875-Y879 PolarHBondContact O-N 3.06Å; Y877-Y879 PolarHBondContact O-N 2.99Å; Y879-M881 VanDerWaalsContact C-N 3.27Å; Y879-M881 PolarHBondContact O-N 2.92Å
880	R	95.9	Very high	97.3	Very high	231 Å²	231	44 Å²	44	87%	0.872	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	23.4	174.3	-51.5	-178.3	-178	-177	-0.4	115.8	L876 Y877	L876-R880 PolarHBondContact O-N 3.49Å; Y877-R880 PolarHBondContact O-N 3.14Å
881	M	96.3	Very high	97.3	Very high	39 Å²	39	44 Å²	44	19%	0.192	20%	0.197	C	C	.	.	S	Bend	trans	-76.6	-21.6	171	-64.7	-52.7	-47	0	0	113	L829 A830 V833 V844 L876 Y879	L829-M881 HydrophobicContact CD2-CE 4.39Å; L829-M881 HydrophobicContact CG-CE 4.29Å; L829-M881 HydrophobicContact CG-SD 4.49Å; A830-M881 VanDerWaalsContact CA-SD 3.58Å; A830-M881 HydrophobicContact CB-CG 4.46Å; A830-M881 HydrophobicContact CB-SD 3.87Å; V833-M881 HydrophobicContact CB-CE 4.48Å; V833-M881 HydrophobicContact CG1-CE 3.73Å; V833-M881 HydrophobicContact CG2-CE 4.08Å; V833-M881 HydrophobicContact CG2-SD 4.09Å; V844-M881 HydrophobicContact CG2-CB 4.49Å; L876-M881 HydrophobicContact CB-CB 4.01Å; L876-M881 HydrophobicContact CD2-CB 3.72Å; L876-M881 HydrophobicContact CD2-CG 3.76Å; L876-M881 HydrophobicContact CG-CB 4.47Å; L876-M881 WeakPolarHBondContact O-CA 3.46Å; L876-M881 WeakPolarHBondContact O-CB 3.45Å; L876-M881 PolarHBondContact O-N 3.19Å; Y879-M881 VanDerWaalsContact C-N 3.27Å; Y879-M881 PolarHBondContact O-N 2.92Å
882	V	97	Very high	97.3	Very high	15 Å²	15	45.9 Å²	45.9	9%	0.091	21%	0.205	C	C	.	.	S	Bend	trans	-140.9	151.9	174	-62.2	0	0	0	0	111.8	V844 L873 L876 Y877 V886	V844-V882 HydrophobicContact CB-CG1 4.25Å; V844-V882 HydrophobicContact CG1-CG1 3.47Å; V844-V882 VanDerWaalsContact CG1-CG1 3.47Å; V844-V882 HydrophobicContact CG2-CG1 3.66Å; L873-V882 HydrophobicContact CD1-CG2 4.24Å; L876-V882 HydrophobicContact CB-CG2 4.24Å; L876-V882 PolarHBondContact O-N 2.72Å; Y877-V882 WeakPolarHBondContact CD2-O 3.37Å; V882-V886 HydrophobicContact CB-CB 4.1Å; V882-V886 HydrophobicContact CB-CG1 4.36Å; V882-V886 HydrophobicContact CB-CG2 4.11Å; V882-V886 HydrophobicContact CG1-CG1 4.43Å; V882-V886 HydrophobicContact CG2-CB 4.45Å
883	E	96	Very high	97.2	Very high	144 Å²	144	46.5 Å²	46.5	67%	0.673	21%	0.21	S	C	*	.			trans	-81.2	163.5	174.5	-63.2	-164.6	163.2	0	0	113.7	A885 V886	E883-A885 PolarHBondContact O-N 2.96Å; E883-A885 VanDerWaalsContact O-N 3.1Å; E883-V886 WeakPolarHBondContact O-CB 3.49Å; E883-V886 PolarHBondContact O-N 2.61Å
884	S	95.4	Very high	97.2	Very high	29 Å²	29	46.5 Å²	46.5	20%	0.203	21%	0.21	C	C	.	.	H	α-helix	trans	-56	-27.5	172.8	68.2	0	0	0	0	113.4	V886 V887 F888	S884-V886 VanDerWaalsContact C-N 3.25Å; S884-V886 PolarHBondContact O-N 3.13Å; S884-V887 PolarHBondContact O-N 3.43Å; S884-F888 WeakPolarHBondContact O-CD2 3.43Å; S884-F888 PolarHBondContact O-N 2.96Å
885	A	96.1	Very high	97.1	Very high	31 Å²	31	47.2 Å²	47.2	26%	0.256	21%	0.213	S	C	.	.	H	α-helix	trans	-65.2	-25.1	175.9	0	0	0	0	0	113.5	E883 R889	E883-A885 PolarHBondContact O-N 2.96Å; E883-A885 VanDerWaalsContact O-N 3.1Å; A885-R889 WeakPolarHBondContact O-CB 3.41Å; A885-R889 WeakPolarHBondContact O-CG 3.14Å; A885-R889 PolarHBondContact O-N 3.45Å; A885-R889 PolarHBondContact O-NE 3.37Å
886	V	97.4	Very high	97	Very high	25 Å²	25	49.7 Å²	49.7	15%	0.152	23%	0.233	C	C	.	.	H	α-helix	trans	-75.6	-50.3	171.2	-179.2	0	0	0	0	109.5	L848 L873 V882 E883 S884 F888 R889 T890	L848-V886 HydrophobicContact CD1-CG1 3.88Å; L848-V886 HydrophobicContact CD2-CG1 3.75Å; L848-V886 HydrophobicContact CG-CG1 4.4Å; L873-V886 HydrophobicContact CD1-CG1 4.17Å; V882-V886 HydrophobicContact CB-CB 4.1Å; V882-V886 HydrophobicContact CB-CG1 4.36Å; V882-V886 HydrophobicContact CB-CG2 4.11Å; V882-V886 HydrophobicContact CG1-CG1 4.43Å; V882-V886 HydrophobicContact CG2-CB 4.45Å; E883-V886 WeakPolarHBondContact O-CB 3.49Å; E883-V886 PolarHBondContact O-N 2.61Å; S884-V886 VanDerWaalsContact C-N 3.25Å; S884-V886 PolarHBondContact O-N 3.13Å; V886-F888 VanDerWaalsContact C-N 3.35Å; V886-F888 PolarHBondContact O-N 3.47Å; V886-R889 PolarHBondContact O-N 3.16Å; V886-R889 VanDerWaalsContact O-N 3.1Å; V886-T890 PolarHBondContact O-N 2.89Å; V886-T890 PolarHBondContact O-OG1 3.03Å
887	V	97.6	Very high	96.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-55.1	-47.2	179.2	-177.4	0	0	0	0	111.8	Y877 S884 T890 L891 L923 F931	Y877-V887 HydrophobicContact CD2-CG2 3.92Å; Y877-V887 HydrophobicContact CG-CG2 3.9Å; S884-V887 PolarHBondContact O-N 3.43Å; V887-T890 PolarHBondContact O-N 3.08Å; V887-L891 HydrophobicContact CG1-CD1 4.05Å; V887-L891 HydrophobicContact CG1-CG 4.42Å; V887-L891 WeakPolarHBondContact O-CB 3.4Å; V887-L891 WeakPolarHBondContact O-CG 3.2Å; V887-L891 PolarHBondContact O-N 3.47Å; V887-L923 HydrophobicContact CG1-CD1 4.21Å; V887-L923 HydrophobicContact CG1-CD2 4.12Å; V887-L923 HydrophobicContact CG1-CG 4.09Å; V887-F931 HydrophobicContact CB-CZ 4.2Å; V887-F931 HydrophobicContact CG1-CE2 3.95Å; V887-F931 HydrophobicContact CG1-CZ 3.9Å
888	F	97.6	Very high	96.6	Very high	12 Å²	12	51.3 Å²	51.3	5%	0.053	25%	0.25	C	S	.	.	H	α-helix	trans	-66.1	-38.1	177.9	-73.9	-60.7	0	0	0	112.9	S884 V886 T890 L891 F892 F931 K939 L940	S884-F888 WeakPolarHBondContact O-CD2 3.43Å; S884-F888 PolarHBondContact O-N 2.96Å; V886-F888 VanDerWaalsContact C-N 3.35Å; V886-F888 PolarHBondContact O-N 3.47Å; F888-T890 VanDerWaalsContact C-N 3.34Å; F888-T890 PolarHBondContact O-N 3.12Å; F888-L891 HydrophobicContact CD1-CD1 4.05Å; F888-L891 HydrophobicContact CE1-CD1 4.33Å; F888-L891 PolarHBondContact O-N 2.99Å; F888-F892 VanDerWaalsContact O-CD2 3.31Å; F888-F892 WeakPolarHBondContact O-CD2 3.35Å; F888-F892 PolarHBondContact O-N 3.46Å; F888-F931 HydrophobicContact CE1-CD2 4.22Å; F888-F931 HydrophobicContact CE1-CE2 4.36Å; F888-F931 HydrophobicContact CE2-CD1 4.45Å; F888-F931 HydrophobicContact CE2-CE1 4.36Å; F888-F931 HydrophobicContact CE2-CE2 4.46Å; F888-F931 HydrophobicContact CE2-CZ 4.39Å; F888-F931 HydrophobicContact CZ-CD1 4.29Å; F888-F931 AromaticContact CZ-CD2 3.74Å; F888-F931 HydrophobicContact CZ-CD2 3.74Å; F888-F931 HydrophobicContact CZ-CE1 4.47Å; F888-F931 AromaticContact CZ-CE2 3.98Å; F888-F931 HydrophobicContact CZ-CE2 3.98Å; F888-F931 AromaticContact CZ-CG 3.93Å; F888-F931 HydrophobicContact CZ-CG 3.93Å; F888-F931 HydrophobicContact CZ-CZ 4.35Å; F888-K939 HydrophobicContact CD1-CB 4.2Å; F888-K939 HydrophobicContact CD2-CB 3.92Å; F888-K939 HydrophobicContact CD2-CD 3.8Å; F888-K939 HydrophobicContact CD2-CG 4.48Å; F888-K939 HydrophobicContact CE1-CB 3.89Å; F888-K939 HydrophobicContact CE2-CB 3.58Å; F888-K939 HydrophobicContact CE2-CD 3.94Å; F888-K939 HydrophobicContact CE2-CG 4.39Å; F888-K939 HydrophobicContact CG-CB 4.24Å; F888-K939 HydrophobicContact CZ-CB 3.57Å; F888-L940 HydrophobicContact CE1-CB 3.98Å; F888-L940 HydrophobicContact CZ-CB 4.08Å
889	R	97.5	Very high	96.5	Very high	174 Å²	174	50.4 Å²	50.4	66%	0.657	25%	0.246	S	C	*	.	H	α-helix	trans	-61.3	-42.6	174.6	-81.5	-177.1	-75.4	-175.1	0.8	111.5	A885 V886 S893	A885-R889 WeakPolarHBondContact O-CB 3.41Å; A885-R889 WeakPolarHBondContact O-CG 3.14Å; A885-R889 PolarHBondContact O-N 3.45Å; A885-R889 PolarHBondContact O-NE 3.37Å; V886-R889 PolarHBondContact O-N 3.16Å; V886-R889 VanDerWaalsContact O-N 3.1Å; R889-S893 WeakPolarHBondContact O-CB 3.26Å; R889-S893 PolarHBondContact O-N 3.48Å
890	T	98	Very high	96.3	Very high	13 Å²	13	49.6 Å²	49.6	8%	0.08	25%	0.247	C	C	.	.	H	α-helix	trans	-68.6	-41.6	176.3	-53.8	0	0	0	0	112.4	I851 L873 V886 V887 F888 F892 S893 F894 L923	I851-T890 HydrophobicContact CG2-CG2 3.87Å; L873-T890 HydrophobicContact CD2-CG2 3.74Å; V886-T890 PolarHBondContact O-N 2.89Å; V886-T890 PolarHBondContact O-OG1 3.03Å; V887-T890 PolarHBondContact O-N 3.08Å; F888-T890 VanDerWaalsContact C-N 3.34Å; F888-T890 PolarHBondContact O-N 3.12Å; T890-F892 PolarHBondContact O-N 3.14Å; T890-S893 WeakPolarHBondContact O-CB 3.3Å; T890-S893 PolarHBondContact O-N 2.98Å; T890-F894 HydrophobicContact CG2-CE1 4.14Å; T890-F894 HydrophobicContact CG2-CE2 3.91Å; T890-F894 HydrophobicContact CG2-CZ 3.65Å; T890-F894 WeakPolarHBondContact O-CD2 3.33Å; T890-F894 WeakPolarHBondContact O-CG 3.46Å; T890-F894 PolarHBondContact O-N 3.45Å; T890-L923 HydrophobicContact CG2-CD2 4.39Å
891	L	97.9	Very high	96	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.2	-49	174.7	-78	172.1	0	0	0	112	V887 F888 F894 V920 L923 L924 F943	V887-L891 HydrophobicContact CG1-CD1 4.05Å; V887-L891 HydrophobicContact CG1-CG 4.42Å; V887-L891 WeakPolarHBondContact O-CB 3.4Å; V887-L891 WeakPolarHBondContact O-CG 3.2Å; V887-L891 PolarHBondContact O-N 3.47Å; F888-L891 HydrophobicContact CD1-CD1 4.05Å; F888-L891 HydrophobicContact CE1-CD1 4.33Å; F888-L891 PolarHBondContact O-N 2.99Å; L891-F894 PolarHBondContact O-N 2.95Å; L891-V920 HydrophobicContact CD2-CG1 4.13Å; L891-L923 HydrophobicContact CD2-CB 4.23Å; L891-L923 HydrophobicContact CD2-CD2 3.85Å; L891-L923 HydrophobicContact CD2-CG 4.16Å; L891-L923 HydrophobicContact CG-CD2 3.86Å; L891-L923 HydrophobicContact CG-CG 4.42Å; L891-L924 HydrophobicContact CD1-CD2 3.95Å; L891-L924 HydrophobicContact CD2-CD2 4.17Å; L891-L924 HydrophobicContact CD2-CG 4.12Å; L891-F943 VanDerWaalsContact C-CE2 3.42Å; L891-F943 HydrophobicContact CB-CD1 4.5Å; L891-F943 HydrophobicContact CB-CD2 4.06Å; L891-F943 HydrophobicContact CB-CE1 4.2Å; L891-F943 HydrophobicContact CB-CE2 3.73Å; L891-F943 HydrophobicContact CB-CG 4.44Å; L891-F943 HydrophobicContact CB-CZ 3.81Å; L891-F943 HydrophobicContact CD1-CD1 4.36Å; L891-F943 HydrophobicContact CD1-CE1 4.41Å; L891-F943 HydrophobicContact CD2-CE1 4.01Å; L891-F943 HydrophobicContact CD2-CZ 4.06Å; L891-F943 HydrophobicContact CG-CE1 4.45Å; L891-F943 HydrophobicContact CG-CZ 4.44Å; L891-F943 VanDerWaalsContact O-CE2 3.25Å; L891-F943 WeakPolarHBondContact O-CE2 3.3Å
892	F	97.6	Very high	95.6	Very high	71 Å²	71	47.8 Å²	47.8	31%	0.311	26%	0.262	S	S	.	.	H	α-helix	trans	-63.7	-41.7	174.3	-83.2	-72.6	0	0	0	111.8	F888 T890 F894 I895 S896 F943 Y946	F888-F892 VanDerWaalsContact O-CD2 3.31Å; F888-F892 WeakPolarHBondContact O-CD2 3.35Å; F888-F892 PolarHBondContact O-N 3.46Å; T890-F892 PolarHBondContact O-N 3.14Å; F892-F894 PolarHBondContact O-N 2.91Å; F892-I895 HydrophobicContact CD1-CD1 4.22Å; F892-I895 VanDerWaalsContact O-CG1 3.27Å; F892-I895 WeakPolarHBondContact O-CG1 3.38Å; F892-I895 PolarHBondContact O-N 3.39Å; F892-S896 PolarHBondContact O-N 3.08Å; F892-S896 PolarHBondContact O-OG 3.49Å; F892-S896 VanDerWaalsContact O-OG 3.06Å; F892-F943 AromaticContact CD1-CD2 3.99Å; F892-F943 HydrophobicContact CD1-CD2 3.99Å; F892-F943 HydrophobicContact CD1-CE2 4.48Å; F892-F943 HydrophobicContact CD2-CD2 4.13Å; F892-F943 AromaticContact CE1-CD2 3.93Å; F892-F943 HydrophobicContact CE1-CD2 3.93Å; F892-F943 HydrophobicContact CE2-CB 4.13Å; F892-F943 HydrophobicContact CE2-CD2 4.05Å; F892-F943 HydrophobicContact CG-CD2 4.09Å; F892-F943 HydrophobicContact CZ-CB 3.96Å; F892-F943 AromaticContact CZ-CD2 3.95Å; F892-F943 HydrophobicContact CZ-CD2 3.95Å; F892-F943 HydrophobicContact CZ-CG 4.48Å; F892-Y946 AromaticContact CE1-CD2 3.84Å; F892-Y946 HydrophobicContact CE1-CD2 3.84Å; F892-Y946 HydrophobicContact CE1-CE2 4.5Å; F892-Y946 HydrophobicContact CE1-CG 4.1Å; F892-Y946 HydrophobicContact CZ-CD2 4.29Å
893	S	97.6	Very high	95.1	Very high	14 Å²	14	47.9 Å²	47.9	10%	0.098	27%	0.266	C	S	.	.	H	α-helix	trans	-57.8	-32.7	176.6	-167.3	0	0	0	0	112.7	R852 R889 T890 I895 F897	R852-S893 PolarHBondContact NH2-OG 3.35Å; R889-S893 WeakPolarHBondContact O-CB 3.26Å; R889-S893 PolarHBondContact O-N 3.48Å; T890-S893 WeakPolarHBondContact O-CB 3.3Å; T890-S893 PolarHBondContact O-N 2.98Å; S893-I895 VanDerWaalsContact C-N 3.28Å; S893-I895 PolarHBondContact O-N 3.18Å; S893-F897 WeakPolarHBondContact O-CB 3.27Å; S893-F897 PolarHBondContact O-N 3Å
894	F	97.6	Very high	94.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.4	-31.8	175.8	-67.7	-41.9	0	0	0	113.6	I851 M855 A870 T890 L891 F892 R916 L919 V920 L923	I851-F894 HydrophobicContact CG2-CE1 3.58Å; I851-F894 HydrophobicContact CG2-CZ 3.91Å; M855-F894 HydrophobicContact CE-CD1 4.48Å; M855-F894 HydrophobicContact SD-CD1 3.76Å; M855-F894 HydrophobicContact SD-CE1 4.41Å; A870-F894 HydrophobicContact CB-CZ 4.37Å; T890-F894 HydrophobicContact CG2-CE1 4.14Å; T890-F894 HydrophobicContact CG2-CE2 3.91Å; T890-F894 HydrophobicContact CG2-CZ 3.65Å; T890-F894 WeakPolarHBondContact O-CD2 3.33Å; T890-F894 WeakPolarHBondContact O-CG 3.46Å; T890-F894 PolarHBondContact O-N 3.45Å; L891-F894 PolarHBondContact O-N 2.95Å; F892-F894 PolarHBondContact O-N 2.91Å; F894-R916 WeakPolarHBondContact O-CD 3.41Å; F894-R916 PolarHBondContact O-NH1 3.43Å; F894-L919 HydrophobicContact CD1-CB 4Å; F894-L919 HydrophobicContact CD1-CD1 3.99Å; F894-L919 HydrophobicContact CD2-CB 4.13Å; F894-L919 HydrophobicContact CE1-CB 3.82Å; F894-L919 HydrophobicContact CE1-CD1 3.81Å; F894-L919 HydrophobicContact CE1-CG 4.27Å; F894-L919 HydrophobicContact CE2-CB 3.94Å; F894-L919 HydrophobicContact CG-CB 4.17Å; F894-L919 HydrophobicContact CZ-CB 3.79Å; F894-V920 HydrophobicContact CB-CG2 3.71Å; F894-V920 HydrophobicContact CD2-CG2 3.82Å; F894-V920 HydrophobicContact CG-CG2 4.18Å; F894-L923 HydrophobicContact CE2-CD2 3.92Å
895	I	96.7	Very high	94.6	Very high	14 Å²	14	44.6 Å²	44.6	7%	0.072	26%	0.257	C	S	.	.	H	α-helix	trans	-104.2	-7.4	-174.8	64.9	167.7	0	0	0	114.4	F892 S893 V920 F943 F947 Y950	F892-I895 HydrophobicContact CD1-CD1 4.22Å; F892-I895 VanDerWaalsContact O-CG1 3.27Å; F892-I895 WeakPolarHBondContact O-CG1 3.38Å; F892-I895 PolarHBondContact O-N 3.39Å; S893-I895 VanDerWaalsContact C-N 3.28Å; S893-I895 PolarHBondContact O-N 3.18Å; I895-V920 HydrophobicContact CG2-CG2 4.12Å; I895-F943 HydrophobicContact CD1-CD2 4.16Å; I895-F943 HydrophobicContact CD1-CE2 3.58Å; I895-F943 HydrophobicContact CD1-CZ 4.37Å; I895-F943 HydrophobicContact CG1-CE2 4.05Å; I895-F947 HydrophobicContact CG2-CD2 3.93Å; I895-Y950 HydrophobicContact CB-CD1 4.5Å; I895-Y950 HydrophobicContact CB-CD2 4.14Å; I895-Y950 HydrophobicContact CB-CG 3.98Å; I895-Y950 HydrophobicContact CG2-CD1 3.93Å; I895-Y950 HydrophobicContact CG2-CD2 4.44Å; I895-Y950 HydrophobicContact CG2-CG 3.9Å
896	S	94.9	Very high	94.4	Very high	74 Å²	74	43.7 Å²	43.7	52%	0.517	25%	0.249	S	C	.	.	H	α-helix	trans	-119.7	-30.4	177.8	66.8	0	0	0	0	114.8	F892 G898 V899	F892-S896 PolarHBondContact O-N 3.08Å; F892-S896 PolarHBondContact O-OG 3.49Å; F892-S896 VanDerWaalsContact O-OG 3.06Å; S896-G898 PolarHBondContact O-N 3.03Å; S896-G898 VanDerWaalsContact O-N 3.1Å; S896-V899 PolarHBondContact O-N 3.14Å; S896-V899 VanDerWaalsContact O-N 3.11Å
897	F	95.9	Very high	94.1	Very high	50 Å²	50	48.5 Å²	48.5	22%	0.219	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	114.7	-174.6	178.7	-100.6	0	0	0	111.1	M855 E856 S893 V899 L908 R916	M855-F897 HydrophobicContact CB-CD1 3.9Å; M855-F897 HydrophobicContact CB-CE1 4.09Å; M855-F897 HydrophobicContact CE-CB 4.27Å; M855-F897 HydrophobicContact CE-CD1 3.95Å; M855-F897 HydrophobicContact CE-CG 4.27Å; M855-F897 HydrophobicContact SD-CB 4.46Å; M855-F897 HydrophobicContact SD-CD1 4.21Å; E856-F897 HydrophobicContact CG-CE1 3.6Å; E856-F897 HydrophobicContact CG-CZ 3.64Å; E856-F897 VanDerWaalsContact OE1-CZ 3.29Å; E856-F897 WeakPolarHBondContact OE1-CZ 3.34Å; S893-F897 WeakPolarHBondContact O-CB 3.27Å; S893-F897 PolarHBondContact O-N 3Å; F897-V899 PolarHBondContact O-N 3.26Å; F897-L908 HydrophobicContact CE1-CD1 3.92Å; F897-L908 HydrophobicContact CZ-CD1 4.37Å; F897-R916 VanDerWaalsContact O-CZ 3.29Å; F897-R916 PolarHBondContact O-NH1 3.43Å; F897-R916 PolarHBondContact O-NH2 2.95Å
898	G	91.8	Very high	93.8	Very high	32 Å²	32	50.9 Å²	50.9	33%	0.33	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	27.2	-175.3	0	0	0	0	0	113.7	S896 S906	S896-G898 PolarHBondContact O-N 3.03Å; S896-G898 VanDerWaalsContact O-N 3.1Å; G898-S906 WeakPolarHBondContact O-CB 3.46Å; G898-S906 PolarHBondContact O-OG 2.83Å
899	V	94.9	Very high	93.6	Very high	20 Å²	20	50.5 Å²	50.5	12%	0.121	29%	0.292	C	S	.	.			trans	-109.2	130.7	173.3	-179	0	0	0	0	108	S896 F897 D909 Y950	S896-V899 PolarHBondContact O-N 3.14Å; S896-V899 VanDerWaalsContact O-N 3.11Å; F897-V899 PolarHBondContact O-N 3.26Å; V899-D909 HydrophobicContact CG2-CB 4.28Å; V899-Y950 HydrophobicContact CG1-CD2 4.16Å; V899-Y950 HydrophobicContact CG1-CE2 4.07Å; V899-Y950 HydrophobicContact CG2-CE2 4.02Å
900	N	92.5	Very high	93.4	Very high	53 Å²	53	44.6 Å²	44.6	28%	0.283	28%	0.276	S	S	.	.			trans	-71.3	137.6	-176.5	-59.2	-8	0	0	0	110.2	D902 G903 S904 P905 S906	N900-D902 WeakPolarHBondContact CB-OD1 3.35Å; N900-D902 PolarHBondContact O-N 3.21Å; N900-D902 VanDerWaalsContact O-N 3.13Å; N900-G903 PolarHBondContact O-N 2.82Å; N900-S904 WeakPolarHBondContact CB-O 3.22Å; N900-S904 WeakPolarHBondContact CB-OG 3.48Å; N900-S904 PolarHBondContact ND2-O 2.7Å; N900-S904 PolarHBondContact ND2-OG 2.99Å; N900-P905 PolarHBondContact ND2-O 3.45Å; N900-S906 VanDerWaalsContact OD1-CB 3.31Å; N900-S906 WeakPolarHBondContact OD1-CB 3.42Å
901	P	88.9	Confident	93	Very high	124 Å²	124	46.1 Å²	46.1	81%	0.805	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.5	-173.7	-26	35.6	0	0	0	116	W953	P901-W953 WeakPolarHBondContact O-CH2 3.32Å; P901-W953 VanDerWaalsContact O-CZ2 3.3Å; P901-W953 WeakPolarHBondContact O-CZ2 3.25Å
902	D	87.8	Confident	92.8	Very high	108 Å²	108	52 Å²	52	58%	0.578	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-11.7	175.3	67.2	-23.2	0	0	0	113.3	N900 S904 W953	N900-D902 WeakPolarHBondContact CB-OD1 3.35Å; N900-D902 PolarHBondContact O-N 3.21Å; N900-D902 VanDerWaalsContact O-N 3.13Å; D902-S904 VanDerWaalsContact CG-OG 3.23Å; D902-S904 WeakPolarHBondContact OD1-CB 3.43Å; D902-S904 PolarHBondContact OD1-N 2.68Å; D902-S904 PolarHBondContact OD1-OG 3.39Å; D902-S904 VanDerWaalsContact OD2-CB 3.29Å; D902-S904 WeakPolarHBondContact OD2-CB 3.23Å; D902-S904 PolarHBondContact OD2-OG 3.21Å; D902-S904 VanDerWaalsContact OD2-OG 3.04Å; D902-W953 PolarHBondContact O-NE1 2.99Å
903	G	86.8	Confident	92.6	Very high	17 Å²	17	50 Å²	50	18%	0.175	31%	0.306	C	S	.	.			trans	88	6.4	-173.2	0	0	0	0	0	115	N900 W953	N900-G903 PolarHBondContact O-N 2.82Å; G903-W953 VanDerWaalsContact CA-CD2 3.43Å; G903-W953 VanDerWaalsContact CA-CG 3.49Å
904	S	90.5	Very high	92.4	Very high	44 Å²	44	50 Å²	50	31%	0.308	30%	0.304	S	S	.	.			trans	-69	153.7	176	61.9	0	0	0	0	112	N900 D902	N900-S904 WeakPolarHBondContact CB-O 3.22Å; N900-S904 WeakPolarHBondContact CB-OG 3.48Å; N900-S904 PolarHBondContact ND2-O 2.7Å; N900-S904 PolarHBondContact ND2-OG 2.99Å; D902-S904 VanDerWaalsContact CG-OG 3.23Å; D902-S904 WeakPolarHBondContact OD1-CB 3.43Å; D902-S904 PolarHBondContact OD1-N 2.68Å; D902-S904 PolarHBondContact OD1-OG 3.39Å; D902-S904 VanDerWaalsContact OD2-CB 3.29Å; D902-S904 WeakPolarHBondContact OD2-CB 3.23Å; D902-S904 PolarHBondContact OD2-OG 3.21Å; D902-S904 VanDerWaalsContact OD2-OG 3.04Å
905	P	91.1	Very high	92.4	Very high	60 Å²	60	50.5 Å²	50.5	39%	0.39	31%	0.306	S	S	.	.			trans	-67	144.2	-179.1	-19.1	32.2	0	0	0	112.6	N900 P911 V957	N900-P905 PolarHBondContact ND2-O 3.45Å; P905-P911 HydrophobicContact CB-CG 3.88Å; P905-P911 HydrophobicContact CG-CG 3.89Å; P905-V957 HydrophobicContact CG-CG1 3.97Å
906	S	92.4	Very high	92.4	Very high	12 Å²	12	49.8 Å²	49.8	8%	0.084	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-123.6	169.5	-179.9	83.1	0	0	0	0	111.9	G898 N900 L908 D909 P910	G898-S906 WeakPolarHBondContact O-CB 3.46Å; G898-S906 PolarHBondContact O-OG 2.83Å; N900-S906 VanDerWaalsContact OD1-CB 3.31Å; N900-S906 WeakPolarHBondContact OD1-CB 3.42Å; S906-L908 VanDerWaalsContact C-N 3.28Å; S906-L908 PolarHBondContact O-N 2.92Å; S906-L908 PolarHBondContact OG-N 3.47Å; S906-D909 CarbonylContact O-C 3.45Å; S906-D909 VanDerWaalsContact O-C 3.31Å; S906-D909 PolarHBondContact O-N 2.8Å; S906-D909 PolarHBondContact OG-N 2.66Å; S906-P910 WeakPolarHBondContact O-CA 3.43Å; S906-P910 VanDerWaalsContact O-N 3.14Å
907	P	90.3	Very high	92.5	Very high	127 Å²	127	46.3 Å²	46.3	83%	0.825	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-32.4	173.2	-24.2	35.2	0	0	0	114.2
908	L	91	Very high	92.5	Very high	49 Å²	49	49 Å²	49	26%	0.257	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-4	-179.1	-60.9	-173.8	0	0	0	113.6	E856 N858 F897 S906 R916	E856-L908 WeakPolarHBondContact O-CD2 3.35Å; N858-L908 PolarHBondContact ND2-O 3.49Å; F897-L908 HydrophobicContact CE1-CD1 3.92Å; F897-L908 HydrophobicContact CZ-CD1 4.37Å; S906-L908 VanDerWaalsContact C-N 3.28Å; S906-L908 PolarHBondContact O-N 2.92Å; S906-L908 PolarHBondContact OG-N 3.47Å; L908-R916 PolarHBondContact O-NH2 3.44Å
909	D	94.3	Very high	92.8	Very high	5 Å²	5	47.8 Å²	47.8	3%	0.027	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-149.1	65.8	171.6	-165.1	40.8	0	0	0	113.4	V899 S906 H913 Y950 K954	V899-D909 HydrophobicContact CG2-CB 4.28Å; S906-D909 CarbonylContact O-C 3.45Å; S906-D909 VanDerWaalsContact O-C 3.31Å; S906-D909 PolarHBondContact O-N 2.8Å; S906-D909 PolarHBondContact OG-N 2.66Å; D909-H913 IonicContact OD1-CE1 2.77Å; D909-H913 IonicContact OD1-CG 2.7Å; D909-H913 IonicContact OD1-ND1 2.69Å; D909-H913 PolarHBondContact OD1-ND1 2.93Å; D909-Y950 PolarHBondContact OD1-OH 3.26Å; D909-Y950 PolarHBondContact OD2-OH 3.41Å; D909-K954 PolarHBondContact O-NZ 2.92Å; D909-K954 IonicContact OD1-NZ 3.32Å; D909-K954 PolarHBondContact OD1-NZ 3.11Å; D909-K954 WeakPolarHBondContact OD2-CD 3.32Å; D909-K954 IonicContact OD2-NZ 2.68Å; D909-K954 PolarHBondContact OD2-NZ 3.02Å
910	P	93.1	Very high	93	Very high	50 Å²	50	46.8 Å²	46.8	33%	0.325	27%	0.267	S	S	.	.			trans	-66.4	168.3	-176.8	26	-33.8	0	0	0	113.3	S906 E912 H913 K954	S906-P910 WeakPolarHBondContact O-CA 3.43Å; S906-P910 VanDerWaalsContact O-N 3.14Å; P910-E912 PolarHBondContact O-N 3.29Å; P910-H913 HydrophobicContact CG-CB 3.84Å; P910-H913 VanDerWaalsContact O-CB 3.32Å; P910-H913 WeakPolarHBondContact O-CB 3.44Å; P910-H913 PolarHBondContact O-N 2.95Å; P910-K954 PolarHBondContact O-NZ 3.15Å
911	P	90.8	Very high	93.2	Very high	44 Å²	44	44.3 Å²	44.3	29%	0.286	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47	-60.8	-166.9	-33.7	38.7	0	0	0	115.9	P905 H913 K954 V957 V959	P905-P911 HydrophobicContact CB-CG 3.88Å; P905-P911 HydrophobicContact CG-CG 3.89Å; P911-H913 PolarHBondContact O-N 3.32Å; P911-K954 WeakPolarHBondContact O-CE 3.5Å; P911-V957 HydrophobicContact CB-CG1 3.82Å; P911-V957 HydrophobicContact CG-CG1 4.11Å; P911-V959 HydrophobicContact CB-CB 4.4Å; P911-V959 HydrophobicContact CB-CG1 3.89Å
912	E	91.7	Very high	93.7	Very high	123 Å²	123	39.2 Å²	39.2	58%	0.575	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-5	-176.3	-64.8	171.8	-138.6	0	0	113.6	P910 L914 V959 W960	P910-E912 PolarHBondContact O-N 3.29Å; E912-L914 PolarHBondContact O-N 3.45Å; E912-V959 HydrophobicContact CG-CG1 4.28Å; E912-V959 HydrophobicContact CG-CG2 3.94Å; E912-W960 HydrophobicContact CB-CH2 4.28Å; E912-W960 HydrophobicContact CG-CH2 4.15Å
913	H	93.5	Very high	94.1	Very high	31 Å²	31	34 Å²	34	14%	0.144	19%	0.193	C	C	.	.			trans	-80.4	92.4	-175.4	178.8	-96.3	0	0	0	111.5	N858 D909 P910 P911 F915 K954	N858-H913 PolarHBondContact ND2-CE1 3.43Å; N858-H913 VanDerWaalsContact ND2-CE1 3.34Å; N858-H913 PolarHBondContact ND2-NE2 3.18Å; N858-H913 PolarHBondContact OD1-CE1 2.64Å; N858-H913 PolarHBondContact OD1-NE2 3.44Å; D909-H913 IonicContact OD1-CE1 2.77Å; D909-H913 IonicContact OD1-CG 2.7Å; D909-H913 IonicContact OD1-ND1 2.69Å; D909-H913 PolarHBondContact OD1-ND1 2.93Å; P910-H913 HydrophobicContact CG-CB 3.84Å; P910-H913 VanDerWaalsContact O-CB 3.32Å; P910-H913 WeakPolarHBondContact O-CB 3.44Å; P910-H913 PolarHBondContact O-N 2.95Å; P911-H913 PolarHBondContact O-N 3.32Å; H913-F915 VanDerWaalsContact NE2-CB 3.29Å; H913-F915 WeakPolarHBondContact NE2-CB 3.27Å; H913-K954 WeakPolarHBondContact O-CE 3.3Å; H913-K954 PolarHBondContact O-NZ 3.06Å
914	L	95.1	Very high	94.6	Very high	13 Å²	13	33.2 Å²	33.2	7%	0.068	18%	0.184	C	C	.	.			trans	-94	10.8	-178.5	-56.9	-179.8	0	0	0	114	E912 R916 I917 K954 W960 F966 P967 I970	E912-L914 PolarHBondContact O-N 3.45Å; L914-R916 PolarHBondContact O-N 2.83Å; L914-I917 HydrophobicContact CB-CD1 4.34Å; L914-I917 HydrophobicContact CD2-CD1 4.23Å; L914-I917 WeakPolarHBondContact O-CB 3.29Å; L914-I917 PolarHBondContact O-N 3.4Å; L914-K954 HydrophobicContact CD2-CB 3.85Å; L914-K954 HydrophobicContact CD2-CG 4.34Å; L914-W960 HydrophobicContact CD1-CH2 4.24Å; L914-W960 HydrophobicContact CD1-CZ2 4.12Å; L914-W960 HydrophobicContact CD2-CZ2 4.22Å; L914-W960 HydrophobicContact CG-CZ2 4.33Å; L914-F966 HydrophobicContact CD1-CD2 4.22Å; L914-F966 HydrophobicContact CD1-CE1 4.35Å; L914-F966 HydrophobicContact CD1-CE2 3.6Å; L914-F966 HydrophobicContact CD1-CZ 3.67Å; L914-F966 HydrophobicContact CD2-CE2 3.66Å; L914-F966 HydrophobicContact CD2-CZ 4.08Å; L914-F966 HydrophobicContact CG-CE2 4.3Å; L914-P967 HydrophobicContact CD1-CG 3.89Å; L914-I970 HydrophobicContact CD1-CB 4.48Å; L914-I970 HydrophobicContact CD1-CG1 4.09Å; L914-I970 HydrophobicContact CD1-CG2 4.39Å
915	F	96.1	Very high	94.9	Very high	10 Å²	10	34.5 Å²	34.5	4%	0.044	19%	0.188	C	C	.	.	H	α-helix	trans	-71.5	-25.7	-169.5	-166.2	-101.8	0	0	0	114.4	N863 R866 I867 H913 I917 R918 L919	N863-F915 HydrophobicContact CB-CD2 4.26Å; N863-F915 HydrophobicContact CB-CE2 3.47Å; N863-F915 VanDerWaalsContact CB-CE2 3.47Å; N863-F915 HydrophobicContact CB-CZ 3.66Å; N863-F915 WeakPolarHBondContact O-CZ 3.31Å; R866-F915 HydrophobicContact CB-CE1 3.75Å; R866-F915 HydrophobicContact CB-CZ 4.04Å; R866-F915 HydrophobicContact CG-CE1 4.41Å; R866-F915 VanDerWaalsContact CZ-CE1 3.47Å; R866-F915 VanDerWaalsContact NH1-CD1 3.26Å; I867-F915 HydrophobicContact CD1-CE2 4.18Å; I867-F915 HydrophobicContact CD1-CZ 3.96Å; I867-F915 HydrophobicContact CG1-CE2 4.09Å; I867-F915 HydrophobicContact CG1-CZ 3.75Å; H913-F915 VanDerWaalsContact NE2-CB 3.29Å; H913-F915 WeakPolarHBondContact NE2-CB 3.27Å; F915-I917 PolarHBondContact O-N 2.86Å; F915-R918 HydrophobicContact CD2-CB 4.41Å; F915-R918 WeakPolarHBondContact O-CB 3.48Å; F915-R918 PolarHBondContact O-N 2.91Å; F915-R918 VanDerWaalsContact O-N 3.1Å; F915-L919 HydrophobicContact CD1-CD1 3.73Å; F915-L919 HydrophobicContact CD1-CG 3.89Å; F915-L919 HydrophobicContact CE1-CD1 3.73Å; F915-L919 HydrophobicContact CE1-CD2 3.79Å; F915-L919 HydrophobicContact CE1-CG 3.65Å; F915-L919 HydrophobicContact CZ-CD2 4.34Å; F915-L919 HydrophobicContact CZ-CG 4.45Å; F915-L919 PolarHBondContact O-N 3.35Å; F915-L919 VanDerWaalsContact O-N 3.1Å
916	R	96.2	Very high	95.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.7	-39.3	173.5	-53.8	-61.9	-170	94.9	-0.6	111.5	F894 F897 L908 L914 R918 L919 V920 Y950	F894-R916 WeakPolarHBondContact O-CD 3.41Å; F894-R916 PolarHBondContact O-NH1 3.43Å; F897-R916 VanDerWaalsContact O-CZ 3.29Å; F897-R916 PolarHBondContact O-NH1 3.43Å; F897-R916 PolarHBondContact O-NH2 2.95Å; L908-R916 PolarHBondContact O-NH2 3.44Å; L914-R916 PolarHBondContact O-N 2.83Å; R916-R918 VanDerWaalsContact C-N 3.34Å; R916-R918 PolarHBondContact O-N 2.78Å; R916-L919 PolarHBondContact O-N 2.87Å; R916-V920 WeakPolarHBondContact O-CG2 3.43Å; R916-V920 PolarHBondContact O-N 2.85Å; R916-Y950 HydrophobicContact CB-CE1 4.04Å; R916-Y950 VanDerWaalsContact CB-OH 3.32Å; R916-Y950 WeakPolarHBondContact CB-OH 3.33Å; R916-Y950 VanDerWaalsContact CG-OH 3.27Å; R916-Y950 WeakPolarHBondContact CG-OH 3.47Å
917	I	97.2	Very high	95.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.7	-45.7	177	-53.8	177.9	0	0	0	110	L914 F915 L919 V920 C921 F947 Y950 I951 I970 I974	L914-I917 HydrophobicContact CB-CD1 4.34Å; L914-I917 HydrophobicContact CD2-CD1 4.23Å; L914-I917 WeakPolarHBondContact O-CB 3.29Å; L914-I917 PolarHBondContact O-N 3.4Å; F915-I917 PolarHBondContact O-N 2.86Å; I917-L919 VanDerWaalsContact C-N 3.33Å; I917-L919 PolarHBondContact O-N 2.95Å; I917-V920 PolarHBondContact O-N 3.34Å; I917-C921 PolarHBondContact O-N 3.43Å; I917-F947 HydrophobicContact CB-CE2 4.48Å; I917-F947 HydrophobicContact CG1-CE2 4.47Å; I917-F947 HydrophobicContact CG2-CE2 4.24Å; I917-F947 HydrophobicContact CG2-CZ 3.86Å; I917-Y950 HydrophobicContact CG1-CD1 4.46Å; I917-Y950 HydrophobicContact CG1-CE1 3.83Å; I917-I951 HydrophobicContact CD1-CG1 4.38Å; I917-I970 HydrophobicContact CD1-CG2 3.95Å; I917-I970 HydrophobicContact CG2-CG2 4.08Å; I917-I974 HydrophobicContact CD1-CD1 4.39Å; I917-I974 HydrophobicContact CG2-CD1 3.84Å; I917-I974 HydrophobicContact CG2-CG1 3.61Å
918	R	97.5	Very high	95.6	Very high	108 Å²	108	25.7 Å²	25.7	41%	0.408	13%	0.13	S	C	.	.	H	α-helix	trans	-64.7	-35	179.2	-55.6	-173.1	66.4	170.2	2.6	112.7	I867 F915 R916 T922 I970 M973	I867-R918 HydrophobicContact CD1-CB 4.22Å; F915-R918 HydrophobicContact CD2-CB 4.41Å; F915-R918 WeakPolarHBondContact O-CB 3.48Å; F915-R918 PolarHBondContact O-N 2.91Å; F915-R918 VanDerWaalsContact O-N 3.1Å; R916-R918 VanDerWaalsContact C-N 3.34Å; R916-R918 PolarHBondContact O-N 2.78Å; R918-T922 WeakPolarHBondContact O-CB 3.42Å; R918-T922 PolarHBondContact O-N 3.33Å; R918-T922 PolarHBondContact O-OG1 3.08Å; R918-I970 HydrophobicContact CG-CD1 3.95Å; R918-M973 HydrophobicContact CB-SD 4.27Å; R918-M973 HydrophobicContact CG-CE 4.41Å; R918-M973 HydrophobicContact CG-SD 3.9Å
919	L	97.6	Very high	95.8	Very high	5 Å²	5	28.7 Å²	28.7	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-68.6	-42.8	174.7	-70.2	169.1	0	0	0	111.9	R866 I867 A870 F894 F915 R916 I917 T922 L923	R866-L919 HydrophobicContact CB-CD2 4.12Å; I867-L919 HydrophobicContact CD1-CD2 4.26Å; A870-L919 HydrophobicContact CB-CD2 3.9Å; F894-L919 HydrophobicContact CD1-CB 4Å; F894-L919 HydrophobicContact CD1-CD1 3.99Å; F894-L919 HydrophobicContact CD2-CB 4.13Å; F894-L919 HydrophobicContact CE1-CB 3.82Å; F894-L919 HydrophobicContact CE1-CD1 3.81Å; F894-L919 HydrophobicContact CE1-CG 4.27Å; F894-L919 HydrophobicContact CE2-CB 3.94Å; F894-L919 HydrophobicContact CG-CB 4.17Å; F894-L919 HydrophobicContact CZ-CB 3.79Å; F915-L919 HydrophobicContact CD1-CD1 3.73Å; F915-L919 HydrophobicContact CD1-CG 3.89Å; F915-L919 HydrophobicContact CE1-CD1 3.73Å; F915-L919 HydrophobicContact CE1-CD2 3.79Å; F915-L919 HydrophobicContact CE1-CG 3.65Å; F915-L919 HydrophobicContact CZ-CD2 4.34Å; F915-L919 HydrophobicContact CZ-CG 4.45Å; F915-L919 PolarHBondContact O-N 3.35Å; F915-L919 VanDerWaalsContact O-N 3.1Å; R916-L919 PolarHBondContact O-N 2.87Å; I917-L919 VanDerWaalsContact C-N 3.33Å; I917-L919 PolarHBondContact O-N 2.95Å; L919-T922 PolarHBondContact O-N 2.89Å; L919-L923 PolarHBondContact O-N 3.22Å; L919-L923 VanDerWaalsContact O-N 3.17Å
920	V	98.3	Very high	95.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.7	-53.1	173.5	171.8	0	0	0	0	110.7	L891 F894 I895 R916 I917 T922 L923 L924 F943 F947	L891-V920 HydrophobicContact CD2-CG1 4.13Å; F894-V920 HydrophobicContact CB-CG2 3.71Å; F894-V920 HydrophobicContact CD2-CG2 3.82Å; F894-V920 HydrophobicContact CG-CG2 4.18Å; I895-V920 HydrophobicContact CG2-CG2 4.12Å; R916-V920 WeakPolarHBondContact O-CG2 3.43Å; R916-V920 PolarHBondContact O-N 2.85Å; I917-V920 PolarHBondContact O-N 3.34Å; V920-T922 PolarHBondContact O-N 3.42Å; V920-L923 PolarHBondContact O-N 2.65Å; V920-L924 HydrophobicContact CG1-CD1 3.7Å; V920-L924 HydrophobicContact CG1-CG 4.17Å; V920-L924 WeakPolarHBondContact O-CB 3.35Å; V920-L924 VanDerWaalsContact O-CG 3.31Å; V920-L924 WeakPolarHBondContact O-CG 3.47Å; V920-L924 PolarHBondContact O-N 3.2Å; V920-F943 HydrophobicContact CG1-CE1 3.68Å; V920-F943 HydrophobicContact CG1-CZ 3.75Å; V920-F943 HydrophobicContact CG2-CZ 4.09Å; V920-F947 HydrophobicContact CB-CD2 4.44Å; V920-F947 HydrophobicContact CB-CE1 4.33Å; V920-F947 HydrophobicContact CB-CE2 3.81Å; V920-F947 HydrophobicContact CB-CZ 3.74Å; V920-F947 HydrophobicContact CG1-CD1 3.85Å; V920-F947 HydrophobicContact CG1-CD2 4.03Å; V920-F947 HydrophobicContact CG1-CE1 3.51Å; V920-F947 HydrophobicContact CG1-CE2 3.71Å; V920-F947 HydrophobicContact CG1-CG 4.09Å; V920-F947 HydrophobicContact CG1-CZ 3.43Å; V920-F947 VanDerWaalsContact CG1-CZ 3.43Å; V920-F947 HydrophobicContact CG2-CD2 4.32Å; V920-F947 HydrophobicContact CG2-CE2 3.99Å; V920-F947 HydrophobicContact CG2-CZ 4.43Å
921	C	97.8	Very high	95.9	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.007	15%	0.15	C	C	.	.	H	α-helix	trans	-57.2	-48	177.4	-70.5	0	0	0	0	111.9	I917 L923 L924 D925 M973 T977	I917-C921 PolarHBondContact O-N 3.43Å; C921-L923 VanDerWaalsContact C-N 3.29Å; C921-L923 PolarHBondContact O-N 2.87Å; C921-L924 CarbonylContact O-C 3.6Å; C921-L924 PolarHBondContact O-N 3Å; C921-L924 VanDerWaalsContact O-N 3.12Å; C921-D925 WeakPolarHBondContact O-CB 3.33Å; C921-D925 PolarHBondContact O-N 3.42Å; C921-M973 HydrophobicContact CB-CG 4.05Å; C921-M973 HydrophobicContact CB-SD 4.23Å; C921-T977 HydrophobicContact CB-CG2 4.48Å; C921-T977 PolarHBondContact SG-OG1 2.88Å
922	T	97.9	Very high	95.9	Very high	16 Å²	16	33.6 Å²	33.6	10%	0.098	16%	0.155	C	C	.	.	H	α-helix	trans	-54.5	-42.2	178.9	-60.7	0	0	0	0	113.3	I867 A870 K871 R918 L919 V920 T926	I867-T922 VanDerWaalsContact CD1-OG1 3.3Å; I867-T922 WeakPolarHBondContact CD1-OG1 3.45Å; I867-T922 HydrophobicContact CG2-CG2 4.06Å; A870-T922 HydrophobicContact CB-CG2 4.35Å; K871-T922 HydrophobicContact CB-CG2 4.05Å; R918-T922 WeakPolarHBondContact O-CB 3.42Å; R918-T922 PolarHBondContact O-N 3.33Å; R918-T922 PolarHBondContact O-OG1 3.08Å; L919-T922 PolarHBondContact O-N 2.89Å; V920-T922 PolarHBondContact O-N 3.42Å; T922-T926 WeakPolarHBondContact O-CB 3.27Å; T922-T926 PolarHBondContact O-N 2.95Å; T922-T926 PolarHBondContact O-OG1 2.89Å
923	L	97.7	Very high	95.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-74.4	-41.3	179.7	-175.5	53.7	0	0	0	111.2	L873 V887 T890 L891 F894 L919 V920 C921 T926 C927	L873-L923 HydrophobicContact CD2-CD2 4.44Å; V887-L923 HydrophobicContact CG1-CD1 4.21Å; V887-L923 HydrophobicContact CG1-CD2 4.12Å; V887-L923 HydrophobicContact CG1-CG 4.09Å; T890-L923 HydrophobicContact CG2-CD2 4.39Å; L891-L923 HydrophobicContact CD2-CB 4.23Å; L891-L923 HydrophobicContact CD2-CD2 3.85Å; L891-L923 HydrophobicContact CD2-CG 4.16Å; L891-L923 HydrophobicContact CG-CD2 3.86Å; L891-L923 HydrophobicContact CG-CG 4.42Å; F894-L923 HydrophobicContact CE2-CD2 3.92Å; L919-L923 PolarHBondContact O-N 3.22Å; L919-L923 VanDerWaalsContact O-N 3.17Å; V920-L923 PolarHBondContact O-N 2.65Å; C921-L923 VanDerWaalsContact C-N 3.29Å; C921-L923 PolarHBondContact O-N 2.87Å; L923-T926 PolarHBondContact O-N 3.22Å; L923-C927 PolarHBondContact O-N 3.4Å; L923-C927 VanDerWaalsContact O-N 3.11Å; L923-C927 PolarHBondContact O-SG 2.94Å
924	L	97.4	Very high	95.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.3	-44.3	176.2	-75.6	-174.9	0	0	0	113.2	L891 V920 C921 T926 G928 L940 F943 L944 T977 L981	L891-L924 HydrophobicContact CD1-CD2 3.95Å; L891-L924 HydrophobicContact CD2-CD2 4.17Å; L891-L924 HydrophobicContact CD2-CG 4.12Å; V920-L924 HydrophobicContact CG1-CD1 3.7Å; V920-L924 HydrophobicContact CG1-CG 4.17Å; V920-L924 WeakPolarHBondContact O-CB 3.35Å; V920-L924 VanDerWaalsContact O-CG 3.31Å; V920-L924 WeakPolarHBondContact O-CG 3.47Å; V920-L924 PolarHBondContact O-N 3.2Å; C921-L924 CarbonylContact O-C 3.6Å; C921-L924 PolarHBondContact O-N 3Å; C921-L924 VanDerWaalsContact O-N 3.12Å; L924-T926 PolarHBondContact O-N 2.84Å; L924-G928 WeakPolarHBondContact O-CA 3.46Å; L924-G928 PolarHBondContact O-N 3.39Å; L924-L940 HydrophobicContact CD2-CD1 3.59Å; L924-F943 HydrophobicContact CD1-CE1 4.33Å; L924-L944 HydrophobicContact CD1-CD2 4.01Å; L924-T977 HydrophobicContact CB-CG2 3.74Å; L924-T977 HydrophobicContact CD1-CG2 3.93Å; L924-L981 HydrophobicContact CB-CD1 3.82Å; L924-L981 HydrophobicContact CD1-CD1 4.28Å; L924-L981 HydrophobicContact CD2-CD1 4.07Å; L924-L981 HydrophobicContact CG-CD1 4.28Å
925	D	96.6	Very high	95.6	Very high	71 Å²	71	41.3 Å²	41.3	38%	0.38	21%	0.208	S	C	.	.	H	α-helix	trans	-64.7	-22.1	176.2	-61.1	-25.4	0	0	0	112	C921 T977	C921-D925 WeakPolarHBondContact O-CB 3.33Å; C921-D925 PolarHBondContact O-N 3.42Å; D925-T977 WeakPolarHBondContact OD1-CB 3.35Å; D925-T977 WeakPolarHBondContact OD1-CG2 3.31Å; D925-T977 PolarHBondContact OD1-OG1 3.33Å
926	T	96.9	Very high	95.3	Very high	13 Å²	13	41.9 Å²	41.9	8%	0.08	21%	0.213	C	C	.	.	H	α-helix	trans	-89	-39	-177.5	-64.3	0	0	0	0	113.9	K871 G874 E875 N878 T922 L923 L924	K871-T926 HydrophobicContact CD-CG2 3.88Å; K871-T926 WeakPolarHBondContact CD-OG1 3.35Å; K871-T926 VanDerWaalsContact NZ-CG2 3.33Å; K871-T926 PolarHBondContact NZ-OG1 3.35Å; G874-T926 VanDerWaalsContact C-CG2 3.45Å; E875-T926 HydrophobicContact CG-CG2 4.14Å; N878-T926 PolarHBondContact ND2-O 3.43Å; T922-T926 WeakPolarHBondContact O-CB 3.27Å; T922-T926 PolarHBondContact O-N 2.95Å; T922-T926 PolarHBondContact O-OG1 2.89Å; L923-T926 PolarHBondContact O-N 3.22Å; L924-T926 PolarHBondContact O-N 2.84Å
927	C	96.5	Very high	95.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-136.4	-10.3	-173.5	64.2	0	0	0	0	114.9	Y877 N878 L923 Q929 Y930	Y877-C927 HydrophobicContact CD1-CB 3.63Å; Y877-C927 HydrophobicContact CE1-CB 4.24Å; Y877-C927 HydrophobicContact CG-CB 4.44Å; N878-C927 WeakPolarHBondContact OD1-CB 3.33Å; L923-C927 PolarHBondContact O-N 3.4Å; L923-C927 VanDerWaalsContact O-N 3.11Å; L923-C927 PolarHBondContact O-SG 2.94Å; C927-Q929 PolarHBondContact O-N 2.93Å; C927-Q929 VanDerWaalsContact O-N 3.16Å; C927-Y930 HydrophobicContact CB-CD2 4.42Å; C927-Y930 WeakPolarHBondContact O-CD2 3.39Å; C927-Y930 PolarHBondContact O-N 3.5Å
928	G	94.6	Very high	94.9	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-62.6	-24.5	-176.8	0	0	0	0	0	114.4	L924 Y930 F931 L981	L924-G928 WeakPolarHBondContact O-CA 3.46Å; L924-G928 PolarHBondContact O-N 3.39Å; G928-Y930 PolarHBondContact O-N 2.8Å; G928-F931 WeakPolarHBondContact O-CB 3.43Å; G928-F931 PolarHBondContact O-N 2.92Å; G928-L981 VanDerWaalsContact C-CD2 3.4Å
929	Q	94.4	Very high	94.8	Very high	113 Å²	113	52.4 Å²	52.4	53%	0.528	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-62.6	-26.4	175.4	-63.1	-176.5	10.1	0	0	112.6	C927 F931 L981	C927-Q929 PolarHBondContact O-N 2.93Å; C927-Q929 VanDerWaalsContact O-N 3.16Å; Q929-F931 PolarHBondContact O-N 3.3Å; Q929-L981 HydrophobicContact CB-CD2 4.48Å; Q929-L981 HydrophobicContact CG-CD2 3.83Å
930	Y	94.4	Very high	94.7	Very high	132 Å²	132	52.2 Å²	52.2	52%	0.518	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-82.2	1.8	175.3	-53.3	-69.7	0	0	0	113.4	Y877 N878 C927 G928	Y877-Y930 HydrophobicContact CE1-CD2 4.05Å; Y877-Y930 HydrophobicContact CE1-CG 4.31Å; N878-Y930 WeakPolarHBondContact OD1-CD2 3.18Å; N878-Y930 WeakPolarHBondContact OD1-CE2 3.36Å; C927-Y930 HydrophobicContact CB-CD2 4.42Å; C927-Y930 WeakPolarHBondContact O-CD2 3.39Å; C927-Y930 PolarHBondContact O-N 3.5Å; G928-Y930 PolarHBondContact O-N 2.8Å
931	F	95.6	Very high	94.4	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.27	C	S	.	.			trans	-104.6	42.6	174.4	-50.8	-34	0	0	0	110.9	Y877 V887 F888 G928 Q929 K937 L940 R982	Y877-F931 AromaticContact CE1-CE1 3.96Å; Y877-F931 HydrophobicContact CE1-CE1 3.96Å; Y877-F931 HydrophobicContact CE1-CZ 4.3Å; Y877-F931 HydrophobicContact CE2-CE1 4.04Å; Y877-F931 HydrophobicContact CE2-CZ 4.48Å; Y877-F931 AromaticContact CZ-CE1 3.57Å; Y877-F931 WeakPolarHBondContact OH-CE1 3.36Å; V887-F931 HydrophobicContact CB-CZ 4.2Å; V887-F931 HydrophobicContact CG1-CE2 3.95Å; V887-F931 HydrophobicContact CG1-CZ 3.9Å; F888-F931 HydrophobicContact CE1-CD2 4.22Å; F888-F931 HydrophobicContact CE1-CE2 4.36Å; F888-F931 HydrophobicContact CE2-CD1 4.45Å; F888-F931 HydrophobicContact CE2-CE1 4.36Å; F888-F931 HydrophobicContact CE2-CE2 4.46Å; F888-F931 HydrophobicContact CE2-CZ 4.39Å; F888-F931 HydrophobicContact CZ-CD1 4.29Å; F888-F931 AromaticContact CZ-CD2 3.74Å; F888-F931 HydrophobicContact CZ-CD2 3.74Å; F888-F931 HydrophobicContact CZ-CE1 4.47Å; F888-F931 AromaticContact CZ-CE2 3.98Å; F888-F931 HydrophobicContact CZ-CE2 3.98Å; F888-F931 AromaticContact CZ-CG 3.93Å; F888-F931 HydrophobicContact CZ-CG 3.93Å; F888-F931 HydrophobicContact CZ-CZ 4.35Å; G928-F931 WeakPolarHBondContact O-CB 3.43Å; G928-F931 PolarHBondContact O-N 2.92Å; Q929-F931 PolarHBondContact O-N 3.3Å; F931-K937 WeakPolarHBondContact O-CA 3.37Å; F931-L940 HydrophobicContact CB-CB 4.01Å; F931-L940 HydrophobicContact CB-CD2 3.77Å; F931-L940 HydrophobicContact CD2-CB 4.5Å; F931-L940 HydrophobicContact CD2-CD2 4.26Å; F931-R982 PolarHBondContact O-NH1 3.05Å; F931-R982 PolarHBondContact O-NH2 2.87Å
932	D	91.8	Very high	94.3	Very high	70 Å²	70	56 Å²	56	37%	0.374	28%	0.284	S	S	.	.	S	Bend	trans	-88.8	-24.4	179	77.9	-34	0	0	0	113.6	K937	D932-K937 VanDerWaalsContact O-CD 3.3Å; D932-K937 WeakPolarHBondContact O-CD 3.48Å; D932-K937 WeakPolarHBondContact O-CG 3.28Å
933	R	89.9	Confident	94.2	Very high	183 Å²	183	55.2 Å²	55.2	69%	0.691	28%	0.279	S	S	*	.	S	Bend	trans	-124.4	166.7	-171.7	-72.4	162.9	-144.9	-143.5	-1	114.5	S936 K937	R933-S936 PolarHBondContact O-OG 3.18Å; R933-S936 VanDerWaalsContact O-OG 3.07Å; R933-K937 VanDerWaalsContact O-CB 3.32Å; R933-K937 WeakPolarHBondContact O-CB 3.41Å; R933-K937 PolarHBondContact O-N 2.94Å
934	G	92.1	Very high	94.1	Very high	59 Å²	59	55.2 Å²	55.2	61%	0.608	28%	0.279	S	S	*	.	H	α-helix	trans	58.8	-140.6	165.8	0	0	0	0	0	115.2
935	S	90.5	Very high	94	Very high	86 Å²	86	56.7 Å²	56.7	60%	0.601	29%	0.286	S	S	*	.	H	α-helix	trans	-75.1	-33.6	-179.9	56.3	0	0	0	0	113	K937 K938 K939	S935-K937 VanDerWaalsContact C-N 3.35Å; S935-K938 PolarHBondContact O-N 3.2Å; S935-K939 WeakPolarHBondContact O-CG 3.41Å; S935-K939 PolarHBondContact O-N 3.43Å
936	S	91.2	Very high	94	Very high	22 Å²	22	55.8 Å²	55.8	15%	0.154	28%	0.278	C	S	.	.	H	α-helix	trans	-65.7	-36.8	176.6	58.2	0	0	0	0	111.9	R933 K938 K939 L940	R933-S936 PolarHBondContact O-OG 3.18Å; R933-S936 VanDerWaalsContact O-OG 3.07Å; S936-K938 PolarHBondContact O-N 2.93Å; S936-K939 PolarHBondContact O-N 3.04Å; S936-L940 PolarHBondContact O-N 3.43Å
937	K	93.8	Very high	94	Very high	79 Å²	79	55.2 Å²	55.2	34%	0.343	27%	0.274	S	S	.	.	H	α-helix	trans	-53.8	-52.9	168.9	-170.1	-161.5	-176.9	-69.3	0	111.7	F931 D932 R933 S935 K939 L940 D941 R982	F931-K937 WeakPolarHBondContact O-CA 3.37Å; D932-K937 VanDerWaalsContact O-CD 3.3Å; D932-K937 WeakPolarHBondContact O-CD 3.48Å; D932-K937 WeakPolarHBondContact O-CG 3.28Å; R933-K937 VanDerWaalsContact O-CB 3.32Å; R933-K937 WeakPolarHBondContact O-CB 3.41Å; R933-K937 PolarHBondContact O-N 2.94Å; S935-K937 VanDerWaalsContact C-N 3.35Å; K937-K939 VanDerWaalsContact C-N 3.34Å; K937-K939 PolarHBondContact O-N 3.17Å; K937-L940 PolarHBondContact O-N 3.35Å; K937-D941 IonicContact NZ-OD1 2.71Å; K937-D941 IonicContact NZ-OD2 3.45Å; K937-D941 PolarHBondContact NZ-OD2 3.18Å; K937-D941 WeakPolarHBondContact O-CB 3.25Å; K937-D941 PolarHBondContact O-N 2.9Å; K937-D941 VanDerWaalsContact O-OD1 3.13Å; K937-R982 PolarHBondContact O-NH2 2.83Å
938	K	91.6	Very high	93.9	Very high	152 Å²	152	55.5 Å²	55.5	66%	0.661	28%	0.276	S	S	*	.	H	α-helix	trans	-60.1	-43.2	179.8	-67.2	-176.7	178.4	-178.5	0	111.4	S935 S936 D941 C942	S935-K938 PolarHBondContact O-N 3.2Å; S936-K938 PolarHBondContact O-N 2.93Å; K938-D941 PolarHBondContact O-N 3.03Å; K938-C942 PolarHBondContact O-N 3.28Å; K938-C942 PolarHBondContact O-SG 2.95Å
939	K	93.7	Very high	94	Very high	99 Å²	99	57.6 Å²	57.6	43%	0.43	28%	0.284	S	S	.	.	H	α-helix	trans	-60.8	-43.8	176.3	-71.8	-179.9	179.2	-176.9	0	112.2	F888 S935 S936 K937 C942 F943	F888-K939 HydrophobicContact CD1-CB 4.2Å; F888-K939 HydrophobicContact CD2-CB 3.92Å; F888-K939 HydrophobicContact CD2-CD 3.8Å; F888-K939 HydrophobicContact CD2-CG 4.48Å; F888-K939 HydrophobicContact CE1-CB 3.89Å; F888-K939 HydrophobicContact CE2-CB 3.58Å; F888-K939 HydrophobicContact CE2-CD 3.94Å; F888-K939 HydrophobicContact CE2-CG 4.39Å; F888-K939 HydrophobicContact CG-CB 4.24Å; F888-K939 HydrophobicContact CZ-CB 3.57Å; S935-K939 WeakPolarHBondContact O-CG 3.41Å; S935-K939 PolarHBondContact O-N 3.43Å; S936-K939 PolarHBondContact O-N 3.04Å; K937-K939 VanDerWaalsContact C-N 3.34Å; K937-K939 PolarHBondContact O-N 3.17Å; K939-C942 PolarHBondContact O-N 2.86Å; K939-F943 WeakPolarHBondContact O-CB 3.35Å; K939-F943 PolarHBondContact O-N 3.4Å
940	L	95.3	Very high	94.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.9	-43.6	175.6	178.7	59.9	0	0	0	112	F888 L924 F931 S936 K937 C942 F943 L944 L981	F888-L940 HydrophobicContact CE1-CB 3.98Å; F888-L940 HydrophobicContact CZ-CB 4.08Å; L924-L940 HydrophobicContact CD2-CD1 3.59Å; F931-L940 HydrophobicContact CB-CB 4.01Å; F931-L940 HydrophobicContact CB-CD2 3.77Å; F931-L940 HydrophobicContact CD2-CB 4.5Å; F931-L940 HydrophobicContact CD2-CD2 4.26Å; S936-L940 PolarHBondContact O-N 3.43Å; K937-L940 PolarHBondContact O-N 3.35Å; L940-C942 VanDerWaalsContact C-N 3.28Å; L940-C942 PolarHBondContact O-N 3.19Å; L940-F943 HydrophobicContact CD1-CD1 4.24Å; L940-F943 PolarHBondContact O-N 2.88Å; L940-L944 HydrophobicContact CD1-CD1 4.08Å; L940-L944 HydrophobicContact CD1-CD2 4.27Å; L940-L944 HydrophobicContact CD1-CG 3.85Å; L940-L944 HydrophobicContact CG-CD1 3.98Å; L940-L944 HydrophobicContact CG-CG 4.22Å; L940-L944 WeakPolarHBondContact O-CG 3.35Å; L940-L944 PolarHBondContact O-N 3.39Å; L940-L981 HydrophobicContact CD2-CD1 4.29Å
941	D	93.8	Very high	94.1	Very high	37 Å²	37	46.4 Å²	46.4	20%	0.198	24%	0.236	C	C	.	.	H	α-helix	trans	-58.7	-41.4	178	-61.8	-12.2	0	0	0	111.1	K937 K938 I945 R982	K937-D941 IonicContact NZ-OD1 2.71Å; K937-D941 IonicContact NZ-OD2 3.45Å; K937-D941 PolarHBondContact NZ-OD2 3.18Å; K937-D941 WeakPolarHBondContact O-CB 3.25Å; K937-D941 PolarHBondContact O-N 2.9Å; K937-D941 VanDerWaalsContact O-OD1 3.13Å; K938-D941 PolarHBondContact O-N 3.03Å; D941-I945 WeakPolarHBondContact O-CG1 3.39Å; D941-I945 PolarHBondContact O-N 3.14Å; D941-R982 IonicContact OD1-CZ 3.29Å; D941-R982 VanDerWaalsContact OD1-CZ 3.22Å; D941-R982 IonicContact OD1-NE 3.01Å; D941-R982 PolarHBondContact OD1-NE 2.81Å; D941-R982 IonicContact OD1-NH2 3.37Å; D941-R982 PolarHBondContact OD1-NH2 3.21Å
942	C	94.1	Very high	94.1	Very high	43 Å²	43	49 Å²	49	29%	0.291	25%	0.246	S	C	.	.	H	α-helix	trans	-65.5	-47.2	174	-62.5	0	0	0	0	112	K938 K939 L940 L944 I945 Y946 L1001	K938-C942 PolarHBondContact O-N 3.28Å; K938-C942 PolarHBondContact O-SG 2.95Å; K939-C942 PolarHBondContact O-N 2.86Å; L940-C942 VanDerWaalsContact C-N 3.28Å; L940-C942 PolarHBondContact O-N 3.19Å; C942-L944 VanDerWaalsContact C-N 3.32Å; C942-L944 PolarHBondContact O-N 3.41Å; C942-I945 PolarHBondContact O-N 3.14Å; C942-Y946 WeakPolarHBondContact O-CD2 3.45Å; C942-Y946 PolarHBondContact O-N 3.18Å; C942-L1001 HydrophobicContact CB-CD2 4.09Å
943	F	96.8	Very high	94.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59	-41.5	178.2	172.2	-99.8	0	0	0	112.3	L891 F892 I895 V920 L924 K939 L940 I945 Y946 F947	L891-F943 VanDerWaalsContact C-CE2 3.42Å; L891-F943 HydrophobicContact CB-CD1 4.5Å; L891-F943 HydrophobicContact CB-CD2 4.06Å; L891-F943 HydrophobicContact CB-CE1 4.2Å; L891-F943 HydrophobicContact CB-CE2 3.73Å; L891-F943 HydrophobicContact CB-CG 4.44Å; L891-F943 HydrophobicContact CB-CZ 3.81Å; L891-F943 HydrophobicContact CD1-CD1 4.36Å; L891-F943 HydrophobicContact CD1-CE1 4.41Å; L891-F943 HydrophobicContact CD2-CE1 4.01Å; L891-F943 HydrophobicContact CD2-CZ 4.06Å; L891-F943 HydrophobicContact CG-CE1 4.45Å; L891-F943 HydrophobicContact CG-CZ 4.44Å; L891-F943 VanDerWaalsContact O-CE2 3.25Å; L891-F943 WeakPolarHBondContact O-CE2 3.3Å; F892-F943 AromaticContact CD1-CD2 3.99Å; F892-F943 HydrophobicContact CD1-CD2 3.99Å; F892-F943 HydrophobicContact CD1-CE2 4.48Å; F892-F943 HydrophobicContact CD2-CD2 4.13Å; F892-F943 AromaticContact CE1-CD2 3.93Å; F892-F943 HydrophobicContact CE1-CD2 3.93Å; F892-F943 HydrophobicContact CE2-CB 4.13Å; F892-F943 HydrophobicContact CE2-CD2 4.05Å; F892-F943 HydrophobicContact CG-CD2 4.09Å; F892-F943 HydrophobicContact CZ-CB 3.96Å; F892-F943 AromaticContact CZ-CD2 3.95Å; F892-F943 HydrophobicContact CZ-CD2 3.95Å; F892-F943 HydrophobicContact CZ-CG 4.48Å; I895-F943 HydrophobicContact CD1-CD2 4.16Å; I895-F943 HydrophobicContact CD1-CE2 3.58Å; I895-F943 HydrophobicContact CD1-CZ 4.37Å; I895-F943 HydrophobicContact CG1-CE2 4.05Å; V920-F943 HydrophobicContact CG1-CE1 3.68Å; V920-F943 HydrophobicContact CG1-CZ 3.75Å; V920-F943 HydrophobicContact CG2-CZ 4.09Å; L924-F943 HydrophobicContact CD1-CE1 4.33Å; K939-F943 WeakPolarHBondContact O-CB 3.35Å; K939-F943 PolarHBondContact O-N 3.4Å; L940-F943 HydrophobicContact CD1-CD1 4.24Å; L940-F943 PolarHBondContact O-N 2.88Å; F943-I945 PolarHBondContact O-N 3.42Å; F943-Y946 PolarHBondContact O-N 3.29Å; F943-F947 HydrophobicContact CE1-CB 4Å; F943-F947 HydrophobicContact CE1-CD1 4.44Å; F943-F947 HydrophobicContact CE1-CG 4.26Å; F943-F947 HydrophobicContact CZ-CB 4.01Å; F943-F947 HydrophobicContact CZ-CG 4.29Å; F943-F947 WeakPolarHBondContact O-CB 3.44Å; F943-F947 PolarHBondContact O-N 3.5Å
944	L	96.1	Very high	94.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66	-23.5	179.4	-70.5	176.1	0	0	0	113.4	L924 L940 C942 F947 Q948 L978 R982 M985	L924-L944 HydrophobicContact CD1-CD2 4.01Å; L940-L944 HydrophobicContact CD1-CD1 4.08Å; L940-L944 HydrophobicContact CD1-CD2 4.27Å; L940-L944 HydrophobicContact CD1-CG 3.85Å; L940-L944 HydrophobicContact CG-CD1 3.98Å; L940-L944 HydrophobicContact CG-CG 4.22Å; L940-L944 WeakPolarHBondContact O-CG 3.35Å; L940-L944 PolarHBondContact O-N 3.39Å; C942-L944 VanDerWaalsContact C-N 3.32Å; C942-L944 PolarHBondContact O-N 3.41Å; L944-F947 HydrophobicContact CD2-CD1 4.22Å; L944-Q948 VanDerWaalsContact O-CG 3.3Å; L944-Q948 WeakPolarHBondContact O-CG 3.46Å; L944-Q948 PolarHBondContact O-N 3.46Å; L944-Q948 VanDerWaalsContact O-N 3.17Å; L944-Q948 PolarHBondContact O-NE2 2.93Å; L944-L978 HydrophobicContact CD2-CD1 4.01Å; L944-L978 HydrophobicContact CD2-CG 4.09Å; L944-R982 HydrophobicContact CD1-CG 3.94Å; L944-M985 HydrophobicContact CB-CE 3.78Å; L944-M985 HydrophobicContact CB-SD 3.85Å; L944-M985 HydrophobicContact CD1-SD 3.93Å
945	I	95.1	Very high	94.5	Very high	31 Å²	31	38.8 Å²	38.8	16%	0.159	19%	0.186	C	C	.	.	H	α-helix	trans	-72.7	-46.8	172.1	-67.4	163.6	0	0	0	110.1	D941 C942 F943 Q948 R949 M985 Q997 V998 L1001	D941-I945 WeakPolarHBondContact O-CG1 3.39Å; D941-I945 PolarHBondContact O-N 3.14Å; C942-I945 PolarHBondContact O-N 3.14Å; F943-I945 PolarHBondContact O-N 3.42Å; I945-Q948 PolarHBondContact O-N 2.88Å; I945-R949 PolarHBondContact O-N 3.45Å; I945-M985 HydrophobicContact CG1-CE 3.78Å; I945-Q997 HydrophobicContact CG2-CB 3.99Å; I945-V998 HydrophobicContact CG2-CB 4.38Å; I945-V998 HydrophobicContact CG2-CG2 3.7Å; I945-L1001 HydrophobicContact CB-CD2 4.13Å; I945-L1001 HydrophobicContact CD1-CD2 4.12Å; I945-L1001 HydrophobicContact CG2-CD2 4.09Å
946	Y	96.2	Very high	94.6	Very high	53 Å²	53	37.6 Å²	37.6	21%	0.208	18%	0.178	C	C	.	.	H	α-helix	trans	-62.9	-41.5	173.7	-79.5	-76.9	0	0	0	113.2	F892 C942 F943 Q948 R949 Y950 V998 L1001 E1002	F892-Y946 AromaticContact CE1-CD2 3.84Å; F892-Y946 HydrophobicContact CE1-CD2 3.84Å; F892-Y946 HydrophobicContact CE1-CE2 4.5Å; F892-Y946 HydrophobicContact CE1-CG 4.1Å; F892-Y946 HydrophobicContact CZ-CD2 4.29Å; C942-Y946 WeakPolarHBondContact O-CD2 3.45Å; C942-Y946 PolarHBondContact O-N 3.18Å; F943-Y946 PolarHBondContact O-N 3.29Å; Y946-Q948 VanDerWaalsContact C-N 3.32Å; Y946-Q948 PolarHBondContact O-N 2.57Å; Y946-R949 PolarHBondContact O-N 3.01Å; Y946-Y950 PolarHBondContact O-N 3.32Å; Y946-V998 HydrophobicContact CD1-CG1 3.84Å; Y946-V998 HydrophobicContact CD1-CG2 4.26Å; Y946-V998 HydrophobicContact CE1-CG1 3.35Å; Y946-L1001 HydrophobicContact CD2-CD2 4.15Å; Y946-L1001 HydrophobicContact CE2-CD2 3.77Å; Y946-E1002 VanDerWaalsContact CE1-OE1 3.27Å; Y946-E1002 WeakPolarHBondContact CE1-OE1 3.16Å; Y946-E1002 WeakPolarHBondContact OH-CG 3.29Å; Y946-E1002 PolarHBondContact OH-OE1 3.4Å
947	F	97.1	Very high	94.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.4	-37.5	177.7	-179	-138.9	0	0	0	111.9	I895 I917 V920 F943 L944 Y950 I951 L978	I895-F947 HydrophobicContact CG2-CD2 3.93Å; I917-F947 HydrophobicContact CB-CE2 4.48Å; I917-F947 HydrophobicContact CG1-CE2 4.47Å; I917-F947 HydrophobicContact CG2-CE2 4.24Å; I917-F947 HydrophobicContact CG2-CZ 3.86Å; V920-F947 HydrophobicContact CB-CD2 4.44Å; V920-F947 HydrophobicContact CB-CE1 4.33Å; V920-F947 HydrophobicContact CB-CE2 3.81Å; V920-F947 HydrophobicContact CB-CZ 3.74Å; V920-F947 HydrophobicContact CG1-CD1 3.85Å; V920-F947 HydrophobicContact CG1-CD2 4.03Å; V920-F947 HydrophobicContact CG1-CE1 3.51Å; V920-F947 HydrophobicContact CG1-CE2 3.71Å; V920-F947 HydrophobicContact CG1-CG 4.09Å; V920-F947 HydrophobicContact CG1-CZ 3.43Å; V920-F947 VanDerWaalsContact CG1-CZ 3.43Å; V920-F947 HydrophobicContact CG2-CD2 4.32Å; V920-F947 HydrophobicContact CG2-CE2 3.99Å; V920-F947 HydrophobicContact CG2-CZ 4.43Å; F943-F947 HydrophobicContact CE1-CB 4Å; F943-F947 HydrophobicContact CE1-CD1 4.44Å; F943-F947 HydrophobicContact CE1-CG 4.26Å; F943-F947 HydrophobicContact CZ-CB 4.01Å; F943-F947 HydrophobicContact CZ-CG 4.29Å; F943-F947 WeakPolarHBondContact O-CB 3.44Å; F943-F947 PolarHBondContact O-N 3.5Å; L944-F947 HydrophobicContact CD2-CD1 4.22Å; F947-Y950 HydrophobicContact CD2-CD1 4.28Å; F947-Y950 HydrophobicContact CE2-CD1 4.4Å; F947-Y950 PolarHBondContact O-N 3.29Å; F947-I951 HydrophobicContact CD1-CD1 3.92Å; F947-I951 HydrophobicContact CD2-CD1 4.04Å; F947-I951 HydrophobicContact CD2-CG1 4.18Å; F947-I951 HydrophobicContact CE1-CD1 3.77Å; F947-I951 HydrophobicContact CE2-CD1 3.89Å; F947-I951 HydrophobicContact CE2-CG1 3.96Å; F947-I951 HydrophobicContact CG-CD1 4.06Å; F947-I951 HydrophobicContact CZ-CD1 3.77Å; F947-I951 HydrophobicContact CZ-CG1 4.24Å; F947-I951 WeakPolarHBondContact O-CD1 3.42Å; F947-I951 WeakPolarHBondContact O-CG1 3.49Å; F947-I951 PolarHBondContact O-N 2.96Å; F947-L978 HydrophobicContact CD1-CD1 4.26Å; F947-L978 HydrophobicContact CE1-CD1 4.02Å
948	Q	94.8	Very high	94.3	Very high	7 Å²	7	41.4 Å²	41.4	3%	0.033	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-38.7	172.7	-79.3	-179.4	77.7	0	0	113	L944 I945 Y946 Y950 I951 W952 L978 S988	L944-Q948 VanDerWaalsContact O-CG 3.3Å; L944-Q948 WeakPolarHBondContact O-CG 3.46Å; L944-Q948 PolarHBondContact O-N 3.46Å; L944-Q948 VanDerWaalsContact O-N 3.17Å; L944-Q948 PolarHBondContact O-NE2 2.93Å; I945-Q948 PolarHBondContact O-N 2.88Å; Y946-Q948 VanDerWaalsContact C-N 3.32Å; Y946-Q948 PolarHBondContact O-N 2.57Å; Q948-Y950 VanDerWaalsContact C-N 3.35Å; Q948-I951 PolarHBondContact O-N 3.31Å; Q948-W952 PolarHBondContact O-N 3.03Å; Q948-L978 HydrophobicContact CG-CD2 4.25Å; Q948-S988 PolarHBondContact OE1-OG 3.43Å
949	R	95.3	Very high	94.4	Very high	43 Å²	43	36.1 Å²	36.1	16%	0.162	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-44.1	172	-173.5	175.7	74.1	-168.4	-2	111	I945 Y946 W952 W953 A994 V998 E1002	I945-R949 PolarHBondContact O-N 3.45Å; Y946-R949 PolarHBondContact O-N 3.01Å; R949-W952 PolarHBondContact O-N 3.45Å; R949-W953 HydrophobicContact CG-CD2 4.14Å; R949-W953 HydrophobicContact CG-CH2 4.48Å; R949-W953 HydrophobicContact CG-CZ2 4.01Å; R949-W953 VanDerWaalsContact NE-CZ2 3.32Å; R949-W953 PolarHBondContact O-N 2.9Å; R949-A994 HydrophobicContact CB-CB 4.42Å; R949-V998 HydrophobicContact CB-CG2 3.75Å; R949-V998 HydrophobicContact CG-CG2 4.41Å; R949-E1002 IonicContact NH1-OE1 2.67Å
950	Y	96.7	Very high	94.3	Very high	3 Å²	3	33.2 Å²	33.2	1%	0.012	17%	0.168	C	C	.	.	H	α-helix	trans	-60.5	-45.1	176	174.4	-92.6	0	0	0	112.9	I895 V899 D909 R916 I917 Y946 F947 Q948 W952 W953 K954	I895-Y950 HydrophobicContact CB-CD1 4.5Å; I895-Y950 HydrophobicContact CB-CD2 4.14Å; I895-Y950 HydrophobicContact CB-CG 3.98Å; I895-Y950 HydrophobicContact CG2-CD1 3.93Å; I895-Y950 HydrophobicContact CG2-CD2 4.44Å; I895-Y950 HydrophobicContact CG2-CG 3.9Å; V899-Y950 HydrophobicContact CG1-CD2 4.16Å; V899-Y950 HydrophobicContact CG1-CE2 4.07Å; V899-Y950 HydrophobicContact CG2-CE2 4.02Å; D909-Y950 PolarHBondContact OD1-OH 3.26Å; D909-Y950 PolarHBondContact OD2-OH 3.41Å; R916-Y950 HydrophobicContact CB-CE1 4.04Å; R916-Y950 VanDerWaalsContact CB-OH 3.32Å; R916-Y950 WeakPolarHBondContact CB-OH 3.33Å; R916-Y950 VanDerWaalsContact CG-OH 3.27Å; R916-Y950 WeakPolarHBondContact CG-OH 3.47Å; I917-Y950 HydrophobicContact CG1-CD1 4.46Å; I917-Y950 HydrophobicContact CG1-CE1 3.83Å; Y946-Y950 PolarHBondContact O-N 3.32Å; F947-Y950 HydrophobicContact CD2-CD1 4.28Å; F947-Y950 HydrophobicContact CE2-CD1 4.4Å; F947-Y950 PolarHBondContact O-N 3.29Å; Q948-Y950 VanDerWaalsContact C-N 3.35Å; Y950-W952 VanDerWaalsContact C-N 3.32Å; Y950-W952 PolarHBondContact O-N 3.15Å; Y950-W953 HydrophobicContact CD2-CE3 4.44Å; Y950-W953 PolarHBondContact O-N 3.41Å; Y950-K954 HydrophobicContact CE1-CG 3.94Å; Y950-K954 HydrophobicContact CE2-CD 4.21Å; Y950-K954 HydrophobicContact CE2-CG 4.24Å; Y950-K954 PolarHBondContact O-N 3.38Å
951	I	95.8	Very high	94.2	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.036	19%	0.188	C	C	.	.	H	α-helix	trans	-57.4	-45.9	174	-71.7	158	0	0	0	110.7	I917 F947 Q948 K954 K955 I974	I917-I951 HydrophobicContact CD1-CG1 4.38Å; F947-I951 HydrophobicContact CD1-CD1 3.92Å; F947-I951 HydrophobicContact CD2-CD1 4.04Å; F947-I951 HydrophobicContact CD2-CG1 4.18Å; F947-I951 HydrophobicContact CE1-CD1 3.77Å; F947-I951 HydrophobicContact CE2-CD1 3.89Å; F947-I951 HydrophobicContact CE2-CG1 3.96Å; F947-I951 HydrophobicContact CG-CD1 4.06Å; F947-I951 HydrophobicContact CZ-CD1 3.77Å; F947-I951 HydrophobicContact CZ-CG1 4.24Å; F947-I951 WeakPolarHBondContact O-CD1 3.42Å; F947-I951 WeakPolarHBondContact O-CG1 3.49Å; F947-I951 PolarHBondContact O-N 2.96Å; Q948-I951 PolarHBondContact O-N 3.31Å; I951-K954 PolarHBondContact O-N 2.91Å; I951-K955 HydrophobicContact CG2-CD 4.37Å; I951-K955 WeakPolarHBondContact O-CG 3.32Å; I951-K955 PolarHBondContact O-N 3.23Å; I951-I974 HydrophobicContact CD1-CD1 3.92Å; I951-I974 HydrophobicContact CD1-CG1 4.02Å; I951-I974 HydrophobicContact CD1-CG2 3.76Å; I951-I974 HydrophobicContact CG1-CD1 3.94Å; I951-I974 HydrophobicContact CG1-CG1 4.48Å; I951-I974 HydrophobicContact CG2-CD1 3.82Å
952	W	94.9	Very high	94	Very high	56 Å²	56	44.4 Å²	44.4	21%	0.212	22%	0.22	C	C	.	.	H	α-helix	trans	-68.2	-36.3	179.7	-86.2	104.8	0	0	0	113.3	Q948 R949 Y950 K955 S956 S988 C989 L991 A994	Q948-W952 PolarHBondContact O-N 3.03Å; R949-W952 PolarHBondContact O-N 3.45Å; Y950-W952 VanDerWaalsContact C-N 3.32Å; Y950-W952 PolarHBondContact O-N 3.15Å; W952-K955 HydrophobicContact CE3-CB 4.19Å; W952-K955 HydrophobicContact CE3-CD 4.31Å; W952-K955 HydrophobicContact CZ3-CD 4.32Å; W952-K955 PolarHBondContact O-N 3.4Å; W952-S956 WeakPolarHBondContact O-CB 3.4Å; W952-S956 PolarHBondContact O-N 2.98Å; W952-S956 PolarHBondContact O-OG 3.38Å; W952-S988 WeakPolarHBondContact CZ2-O 3.32Å; W952-S988 PolarHBondContact NE1-O 3.49Å; W952-C989 WeakPolarHBondContact CH2-O 3.23Å; W952-C989 WeakPolarHBondContact CZ2-O 3.32Å; W952-L991 HydrophobicContact CB-CB 4.22Å; W952-L991 HydrophobicContact CB-CD1 3.86Å; W952-L991 HydrophobicContact CE3-CB 4.5Å; W952-A994 HydrophobicContact CB-CB 4.27Å; W952-A994 HydrophobicContact CG-CB 4.18Å
953	W	95.3	Very high	93.6	Very high	36 Å²	36	50 Å²	50	14%	0.136	25%	0.247	C	C	.	.	H	α-helix	trans	-56	-50.9	168.8	-73.3	-34.2	0	0	0	111.2	P901 D902 G903 R949 Y950 K955 S956 V957 L991	P901-W953 WeakPolarHBondContact O-CH2 3.32Å; P901-W953 VanDerWaalsContact O-CZ2 3.3Å; P901-W953 WeakPolarHBondContact O-CZ2 3.25Å; D902-W953 PolarHBondContact O-NE1 2.99Å; G903-W953 VanDerWaalsContact CA-CD2 3.43Å; G903-W953 VanDerWaalsContact CA-CG 3.49Å; R949-W953 HydrophobicContact CG-CD2 4.14Å; R949-W953 HydrophobicContact CG-CH2 4.48Å; R949-W953 HydrophobicContact CG-CZ2 4.01Å; R949-W953 VanDerWaalsContact NE-CZ2 3.32Å; R949-W953 PolarHBondContact O-N 2.9Å; Y950-W953 HydrophobicContact CD2-CE3 4.44Å; Y950-W953 PolarHBondContact O-N 3.41Å; W953-K955 VanDerWaalsContact C-N 3.3Å; W953-K955 PolarHBondContact O-N 2.97Å; W953-S956 PolarHBondContact O-N 3.38Å; W953-S956 VanDerWaalsContact O-N 3.16Å; W953-V957 WeakPolarHBondContact O-CG2 3.28Å; W953-L991 HydrophobicContact CG-CD1 4.41Å
954	K	94.5	Very high	93.2	Very high	9 Å²	9	53.9 Å²	53.9	4%	0.039	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-34.3	177.7	-60.5	-55.3	-64.9	-154	0	113.1	D909 P910 P911 H913 L914 Y950 I951 W960	D909-K954 PolarHBondContact O-NZ 2.92Å; D909-K954 IonicContact OD1-NZ 3.32Å; D909-K954 PolarHBondContact OD1-NZ 3.11Å; D909-K954 WeakPolarHBondContact OD2-CD 3.32Å; D909-K954 IonicContact OD2-NZ 2.68Å; D909-K954 PolarHBondContact OD2-NZ 3.02Å; P910-K954 PolarHBondContact O-NZ 3.15Å; P911-K954 WeakPolarHBondContact O-CE 3.5Å; H913-K954 WeakPolarHBondContact O-CE 3.3Å; H913-K954 PolarHBondContact O-NZ 3.06Å; L914-K954 HydrophobicContact CD2-CB 3.85Å; L914-K954 HydrophobicContact CD2-CG 4.34Å; Y950-K954 HydrophobicContact CE1-CG 3.94Å; Y950-K954 HydrophobicContact CE2-CD 4.21Å; Y950-K954 HydrophobicContact CE2-CG 4.24Å; Y950-K954 PolarHBondContact O-N 3.38Å; I951-K954 PolarHBondContact O-N 2.91Å; K954-W960 VanDerWaalsContact O-CD1 3.25Å; K954-W960 PolarHBondContact O-NE1 2.75Å
955	K	92.9	Very high	93.1	Very high	51 Å²	51	58 Å²	58	22%	0.222	29%	0.292	C	S	.	.	H	α-helix	trans	-72.2	-27.6	175.4	-75.1	-171.2	-179.5	-162.4	0	114.4	I951 W952 W953 F966 D971	I951-K955 HydrophobicContact CG2-CD 4.37Å; I951-K955 WeakPolarHBondContact O-CG 3.32Å; I951-K955 PolarHBondContact O-N 3.23Å; W952-K955 HydrophobicContact CE3-CB 4.19Å; W952-K955 HydrophobicContact CE3-CD 4.31Å; W952-K955 HydrophobicContact CZ3-CD 4.32Å; W952-K955 PolarHBondContact O-N 3.4Å; W953-K955 VanDerWaalsContact C-N 3.3Å; W953-K955 PolarHBondContact O-N 2.97Å; K955-F966 HydrophobicContact CB-CD2 4.49Å; K955-F966 HydrophobicContact CG-CD1 4.35Å; K955-F966 HydrophobicContact CG-CD2 3.78Å; K955-F966 HydrophobicContact CG-CE1 4.26Å; K955-F966 HydrophobicContact CG-CE2 3.66Å; K955-F966 HydrophobicContact CG-CG 4.13Å; K955-F966 HydrophobicContact CG-CZ 3.91Å; K955-D971 WeakPolarHBondContact CE-OD1 3.49Å; K955-D971 IonicContact NZ-OD1 2.7Å; K955-D971 PolarHBondContact NZ-OD1 3.11Å; K955-D971 IonicContact NZ-OD2 2.64Å; K955-D971 PolarHBondContact NZ-OD2 2.93Å
956	S	91.1	Very high	93	Very high	62 Å²	62	58 Å²	58	43%	0.434	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	4.1	-175.7	-75.3	0	0	0	0	114.5	W952 W953	W952-S956 WeakPolarHBondContact O-CB 3.4Å; W952-S956 PolarHBondContact O-N 2.98Å; W952-S956 PolarHBondContact O-OG 3.38Å; W953-S956 PolarHBondContact O-N 3.38Å; W953-S956 VanDerWaalsContact O-N 3.16Å
957	V	91.2	Very high	92.9	Very high	26 Å²	26	57.9 Å²	57.9	16%	0.158	30%	0.297	C	S	.	.	S	Bend	trans	-74.5	136	175.3	-168.1	0	0	0	0	111.1	P905 P911 W953 V959 W960	P905-V957 HydrophobicContact CG-CG1 3.97Å; P911-V957 HydrophobicContact CB-CG1 3.82Å; P911-V957 HydrophobicContact CG-CG1 4.11Å; W953-V957 WeakPolarHBondContact O-CG2 3.28Å; V957-V959 HydrophobicContact CB-CG1 4.4Å; V957-V959 HydrophobicContact CG1-CG1 4.35Å; V957-V959 PolarHBondContact O-N 3.21Å; V957-W960 VanDerWaalsContact O-CD1 3.29Å; V957-W960 PolarHBondContact O-N 3.17Å; V957-W960 VanDerWaalsContact O-N 3.09Å
958	D	89.4	Confident	92.7	Very high	154 Å²	154	62.3 Å²	62.3	82%	0.824	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-13.5	-172.7	-64.1	-48.7	0	0	0	116.3	W960	D958-W960 PolarHBondContact O-N 3.15Å
959	V	92	Very high	92.6	Very high	42 Å²	42	67.7 Å²	67.7	26%	0.255	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.7	174.8	70.1	0	0	0	0	112.3	P911 E912 V957 T961	P911-V959 HydrophobicContact CB-CB 4.4Å; P911-V959 HydrophobicContact CB-CG1 3.89Å; E912-V959 HydrophobicContact CG-CG1 4.28Å; E912-V959 HydrophobicContact CG-CG2 3.94Å; V957-V959 HydrophobicContact CB-CG1 4.4Å; V957-V959 HydrophobicContact CG1-CG1 4.35Å; V957-V959 PolarHBondContact O-N 3.21Å; V959-T961 PolarHBondContact O-N 2.84Å
960	W	93.2	Very high	92.6	Very high	38 Å²	38	66.4 Å²	66.4	14%	0.144	35%	0.345	C	S	.	.			trans	-83.2	103.6	-178	-51.7	117.1	0	0	0	111.4	E912 L914 K954 V957 D958 H964 F966 P967	E912-W960 HydrophobicContact CB-CH2 4.28Å; E912-W960 HydrophobicContact CG-CH2 4.15Å; L914-W960 HydrophobicContact CD1-CH2 4.24Å; L914-W960 HydrophobicContact CD1-CZ2 4.12Å; L914-W960 HydrophobicContact CD2-CZ2 4.22Å; L914-W960 HydrophobicContact CG-CZ2 4.33Å; K954-W960 VanDerWaalsContact O-CD1 3.25Å; K954-W960 PolarHBondContact O-NE1 2.75Å; V957-W960 VanDerWaalsContact O-CD1 3.29Å; V957-W960 PolarHBondContact O-N 3.17Å; V957-W960 VanDerWaalsContact O-N 3.09Å; D958-W960 PolarHBondContact O-N 3.15Å; W960-H964 CarbonylContact C-O 3.47Å; W960-H964 WeakPolarHBondContact CA-O 3.36Å; W960-H964 AromaticContact CE3-CD2 3.62Å; W960-H964 AromaticContact CE3-NE2 3.88Å; W960-H964 AromaticContact CZ3-CD2 3.65Å; W960-H964 AromaticContact CZ3-NE2 3.39Å; W960-H964 WeakPolarHBondContact CZ3-NE2 3.39Å; W960-F966 HydrophobicContact CD2-CB 4.25Å; W960-F966 HydrophobicContact CD2-CD2 4Å; W960-F966 AromaticContact CE2-CD2 3.7Å; W960-F966 HydrophobicContact CE3-CB 4.39Å; W960-F966 HydrophobicContact CG-CB 4.38Å; W960-F966 HydrophobicContact CG-CD2 4.28Å; W960-F966 HydrophobicContact CZ2-CD2 4.07Å; W960-F966 HydrophobicContact CZ2-CE2 4.44Å; W960-F966 AromaticContact NE1-CD2 3.8Å; W960-P967 HydrophobicContact CH2-CG 4.27Å; W960-P967 HydrophobicContact CZ3-CG 4.31Å
961	T	92.6	Very high	92.3	Very high	70 Å²	70	68.3 Å²	68.3	43%	0.429	36%	0.355	S	S	.	.			trans	-119.7	-176.7	-176.6	65.4	0	0	0	0	111.1	V959 D963 H964 P965	V959-T961 PolarHBondContact O-N 2.84Å; T961-D963 VanDerWaalsContact C-N 3.29Å; T961-H964 PolarHBondContact N-O 3.48Å; T961-H964 CarbonylContact O-C 3.31Å; T961-H964 PolarHBondContact OG1-N 3.34Å; T961-H964 VanDerWaalsContact OG1-N 3.09Å; T961-P965 VanDerWaalsContact O-CA 3.32Å; T961-P965 WeakPolarHBondContact O-CA 3.46Å
962	K	88.4	Confident	92.3	Very high	201 Å²	201	74.3 Å²	74.3	87%	0.874	38%	0.378	S	S	*	.	S	Bend	trans	-71	-27.5	175.6	-68.5	-178	-179.8	175.6	0	113
963	D	86.7	Confident	92.3	Very high	160 Å²	160	74.2 Å²	74.2	86%	0.856	38%	0.381	S	S	*	.	S	Bend	trans	-94.7	-17.6	180	-53.5	-66	0	0	0	111.7	T961	T961-D963 VanDerWaalsContact C-N 3.29Å
964	H	89	Confident	92.3	Very high	82 Å²	82	73.1 Å²	73.1	38%	0.38	38%	0.378	S	S	.	.	S	Bend	trans	-130.5	76.2	170	-170.7	87.7	0	0	0	110.5	W960 T961	W960-H964 CarbonylContact C-O 3.47Å; W960-H964 WeakPolarHBondContact CA-O 3.36Å; W960-H964 AromaticContact CE3-CD2 3.62Å; W960-H964 AromaticContact CE3-NE2 3.88Å; W960-H964 AromaticContact CZ3-CD2 3.65Å; W960-H964 AromaticContact CZ3-NE2 3.39Å; W960-H964 WeakPolarHBondContact CZ3-NE2 3.39Å; T961-H964 PolarHBondContact N-O 3.48Å; T961-H964 CarbonylContact O-C 3.31Å; T961-H964 PolarHBondContact OG1-N 3.34Å; T961-H964 VanDerWaalsContact OG1-N 3.09Å
965	P	92.3	Very high	92.2	Very high	87 Å²	87	73.9 Å²	73.9	57%	0.565	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-75.4	156.7	-175.5	31.2	-36.3	0	0	0	113	T961	T961-P965 VanDerWaalsContact O-CA 3.32Å; T961-P965 WeakPolarHBondContact O-CA 3.46Å
966	F	93.5	Very high	92.2	Very high	32 Å²	32	76.5 Å²	76.5	14%	0.14	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-56.8	136.3	172.5	-172.1	-90.8	0	0	0	111.2	L914 K955 W960 I968 I970 D971	L914-F966 HydrophobicContact CD1-CD2 4.22Å; L914-F966 HydrophobicContact CD1-CE1 4.35Å; L914-F966 HydrophobicContact CD1-CE2 3.6Å; L914-F966 HydrophobicContact CD1-CZ 3.67Å; L914-F966 HydrophobicContact CD2-CE2 3.66Å; L914-F966 HydrophobicContact CD2-CZ 4.08Å; L914-F966 HydrophobicContact CG-CE2 4.3Å; K955-F966 HydrophobicContact CB-CD2 4.49Å; K955-F966 HydrophobicContact CG-CD1 4.35Å; K955-F966 HydrophobicContact CG-CD2 3.78Å; K955-F966 HydrophobicContact CG-CE1 4.26Å; K955-F966 HydrophobicContact CG-CE2 3.66Å; K955-F966 HydrophobicContact CG-CG 4.13Å; K955-F966 HydrophobicContact CG-CZ 3.91Å; W960-F966 HydrophobicContact CD2-CB 4.25Å; W960-F966 HydrophobicContact CD2-CD2 4Å; W960-F966 AromaticContact CE2-CD2 3.7Å; W960-F966 HydrophobicContact CE3-CB 4.39Å; W960-F966 HydrophobicContact CG-CB 4.38Å; W960-F966 HydrophobicContact CG-CD2 4.28Å; W960-F966 HydrophobicContact CZ2-CD2 4.07Å; W960-F966 HydrophobicContact CZ2-CE2 4.44Å; W960-F966 AromaticContact NE1-CD2 3.8Å; F966-I968 PolarHBondContact O-N 3.1Å; F966-I970 HydrophobicContact CE1-CB 4.09Å; F966-I970 HydrophobicContact CE1-CG2 3.98Å; F966-I970 HydrophobicContact CZ-CB 4.49Å; F966-I970 HydrophobicContact CZ-CG2 4Å; F966-D971 VanDerWaalsContact CE1-OD1 3.28Å; F966-D971 WeakPolarHBondContact CE1-OD1 3.37Å
967	P	94.8	Very high	92.5	Very high	50 Å²	50	73.7 Å²	73.7	33%	0.325	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-63.9	116	-173.5	-25.5	36.4	0	0	0	113.4	L914 W960 D969 I970 D971	L914-P967 HydrophobicContact CD1-CG 3.89Å; W960-P967 HydrophobicContact CH2-CG 4.27Å; W960-P967 HydrophobicContact CZ3-CG 4.31Å; P967-D969 VanDerWaalsContact C-N 3.25Å; P967-D969 PolarHBondContact O-N 3.46Å; P967-I970 HydrophobicContact CB-CG1 4.12Å; P967-I970 WeakPolarHBondContact O-CB 3.33Å; P967-I970 PolarHBondContact O-N 3.22Å; P967-D971 PolarHBondContact O-N 3.38Å
968	I	92.4	Very high	92.5	Very high	92 Å²	92	72.6 Å²	72.6	47%	0.472	37%	0.374	S	S	.	.	H	α-helix	trans	-61.8	-30.6	-175.7	-163.5	68.8	0	0	0	113.2	F966 I970 D971 Y972	F966-I968 PolarHBondContact O-N 3.1Å; I968-I970 PolarHBondContact O-N 2.93Å; I968-D971 HydrophobicContact CD1-CB 4.4Å; I968-D971 WeakPolarHBondContact O-CB 3.42Å; I968-D971 PolarHBondContact O-N 3.03Å; I968-Y972 HydrophobicContact CB-CE2 4.44Å; I968-Y972 HydrophobicContact CD1-CE2 4.5Å; I968-Y972 HydrophobicContact CG1-CD2 4.08Å; I968-Y972 HydrophobicContact CG1-CE2 3.49Å; I968-Y972 VanDerWaalsContact CG1-CE2 3.49Å; I968-Y972 HydrophobicContact CG2-CE2 4.31Å; I968-Y972 WeakPolarHBondContact O-CD2 3.44Å; I968-Y972 PolarHBondContact O-N 3.21Å
969	D	92.6	Very high	92.7	Very high	121 Å²	121	70.7 Å²	70.7	65%	0.647	36%	0.36	S	S	*	.	H	α-helix	trans	-65.2	-26.7	177.2	-55.4	-31.7	0	0	0	112.8	P967 M973	P967-D969 VanDerWaalsContact C-N 3.25Å; P967-D969 PolarHBondContact O-N 3.46Å; D969-M973 WeakPolarHBondContact O-CB 3.37Å; D969-M973 PolarHBondContact O-N 3.09Å; D969-M973 VanDerWaalsContact O-N 3.13Å
970	I	94.7	Very high	92.8	Very high	16 Å²	16	73.5 Å²	73.5	8%	0.082	37%	0.373	C	S	.	.	H	α-helix	trans	-76.9	-35.3	173.4	-60.6	-64.2	0	0	0	110.1	L914 I917 R918 F966 P967 I968 M973 I974	L914-I970 HydrophobicContact CD1-CB 4.48Å; L914-I970 HydrophobicContact CD1-CG1 4.09Å; L914-I970 HydrophobicContact CD1-CG2 4.39Å; I917-I970 HydrophobicContact CD1-CG2 3.95Å; I917-I970 HydrophobicContact CG2-CG2 4.08Å; R918-I970 HydrophobicContact CG-CD1 3.95Å; F966-I970 HydrophobicContact CE1-CB 4.09Å; F966-I970 HydrophobicContact CE1-CG2 3.98Å; F966-I970 HydrophobicContact CZ-CB 4.49Å; F966-I970 HydrophobicContact CZ-CG2 4Å; P967-I970 HydrophobicContact CB-CG1 4.12Å; P967-I970 WeakPolarHBondContact O-CB 3.33Å; P967-I970 PolarHBondContact O-N 3.22Å; I968-I970 PolarHBondContact O-N 2.93Å; I970-M973 PolarHBondContact O-N 3.47Å; I970-I974 HydrophobicContact CG2-CD1 3.96Å; I970-I974 WeakPolarHBondContact O-CD1 3.27Å; I970-I974 VanDerWaalsContact O-CG1 3.22Å; I970-I974 WeakPolarHBondContact O-CG1 3.23Å; I970-I974 PolarHBondContact O-N 3.46Å
971	D	92.2	Very high	92.8	Very high	43 Å²	43	72.3 Å²	72.3	23%	0.23	37%	0.369	C	S	.	.	H	α-helix	trans	-67.2	-41.8	174.9	-90.2	0.4	0	0	0	112.6	K955 F966 P967 I968 I974 S975	K955-D971 WeakPolarHBondContact CE-OD1 3.49Å; K955-D971 IonicContact NZ-OD1 2.7Å; K955-D971 PolarHBondContact NZ-OD1 3.11Å; K955-D971 IonicContact NZ-OD2 2.64Å; K955-D971 PolarHBondContact NZ-OD2 2.93Å; F966-D971 VanDerWaalsContact CE1-OD1 3.28Å; F966-D971 WeakPolarHBondContact CE1-OD1 3.37Å; P967-D971 PolarHBondContact O-N 3.38Å; I968-D971 HydrophobicContact CD1-CB 4.4Å; I968-D971 WeakPolarHBondContact O-CB 3.42Å; I968-D971 PolarHBondContact O-N 3.03Å; D971-I974 PolarHBondContact O-N 2.8Å; D971-S975 PolarHBondContact O-N 3.39Å; D971-S975 PolarHBondContact O-OG 3.48Å
972	Y	94.9	Very high	92.8	Very high	133 Å²	133	70.5 Å²	70.5	52%	0.522	36%	0.355	S	S	.	.	H	α-helix	trans	-63.8	-41.7	171.7	-64.4	-48.3	0	0	0	111.9	I968 I974 S975 D976	I968-Y972 HydrophobicContact CB-CE2 4.44Å; I968-Y972 HydrophobicContact CD1-CE2 4.5Å; I968-Y972 HydrophobicContact CG1-CD2 4.08Å; I968-Y972 HydrophobicContact CG1-CE2 3.49Å; I968-Y972 VanDerWaalsContact CG1-CE2 3.49Å; I968-Y972 HydrophobicContact CG2-CE2 4.31Å; I968-Y972 WeakPolarHBondContact O-CD2 3.44Å; I968-Y972 PolarHBondContact O-N 3.21Å; Y972-I974 VanDerWaalsContact C-N 3.27Å; Y972-I974 PolarHBondContact O-N 3.13Å; Y972-S975 WeakPolarHBondContact CA-OG 3.4Å; Y972-S975 PolarHBondContact O-N 3.26Å; Y972-S975 PolarHBondContact O-OG 3.3Å; Y972-D976 VanDerWaalsContact O-CB 3.3Å; Y972-D976 WeakPolarHBondContact O-CB 3.1Å; Y972-D976 PolarHBondContact O-N 2.89Å
973	M	95.6	Very high	92.9	Very high	53 Å²	53	66.1 Å²	66.1	26%	0.261	35%	0.347	S	S	.	.	H	α-helix	trans	-60	-37	174.8	-172.7	-179.6	-57.1	0	0	112.6	R918 C921 D969 I970 T977	R918-M973 HydrophobicContact CB-SD 4.27Å; R918-M973 HydrophobicContact CG-CE 4.41Å; R918-M973 HydrophobicContact CG-SD 3.9Å; C921-M973 HydrophobicContact CB-CG 4.05Å; C921-M973 HydrophobicContact CB-SD 4.23Å; D969-M973 WeakPolarHBondContact O-CB 3.37Å; D969-M973 PolarHBondContact O-N 3.09Å; D969-M973 VanDerWaalsContact O-N 3.13Å; I970-M973 PolarHBondContact O-N 3.47Å; M973-T977 PolarHBondContact O-N 3.35Å; M973-T977 PolarHBondContact O-OG1 2.94Å
974	I	94	Very high	93	Very high	14 Å²	14	68.5 Å²	68.5	7%	0.072	35%	0.349	C	S	.	.	H	α-helix	trans	-69.4	-48.2	175.2	-69	159.1	0	0	0	110.9	I917 I951 I970 D971 Y972 L978	I917-I974 HydrophobicContact CD1-CD1 4.39Å; I917-I974 HydrophobicContact CG2-CD1 3.84Å; I917-I974 HydrophobicContact CG2-CG1 3.61Å; I951-I974 HydrophobicContact CD1-CD1 3.92Å; I951-I974 HydrophobicContact CD1-CG1 4.02Å; I951-I974 HydrophobicContact CD1-CG2 3.76Å; I951-I974 HydrophobicContact CG1-CD1 3.94Å; I951-I974 HydrophobicContact CG1-CG1 4.48Å; I951-I974 HydrophobicContact CG2-CD1 3.82Å; I970-I974 HydrophobicContact CG2-CD1 3.96Å; I970-I974 WeakPolarHBondContact O-CD1 3.27Å; I970-I974 VanDerWaalsContact O-CG1 3.22Å; I970-I974 WeakPolarHBondContact O-CG1 3.23Å; I970-I974 PolarHBondContact O-N 3.46Å; D971-I974 PolarHBondContact O-N 2.8Å; Y972-I974 VanDerWaalsContact C-N 3.27Å; Y972-I974 PolarHBondContact O-N 3.13Å; I974-L978 HydrophobicContact CG2-CD1 4.49Å; I974-L978 HydrophobicContact CG2-CD2 4.45Å; I974-L978 WeakPolarHBondContact O-CB 3.47Å; I974-L978 WeakPolarHBondContact O-CD1 3.5Å; I974-L978 PolarHBondContact O-N 3.11Å
975	S	92.3	Very high	93	Very high	25 Å²	25	66.9 Å²	66.9	18%	0.175	34%	0.343	C	S	.	.	H	α-helix	trans	-61.2	-47.1	179.9	56.2	0	0	0	0	111.1	D971 Y972 T977 L978 E979	D971-S975 PolarHBondContact O-N 3.39Å; D971-S975 PolarHBondContact O-OG 3.48Å; Y972-S975 WeakPolarHBondContact CA-OG 3.4Å; Y972-S975 PolarHBondContact O-N 3.26Å; Y972-S975 PolarHBondContact O-OG 3.3Å; S975-T977 PolarHBondContact O-N 2.69Å; S975-L978 PolarHBondContact O-N 2.71Å; S975-E979 VanDerWaalsContact O-CB 3.27Å; S975-E979 WeakPolarHBondContact O-CB 3.35Å; S975-E979 WeakPolarHBondContact O-CG 3.45Å; S975-E979 PolarHBondContact O-N 3.07Å
976	D	94.3	Very high	92.7	Very high	105 Å²	105	69 Å²	69	56%	0.561	34%	0.339	S	S	*	.	H	α-helix	trans	-64.2	-45.7	-174.3	-66.3	6.1	0	0	0	111.1	Y972 L980	Y972-D976 VanDerWaalsContact O-CB 3.3Å; Y972-D976 WeakPolarHBondContact O-CB 3.1Å; Y972-D976 PolarHBondContact O-N 2.89Å; D976-L980 WeakPolarHBondContact O-CB 3.37Å; D976-L980 PolarHBondContact O-N 3.21Å
977	T	95.6	Very high	92.4	Very high	3 Å²	3	70.6 Å²	70.6	2%	0.018	35%	0.349	C	S	.	.	H	α-helix	trans	-63.3	-44.8	174.9	-63.9	0	0	0	0	111.9	C921 L924 D925 M973 S975 L981	C921-T977 HydrophobicContact CB-CG2 4.48Å; C921-T977 PolarHBondContact SG-OG1 2.88Å; L924-T977 HydrophobicContact CB-CG2 3.74Å; L924-T977 HydrophobicContact CD1-CG2 3.93Å; D925-T977 WeakPolarHBondContact OD1-CB 3.35Å; D925-T977 WeakPolarHBondContact OD1-CG2 3.31Å; D925-T977 PolarHBondContact OD1-OG1 3.33Å; M973-T977 PolarHBondContact O-N 3.35Å; M973-T977 PolarHBondContact O-OG1 2.94Å; S975-T977 PolarHBondContact O-N 2.69Å; T977-L981 HydrophobicContact CG2-CD1 4.25Å; T977-L981 WeakPolarHBondContact O-CB 3.48Å; T977-L981 WeakPolarHBondContact O-CG 3.46Å; T977-L981 PolarHBondContact O-N 3.32Å; T977-L981 VanDerWaalsContact O-N 3.15Å
978	L	93	Very high	92.1	Very high	3 Å²	3	68.7 Å²	68.7	2%	0.016	34%	0.337	C	S	.	.	H	α-helix	trans	-74.8	-38.2	-175.4	-90.5	63.4	0	0	0	112.5	L944 F947 Q948 I974 S975 R982 L987	L944-L978 HydrophobicContact CD2-CD1 4.01Å; L944-L978 HydrophobicContact CD2-CG 4.09Å; F947-L978 HydrophobicContact CD1-CD1 4.26Å; F947-L978 HydrophobicContact CE1-CD1 4.02Å; Q948-L978 HydrophobicContact CG-CD2 4.25Å; I974-L978 HydrophobicContact CG2-CD1 4.49Å; I974-L978 HydrophobicContact CG2-CD2 4.45Å; I974-L978 WeakPolarHBondContact O-CB 3.47Å; I974-L978 WeakPolarHBondContact O-CD1 3.5Å; I974-L978 PolarHBondContact O-N 3.11Å; S975-L978 PolarHBondContact O-N 2.71Å; L978-R982 CarbonylContact O-C 3.58Å; L978-R982 WeakPolarHBondContact O-CA 3.27Å; L978-R982 PolarHBondContact O-N 2.96Å; L978-L987 HydrophobicContact CB-CD2 4.1Å; L978-L987 HydrophobicContact CD2-CD2 3.55Å; L978-L987 HydrophobicContact CG-CD2 4.47Å
979	E	93.1	Very high	92	Very high	114 Å²	114	68.7 Å²	68.7	53%	0.533	34%	0.344	S	S	.	.	H	α-helix	trans	-68.8	-40.2	174.9	-70.9	-174	-160	0	0	111.3	S975 L981 R982 P983	S975-E979 VanDerWaalsContact O-CB 3.27Å; S975-E979 WeakPolarHBondContact O-CB 3.35Å; S975-E979 WeakPolarHBondContact O-CG 3.45Å; S975-E979 PolarHBondContact O-N 3.07Å; E979-L981 PolarHBondContact O-N 3.19Å; E979-R982 CarbonylContact O-C 3.58Å; E979-P983 WeakPolarHBondContact O-CA 3.32Å; E979-P983 WeakPolarHBondContact O-CD 3.47Å; E979-P983 WeakPolarHBondContact O-CG 3.26Å; E979-P983 VanDerWaalsContact O-N 3.1Å
980	L	93.3	Very high	92	Very high	101 Å²	101	64.9 Å²	64.9	53%	0.529	33%	0.327	S	S	.	.	H	α-helix	trans	-59	-44.8	174.1	176.4	61.3	0	0	0	112.3	D976	D976-L980 WeakPolarHBondContact O-CB 3.37Å; D976-L980 PolarHBondContact O-N 3.21Å
981	L	93.4	Very high	91.8	Very high	13 Å²	13	66.4 Å²	66.4	7%	0.068	34%	0.335	C	S	.	.	H	α-helix	trans	-82.6	-29.3	-177.8	-66.9	-175.7	0	0	0	113.6	L924 G928 Q929 L940 T977 E979	L924-L981 HydrophobicContact CB-CD1 3.82Å; L924-L981 HydrophobicContact CD1-CD1 4.28Å; L924-L981 HydrophobicContact CD2-CD1 4.07Å; L924-L981 HydrophobicContact CG-CD1 4.28Å; G928-L981 VanDerWaalsContact C-CD2 3.4Å; Q929-L981 HydrophobicContact CB-CD2 4.48Å; Q929-L981 HydrophobicContact CG-CD2 3.83Å; L940-L981 HydrophobicContact CD2-CD1 4.29Å; T977-L981 HydrophobicContact CG2-CD1 4.25Å; T977-L981 WeakPolarHBondContact O-CB 3.48Å; T977-L981 WeakPolarHBondContact O-CG 3.46Å; T977-L981 PolarHBondContact O-N 3.32Å; T977-L981 VanDerWaalsContact O-N 3.15Å; E979-L981 PolarHBondContact O-N 3.19Å
982	R	93.3	Very high	91.9	Very high	33 Å²	33	69.8 Å²	69.8	13%	0.125	35%	0.353	C	S	.	.			trans	-148	76.2	-176.2	-63.6	-63.7	-176	-93.4	-0.5	112.3	F931 K937 D941 L944 L978 E979 K984 M985	F931-R982 PolarHBondContact O-NH1 3.05Å; F931-R982 PolarHBondContact O-NH2 2.87Å; K937-R982 PolarHBondContact O-NH2 2.83Å; D941-R982 IonicContact OD1-CZ 3.29Å; D941-R982 VanDerWaalsContact OD1-CZ 3.22Å; D941-R982 IonicContact OD1-NE 3.01Å; D941-R982 PolarHBondContact OD1-NE 2.81Å; D941-R982 IonicContact OD1-NH2 3.37Å; D941-R982 PolarHBondContact OD1-NH2 3.21Å; L944-R982 HydrophobicContact CD1-CG 3.94Å; L978-R982 CarbonylContact O-C 3.58Å; L978-R982 WeakPolarHBondContact O-CA 3.27Å; L978-R982 PolarHBondContact O-N 2.96Å; E979-R982 CarbonylContact O-C 3.58Å; R982-K984 PolarHBondContact O-N 3.09Å; R982-M985 HydrophobicContact CB-CB 3.66Å; R982-M985 HydrophobicContact CG-CB 4.47Å; R982-M985 PolarHBondContact O-N 2.79Å
983	P	90.9	Very high	91.8	Very high	109 Å²	109	64.3 Å²	64.3	71%	0.708	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	2	178.7	-19.4	27.1	0	0	0	116.7	E979	E979-P983 WeakPolarHBondContact O-CA 3.32Å; E979-P983 WeakPolarHBondContact O-CD 3.47Å; E979-P983 WeakPolarHBondContact O-CG 3.26Å; E979-P983 VanDerWaalsContact O-N 3.1Å
984	K	89.1	Confident	91.6	Very high	209 Å²	209	61.8 Å²	61.8	91%	0.909	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.7	2.4	-178.8	-61.1	-177.4	-179.4	178.5	0	112.9	R982	R982-K984 PolarHBondContact O-N 3.09Å
985	M	87.4	Confident	91.6	Very high	49 Å²	49	63.7 Å²	63.7	24%	0.241	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-77.6	135	176.6	-173.2	168.1	-160.9	0	0	109.5	L944 I945 R982 L987	L944-M985 HydrophobicContact CB-CE 3.78Å; L944-M985 HydrophobicContact CB-SD 3.85Å; L944-M985 HydrophobicContact CD1-SD 3.93Å; I945-M985 HydrophobicContact CG1-CE 3.78Å; R982-M985 HydrophobicContact CB-CB 3.66Å; R982-M985 HydrophobicContact CG-CB 4.47Å; R982-M985 PolarHBondContact O-N 2.79Å; M985-L987 PolarHBondContact O-N 2.93Å
986	R	85.6	Confident	91.6	Very high	130 Å²	130	69.4 Å²	69.4	49%	0.491	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-74.8	120.5	173.6	178.5	173.2	175.5	-92.2	-14.7	109	C989 D993	R986-C989 PolarHBondContact NH2-SG 2.95Å; R986-C989 VanDerWaalsContact NH2-SG 3.44Å; R986-D993 IonicContact CZ-OD1 2.97Å; R986-D993 IonicContact CZ-OD2 3.28Å; R986-D993 VanDerWaalsContact CZ-OD2 3.26Å; R986-D993 VanDerWaalsContact NH1-CG 3.31Å; R986-D993 IonicContact NH1-OD1 2.71Å; R986-D993 PolarHBondContact NH1-OD1 2.96Å; R986-D993 IonicContact NH1-OD2 2.67Å; R986-D993 PolarHBondContact NH1-OD2 3.41Å; R986-D993 IonicContact NH2-OD1 2.79Å; R986-D993 PolarHBondContact NH2-OD1 2.99Å; R986-D993 IonicContact NH2-OD2 3.18Å; R986-D993 PolarHBondContact NH2-OD2 2.91Å
987	L	88	Confident	91.6	Very high	66 Å²	66	66.3 Å²	66.3	35%	0.346	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-73.6	134.7	166.8	-60.4	-178.9	0	0	0	109.8	L978 M985	L978-L987 HydrophobicContact CB-CD2 4.1Å; L978-L987 HydrophobicContact CD2-CD2 3.55Å; L978-L987 HydrophobicContact CG-CD2 4.47Å; M985-L987 PolarHBondContact O-N 2.93Å
988	S	89.6	Confident	91.5	Very high	10 Å²	10	66.1 Å²	66.1	7%	0.07	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-70.9	133.8	-178.3	-55.8	0	0	0	0	110.7	Q948 W952 D993 Q997	Q948-S988 PolarHBondContact OE1-OG 3.43Å; W952-S988 WeakPolarHBondContact CZ2-O 3.32Å; W952-S988 PolarHBondContact NE1-O 3.49Å; S988-D993 WeakPolarHBondContact CA-OD2 3.42Å; S988-Q997 PolarHBondContact OG-NE2 2.85Å
989	C	88.9	Confident	91.4	Very high	93 Å²	93	67.9 Å²	67.9	63%	0.628	35%	0.347	S	S	*	.	S	Bend	trans	-95.8	-9.2	-171.7	-50.8	0	0	0	0	114.2	W952 R986 D993	W952-C989 WeakPolarHBondContact CH2-O 3.23Å; W952-C989 WeakPolarHBondContact CZ2-O 3.32Å; R986-C989 PolarHBondContact NH2-SG 2.95Å; R986-C989 VanDerWaalsContact NH2-SG 3.44Å; C989-D993 PolarHBondContact N-OD2 3.22Å
990	S	92.5	Very high	91.4	Very high	40 Å²	40	65.8 Å²	65.8	28%	0.28	34%	0.339	S	S	.	.	S	Bend	trans	-156.9	169.9	173.3	73.1	0	0	0	0	111.4	D992 D993 A994	S990-D992 VanDerWaalsContact C-N 3.31Å; S990-D992 PolarHBondContact O-N 2.91Å; S990-D992 PolarHBondContact OG-N 3.5Å; S990-D993 WeakPolarHBondContact O-CB 3.35Å; S990-D993 PolarHBondContact O-N 3.45Å; S990-D993 PolarHBondContact OG-N 3.42Å; S990-A994 PolarHBondContact O-N 3.22Å
991	L	91.6	Very high	91.4	Very high	49 Å²	49	61.7 Å²	61.7	26%	0.257	32%	0.318	S	S	.	.	H	α-helix	trans	-59.6	-39.4	171.9	177.7	60.6	0	0	0	112.3	W952 W953 D993 A994 T995	W952-L991 HydrophobicContact CB-CB 4.22Å; W952-L991 HydrophobicContact CB-CD1 3.86Å; W952-L991 HydrophobicContact CE3-CB 4.5Å; W953-L991 HydrophobicContact CG-CD1 4.41Å; L991-D993 VanDerWaalsContact C-N 3.28Å; L991-D993 PolarHBondContact O-N 3.22Å; L991-A994 PolarHBondContact O-N 2.93Å; L991-T995 VanDerWaalsContact O-CB 3.22Å; L991-T995 WeakPolarHBondContact O-CB 3.35Å; L991-T995 PolarHBondContact O-N 3.48Å; L991-T995 PolarHBondContact O-OG1 3.49Å
992	D	93.1	Very high	91.2	Very high	113 Å²	113	64.8 Å²	64.8	60%	0.604	33%	0.332	S	S	*	.	H	α-helix	trans	-62	-38.2	176.1	-50.6	-60.2	0	0	0	112	S990 R996	S990-D992 VanDerWaalsContact C-N 3.31Å; S990-D992 PolarHBondContact O-N 2.91Å; S990-D992 PolarHBondContact OG-N 3.5Å; D992-R996 WeakPolarHBondContact O-CB 3.47Å; D992-R996 PolarHBondContact O-N 2.85Å
993	D	92.9	Very high	91	Very high	19 Å²	19	69.4 Å²	69.4	10%	0.102	35%	0.349	C	S	.	.	H	α-helix	trans	-73.3	-39.6	-177.8	-175.4	35.8	0	0	0	111.6	R986 S988 C989 S990 L991 Q997	R986-D993 IonicContact CZ-OD1 2.97Å; R986-D993 IonicContact CZ-OD2 3.28Å; R986-D993 VanDerWaalsContact CZ-OD2 3.26Å; R986-D993 VanDerWaalsContact NH1-CG 3.31Å; R986-D993 IonicContact NH1-OD1 2.71Å; R986-D993 PolarHBondContact NH1-OD1 2.96Å; R986-D993 IonicContact NH1-OD2 2.67Å; R986-D993 PolarHBondContact NH1-OD2 3.41Å; R986-D993 IonicContact NH2-OD1 2.79Å; R986-D993 PolarHBondContact NH2-OD1 2.99Å; R986-D993 IonicContact NH2-OD2 3.18Å; R986-D993 PolarHBondContact NH2-OD2 2.91Å; S988-D993 WeakPolarHBondContact CA-OD2 3.42Å; C989-D993 PolarHBondContact N-OD2 3.22Å; S990-D993 WeakPolarHBondContact O-CB 3.35Å; S990-D993 PolarHBondContact O-N 3.45Å; S990-D993 PolarHBondContact OG-N 3.42Å; L991-D993 VanDerWaalsContact C-N 3.28Å; L991-D993 PolarHBondContact O-N 3.22Å; D993-Q997 WeakPolarHBondContact O-CG 3.49Å; D993-Q997 PolarHBondContact O-N 3.42Å; D993-Q997 VanDerWaalsContact O-N 3.16Å; D993-Q997 PolarHBondContact O-NE2 3.22Å; D993-Q997 PolarHBondContact OD1-NE2 2.89Å
994	A	92.7	Very high	90.9	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-69.5	-42.3	172.2	0	0	0	0	0	112	R949 W952 S990 L991 Q997 V998	R949-A994 HydrophobicContact CB-CB 4.42Å; W952-A994 HydrophobicContact CB-CB 4.27Å; W952-A994 HydrophobicContact CG-CB 4.18Å; S990-A994 PolarHBondContact O-N 3.22Å; L991-A994 PolarHBondContact O-N 2.93Å; A994-Q997 PolarHBondContact O-N 3.15Å; A994-V998 PolarHBondContact O-N 2.83Å
995	T	92.8	Very high	90.7	Very high	54 Å²	54	62.3 Å²	62.3	33%	0.331	31%	0.314	S	S	.	.	H	α-helix	trans	-65.7	-39.8	178.3	-56.9	0	0	0	0	111.3	L991 V998 A999	L991-T995 VanDerWaalsContact O-CB 3.22Å; L991-T995 WeakPolarHBondContact O-CB 3.35Å; L991-T995 PolarHBondContact O-N 3.48Å; L991-T995 PolarHBondContact O-OG1 3.49Å; T995-V998 PolarHBondContact O-N 3.34Å; T995-A999 WeakPolarHBondContact O-CB 3.34Å; T995-A999 PolarHBondContact O-N 2.91Å
996	R	93.7	Very high	90.4	Very high	144 Å²	144	63.6 Å²	63.6	54%	0.543	32%	0.321	S	S	.	.	H	α-helix	trans	-63.1	-44.1	173.8	-170.2	-177.8	-59.2	117	5.6	112	D992 V998 A999 D1000	D992-R996 WeakPolarHBondContact O-CB 3.47Å; D992-R996 PolarHBondContact O-N 2.85Å; R996-V998 VanDerWaalsContact C-N 3.33Å; R996-V998 PolarHBondContact O-N 3.4Å; R996-A999 PolarHBondContact O-N 2.87Å; R996-A999 VanDerWaalsContact O-N 3.17Å; R996-D1000 WeakPolarHBondContact O-CB 3.44Å; R996-D1000 VanDerWaalsContact O-CG 3.23Å; R996-D1000 PolarHBondContact O-N 3.43Å
997	Q	92.6	Very high	90.4	Very high	40 Å²	40	61.9 Å²	61.9	19%	0.187	33%	0.325	C	S	.	.	H	α-helix	trans	-60.8	-39.5	176.5	-78.9	168.5	75.2	0	0	112.7	I945 S988 D993 A994 L1001	I945-Q997 HydrophobicContact CG2-CB 3.99Å; S988-Q997 PolarHBondContact OG-NE2 2.85Å; D993-Q997 WeakPolarHBondContact O-CG 3.49Å; D993-Q997 PolarHBondContact O-N 3.42Å; D993-Q997 VanDerWaalsContact O-N 3.16Å; D993-Q997 PolarHBondContact O-NE2 3.22Å; D993-Q997 PolarHBondContact OD1-NE2 2.89Å; A994-Q997 PolarHBondContact O-N 3.15Å; Q997-L1001 WeakPolarHBondContact O-CB 3.49Å; Q997-L1001 PolarHBondContact O-N 3.26Å
998	V	93.3	Very high	90	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-67.4	-44.1	172.8	179.7	0	0	0	0	111.2	I945 Y946 R949 A994 T995 R996 D1000 L1001 E1002	I945-V998 HydrophobicContact CG2-CB 4.38Å; I945-V998 HydrophobicContact CG2-CG2 3.7Å; Y946-V998 HydrophobicContact CD1-CG1 3.84Å; Y946-V998 HydrophobicContact CD1-CG2 4.26Å; Y946-V998 HydrophobicContact CE1-CG1 3.35Å; R949-V998 HydrophobicContact CB-CG2 3.75Å; R949-V998 HydrophobicContact CG-CG2 4.41Å; A994-V998 PolarHBondContact O-N 2.83Å; T995-V998 PolarHBondContact O-N 3.34Å; R996-V998 VanDerWaalsContact C-N 3.33Å; R996-V998 PolarHBondContact O-N 3.4Å; V998-D1000 VanDerWaalsContact C-N 3.27Å; V998-D1000 PolarHBondContact O-N 2.74Å; V998-L1001 WeakPolarHBondContact O-CB 3.39Å; V998-L1001 PolarHBondContact O-N 2.89Å; V998-L1001 VanDerWaalsContact O-N 3.16Å; V998-E1002 VanDerWaalsContact CG1-CD 3.43Å; V998-E1002 HydrophobicContact CG1-CG 4.04Å; V998-E1002 VanDerWaalsContact CG1-OE1 3.23Å; V998-E1002 WeakPolarHBondContact CG1-OE1 3.47Å; V998-E1002 WeakPolarHBondContact O-CB 3.38Å; V998-E1002 WeakPolarHBondContact O-CG 3.44Å; V998-E1002 PolarHBondContact O-N 2.9Å
999	A	92.7	Very high	89.2	Confident	40 Å²	40	70.8 Å²	70.8	33%	0.331	37%	0.365	S	S	.	.	H	α-helix	trans	-65	-28.2	178.2	0	0	0	0	0	113.5	T995 R996 R1003	T995-A999 WeakPolarHBondContact O-CB 3.34Å; T995-A999 PolarHBondContact O-N 2.91Å; R996-A999 PolarHBondContact O-N 2.87Å; R996-A999 VanDerWaalsContact O-N 3.17Å; A999-R1003 WeakPolarHBondContact O-CB 3.49Å; A999-R1003 PolarHBondContact O-N 3.03Å; A999-R1003 VanDerWaalsContact O-N 3.14Å; A999-R1003 PolarHBondContact O-NH2 2.96Å
1000	D	92.6	Very high	87.9	Confident	69 Å²	69	69.4 Å²	69.4	37%	0.369	37%	0.367	S	S	.	.	H	α-helix	trans	-73.4	-41.3	172.4	-69.4	-27.4	0	0	0	111.3	R996 V998 R1003 E1004	R996-D1000 WeakPolarHBondContact O-CB 3.44Å; R996-D1000 VanDerWaalsContact O-CG 3.23Å; R996-D1000 PolarHBondContact O-N 3.43Å; V998-D1000 VanDerWaalsContact C-N 3.27Å; V998-D1000 PolarHBondContact O-N 2.74Å; D1000-R1003 PolarHBondContact O-N 2.94Å; D1000-R1003 IonicContact OD1-CZ 2.82Å; D1000-R1003 IonicContact OD1-NH1 2.85Å; D1000-R1003 PolarHBondContact OD1-NH1 3.02Å; D1000-R1003 IonicContact OD1-NH2 3.92Å; D1000-R1003 PolarHBondContact OD1-NH2 2.7Å; D1000-E1004 PolarHBondContact O-N 3.2Å
1001	L	92.1	Very high	86.2	Confident	16 Å²	16	74.3 Å²	74.3	8%	0.084	39%	0.387	C	S	.	.	H	α-helix	trans	-64.4	-44.8	173.2	176.7	64.3	0	0	0	112	C942 I945 Y946 Q997 V998 R1003 E1004 V1005	C942-L1001 HydrophobicContact CB-CD2 4.09Å; I945-L1001 HydrophobicContact CB-CD2 4.13Å; I945-L1001 HydrophobicContact CD1-CD2 4.12Å; I945-L1001 HydrophobicContact CG2-CD2 4.09Å; Y946-L1001 HydrophobicContact CD2-CD2 4.15Å; Y946-L1001 HydrophobicContact CE2-CD2 3.77Å; Q997-L1001 WeakPolarHBondContact O-CB 3.49Å; Q997-L1001 PolarHBondContact O-N 3.26Å; V998-L1001 WeakPolarHBondContact O-CB 3.39Å; V998-L1001 PolarHBondContact O-N 2.89Å; V998-L1001 VanDerWaalsContact O-N 3.16Å; L1001-R1003 VanDerWaalsContact C-N 3.27Å; L1001-R1003 PolarHBondContact O-N 3Å; L1001-E1004 WeakPolarHBondContact O-CB 3.41Å; L1001-E1004 PolarHBondContact O-N 3.03Å; L1001-E1004 VanDerWaalsContact O-N 3.12Å; L1001-V1005 WeakPolarHBondContact O-CG2 3.24Å; L1001-V1005 PolarHBondContact O-N 2.9Å
1002	E	90.6	Very high	84	Confident	77 Å²	77	74.3 Å²	74.3	36%	0.36	39%	0.394	S	S	.	.	H	α-helix	trans	-62.9	-35.3	177.1	-75.9	169.5	172.4	0	0	111	Y946 R949 V998 V1005 L1006	Y946-E1002 VanDerWaalsContact CE1-OE1 3.27Å; Y946-E1002 WeakPolarHBondContact CE1-OE1 3.16Å; Y946-E1002 WeakPolarHBondContact OH-CG 3.29Å; Y946-E1002 PolarHBondContact OH-OE1 3.4Å; R949-E1002 IonicContact NH1-OE1 2.67Å; V998-E1002 VanDerWaalsContact CG1-CD 3.43Å; V998-E1002 HydrophobicContact CG1-CG 4.04Å; V998-E1002 VanDerWaalsContact CG1-OE1 3.23Å; V998-E1002 WeakPolarHBondContact CG1-OE1 3.47Å; V998-E1002 WeakPolarHBondContact O-CB 3.38Å; V998-E1002 WeakPolarHBondContact O-CG 3.44Å; V998-E1002 PolarHBondContact O-N 2.9Å; E1002-V1005 PolarHBondContact O-N 2.83Å; E1002-L1006 VanDerWaalsContact O-CB 3.3Å; E1002-L1006 WeakPolarHBondContact O-CB 3.44Å; E1002-L1006 PolarHBondContact O-N 3.24Å
1003	R	89.1	Confident	81.5	Confident	130 Å²	130	77.5 Å²	77.5	49%	0.491	41%	0.407	S	S	.	.	H	α-helix	trans	-67.6	-40.8	171	-162	-174.2	-45.7	109.6	16.7	112.5	A999 D1000 L1001 V1005 L1006 V1007	A999-R1003 WeakPolarHBondContact O-CB 3.49Å; A999-R1003 PolarHBondContact O-N 3.03Å; A999-R1003 VanDerWaalsContact O-N 3.14Å; A999-R1003 PolarHBondContact O-NH2 2.96Å; D1000-R1003 PolarHBondContact O-N 2.94Å; D1000-R1003 IonicContact OD1-CZ 2.82Å; D1000-R1003 IonicContact OD1-NH1 2.85Å; D1000-R1003 PolarHBondContact OD1-NH1 3.02Å; D1000-R1003 IonicContact OD1-NH2 3.92Å; D1000-R1003 PolarHBondContact OD1-NH2 2.7Å; L1001-R1003 VanDerWaalsContact C-N 3.27Å; L1001-R1003 PolarHBondContact O-N 3Å; R1003-V1005 VanDerWaalsContact C-N 3.27Å; R1003-V1005 PolarHBondContact O-N 3.47Å; R1003-L1006 PolarHBondContact O-N 3.48Å; R1003-V1007 WeakPolarHBondContact O-CB 3.47Å; R1003-V1007 VanDerWaalsContact O-CG2 3.3Å; R1003-V1007 WeakPolarHBondContact O-CG2 3.48Å; R1003-V1007 PolarHBondContact O-N 3.46Å
1004	E	88.6	Confident	79.2	Confident	108 Å²	108	85.2 Å²	85.2	51%	0.505	44%	0.443	S	S	.	.	H	α-helix	trans	-63.3	-34.4	174.6	-160.1	-165.2	144.9	0	0	111.7	D1000 L1001 K1008	D1000-E1004 PolarHBondContact O-N 3.2Å; L1001-E1004 WeakPolarHBondContact O-CB 3.41Å; L1001-E1004 PolarHBondContact O-N 3.03Å; L1001-E1004 VanDerWaalsContact O-N 3.12Å; E1004-K1008 VanDerWaalsContact CD-NZ 3.33Å; E1004-K1008 WeakPolarHBondContact O-CD 3.23Å; E1004-K1008 VanDerWaalsContact O-CG 3.27Å; E1004-K1008 WeakPolarHBondContact O-CG 3.44Å; E1004-K1008 PolarHBondContact O-N 3.32Å; E1004-K1008 WeakPolarHBondContact OE1-CE 3.41Å; E1004-K1008 IonicContact OE1-NZ 2.69Å; E1004-K1008 PolarHBondContact OE1-NZ 2.81Å
1005	V	84.2	Confident	76.6	Confident	62 Å²	62	95.4 Å²	95.4	38%	0.376	49%	0.487	S	S	.	.	H	α-helix	trans	-72.9	-46.1	173.7	172	0	0	0	0	111.3	L1001 E1002 R1003 V1007 K1008 L1009	L1001-V1005 WeakPolarHBondContact O-CG2 3.24Å; L1001-V1005 PolarHBondContact O-N 2.9Å; E1002-V1005 PolarHBondContact O-N 2.83Å; R1003-V1005 VanDerWaalsContact C-N 3.27Å; R1003-V1005 PolarHBondContact O-N 3.47Å; V1005-V1007 VanDerWaalsContact C-N 3.29Å; V1005-V1007 PolarHBondContact O-N 2.92Å; V1005-K1008 CarbonylContact O-C 3.55Å; V1005-K1008 WeakPolarHBondContact O-CA 3.46Å; V1005-K1008 WeakPolarHBondContact O-CB 3.02Å; V1005-K1008 PolarHBondContact O-N 3.18Å; V1005-L1009 HydrophobicContact CG1-CD1 3.79Å; V1005-L1009 HydrophobicContact CG1-CG 4.27Å; V1005-L1009 WeakPolarHBondContact O-CG 3.43Å; V1005-L1009 PolarHBondContact O-N 3.16Å
1006	L	80.3	Confident	73.9	Confident	76 Å²	76	101 Å²	101	40%	0.398	52%	0.515	S	S	.	.	H	α-helix	trans	-60	-38	179.3	-166.1	75.7	0	0	0	112.3	E1002 R1003 L1009 G1010 M1011 A1012	E1002-L1006 VanDerWaalsContact O-CB 3.3Å; E1002-L1006 WeakPolarHBondContact O-CB 3.44Å; E1002-L1006 PolarHBondContact O-N 3.24Å; R1003-L1006 PolarHBondContact O-N 3.48Å; L1006-L1009 PolarHBondContact O-N 3.17Å; L1006-G1010 PolarHBondContact O-N 3.42Å; L1006-M1011 HydrophobicContact CD1-CB 3.71Å; L1006-M1011 HydrophobicContact CD1-SD 4.38Å; L1006-M1011 HydrophobicContact CG-CB 4.11Å; L1006-M1011 PolarHBondContact O-N 2.9Å; L1006-M1011 VanDerWaalsContact O-N 3.16Å; L1006-A1012 HydrophobicContact CD2-CB 4.35Å; L1006-A1012 HydrophobicContact CG-CB 4.41Å
1007	V	85.6	Confident	71	Confident	93 Å²	93	97.4 Å²	97.4	56%	0.564	52%	0.523	S	S	*	.	H	α-helix	trans	-65.8	-38.5	173.3	168.6	0	0	0	0	111.7	R1003 V1005 G1010 A1012	R1003-V1007 WeakPolarHBondContact O-CB 3.47Å; R1003-V1007 VanDerWaalsContact O-CG2 3.3Å; R1003-V1007 WeakPolarHBondContact O-CG2 3.48Å; R1003-V1007 PolarHBondContact O-N 3.46Å; V1005-V1007 VanDerWaalsContact C-N 3.29Å; V1005-V1007 PolarHBondContact O-N 2.92Å; V1007-G1010 PolarHBondContact O-N 3.34Å; V1007-A1012 HydrophobicContact CG2-CB 3.91Å
1008	K	80	Confident	68.3	Low	145 Å²	145	107.5 Å²	107.5	63%	0.63	56%	0.559	S	S	*	*	H	α-helix	trans	-72.5	-26.7	175.7	-70.5	165	-170.1	160.6	0	113.5	E1004 V1005 G1010	E1004-K1008 VanDerWaalsContact CD-NZ 3.33Å; E1004-K1008 WeakPolarHBondContact O-CD 3.23Å; E1004-K1008 VanDerWaalsContact O-CG 3.27Å; E1004-K1008 WeakPolarHBondContact O-CG 3.44Å; E1004-K1008 PolarHBondContact O-N 3.32Å; E1004-K1008 WeakPolarHBondContact OE1-CE 3.41Å; E1004-K1008 IonicContact OE1-NZ 2.69Å; E1004-K1008 PolarHBondContact OE1-NZ 2.81Å; V1005-K1008 CarbonylContact O-C 3.55Å; V1005-K1008 WeakPolarHBondContact O-CA 3.46Å; V1005-K1008 WeakPolarHBondContact O-CB 3.02Å; V1005-K1008 PolarHBondContact O-N 3.18Å; K1008-G1010 VanDerWaalsContact C-N 3.26Å
1009	L	73.8	Confident	65.2	Low	118 Å²	118	112.9 Å²	112.9	62%	0.618	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	0.9	172.7	-66	173.2	0	0	0	112.7	V1005 L1006 M1011	V1005-L1009 HydrophobicContact CG1-CD1 3.79Å; V1005-L1009 HydrophobicContact CG1-CG 4.27Å; V1005-L1009 WeakPolarHBondContact O-CG 3.43Å; V1005-L1009 PolarHBondContact O-N 3.16Å; L1006-L1009 PolarHBondContact O-N 3.17Å; L1009-M1011 HydrophobicContact CB-CG 4.19Å; L1009-M1011 WeakPolarHBondContact O-CG 3.48Å; L1009-M1011 PolarHBondContact O-N 2.7Å
1010	G	60.8	Low	62.2	Low	65 Å²	65	116.7 Å²	116.7	67%	0.67	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.2	-0.7	177.7	0	0	0	0	0	115.7	L1006 V1007 K1008 A1012	L1006-G1010 PolarHBondContact O-N 3.42Å; V1007-G1010 PolarHBondContact O-N 3.34Å; K1008-G1010 VanDerWaalsContact C-N 3.26Å; G1010-A1012 PolarHBondContact O-N 3.42Å; G1010-A1012 VanDerWaalsContact O-N 3.15Å
1011	M	56.5	Low	59.2	Low	142 Å²	142	117.7 Å²	117.7	70%	0.7	64%	0.639	S	S	*	*			trans	-83.3	14.6	-170.4	-54.7	-174.6	81.2	0	0	114.4	L1006 L1009	L1006-M1011 HydrophobicContact CD1-CB 3.71Å; L1006-M1011 HydrophobicContact CD1-SD 4.38Å; L1006-M1011 HydrophobicContact CG-CB 4.11Å; L1006-M1011 PolarHBondContact O-N 2.9Å; L1006-M1011 VanDerWaalsContact O-N 3.16Å; L1009-M1011 HydrophobicContact CB-CG 4.19Å; L1009-M1011 WeakPolarHBondContact O-CG 3.48Å; L1009-M1011 PolarHBondContact O-N 2.7Å
1012	A	45.7	Very low	56.1	Low	50 Å²	50	125.7 Å²	125.7	41%	0.413	68%	0.678	S	S	.	*			trans	-112	81.9	-170.7	0	0	0	0	0	112.5	L1006 V1007 G1010	L1006-A1012 HydrophobicContact CD2-CB 4.35Å; L1006-A1012 HydrophobicContact CG-CB 4.41Å; V1007-A1012 HydrophobicContact CG2-CB 3.91Å; G1010-A1012 PolarHBondContact O-N 3.42Å; G1010-A1012 VanDerWaalsContact O-N 3.15Å
1013	M	41.1	Very low	53.1	Low	179 Å²	179	127.1 Å²	127.1	88%	0.882	70%	0.697	S	S	*	*			trans	-127.1	134.3	163.9	-93.1	-165.2	168.4	0	0	113.6
1014	E	43.9	Very low	50.3	Low	181 Å²	181	129.8 Å²	129.8	85%	0.846	72%	0.715	S	S	*	*			trans	43.7	107.7	160.5	-55.2	-158	158.1	0	0	120.5
1015	K	38.1	Very low	47.4	Very low	214 Å²	214	128.6 Å²	128.6	93%	0.93	73%	0.731	S	S	*	*			trans	-151.8	87.5	135.7	-128.2	169.5	-170.3	169.4	0	112.9
1016	D	36.2	Very low	44.7	Very low	171 Å²	171	134.3 Å²	134.3	91%	0.914	75%	0.754	S	S	*	*			trans	-133.7	93.5	159.6	-158.3	0.7	0	0	0	108.4
1017	G	34.1	Very low	43.1	Very low	70 Å²	70	134.9 Å²	134.9	72%	0.722	76%	0.762	S	S	*	*			trans	-176.5	79.8	-161.3	0	0	0	0	0	112
1018	R	35.7	Very low	40.4	Very low	251 Å²	251	137 Å²	137	95%	0.947	77%	0.77	S	S	*	*			trans	-92	107.9	-167.1	-179.7	-172	-173.7	172.5	3.6	113.1
1019	S	27.5	Very low	37.9	Very low	114 Å²	114	135.1 Å²	135.1	80%	0.797	77%	0.767	S	S	*	*			trans	-152.2	132.6	157.8	56.1	0	0	0	0	113.4
1020	S	29.3	Very low	35.9	Very low	120 Å²	120	136.1 Å²	136.1	84%	0.839	77%	0.768	S	S	*	*			trans	-66	155.5	176.6	-37.7	0	0	0	0	113.8
1021	A	30	Very low	34.3	Very low	90 Å²	90	140.2 Å²	140.2	74%	0.744	77%	0.77	S	S	*	*				176.2	125.1	104.8	0	0	0	0	0	115.7
1022	M	27.7	Very low	33.1	Very low	183 Å²	183	139.2 Å²	139.2	90%	0.901	77%	0.767	S	S	*	*			trans	68.9	163.5	137.5	-68.8	-160.7	68.8	0	0	123.5
1023	S	27.7	Very low	32.4	Very low	107 Å²	107	144.6 Å²	144.6	75%	0.748	78%	0.784	S	S	*	*			trans	67.9	114.8	-174.1	-134.7	0	0	0	0	113.6
1024	E	30	Very low	32.1	Very low	187 Å²	187	142.4 Å²	142.4	87%	0.874	78%	0.776	S	S	*	*			cis	58.7	119.5	47.8	-61.9	-165.8	165.6	0	0	113.4
1025	G	28.4	Very low	31.6	Very low	82 Å²	82	141.2 Å²	141.2	85%	0.845	77%	0.77	S	S	*	*			trans	164.5	54.1	-171.5	0	0	0	0	0	113.5
1026	E	26.3	Very low	31.3	Very low	183 Å²	183	137.7 Å²	137.7	86%	0.855	76%	0.762	S	S	*	*			trans	-76.8	170.9	156	-111.2	-171.9	-151.4	0	0	109.2
1027	P	46.3	Very low	31.1	Very low	88 Å²	88	137.2 Å²	137.2	57%	0.571	75%	0.754	S	S	*	*			cis	-131.8	-155.5	-22.7	23.3	2.8	0	0	0	110.4
1028	L	29.6	Very low	31	Very low	137 Å²	137	142.8 Å²	142.8	72%	0.717	76%	0.761	S	S	*	*			trans	73.2	153.2	153.7	-51.7	-174.6	0	0	0	117.6
1029	D	28.2	Very low	30.8	Very low	106 Å²	106	134 Å²	134	57%	0.567	75%	0.749	S	S	*	*			cis	-156.3	163.5	-13.2	-110.1	-18.5	0	0	0	112.5
1030	E	30.6	Very low	30.8	Very low	138 Å²	138	133.8 Å²	133.8	65%	0.645	75%	0.754	S	S	*	*			trans	44.7	132.5	137.2	-63.2	168.7	164.3	0	0	122.3
1031	E	28.1	Very low	31.2	Very low	152 Å²	152	131.7 Å²	131.7	71%	0.71	74%	0.743	S	S	*	*				69.8	150	127.8	-66.1	171.2	-174.8	0	0	119.4
1032	D	30.7	Very low	31.1	Very low	120 Å²	120	134.5 Å²	134.5	64%	0.642	75%	0.746	S	S	*	*			cis	-161.6	-179	-7.8	-125.4	-22.4	0	0	0	111.1
1033	E	31.8	Very low	31.2	Very low	163 Å²	163	131 Å²	131	76%	0.762	74%	0.735	S	S	*	*			trans	60.2	155.6	147.8	-74.3	171.5	-178.9	0	0	120.2
1034	D	33.8	Very low	31.2	Very low	133 Å²	133	133.9 Å²	133.9	71%	0.711	74%	0.737	S	S	*	*			cis	-163	173.8	-40.5	-128.2	-20.6	0	0	0	110.5
1035	E	34	Very low	31.1	Very low	157 Å²	157	131.9 Å²	131.9	73%	0.734	73%	0.728	S	S	*	*			trans	53.8	131.3	152.8	-68	-177.6	157.8	0	0	123.5
1036	D	31.1	Very low	31	Very low	140 Å²	140	135.6 Å²	135.6	75%	0.749	72%	0.723	S	S	*	*			trans	64.6	162	134.1	-63.6	1.1	0	0	0	123.3
1037	E	32.6	Very low	31	Very low	161 Å²	161	132.6 Å²	132.6	75%	0.752	72%	0.722	S	S	*	*			cis	-160.8	165.3	-38.7	-166.2	177.7	-155.1	0	0	107
1038	E	31.1	Very low	29.9	Very low	187 Å²	187	131.6 Å²	131.6	87%	0.874	73%	0.728	S	S	*	*			trans	64.9	160.1	173.7	-55.2	-161.3	143.9	0	0	116.6
1039	G	32.3	Very low	29.8	Very low	67 Å²	67	131.7 Å²	131.7	69%	0.691	73%	0.729	S	S	*	*			cis	156.2	123	-11.8	0	0	0	0	0	112.9
1040	A	27.2	Very low	29.7	Very low	108 Å²	108	136 Å²	136	89%	0.893	75%	0.745	S	S	*	*			trans	64.3	166.7	174.8	0	0	0	0	0	116.9
1041	A	37.7	Very low	29.6	Very low	76 Å²	76	133.7 Å²	133.7	63%	0.628	75%	0.745	S	S	*	*			cis	-169.9	162.8	-38.8	0	0	0	0	0	108.7
1042	D	28.8	Very low	29.7	Very low	150 Å²	150	135.5 Å²	135.5	80%	0.802	75%	0.753	S	S	*	*			trans	64	151.2	167.8	-60.6	-20.9	0	0	0	116.6
1043	T	29.3	Very low	29.4	Very low	108 Å²	108	138.5 Å²	138.5	66%	0.663	77%	0.766	S	S	*	*			cis	-156	163.1	-7.2	6.5	0	0	0	0	109.8
1044	E	27.8	Very low	29.3	Very low	168 Å²	168	137 Å²	137	79%	0.785	76%	0.763	S	S	*	*			trans	63.4	159	153.6	-76	168.3	-134.7	0	0	118.4
1045	E	27.3	Very low	29	Very low	146 Å²	146	137.6 Å²	137.6	68%	0.682	76%	0.761	S	S	*	*			cis	-151	165.1	-36.7	-137.4	-168.1	-150.4	0	0	109.2
1046	Q	26.5	Very low	28.6	Very low	160 Å²	160	137.5 Å²	137.5	75%	0.748	76%	0.761	S	S	*	*			trans	50	123.8	158.3	-64.8	-173.2	44.6	0	0	122.7
1047	S	26.4	Very low	28.5	Very low	120 Å²	120	138.9 Å²	138.9	84%	0.839	76%	0.763	S	S	*	*				64	116.3	128.3	-176.7	0	0	0	0	121.4
1048	G	24.3	Very low	28.3	Very low	67 Å²	67	140 Å²	140	69%	0.691	77%	0.768	S	S	*	*				127.1	87.6	121.6	0	0	0	0	0	119.1
1049	N	26.3	Very low	28.1	Very low	139 Å²	139	138.3 Å²	138.3	74%	0.743	77%	0.765	S	S	*	*			trans	56.8	99.8	135.1	-166.6	86	0	0	0	119.7
1050	E	26.1	Very low	27.9	Very low	195 Å²	195	144 Å²	144	91%	0.911	77%	0.774	S	S	*	*			trans	-99.3	129.8	153.2	-75	-72.3	166.4	0	0	108.6
1051	S	28.6	Very low	27.9	Very low	91 Å²	91	142.5 Å²	142.5	64%	0.636	77%	0.769	S	S	*	*			trans	-114.2	174.9	-164	51.2	0	0	0	0	114.4
1052	E	29.6	Very low	27.4	Very low	190 Å²	190	143.8 Å²	143.8	89%	0.888	77%	0.773	S	S	*	*			trans	-58.3	153.2	173.1	-62.3	-178.2	128.3	0	0	112.2	N1054	E1052-N1054 PolarHBondContact O-N 2.91Å
1053	M	25.8	Very low	27.2	Very low	183 Å²	183	144.9 Å²	144.9	90%	0.901	77%	0.773	S	S	*	*			trans	-68.8	118.4	179	-72.8	170.5	54	0	0	111.9
1054	N	27.9	Very low	27.1	Very low	131 Å²	131	145.6 Å²	145.6	70%	0.701	77%	0.773	S	S	*	*				27	133.8	121.8	-138.6	26.3	0	0	0	116.8	E1052	E1052-N1054 PolarHBondContact O-N 2.91Å
1055	E	28.4	Very low	27.1	Very low	145 Å²	145	145 Å²	145	68%	0.678	77%	0.771	S	S	*	*				-157.5	145.7	52.7	-83.9	173.2	163	0	0	114.7
1056	Q	26.6	Very low	27	Very low	155 Å²	155	146.5 Å²	146.5	72%	0.724	78%	0.777	S	S	*	*			trans	68.3	149.5	137.9	-74.7	175.3	-7.9	0	0	120.5
1057	E	27.3	Very low	26.9	Very low	170 Å²	170	146.8 Å²	146.8	79%	0.794	78%	0.779	S	S	*	*			cis	-131.4	178	5.3	-68.6	-170.8	132.1	0	0	113.6
1058	E	29.3	Very low	26.9	Very low	184 Å²	184	147.3 Å²	147.3	86%	0.86	77%	0.768	S	S	*	*			trans	-40.2	153.7	174.8	-52.8	169	161	0	0	116
1059	D	27.2	Very low	26.9	Very low	151 Å²	151	152.3 Å²	152.3	81%	0.807	77%	0.766	S	S	*	*				-178.8	-171.1	57.2	-163.4	8.9	0	0	0	112.6
1060	E	28.5	Very low	26.9	Very low	188 Å²	188	152.8 Å²	152.8	88%	0.879	76%	0.764	S	S	*	*			trans	-58.9	156.4	-171.3	-65.3	-179.9	168.5	0	0	120.1
1061	G	26.3	Very low	27	Very low	76 Å²	76	152.3 Å²	152.3	78%	0.784	76%	0.761	S	S	*	*			trans	143.6	92.7	135.1	0	0	0	0	0	122.5
1062	S	27	Very low	26.8	Very low	103 Å²	103	156.4 Å²	156.4	72%	0.72	77%	0.771	S	S	*	*			trans	52.2	136	140	-131.9	0	0	0	0	125.7
1063	E	24.4	Very low	26.8	Very low	172 Å²	172	155.7 Å²	155.7	80%	0.804	77%	0.767	S	S	*	*			trans	66.7	110.1	138.7	-76.7	162.2	154	0	0	124.6
1064	N	26.8	Very low	26.9	Very low	124 Å²	124	154.2 Å²	154.2	66%	0.663	76%	0.758	S	S	*	*				57.9	127.7	122.1	-81.9	32.3	0	0	0	126.1
1065	E	28.6	Very low	26.9	Very low	156 Å²	156	155 Å²	155	73%	0.729	76%	0.758	S	S	*	*				79.1	144.7	127	-71.9	168.4	158.2	0	0	123.6
1066	E	25.1	Very low	26.8	Very low	177 Å²	177	153.2 Å²	153.2	83%	0.827	75%	0.753	S	S	*	*			trans	61	164.5	155.4	-72.3	176.9	-167.8	0	0	119.8
1067	E	25.1	Very low	26.8	Very low	165 Å²	165	151.6 Å²	151.6	77%	0.771	75%	0.754	S	S	*	*				-162.8	157.9	-51.3	-136.5	-176.1	-153.3	0	0	108.7
1068	E	25.5	Very low	26.9	Very low	131 Å²	131	150.1 Å²	150.1	61%	0.612	75%	0.751	S	S	*	*			trans	47.9	159	157.7	-67.9	-148.3	142.1	0	0	125.1
1069	R	24.1	Very low	26.7	Very low	172 Å²	172	150.8 Å²	150.8	65%	0.649	75%	0.747	S	S	*	*			trans	78.3	127.7	157.1	-74.5	149.4	-158.6	-48	-25.3	118.6
1070	E	27.1	Very low	26.8	Very low	150 Å²	150	151 Å²	151	70%	0.701	75%	0.747	S	S	*	*				66	145.7	56.6	-56.6	173.5	150.2	0	0	111.1
1071	E	26.8	Very low	26.8	Very low	184 Å²	184	147 Å²	147	86%	0.86	74%	0.736	S	S	*	*			cis	-112.3	-154.4	8	-66.4	159.1	121	0	0	109.9
1072	E	26.2	Very low	26.8	Very low	178 Å²	178	150.3 Å²	150.3	83%	0.832	74%	0.736	S	S	*	*			cis	-153.1	-154	9	-154.8	179.7	-146	0	0	110
1073	E	29.6	Very low	26.8	Very low	174 Å²	174	149.7 Å²	149.7	81%	0.813	73%	0.731	S	S	*	*			trans	-103.9	-173.9	-161.4	-69.2	167.9	157.9	0	0	115.7
1074	E	28	Very low	27.1	Very low	152 Å²	152	147.8 Å²	147.8	71%	0.71	73%	0.727	S	S	*	*			cis	-132.1	-153.4	-1.5	-139	-147.8	120.2	0	0	109
1075	E	26.8	Very low	27.2	Very low	149 Å²	149	150.2 Å²	150.2	70%	0.696	73%	0.731	S	S	*	*			cis	-148.8	166.4	12.6	-150.9	-144.2	135.4	0	0	112.5
1076	N	26.3	Very low	27.1	Very low	107 Å²	107	152.2 Å²	152.2	57%	0.572	74%	0.741	S	S	*	*			trans	-13.2	146.2	159.8	-76.8	-59.8	0	0	0	119.8
1077	T	27	Very low	27.4	Very low	121 Å²	121	150.8 Å²	150.8	74%	0.742	74%	0.739	S	S	*	*			cis	-164.3	157.2	45.8	6.8	0	0	0	0	113.5
1078	D	28.2	Very low	27.4	Very low	138 Å²	138	151.5 Å²	151.5	74%	0.738	74%	0.742	S	S	*	*			trans	47.5	110.2	164.1	-75	-10.7	0	0	0	120.3
1079	Y	26.3	Very low	27.5	Very low	199 Å²	199	150.4 Å²	150.4	78%	0.78	75%	0.745	S	S	*	*				58.5	115.4	83.6	-88.1	-94.6	0	0	0	113.9
1080	L	29.5	Very low	27.7	Very low	154 Å²	154	149 Å²	149	81%	0.806	75%	0.75	S	S	*	*			cis	-144.4	143.5	47	-102.8	162.4	0	0	0	114.9
1081	T	28.8	Very low	27.8	Very low	105 Å²	105	150.2 Å²	150.2	64%	0.644	76%	0.756	S	S	*	*			trans	-70.2	174.1	164.7	39.1	0	0	0	0	111.7
1082	D	26	Very low	27.9	Very low	145 Å²	145	149.3 Å²	149.3	78%	0.775	75%	0.751	S	S	*	*			cis	-155.5	170.7	31	-144.8	-8.3	0	0	0	116.9
1083	S	27.1	Very low	28.1	Very low	90 Å²	90	146.9 Å²	146.9	63%	0.629	74%	0.744	S	S	*	*			trans	-133.3	152.1	176.3	-66.5	0	0	0	0	111.7
1084	N	29.5	Very low	28	Very low	133 Å²	133	143.2 Å²	143.2	71%	0.711	73%	0.73	S	S	*	*			trans	71.4	132.8	153.8	-69.9	-47.3	0	0	0	120.9
1085	K	30.4	Very low	28	Very low	175 Å²	175	141 Å²	141	76%	0.761	72%	0.719	S	S	*	*			trans	50.5	129.6	130	-57.6	173.1	-177.1	177.5	0	120.3
1086	E	26.8	Very low	28.1	Very low	198 Å²	198	138.6 Å²	138.6	93%	0.925	72%	0.715	S	S	*	*				-139.4	163.5	111	-118.2	163.6	-158.5	0	0	109.7
1087	N	29.6	Very low	28.2	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	72%	0.718	S	S	*	*			trans	-101.9	151.5	178	-64	-35.5	0	0	0	109.5
1088	E	26.4	Very low	28.3	Very low	180 Å²	180	140.6 Å²	140.6	84%	0.841	72%	0.723	S	S	*	*				-170.8	146.2	127.9	-108.1	170.4	-165.1	0	0	113.9
1089	T	27.9	Very low	28.3	Very low	109 Å²	109	144.4 Å²	144.4	67%	0.669	73%	0.727	S	S	*	*			trans	43.3	126.7	153.9	56.7	0	0	0	0	123.5
1090	D	27.7	Very low	28.6	Very low	141 Å²	141	139 Å²	139	75%	0.754	73%	0.732	S	S	*	*				77.8	123.4	127.4	-58.4	-8.5	0	0	0	124.1
1091	E	29.4	Very low	28.5	Very low	177 Å²	177	135.4 Å²	135.4	83%	0.827	73%	0.732	S	S	*	*			trans	74.5	136.6	135.8	-68.2	-170.6	159.6	0	0	124.4
1092	E	29.4	Very low	28.7	Very low	164 Å²	164	133.8 Å²	133.8	77%	0.766	74%	0.736	S	S	*	*			trans	65.2	118	153.6	-69.1	-148.4	176.5	0	0	124.8
1093	N	28.6	Very low	29.1	Very low	128 Å²	128	135.7 Å²	135.7	68%	0.684	75%	0.745	S	S	*	*				73.9	138.8	129.2	-77.3	-45.5	0	0	0	124.2
1094	N	27.8	Very low	29.3	Very low	97 Å²	97	141 Å²	141	52%	0.519	76%	0.757	S	S	.	*			trans	60.3	106.6	151.5	-89.9	21	0	0	0	122.1	E85	E85-N1094 PolarHBondContact OE1-ND2 3.09Å
1095	E	28	Very low	29.7	Very low	104 Å²	104	142.1 Å²	142.1	49%	0.486	76%	0.758	S	S	.	*				64.9	129.8	108.3	-156.4	-145.5	175.5	0	0	120.5	K81	K81-E1095 WeakPolarHBondContact CE-OE1 3.19Å; K81-E1095 WeakPolarHBondContact CE-OE2 3.41Å; K81-E1095 IonicContact NZ-OE1 3.66Å; K81-E1095 IonicContact NZ-OE2 2.81Å; K81-E1095 PolarHBondContact NZ-OE2 3.05Å
1096	V	29.2	Very low	30.3	Very low	99 Å²	99	139.2 Å²	139.2	60%	0.6	76%	0.755	S	S	*	*				172.1	116.4	121.5	155.4	0	0	0	0	112.7	K81	K81-V1096 VanDerWaalsContact CE-CG2 3.47Å
1097	T	27.8	Very low	31.2	Very low	104 Å²	104	133.9 Å²	133.9	64%	0.638	74%	0.744	S	S	*	*			trans	16	114.2	141.2	-34.9	0	0	0	0	120.2	R1099	T1097-R1099 PolarHBondContact O-N 3.17Å
1098	I	30.5	Very low	32.1	Very low	167 Å²	167	129.9 Å²	129.9	86%	0.856	73%	0.727	S	S	*	*			trans	-79.9	114.1	154.1	-65.1	179.1	0	0	0	109.2
1099	R	28.4	Very low	33.5	Very low	218 Å²	218	125.2 Å²	125.2	82%	0.823	72%	0.719	S	S	*	*			trans	-75.9	144.5	163.1	-87.8	-175	167.2	-130.4	-4.1	110.1	T1097	T1097-R1099 PolarHBondContact O-N 3.17Å
1100	G	30.9	Very low	34.8	Very low	85 Å²	85	127.2 Å²	127.2	88%	0.876	72%	0.721	S	S	*	*			trans	-61.5	141.4	-177.1	0	0	0	0	0	114.3
1101	G	28.6	Very low	36	Very low	79 Å²	79	123.3 Å²	123.3	81%	0.814	70%	0.7	S	S	*	*			trans	-140.9	83.8	172.5	0	0	0	0	0	109.9
1102	G	33.3	Very low	37.4	Very low	70 Å²	70	121.3 Å²	121.3	72%	0.722	69%	0.691	S	S	*	*			trans	-65.7	158.4	173.2	0	0	0	0	0	112	K1104	G1102-K1104 PolarHBondContact O-N 2.92Å
1103	L	33.2	Very low	39.3	Very low	185 Å²	185	118.9 Å²	118.9	97%	0.969	68%	0.683	S	S	*	*			trans	-54.7	126.1	175.1	-72.3	163.2	0	0	0	110.2	H1105	L1103-H1105 PolarHBondContact O-N 3.28Å
1104	K	32.7	Very low	40.8	Very low	201 Å²	201	119.5 Å²	119.5	87%	0.874	68%	0.68	S	S	*	*			trans	-75.5	114.7	175.1	-73.1	-178.9	178.7	177.3	0	109.2	G1102 V1106	G1102-K1104 PolarHBondContact O-N 2.92Å; K1104-V1106 PolarHBondContact O-N 2.98Å
1105	H	37.3	Very low	42.8	Very low	157 Å²	157	119.2 Å²	119.2	73%	0.727	68%	0.677	S	S	*	*			trans	-60	126.4	164.5	-159.7	-78.4	0	0	0	108.9	L1103 D1111	L1103-H1105 PolarHBondContact O-N 3.28Å; H1105-D1111 IonicContact CE1-OD2 3.72Å
1106	V	42.4	Very low	44.9	Very low	115 Å²	115	119.8 Å²	119.8	70%	0.697	68%	0.68	S	S	*	*			trans	-95.5	115.9	166.5	178.6	0	0	0	0	105.3	K1104 C1108	K1104-V1106 PolarHBondContact O-N 2.98Å; V1106-C1108 PolarHBondContact O-N 3.38Å
1107	A	45.3	Very low	46.9	Very low	85 Å²	85	117.9 Å²	117.9	70%	0.702	68%	0.675	S	S	*	*			trans	-72.3	122.6	175.5	0	0	0	0	0	109.3
1108	C	49.6	Very low	48.5	Very low	62 Å²	62	116.4 Å²	116.4	42%	0.419	66%	0.663	S	S	.	*			trans	-96.1	151.3	173.5	-73.2	0	0	0	0	109.5	V1106 E1110 D1111	V1106-C1108 PolarHBondContact O-N 3.38Å; C1108-E1110 PolarHBondContact O-N 2.7Å; C1108-D1111 PolarHBondContact N-OD2 3.15Å; C1108-D1111 VanDerWaalsContact O-CB 3.31Å; C1108-D1111 WeakPolarHBondContact O-CB 3.18Å; C1108-D1111 PolarHBondContact O-N 3.11Å
1109	A	55.8	Low	50.3	Low	83 Å²	83	112.9 Å²	112.9	69%	0.686	65%	0.646	S	S	*	*	H	α-helix	trans	-61.1	-28.2	176.6	0	0	0	0	0	112.3	D1111 E1112 D1113	A1109-D1111 PolarHBondContact O-N 3.48Å; A1109-E1112 PolarHBondContact O-N 2.85Å; A1109-D1113 PolarHBondContact O-N 3.07Å
1110	E	54.1	Low	52.3	Low	150 Å²	150	108.5 Å²	108.5	70%	0.701	63%	0.632	S	S	*	*	H	α-helix	trans	-63	-25	175	-63.7	161	162.2	0	0	112.6	C1108 F1114	C1108-E1110 PolarHBondContact O-N 2.7Å; E1110-F1114 VanDerWaalsContact O-CB 3.27Å; E1110-F1114 WeakPolarHBondContact O-CB 3.37Å; E1110-F1114 PolarHBondContact O-N 3.05Å
1111	D	54.6	Low	54	Low	60 Å²	60	109.5 Å²	109.5	32%	0.321	62%	0.616	S	S	.	*	H	α-helix	trans	-69.5	-39.3	175	-60.2	-38.1	0	0	0	111.3	H1105 C1108 A1109 F1114 I1115	H1105-D1111 IonicContact CE1-OD2 3.72Å; C1108-D1111 PolarHBondContact N-OD2 3.15Å; C1108-D1111 VanDerWaalsContact O-CB 3.31Å; C1108-D1111 WeakPolarHBondContact O-CB 3.18Å; C1108-D1111 PolarHBondContact O-N 3.11Å; A1109-D1111 PolarHBondContact O-N 3.48Å; D1111-F1114 PolarHBondContact O-N 3.26Å; D1111-I1115 WeakPolarHBondContact O-CB 3.31Å; D1111-I1115 VanDerWaalsContact O-CG1 3.26Å; D1111-I1115 WeakPolarHBondContact O-CG1 3.26Å; D1111-I1115 PolarHBondContact O-N 3.37Å
1112	E	58.8	Low	55.6	Low	135 Å²	135	111.4 Å²	111.4	63%	0.631	61%	0.605	S	S	*	*	H	α-helix	trans	-74.8	-36.7	177.2	-71.9	-148	178.5	0	0	112.2	A1109 F1114 I1115 Q1116	A1109-E1112 PolarHBondContact O-N 2.85Å; E1112-F1114 VanDerWaalsContact C-N 3.31Å; E1112-I1115 PolarHBondContact O-N 2.87Å; E1112-Q1116 WeakPolarHBondContact O-CB 3.32Å; E1112-Q1116 VanDerWaalsContact O-CG 3.32Å; E1112-Q1116 WeakPolarHBondContact O-CG 3.44Å; E1112-Q1116 PolarHBondContact O-N 2.95Å
1113	D	67.7	Low	57	Low	113 Å²	113	112.8 Å²	112.8	60%	0.604	60%	0.595	S	S	*	*	H	α-helix	trans	-63.6	-38	171.2	-83.2	-17.5	0	0	0	111.2	A1109 A1117	A1109-D1113 PolarHBondContact O-N 3.07Å; D1113-A1117 VanDerWaalsContact O-CB 3.23Å; D1113-A1117 WeakPolarHBondContact O-CB 3.38Å; D1113-A1117 PolarHBondContact O-N 3.48Å
1114	F	61.3	Low	58	Low	140 Å²	140	108.7 Å²	108.7	61%	0.614	57%	0.571	S	S	*	*	H	α-helix	trans	-66.2	-45.1	174.1	-178.1	-98.1	0	0	0	112.3	E1110 D1111 E1112 A1117 L1118	E1110-F1114 VanDerWaalsContact O-CB 3.27Å; E1110-F1114 WeakPolarHBondContact O-CB 3.37Å; E1110-F1114 PolarHBondContact O-N 3.05Å; D1111-F1114 PolarHBondContact O-N 3.26Å; E1112-F1114 VanDerWaalsContact C-N 3.31Å; F1114-A1117 PolarHBondContact O-N 3.48Å; F1114-L1118 HydrophobicContact CE1-CD2 4.45Å; F1114-L1118 VanDerWaalsContact O-CB 3.32Å; F1114-L1118 WeakPolarHBondContact O-CB 3.41Å; F1114-L1118 PolarHBondContact O-N 3.33Å
1115	I	69.4	Low	58.6	Low	91 Å²	91	103 Å²	103	47%	0.467	55%	0.55	S	S	.	.	H	α-helix	trans	-65.1	-42.4	177.1	-70.4	165.4	0	0	0	110.9	D1111 E1112 A1117 L1118 D1119	D1111-I1115 WeakPolarHBondContact O-CB 3.31Å; D1111-I1115 VanDerWaalsContact O-CG1 3.26Å; D1111-I1115 WeakPolarHBondContact O-CG1 3.26Å; D1111-I1115 PolarHBondContact O-N 3.37Å; E1112-I1115 PolarHBondContact O-N 2.87Å; I1115-A1117 PolarHBondContact O-N 3.3Å; I1115-L1118 PolarHBondContact O-N 2.79Å; I1115-D1119 WeakPolarHBondContact O-CB 3.3Å; I1115-D1119 PolarHBondContact O-N 3.29Å
1116	Q	72.4	Confident	59.1	Low	117 Å²	117	101.6 Å²	101.6	55%	0.547	55%	0.547	S	S	.	.	H	α-helix	trans	-66.6	-35.6	175.8	-72.8	-178.4	51.7	0	0	112.4	E1112 K1120	E1112-Q1116 WeakPolarHBondContact O-CB 3.32Å; E1112-Q1116 VanDerWaalsContact O-CG 3.32Å; E1112-Q1116 WeakPolarHBondContact O-CG 3.44Å; E1112-Q1116 PolarHBondContact O-N 2.95Å; Q1116-K1120 WeakPolarHBondContact O-CB 2.95Å; Q1116-K1120 PolarHBondContact O-N 3.5Å
1117	A	71.7	Confident	59.2	Low	59 Å²	59	103 Å²	103	49%	0.488	55%	0.547	S	S	.	.	H	α-helix	trans	-66.3	-38.9	171.9	0	0	0	0	0	112	D1113 F1114 I1115 M1121	D1113-A1117 VanDerWaalsContact O-CB 3.23Å; D1113-A1117 WeakPolarHBondContact O-CB 3.38Å; D1113-A1117 PolarHBondContact O-N 3.48Å; F1114-A1117 PolarHBondContact O-N 3.48Å; I1115-A1117 PolarHBondContact O-N 3.3Å; A1117-M1121 WeakPolarHBondContact O-CB 3.36Å; A1117-M1121 PolarHBondContact O-N 2.66Å
1118	L	59.7	Low	59.2	Low	73 Å²	73	105.8 Å²	105.8	38%	0.382	55%	0.545	S	S	.	.	H	α-helix	trans	-68.4	-49.7	177.9	-176.4	63.2	0	0	0	111.8	F1114 I1115 K1120 M1121 M1122	F1114-L1118 HydrophobicContact CE1-CD2 4.45Å; F1114-L1118 VanDerWaalsContact O-CB 3.32Å; F1114-L1118 WeakPolarHBondContact O-CB 3.41Å; F1114-L1118 PolarHBondContact O-N 3.33Å; I1115-L1118 PolarHBondContact O-N 2.79Å; L1118-K1120 VanDerWaalsContact C-N 3.3Å; L1118-K1120 PolarHBondContact O-N 2.97Å; L1118-M1121 HydrophobicContact CD1-CE 4.33Å; L1118-M1121 PolarHBondContact O-N 3.45Å; L1118-M1121 VanDerWaalsContact O-N 3.15Å; L1118-M1122 WeakPolarHBondContact O-CG 3.41Å; L1118-M1122 PolarHBondContact O-N 2.95Å
1119	D	68.9	Low	58.7	Low	93 Å²	93	112.8 Å²	112.8	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-59	-42.7	174.6	-91.1	-13.6	0	0	0	110.9	I1115 M1122 L1123	I1115-D1119 WeakPolarHBondContact O-CB 3.3Å; I1115-D1119 PolarHBondContact O-N 3.29Å; D1119-M1122 PolarHBondContact O-N 3.43Å; D1119-L1123 WeakPolarHBondContact O-CB 3.47Å; D1119-L1123 PolarHBondContact O-N 2.83Å
1120	K	71.2	Confident	57.8	Low	125 Å²	125	114 Å²	114	54%	0.543	57%	0.566	S	S	.	*	H	α-helix	trans	-62.1	-44	174.5	-175.9	-178.4	170.5	-169.5	0	111.8	Q1116 L1118 M1122 L1123 E1124	Q1116-K1120 WeakPolarHBondContact O-CB 2.95Å; Q1116-K1120 PolarHBondContact O-N 3.5Å; L1118-K1120 VanDerWaalsContact C-N 3.3Å; L1118-K1120 PolarHBondContact O-N 2.97Å; K1120-M1122 VanDerWaalsContact C-N 3.29Å; K1120-M1122 PolarHBondContact O-N 3.35Å; K1120-L1123 PolarHBondContact O-N 2.92Å; K1120-E1124 WeakPolarHBondContact CE-OE1 3.13Å; K1120-E1124 IonicContact NZ-OE1 2.61Å; K1120-E1124 WeakPolarHBondContact O-CB 3.32Å; K1120-E1124 WeakPolarHBondContact O-CG 3.33Å; K1120-E1124 PolarHBondContact O-N 3.11Å
1121	M	66.3	Low	57.3	Low	107 Å²	107	110.2 Å²	110.2	53%	0.527	57%	0.567	S	S	.	*	H	α-helix	trans	-64.5	-34.6	176.7	-167.4	-177.1	78.9	0	0	111.8	A1117 L1118 N1125	A1117-M1121 WeakPolarHBondContact O-CB 3.36Å; A1117-M1121 PolarHBondContact O-N 2.66Å; L1118-M1121 HydrophobicContact CD1-CE 4.33Å; L1118-M1121 PolarHBondContact O-N 3.45Å; L1118-M1121 VanDerWaalsContact O-N 3.15Å; M1121-N1125 WeakPolarHBondContact O-CB 3.35Å; M1121-N1125 PolarHBondContact O-N 3.21Å; M1121-N1125 PolarHBondContact O-ND2 2.99Å
1122	M	61.4	Low	56.1	Low	118 Å²	118	115 Å²	115	58%	0.581	59%	0.587	S	S	*	*	H	α-helix	trans	-70.8	-40.6	174	-73.2	-172.7	64.2	0	0	112.3	L1118 D1119 K1120 N1125 L1126	L1118-M1122 WeakPolarHBondContact O-CG 3.41Å; L1118-M1122 PolarHBondContact O-N 2.95Å; D1119-M1122 PolarHBondContact O-N 3.43Å; K1120-M1122 VanDerWaalsContact C-N 3.29Å; K1120-M1122 PolarHBondContact O-N 3.35Å; M1122-N1125 PolarHBondContact O-N 3.13Å; M1122-L1126 VanDerWaalsContact O-CB 3.32Å; M1122-L1126 WeakPolarHBondContact O-CB 3.47Å; M1122-L1126 PolarHBondContact O-N 3.33Å
1123	L	62.9	Low	54.9	Low	100 Å²	100	112.9 Å²	112.9	52%	0.524	59%	0.593	S	S	.	*	H	α-helix	trans	-65.6	-41.5	173.9	-91.6	143.5	0	0	0	112.4	D1119 K1120 L1126 Q1127	D1119-L1123 WeakPolarHBondContact O-CB 3.47Å; D1119-L1123 PolarHBondContact O-N 2.83Å; K1120-L1123 PolarHBondContact O-N 2.92Å; L1123-L1126 PolarHBondContact O-N 2.88Å; L1123-Q1127 WeakPolarHBondContact O-CG 3.41Å; L1123-Q1127 PolarHBondContact O-N 3.11Å
1124	E	54	Low	53.2	Low	98 Å²	98	114.1 Å²	114.1	46%	0.458	61%	0.605	S	S	.	*	H	α-helix	trans	-65.3	-39.1	173.9	-74	179	176.2	0	0	111.3	K1120 Q1128	K1120-E1124 WeakPolarHBondContact CE-OE1 3.13Å; K1120-E1124 IonicContact NZ-OE1 2.61Å; K1120-E1124 WeakPolarHBondContact O-CB 3.32Å; K1120-E1124 WeakPolarHBondContact O-CG 3.33Å; K1120-E1124 PolarHBondContact O-N 3.11Å; E1124-Q1128 WeakPolarHBondContact O-CB 3.48Å; E1124-Q1128 WeakPolarHBondContact O-CG 3.48Å; E1124-Q1128 PolarHBondContact O-N 3.35Å
1125	N	46.3	Very low	51.8	Low	81 Å²	81	116 Å²	116	43%	0.433	61%	0.612	S	S	.	*	H	α-helix	trans	-62.8	-42.7	170.8	-94.1	-96.6	0	0	0	112.8	M1121 M1122 Q1128 R1129	M1121-N1125 WeakPolarHBondContact O-CB 3.35Å; M1121-N1125 PolarHBondContact O-N 3.21Å; M1121-N1125 PolarHBondContact O-ND2 2.99Å; M1122-N1125 PolarHBondContact O-N 3.13Å; N1125-Q1128 PolarHBondContact O-N 3.29Å; N1125-R1129 WeakPolarHBondContact O-CG 3.46Å; N1125-R1129 PolarHBondContact O-N 3.41Å
1126	L	47.8	Very low	50.1	Low	128 Å²	128	117.6 Å²	117.6	67%	0.67	63%	0.626	S	S	*	*	H	α-helix	trans	-70.3	-34.3	-176.9	-160	70.4	0	0	0	111.7	M1122 L1123	M1122-L1126 VanDerWaalsContact O-CB 3.32Å; M1122-L1126 WeakPolarHBondContact O-CB 3.47Å; M1122-L1126 PolarHBondContact O-N 3.33Å; L1123-L1126 PolarHBondContact O-N 2.88Å
1127	Q	44.8	Very low	48	Very low	146 Å²	146	120.7 Å²	120.7	68%	0.682	64%	0.64	S	S	*	*	H	α-helix	trans	-79.2	-27.1	175.3	-71	-171.9	-7.3	0	0	113.8	L1123 S1130	L1123-Q1127 WeakPolarHBondContact O-CG 3.41Å; L1123-Q1127 PolarHBondContact O-N 3.11Å; Q1127-S1130 PolarHBondContact O-OG 3.49Å
1128	Q	44.8	Very low	46.1	Very low	143 Å²	143	125.7 Å²	125.7	67%	0.668	65%	0.654	S	S	*	*	H	α-helix	trans	-73.6	-27.4	172.1	-75	180	1.1	0	0	112.9	E1124 N1125 S1130	E1124-Q1128 WeakPolarHBondContact O-CB 3.48Å; E1124-Q1128 WeakPolarHBondContact O-CG 3.48Å; E1124-Q1128 PolarHBondContact O-N 3.35Å; N1125-Q1128 PolarHBondContact O-N 3.29Å; Q1128-S1130 VanDerWaalsContact C-N 3.28Å; Q1128-S1130 PolarHBondContact O-N 2.94Å
1129	R	39.9	Very low	44.8	Very low	208 Å²	208	131 Å²	131	79%	0.785	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-5.8	-177.3	-85.1	-176.4	167.2	-155.1	-4.2	116.4	N1125	N1125-R1129 WeakPolarHBondContact O-CG 3.46Å; N1125-R1129 PolarHBondContact O-N 3.41Å
1130	S	36.5	Very low	43.1	Very low	110 Å²	110	133 Å²	133	77%	0.769	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	1.3	179.2	59.6	0	0	0	0	114.7	Q1127 Q1128	Q1127-S1130 PolarHBondContact O-OG 3.49Å; Q1128-S1130 VanDerWaalsContact C-N 3.28Å; Q1128-S1130 PolarHBondContact O-N 2.94Å
1131	G	42.8	Very low	41.4	Very low	69 Å²	69	133.1 Å²	133.1	71%	0.711	70%	0.703	S	S	*	*	S	Bend	trans	-131.1	-10.5	-171.4	0	0	0	0	0	118.1
1132	E	30.4	Very low	39.9	Very low	160 Å²	160	132.6 Å²	132.6	75%	0.748	72%	0.716	S	S	*	*			trans	-109.9	125.3	-179.1	-77.8	-152.9	109.7	0	0	113.7
1133	A	32.8	Very low	38.9	Very low	92 Å²	92	131.7 Å²	131.7	76%	0.76	71%	0.712	S	S	*	*			trans	-72.8	131.6	169.6	0	0	0	0	0	111	K1135	A1133-K1135 PolarHBondContact O-N 2.97Å; A1133-K1135 VanDerWaalsContact O-N 3.15Å
1134	V	31.7	Very low	38	Very low	139 Å²	139	129.7 Å²	129.7	84%	0.842	71%	0.705	S	S	*	*			trans	-58.6	115	-174.5	179.9	0	0	0	0	111.7
1135	K	32.5	Very low	37.6	Very low	178 Å²	178	132 Å²	132	77%	0.774	72%	0.72	S	S	*	*			trans	-82.8	113.1	167.8	-75.5	172.4	-175.4	145	0	109.8	A1133	A1133-K1135 PolarHBondContact O-N 2.97Å; A1133-K1135 VanDerWaalsContact O-N 3.15Å
1136	V	33.5	Very low	37.8	Very low	126 Å²	126	136.3 Å²	136.3	76%	0.764	74%	0.738	S	S	*	*			trans	-58.6	135	168.7	-178.8	0	0	0	0	109.5	Q1138	V1136-Q1138 PolarHBondContact O-N 2.86Å
1137	H	27.7	Very low	37.8	Very low	182 Å²	182	132.1 Å²	132.1	84%	0.843	72%	0.716	S	S	*	*			trans	-64.9	117.7	172.5	-104	68.6	0	0	0	110.1
1138	Q	31.9	Very low	38	Very low	164 Å²	164	131.6 Å²	131.6	77%	0.766	71%	0.711	S	S	*	*			trans	-87.5	109.6	167	-65.2	-169.7	-81.5	0	0	109.1	V1136 D1140	V1136-Q1138 PolarHBondContact O-N 2.86Å; Q1138-D1140 PolarHBondContact O-N 3.3Å; Q1138-D1140 VanDerWaalsContact O-N 3.14Å
1139	L	32.9	Very low	38	Very low	184 Å²	184	129.1 Å²	129.1	96%	0.963	71%	0.709	S	S	*	*			trans	-74.2	92.5	160.7	-83.8	167	0	0	0	108.1
1140	D	32.7	Very low	38.3	Very low	134 Å²	134	126.5 Å²	126.5	72%	0.717	71%	0.706	S	S	*	*			trans	-140.5	144.2	176.1	-160.2	-2.6	0	0	0	110.2	Q1138 A1142	Q1138-D1140 PolarHBondContact O-N 3.3Å; Q1138-D1140 VanDerWaalsContact O-N 3.14Å; D1140-A1142 PolarHBondContact O-N 2.82Å
1141	V	35.9	Very low	38.8	Very low	129 Å²	129	126.3 Å²	126.3	78%	0.782	70%	0.696	S	S	*	*			trans	-73.3	128.1	-162.5	179.2	0	0	0	0	111.1	I1143	V1141-I1143 PolarHBondContact O-N 2.86Å
1142	A	34.4	Very low	38.8	Very low	96 Å²	96	131.9 Å²	131.9	79%	0.793	70%	0.7	S	S	*	*			trans	-68.8	86.9	-172	0	0	0	0	0	113.9	D1140	D1140-A1142 PolarHBondContact O-N 2.82Å
1143	I	41.3	Very low	39.1	Very low	99 Å²	99	133.7 Å²	133.7	51%	0.508	71%	0.706	S	S	.	*			trans	-63.1	128.5	171.8	-58.8	176.4	0	0	0	110	V1141 L1145 L1147	V1141-I1143 PolarHBondContact O-N 2.86Å; I1143-L1145 PolarHBondContact O-N 2.97Å; I1143-L1147 HydrophobicContact CG2-CB 4.14Å; I1143-L1147 HydrophobicContact CG2-CD2 4.33Å
1144	P	43.2	Very low	39.2	Very low	58 Å²	58	132.1 Å²	132.1	38%	0.377	70%	0.699	S	S	.	*			trans	-53.8	133.7	179.9	-29.5	36	0	0	0	114.3	Q1146 L1147	P1144-Q1146 PolarHBondContact O-N 3.38Å; P1144-L1147 PolarHBondContact O-N 3.08Å
1145	L	46.2	Very low	39.1	Very low	147 Å²	147	132 Å²	132	77%	0.77	70%	0.704	S	S	*	*	H	α-helix	trans	-51.8	-28	-173.8	-77.1	161.4	0	0	0	114.9	I1143 L1147 K1148	I1143-L1145 PolarHBondContact O-N 2.97Å; L1145-L1147 VanDerWaalsContact C-N 3.31Å; L1145-L1147 PolarHBondContact O-N 2.93Å; L1145-K1148 PolarHBondContact O-N 3.27Å
1146	Q	49.5	Very low	39.1	Very low	171 Å²	171	129.5 Å²	129.5	80%	0.799	71%	0.709	S	S	*	*	H	α-helix	trans	-64.2	-30.6	179.9	-68.8	170.5	-14.6	0	0	113	P1144	P1144-Q1146 PolarHBondContact O-N 3.38Å
1147	L	48.2	Very low	38.9	Very low	40 Å²	40	127.1 Å²	127.1	21%	0.209	71%	0.71	C	S	.	*	H	α-helix	trans	-73	-37	175.7	-115.1	74.2	0	0	0	112.5	I1143 P1144 L1145 S1149 Q1150 L1151 V1175 Y1186	I1143-L1147 HydrophobicContact CG2-CB 4.14Å; I1143-L1147 HydrophobicContact CG2-CD2 4.33Å; P1144-L1147 PolarHBondContact O-N 3.08Å; L1145-L1147 VanDerWaalsContact C-N 3.31Å; L1145-L1147 PolarHBondContact O-N 2.93Å; L1147-S1149 PolarHBondContact O-N 3.27Å; L1147-S1149 VanDerWaalsContact O-N 3.11Å; L1147-Q1150 PolarHBondContact O-N 3.03Å; L1147-L1151 PolarHBondContact O-N 2.89Å; L1147-V1175 HydrophobicContact CD2-CG1 4.49Å; L1147-Y1186 HydrophobicContact CD1-CD2 4.36Å
1148	K	48.2	Very low	39	Very low	135 Å²	135	126.6 Å²	126.6	59%	0.587	71%	0.708	S	S	*	*	H	α-helix	trans	-60.7	-21.1	178.2	-86.3	179.1	174.1	170.3	0	113.2	L1145	L1145-K1148 PolarHBondContact O-N 3.27Å
1149	S	45.5	Very low	38.9	Very low	90 Å²	90	126.3 Å²	126.3	63%	0.629	71%	0.707	S	S	*	*	H	α-helix	trans	-76.2	-31	175.2	-175.5	0	0	0	0	113.6	L1147	L1147-S1149 PolarHBondContact O-N 3.27Å; L1147-S1149 VanDerWaalsContact O-N 3.11Å
1150	Q	46.3	Very low	38.5	Very low	153 Å²	153	122.9 Å²	122.9	72%	0.715	70%	0.697	S	S	*	*	H	α-helix	trans	-81.3	-39.5	-179.6	-68.7	-171.9	-20.5	0	0	112.1	L1147 K1152	L1147-Q1150 PolarHBondContact O-N 3.03Å; Q1150-K1152 PolarHBondContact O-N 2.94Å
1151	L	47.7	Very low	38.6	Very low	106 Å²	106	125.6 Å²	125.6	56%	0.555	71%	0.708	S	S	*	*	H	α-helix	trans	-66.2	-21.6	177.9	-74.3	161.8	0	0	0	113.9	L1147 K1153	L1147-L1151 PolarHBondContact O-N 2.89Å; L1151-K1153 PolarHBondContact O-N 3.29Å
1152	K	41.2	Very low	38	Very low	186 Å²	186	123.3 Å²	123.3	81%	0.809	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	7.9	-175.9	-95	-165.8	171.5	-168.7	0	115.9	Q1150	Q1150-K1152 PolarHBondContact O-N 2.94Å
1153	K	37.1	Very low	38.1	Very low	199 Å²	199	128.5 Å²	128.5	87%	0.865	72%	0.718	S	S	*	*	S	Bend	trans	-100	12.6	-173	-137.7	178.7	-176.6	-177.7	0	115.6	L1151	L1151-K1153 PolarHBondContact O-N 3.29Å
1154	G	36	Very low	37.4	Very low	59 Å²	59	127.5 Å²	127.5	61%	0.608	73%	0.731	S	S	*	*	S	Bend	trans	-115.9	137.9	171.1	0	0	0	0	0	112
1155	S	29.6	Very low	36.8	Very low	136 Å²	136	132.6 Å²	132.6	95%	0.951	76%	0.755	S	S	*	*			trans	59.1	108.6	165.6	-57	0	0	0	0	118.6
1156	S	31.3	Very low	36.3	Very low	125 Å²	125	129.9 Å²	129.9	87%	0.874	75%	0.749	S	S	*	*			trans	-124.6	125.4	169.3	57.6	0	0	0	0	111.2
1157	G	30.3	Very low	35.6	Very low	77 Å²	77	129.4 Å²	129.4	79%	0.794	75%	0.752	S	S	*	*			trans	107.3	114.4	155.4	0	0	0	0	0	118.7
1158	Q	29.7	Very low	35.5	Very low	171 Å²	171	134.4 Å²	134.4	80%	0.799	78%	0.777	S	S	*	*				80.8	101.7	124.5	-158.6	163.4	3.4	0	0	122.2
1159	Q	28.8	Very low	35.6	Very low	158 Å²	158	132.8 Å²	132.8	74%	0.738	78%	0.783	S	S	*	*			trans	64.7	125.3	136.7	-68.3	176.4	-56.2	0	0	123.3
1160	C	24.7	Very low	36.2	Very low	112 Å²	112	132.7 Å²	132.7	76%	0.757	78%	0.776	S	S	*	*			trans	66.7	110.8	138.4	-62.5	0	0	0	0	122
1161	M	34.5	Very low	37	Very low	191 Å²	191	128.3 Å²	128.3	94%	0.941	76%	0.759	S	S	*	*			trans	47.2	103.3	137	-57.7	-59.3	-72	0	0	119.4
1162	G	24.9	Very low	37.9	Very low	80 Å²	80	125.1 Å²	125.1	83%	0.825	74%	0.742	S	S	*	*			trans	-158.8	136.4	157.2	0	0	0	0	0	110.1
1163	E	35.4	Very low	39.2	Very low	206 Å²	206	121.8 Å²	121.8	96%	0.963	73%	0.729	S	S	*	*			trans	-79.5	141.9	175.7	-61	173.8	116	0	0	110.2
1164	G	27.9	Very low	40.7	Very low	77 Å²	77	114.6 Å²	114.6	79%	0.794	70%	0.698	S	S	*	*			trans	166.3	63.4	177.6	0	0	0	0	0	118.7
1165	D	30.4	Very low	42.4	Very low	165 Å²	165	115.4 Å²	115.4	88%	0.882	69%	0.691	S	S	*	*			trans	62.1	170.4	154.4	-135.8	-18.5	0	0	0	120.3
1166	S	35.5	Very low	43.8	Very low	91 Å²	91	113.9 Å²	113.9	64%	0.636	67%	0.67	S	S	*	*			trans	-68.6	130.8	-165.3	55.6	0	0	0	0	116.8
1167	D	35.3	Very low	45.4	Very low	161 Å²	161	112.5 Å²	112.5	86%	0.861	65%	0.653	S	S	*	*				-160.6	118.1	103.7	-117.5	-12.8	0	0	0	111.3
1168	I	44.3	Very low	47	Very low	145 Å²	145	110.8 Å²	110.8	74%	0.744	63%	0.626	S	S	*	*			trans	-93	121.5	178.7	-60.8	174.5	0	0	0	108.7	D1170	I1168-D1170 PolarHBondContact O-N 3.19Å
1169	S	50.8	Low	48.4	Very low	101 Å²	101	111.5 Å²	111.5	71%	0.706	62%	0.622	S	S	*	*			trans	-71.9	92.7	174.5	62.6	0	0	0	0	110.4	T1171	S1169-T1171 PolarHBondContact O-N 3.45Å
1170	D	58.1	Low	49.1	Very low	88 Å²	88	112.4 Å²	112.4	47%	0.471	62%	0.623	S	S	.	*			trans	-72.6	35	-166.5	-160.4	38.1	0	0	0	115.1	I1168 P1192 L1193	I1168-D1170 PolarHBondContact O-N 3.19Å; D1170-P1192 CarbonylContact O-C 3.48Å; D1170-P1192 VanDerWaalsContact O-CA 3.27Å; D1170-P1192 WeakPolarHBondContact O-CA 3.4Å; D1170-L1193 PolarHBondContact O-N 3.45Å
1171	T	63.4	Low	51	Low	60 Å²	60	109.7 Å²	109.7	37%	0.368	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-139.9	132	-175.8	67.5	0	0	0	0	113.4	S1169 V1191	S1169-T1171 PolarHBondContact O-N 3.45Å; T1171-V1191 CarbonylContact C-O 3.42Å; T1171-V1191 VanDerWaalsContact CA-O 3.29Å; T1171-V1191 WeakPolarHBondContact CA-O 3.47Å
1172	M	66.6	Low	51.8	Low	39 Å²	39	107.9 Å²	107.9	19%	0.192	61%	0.609	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.9	140.5	174	-168.3	170.4	-171.1	0	0	111	F1174 V1191 L1193 A1198 H1201	M1172-F1174 HydrophobicContact CB-CE2 4.09Å; M1172-F1174 HydrophobicContact CG-CE2 4.03Å; M1172-F1174 HydrophobicContact CG-CZ 4.49Å; M1172-F1174 HydrophobicContact SD-CE2 4.27Å; M1172-F1174 HydrophobicContact SD-CZ 4.23Å; M1172-V1191 PolarHBondContact N-O 2.97Å; M1172-V1191 PolarHBondContact O-N 3.04Å; M1172-L1193 HydrophobicContact CB-CD2 4.04Å; M1172-A1198 HydrophobicContact CB-CB 4.28Å; M1172-A1198 HydrophobicContact SD-CB 4.45Å; M1172-H1201 HydrophobicContact CE-CB 4.4Å
1173	Q	69.6	Low	52.5	Low	117 Å²	117	112.1 Å²	112.1	55%	0.547	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.2	121.7	-175.1	-59.9	-170.9	6.6	0	0	112.2	I1188	Q1173-I1188 HydrophobicContact CB-CG2 4.15Å; Q1173-I1188 HydrophobicContact CG-CG2 4.43Å
1174	F	67.2	Low	53.5	Low	48 Å²	48	107.9 Å²	107.9	21%	0.211	58%	0.584	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.4	150.8	173	-69.1	-96.4	0	0	0	110.6	M1172 I1188 L1189 V1191 L1197 A1198 H1201	M1172-F1174 HydrophobicContact CB-CE2 4.09Å; M1172-F1174 HydrophobicContact CG-CE2 4.03Å; M1172-F1174 HydrophobicContact CG-CZ 4.49Å; M1172-F1174 HydrophobicContact SD-CE2 4.27Å; M1172-F1174 HydrophobicContact SD-CZ 4.23Å; F1174-I1188 CarbonylContact O-C 3.31Å; F1174-I1188 WeakPolarHBondContact O-CA 3.5Å; F1174-L1189 PolarHBondContact N-O 3.47Å; F1174-L1189 PolarHBondContact O-N 2.79Å; F1174-V1191 HydrophobicContact CD2-CB 3.82Å; F1174-V1191 HydrophobicContact CD2-CG2 3.54Å; F1174-V1191 HydrophobicContact CE2-CB 3.94Å; F1174-V1191 HydrophobicContact CE2-CG1 4.46Å; F1174-V1191 HydrophobicContact CE2-CG2 4.09Å; F1174-V1191 HydrophobicContact CG-CG2 4.34Å; F1174-L1197 HydrophobicContact CD1-CD2 4.47Å; F1174-L1197 HydrophobicContact CE1-CD2 4.19Å; F1174-L1197 HydrophobicContact CE1-CG 4.25Å; F1174-L1197 HydrophobicContact CZ-CD2 4.27Å; F1174-L1197 HydrophobicContact CZ-CG 4.14Å; F1174-A1198 HydrophobicContact CE2-CB 4.37Å; F1174-H1201 AromaticContact CE1-CD2 3.93Å; F1174-H1201 HydrophobicContact CZ-CB 4.44Å
1175	V	72.1	Confident	55.3	Low	76 Å²	76	109.2 Å²	109.2	46%	0.461	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105	101.7	176.7	-177	0	0	0	0	109.9	L1147 Y1186 K1187	L1147-V1175 HydrophobicContact CD2-CG1 4.49Å; V1175-Y1186 HydrophobicContact CG1-CD1 4.13Å; V1175-K1187 CarbonylContact C-O 3.54Å
1176	M	59.3	Low	57.3	Low	104 Å²	104	105.9 Å²	105.9	51%	0.512	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	125.4	176.6	-165.9	-174.8	-163	0	0	110.7	T1178 K1187 L1189	M1176-T1178 HydrophobicContact CG-CG2 4.13Å; M1176-T1178 HydrophobicContact SD-CG2 4.13Å; M1176-K1187 PolarHBondContact N-O 2.99Å; M1176-K1187 PolarHBondContact O-N 3.46Å; M1176-L1189 HydrophobicContact CB-CD1 4.26Å; M1176-L1189 HydrophobicContact SD-CD1 3.84Å
1177	L	65	Low	58.8	Low	96 Å²	96	107.8 Å²	107.8	50%	0.503	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	119.6	177.8	-153.2	164.4	0	0	0	109.3	Q1184 Y1186	L1177-Q1184 HydrophobicContact CD2-CB 4.04Å; L1177-Q1184 HydrophobicContact CD2-CG 4.15Å; L1177-Y1186 HydrophobicContact CD1-CD1 4.24Å; L1177-Y1186 HydrophobicContact CD1-CE1 3.66Å; L1177-Y1186 HydrophobicContact CG-CD1 3.99Å; L1177-Y1186 HydrophobicContact CG-CE1 3.85Å
1178	T	63.4	Low	60.4	Low	40 Å²	40	104.4 Å²	104.4	25%	0.245	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	147.5	-175.1	62.4	0	0	0	0	111.1	M1176 Q1185	M1176-T1178 HydrophobicContact CG-CG2 4.13Å; M1176-T1178 HydrophobicContact SD-CG2 4.13Å; T1178-Q1185 PolarHBondContact N-O 3.1Å; T1178-Q1185 PolarHBondContact O-N 3.45Å; T1178-Q1185 PolarHBondContact OG1-O 2.97Å
1179	R	58.6	Low	61.6	Low	187 Å²	187	101.1 Å²	101.1	71%	0.706	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.8	118.7	-174.5	-168.5	173	-175.6	170.5	0.5	110	G1181	R1179-G1181 WeakPolarHBondContact CG-O 3.45Å
1180	K	43.7	Very low	62.7	Low	176 Å²	176	100.5 Å²	100.5	77%	0.765	50%	0.496	S	S	*	.	S	Bend	trans	-125	87.7	176.2	-164.7	174.8	-175.5	179.6	0	109.1
1181	G	65.4	Low	63.3	Low	55 Å²	55	97.1 Å²	97.1	57%	0.567	48%	0.478	S	S	*	.	S	Bend	trans	73.4	-153.4	-167	0	0	0	0	0	112.3	R1179 K1183	R1179-G1181 WeakPolarHBondContact CG-O 3.45Å; G1181-K1183 PolarHBondContact O-N 3.09Å; G1181-K1183 VanDerWaalsContact O-N 3.08Å
1182	N	50	Low	63.6	Low	154 Å²	154	97.1 Å²	97.1	82%	0.824	48%	0.479	S	S	*	.	S	Bend	trans	-81.3	26.2	-174.4	-106.4	1.4	0	0	0	115.2
1183	K	39.8	Very low	63.5	Low	169 Å²	169	97.9 Å²	97.9	74%	0.735	48%	0.484	S	S	*	.	S	Bend	trans	-131.8	135.4	169.2	-68.3	-173.2	177.9	-178.2	0	110.3	G1181	G1181-K1183 PolarHBondContact O-N 3.09Å; G1181-K1183 VanDerWaalsContact O-N 3.08Å
1184	Q	58.1	Low	63.1	Low	116 Å²	116	97.3 Å²	97.3	54%	0.542	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	146	174	-62.7	179.4	5.9	0	0	110	L1177	L1177-Q1184 HydrophobicContact CD2-CB 4.04Å; L1177-Q1184 HydrophobicContact CD2-CG 4.15Å
1185	Q	64.1	Low	63.5	Low	106 Å²	106	97.1 Å²	97.1	50%	0.495	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	123.6	176.8	-69	-170	-29.1	0	0	110.4	T1178	T1178-Q1185 PolarHBondContact N-O 3.1Å; T1178-Q1185 PolarHBondContact O-N 3.45Å; T1178-Q1185 PolarHBondContact OG1-O 2.97Å
1186	Y	72.6	Confident	63.3	Low	95 Å²	95	100.2 Å²	100.2	37%	0.373	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	135	174.5	-51.7	-85.7	0	0	0	110	L1147 V1175 L1177	L1147-Y1186 HydrophobicContact CD1-CD2 4.36Å; V1175-Y1186 HydrophobicContact CG1-CD1 4.13Å; L1177-Y1186 HydrophobicContact CD1-CD1 4.24Å; L1177-Y1186 HydrophobicContact CD1-CE1 3.66Å; L1177-Y1186 HydrophobicContact CG-CD1 3.99Å; L1177-Y1186 HydrophobicContact CG-CE1 3.85Å
1187	K	68.1	Low	63.7	Low	131 Å²	131	100.3 Å²	100.3	57%	0.57	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.4	170	-78.2	-173.4	171.7	-173.7	0	109.8	V1175 M1176	V1175-K1187 CarbonylContact C-O 3.54Å; M1176-K1187 PolarHBondContact N-O 2.99Å; M1176-K1187 PolarHBondContact O-N 3.46Å
1188	I	69.1	Low	63.8	Low	89 Å²	89	95.8 Å²	95.8	46%	0.456	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	135	167.9	-56.8	172.3	0	0	0	107.7	Q1173 F1174	Q1173-I1188 HydrophobicContact CB-CG2 4.15Å; Q1173-I1188 HydrophobicContact CG-CG2 4.43Å; F1174-I1188 CarbonylContact O-C 3.31Å; F1174-I1188 WeakPolarHBondContact O-CA 3.5Å
1189	L	67.9	Low	64.1	Low	77 Å²	77	95.6 Å²	95.6	40%	0.403	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	111.4	-174.9	-162.3	157.8	0	0	0	108	F1174 M1176 V1191	F1174-L1189 PolarHBondContact N-O 3.47Å; F1174-L1189 PolarHBondContact O-N 2.79Å; M1176-L1189 HydrophobicContact CB-CD1 4.26Å; M1176-L1189 HydrophobicContact SD-CD1 3.84Å; L1189-V1191 HydrophobicContact CD2-CG2 3.5Å; L1189-V1191 PolarHBondContact O-N 3.31Å
1190	N	74.8	Confident	64.7	Low	88 Å²	88	91 Å²	91	47%	0.471	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	111.2	-177.9	-61.6	7.3	0	0	0	108.6
1191	V	70.1	Confident	66	Low	16 Å²	16	86.1 Å²	86.1	10%	0.097	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	126	-178.3	178.9	0	0	0	0	108.7	T1171 M1172 F1174 L1189 S1195 A1198	T1171-V1191 CarbonylContact C-O 3.42Å; T1171-V1191 VanDerWaalsContact CA-O 3.29Å; T1171-V1191 WeakPolarHBondContact CA-O 3.47Å; M1172-V1191 PolarHBondContact N-O 2.97Å; M1172-V1191 PolarHBondContact O-N 3.04Å; F1174-V1191 HydrophobicContact CD2-CB 3.82Å; F1174-V1191 HydrophobicContact CD2-CG2 3.54Å; F1174-V1191 HydrophobicContact CE2-CB 3.94Å; F1174-V1191 HydrophobicContact CE2-CG1 4.46Å; F1174-V1191 HydrophobicContact CE2-CG2 4.09Å; F1174-V1191 HydrophobicContact CG-CG2 4.34Å; L1189-V1191 HydrophobicContact CD2-CG2 3.5Å; L1189-V1191 PolarHBondContact O-N 3.31Å; V1191-S1195 VanDerWaalsContact CG1-CB 3.4Å; V1191-A1198 HydrophobicContact CG1-CB 4.23Å
1192	P	71	Confident	66.3	Low	60 Å²	60	88.1 Å²	88.1	39%	0.39	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	143.7	175.3	-27.1	36	0	0	0	113	D1170 S1194 S1195 A1198	D1170-P1192 CarbonylContact O-C 3.48Å; D1170-P1192 VanDerWaalsContact O-CA 3.27Å; D1170-P1192 WeakPolarHBondContact O-CA 3.4Å; P1192-S1194 PolarHBondContact O-N 3.26Å; P1192-S1195 WeakPolarHBondContact O-CB 3.43Å; P1192-S1195 PolarHBondContact O-N 2.87Å; P1192-A1198 WeakPolarHBondContact O-CB 3.4Å
1193	L	63.3	Low	67.5	Low	56 Å²	56	85.4 Å²	85.4	29%	0.293	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.4	178.7	-72.1	172.7	0	0	0	112.6	D1170 M1172 S1195 A1198	D1170-L1193 PolarHBondContact O-N 3.45Å; M1172-L1193 HydrophobicContact CB-CD2 4.04Å; L1193-S1195 PolarHBondContact O-N 3.26Å; L1193-A1198 HydrophobicContact CD2-CB 4.44Å
1194	S	62.4	Low	68.9	Low	104 Å²	104	83.4 Å²	83.4	73%	0.727	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-6.7	169.6	50.5	0	0	0	0	115	P1192	P1192-S1194 PolarHBondContact O-N 3.26Å
1195	S	73.8	Confident	69.5	Low	45 Å²	45	81.8 Å²	81.8	32%	0.315	42%	0.421	S	S	.	.	S	Bend	trans	-78.5	134.7	172	-172	0	0	0	0	111.4	V1191 P1192 L1193 L1197 A1198 A1199	V1191-S1195 VanDerWaalsContact CG1-CB 3.4Å; P1192-S1195 WeakPolarHBondContact O-CB 3.43Å; P1192-S1195 PolarHBondContact O-N 2.87Å; L1193-S1195 PolarHBondContact O-N 3.26Å; S1195-L1197 PolarHBondContact O-N 3.37Å; S1195-A1198 PolarHBondContact O-N 2.69Å; S1195-A1199 PolarHBondContact O-N 2.97Å
1196	H	69.6	Low	69.9	Low	140 Å²	140	81.6 Å²	81.6	65%	0.648	42%	0.42	S	S	*	.	H	α-helix	trans	-54	-28.1	177.6	-162.2	-40.1	0	0	0	113.6	N1200	H1196-N1200 PolarHBondContact CE1-ND2 2.88Å; H1196-N1200 PolarHBondContact CE1-OD1 2.89Å; H1196-N1200 VanDerWaalsContact CE1-OD1 3.3Å; H1196-N1200 PolarHBondContact ND1-OD1 3.48Å; H1196-N1200 WeakPolarHBondContact O-CB 3.4Å; H1196-N1200 PolarHBondContact O-N 2.89Å; H1196-N1200 VanDerWaalsContact O-N 3.12Å; H1196-N1200 PolarHBondContact O-OD1 3.45Å
1197	L	66	Low	69.9	Low	107 Å²	107	79.8 Å²	79.8	56%	0.56	43%	0.425	S	S	*	.	H	α-helix	trans	-70.9	-42.9	175	-173.3	70.8	0	0	0	112.2	F1174 S1195 H1201	F1174-L1197 HydrophobicContact CD1-CD2 4.47Å; F1174-L1197 HydrophobicContact CE1-CD2 4.19Å; F1174-L1197 HydrophobicContact CE1-CG 4.25Å; F1174-L1197 HydrophobicContact CZ-CD2 4.27Å; F1174-L1197 HydrophobicContact CZ-CG 4.14Å; S1195-L1197 PolarHBondContact O-N 3.37Å; L1197-H1201 WeakPolarHBondContact O-CB 3.25Å; L1197-H1201 PolarHBondContact O-N 2.98Å
1198	A	68.7	Low	69.8	Low	0 Å²	0	78.7 Å²	78.7	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-72.7	-43.4	178.4	0	0	0	0	0	111.1	M1172 F1174 V1191 P1192 L1193 S1195 N1200 H1201 F1202	M1172-A1198 HydrophobicContact CB-CB 4.28Å; M1172-A1198 HydrophobicContact SD-CB 4.45Å; F1174-A1198 HydrophobicContact CE2-CB 4.37Å; V1191-A1198 HydrophobicContact CG1-CB 4.23Å; P1192-A1198 WeakPolarHBondContact O-CB 3.4Å; L1193-A1198 HydrophobicContact CD2-CB 4.44Å; S1195-A1198 PolarHBondContact O-N 2.69Å; A1198-N1200 PolarHBondContact O-N 2.79Å; A1198-H1201 PolarHBondContact O-N 3.29Å; A1198-F1202 VanDerWaalsContact O-CB 3.32Å; A1198-F1202 WeakPolarHBondContact O-CB 3.45Å; A1198-F1202 PolarHBondContact O-N 2.95Å
1199	A	69.4	Low	69.6	Low	36 Å²	36	79.9 Å²	79.9	30%	0.298	43%	0.425	S	S	.	.	H	α-helix	trans	-59.9	-45	176.5	0	0	0	0	0	112.7	S1195 F1202 N1203	S1195-A1199 PolarHBondContact O-N 2.97Å; A1199-F1202 PolarHBondContact O-N 3.15Å; A1199-N1203 WeakPolarHBondContact O-CB 3.45Å; A1199-N1203 VanDerWaalsContact O-CG 3.32Å; A1199-N1203 PolarHBondContact O-N 2.79Å
1200	N	70	Confident	69.8	Low	90 Å²	90	80.8 Å²	80.8	48%	0.481	43%	0.428	S	S	.	.	H	α-helix	trans	-63.9	-45.6	176.1	-82.1	18.4	0	0	0	112.1	H1196 A1198 F1202 N1203 Q1204	H1196-N1200 PolarHBondContact CE1-ND2 2.88Å; H1196-N1200 PolarHBondContact CE1-OD1 2.89Å; H1196-N1200 VanDerWaalsContact CE1-OD1 3.3Å; H1196-N1200 PolarHBondContact ND1-OD1 3.48Å; H1196-N1200 WeakPolarHBondContact O-CB 3.4Å; H1196-N1200 PolarHBondContact O-N 2.89Å; H1196-N1200 VanDerWaalsContact O-N 3.12Å; H1196-N1200 PolarHBondContact O-OD1 3.45Å; A1198-N1200 PolarHBondContact O-N 2.79Å; N1200-F1202 VanDerWaalsContact C-N 3.31Å; N1200-F1202 PolarHBondContact O-N 3.18Å; N1200-N1203 PolarHBondContact O-N 2.92Å; N1200-Q1204 WeakPolarHBondContact O-CB 3.45Å; N1200-Q1204 PolarHBondContact O-N 2.74Å
1201	H	72.3	Confident	69.5	Low	75 Å²	75	82 Å²	82	35%	0.347	43%	0.43	S	S	.	.	H	α-helix	trans	-64.6	-36.7	178.6	-170.2	-39.2	0	0	0	111.7	M1172 F1174 L1197 A1198 Q1205	M1172-H1201 HydrophobicContact CE-CB 4.4Å; F1174-H1201 AromaticContact CE1-CD2 3.93Å; F1174-H1201 HydrophobicContact CZ-CB 4.44Å; L1197-H1201 WeakPolarHBondContact O-CB 3.25Å; L1197-H1201 PolarHBondContact O-N 2.98Å; A1198-H1201 PolarHBondContact O-N 3.29Å; H1201-Q1205 VanDerWaalsContact O-CB 3.25Å; H1201-Q1205 WeakPolarHBondContact O-CB 3.48Å; H1201-Q1205 PolarHBondContact O-N 3.23Å
1202	F	72.1	Confident	69.3	Low	97 Å²	97	90.4 Å²	90.4	43%	0.425	46%	0.46	S	S	.	.	H	α-helix	trans	-66	-48.9	175.8	-172.5	-92.1	0	0	0	111.4	A1198 A1199 N1200 Q1204 Q1205 Q1206	A1198-F1202 VanDerWaalsContact O-CB 3.32Å; A1198-F1202 WeakPolarHBondContact O-CB 3.45Å; A1198-F1202 PolarHBondContact O-N 2.95Å; A1199-F1202 PolarHBondContact O-N 3.15Å; N1200-F1202 VanDerWaalsContact C-N 3.31Å; N1200-F1202 PolarHBondContact O-N 3.18Å; F1202-Q1204 PolarHBondContact O-N 2.82Å; F1202-Q1205 PolarHBondContact O-N 3.12Å; F1202-Q1206 WeakPolarHBondContact O-CB 3.44Å; F1202-Q1206 PolarHBondContact O-N 3.36Å
1203	N	73.4	Confident	69	Low	97 Å²	97	93.5 Å²	93.5	52%	0.519	47%	0.471	S	S	.	.	H	α-helix	trans	-61.3	-42	177.5	-72.8	-6	0	0	0	112.3	A1199 N1200 Q1206 A1207	A1199-N1203 WeakPolarHBondContact O-CB 3.45Å; A1199-N1203 VanDerWaalsContact O-CG 3.32Å; A1199-N1203 PolarHBondContact O-N 2.79Å; N1200-N1203 PolarHBondContact O-N 2.92Å; N1203-Q1206 PolarHBondContact O-N 3.35Å; N1203-A1207 WeakPolarHBondContact O-CB 3.38Å; N1203-A1207 PolarHBondContact O-N 2.89Å
1204	Q	70.5	Confident	69.3	Low	127 Å²	127	99 Å²	99	59%	0.593	49%	0.488	S	S	*	.	H	α-helix	trans	-63.5	-45.2	176.6	-174.8	172.7	1.8	0	0	111.6	N1200 F1202 Q1206 A1207 E1208	N1200-Q1204 WeakPolarHBondContact O-CB 3.45Å; N1200-Q1204 PolarHBondContact O-N 2.74Å; F1202-Q1204 PolarHBondContact O-N 2.82Å; Q1204-Q1206 VanDerWaalsContact C-N 3.31Å; Q1204-Q1206 PolarHBondContact O-N 2.58Å; Q1204-A1207 PolarHBondContact O-N 3.19Å; Q1204-E1208 PolarHBondContact O-N 3.03Å
1205	Q	70.8	Confident	69.3	Low	82 Å²	82	99.1 Å²	99.1	38%	0.383	48%	0.478	S	S	.	.	H	α-helix	trans	-68.3	-28.9	177.7	-176	165.7	95.4	0	0	113	H1201 F1202 Q1209	H1201-Q1205 VanDerWaalsContact O-CB 3.25Å; H1201-Q1205 WeakPolarHBondContact O-CB 3.48Å; H1201-Q1205 PolarHBondContact O-N 3.23Å; F1202-Q1205 PolarHBondContact O-N 3.12Å; Q1205-Q1209 WeakPolarHBondContact O-CG 3.46Å; Q1205-Q1209 PolarHBondContact O-N 3.22Å
1206	Q	71.6	Confident	69.3	Low	101 Å²	101	104 Å²	104	47%	0.472	49%	0.494	S	S	.	.	H	α-helix	trans	-73.3	-41.6	173.3	-172.3	167.5	77.2	0	0	111.4	F1202 N1203 Q1204 Q1209 E1210	F1202-Q1206 WeakPolarHBondContact O-CB 3.44Å; F1202-Q1206 PolarHBondContact O-N 3.36Å; N1203-Q1206 PolarHBondContact O-N 3.35Å; Q1204-Q1206 VanDerWaalsContact C-N 3.31Å; Q1204-Q1206 PolarHBondContact O-N 2.58Å; Q1206-Q1209 PolarHBondContact O-N 2.86Å; Q1206-E1210 PolarHBondContact O-N 2.98Å
1207	A	72	Confident	69.5	Low	58 Å²	58	103.4 Å²	103.4	48%	0.479	49%	0.49	S	S	.	.	H	α-helix	trans	-61.5	-45.6	173.5	0	0	0	0	0	112.2	N1203 Q1204 Q1209 E1210 E1211	N1203-A1207 WeakPolarHBondContact O-CB 3.38Å; N1203-A1207 PolarHBondContact O-N 2.89Å; Q1204-A1207 PolarHBondContact O-N 3.19Å; A1207-Q1209 VanDerWaalsContact C-N 3.26Å; A1207-Q1209 PolarHBondContact O-N 3.16Å; A1207-E1210 PolarHBondContact O-N 3.48Å; A1207-E1211 WeakPolarHBondContact O-CB 3.48Å; A1207-E1211 PolarHBondContact O-N 2.98Å
1208	E	66.8	Low	69.5	Low	108 Å²	108	103.3 Å²	103.3	51%	0.505	49%	0.489	S	S	.	.	H	α-helix	trans	-59.1	-35.8	173.5	-76.4	-178.9	-177.4	0	0	112.4	Q1204 R1212	Q1204-E1208 PolarHBondContact O-N 3.03Å; E1208-R1212 WeakPolarHBondContact O-CB 3.32Å; E1208-R1212 PolarHBondContact O-N 3.34Å
1209	Q	65.1	Low	69.4	Low	113 Å²	113	107.6 Å²	107.6	53%	0.528	52%	0.516	S	S	.	.	H	α-helix	trans	-71.4	-40.2	175.9	-77.2	-177.9	38.8	0	0	112.5	Q1205 Q1206 A1207 M1213	Q1205-Q1209 WeakPolarHBondContact O-CG 3.46Å; Q1205-Q1209 PolarHBondContact O-N 3.22Å; Q1206-Q1209 PolarHBondContact O-N 2.86Å; A1207-Q1209 VanDerWaalsContact C-N 3.26Å; A1207-Q1209 PolarHBondContact O-N 3.16Å; Q1209-M1213 WeakPolarHBondContact O-CB 3.48Å; Q1209-M1213 WeakPolarHBondContact O-CG 3.49Å; Q1209-M1213 PolarHBondContact O-N 3.34Å
1210	E	72.7	Confident	69.4	Low	96 Å²	96	110.8 Å²	110.8	45%	0.449	53%	0.527	S	S	.	.	H	α-helix	trans	-62.9	-47.5	172.6	-80.1	-158.5	-163.5	0	0	112	Q1206 A1207 R1212 M1213 R1214	Q1206-E1210 PolarHBondContact O-N 2.98Å; A1207-E1210 PolarHBondContact O-N 3.48Å; E1210-R1212 VanDerWaalsContact C-N 3.34Å; E1210-R1212 PolarHBondContact O-N 2.66Å; E1210-M1213 PolarHBondContact O-N 3.36Å; E1210-R1214 WeakPolarHBondContact O-CG 3.38Å; E1210-R1214 PolarHBondContact O-N 3.4Å; E1210-R1214 IonicContact OE2-NH2 3.18Å; E1210-R1214 PolarHBondContact OE2-NH2 2.79Å; E1210-R1214 VanDerWaalsContact OE2-NH2 3.09Å
1211	E	68.8	Low	69.4	Low	113 Å²	113	109.2 Å²	109.2	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-60.3	-45.5	178	-173.2	178.8	-176.5	0	0	110.9	A1207 M1213 R1214 M1215	A1207-E1211 WeakPolarHBondContact O-CB 3.48Å; A1207-E1211 PolarHBondContact O-N 2.98Å; E1211-M1213 VanDerWaalsContact C-N 3.31Å; E1211-M1213 PolarHBondContact O-N 3.23Å; E1211-R1214 WeakPolarHBondContact O-CB 3.39Å; E1211-R1214 PolarHBondContact O-N 3.28Å; E1211-R1214 VanDerWaalsContact O-N 3.13Å; E1211-M1215 HydrophobicContact CG-CE 4.07Å; E1211-M1215 WeakPolarHBondContact O-CG 3.49Å; E1211-M1215 PolarHBondContact O-N 3.2Å; E1211-M1215 WeakPolarHBondContact OE1-CE 3.34Å
1212	R	64.7	Low	69.3	Low	193 Å²	193	109.5 Å²	109.5	73%	0.728	52%	0.522	S	S	*	.	H	α-helix	trans	-66.7	-30.6	177.6	-164.1	173.2	-164.7	159.3	5.2	113	E1208 E1210 K1216	E1208-R1212 WeakPolarHBondContact O-CB 3.32Å; E1208-R1212 PolarHBondContact O-N 3.34Å; E1210-R1212 VanDerWaalsContact C-N 3.34Å; E1210-R1212 PolarHBondContact O-N 2.66Å; R1212-K1216 VanDerWaalsContact O-CB 3.26Å; R1212-K1216 WeakPolarHBondContact O-CB 3.35Å; R1212-K1216 PolarHBondContact O-N 2.84Å
1213	M	66.2	Low	69	Low	125 Å²	125	109 Å²	109	62%	0.616	52%	0.524	S	S	*	.	H	α-helix	trans	-71.8	-39.3	169.6	-77.9	-166.7	-70.9	0	0	112.3	Q1209 E1210 E1211 K1216 K1217	Q1209-M1213 WeakPolarHBondContact O-CB 3.48Å; Q1209-M1213 WeakPolarHBondContact O-CG 3.49Å; Q1209-M1213 PolarHBondContact O-N 3.34Å; E1210-M1213 PolarHBondContact O-N 3.36Å; E1211-M1213 VanDerWaalsContact C-N 3.31Å; E1211-M1213 PolarHBondContact O-N 3.23Å; M1213-K1216 PolarHBondContact O-N 3.16Å; M1213-K1217 WeakPolarHBondContact O-CB 3.38Å; M1213-K1217 PolarHBondContact O-N 3.27Å
1214	R	69.6	Low	68.7	Low	172 Å²	172	109.9 Å²	109.9	65%	0.649	52%	0.524	S	S	*	.	H	α-helix	trans	-63.3	-47	173.6	-70.7	179.4	-161.8	-168.7	9.5	111.4	E1210 E1211 K1217 L1218	E1210-R1214 WeakPolarHBondContact O-CG 3.38Å; E1210-R1214 PolarHBondContact O-N 3.4Å; E1210-R1214 IonicContact OE2-NH2 3.18Å; E1210-R1214 PolarHBondContact OE2-NH2 2.79Å; E1210-R1214 VanDerWaalsContact OE2-NH2 3.09Å; E1211-R1214 WeakPolarHBondContact O-CB 3.39Å; E1211-R1214 PolarHBondContact O-N 3.28Å; E1211-R1214 VanDerWaalsContact O-N 3.13Å; R1214-K1217 PolarHBondContact O-N 3.15Å; R1214-L1218 WeakPolarHBondContact O-CB 3.4Å; R1214-L1218 PolarHBondContact O-N 3.03Å
1215	M	62.4	Low	68.6	Low	106 Å²	106	110.2 Å²	110.2	52%	0.522	52%	0.52	S	S	.	.	H	α-helix	trans	-58.1	-50.1	173.3	-72.7	-173.2	-177.6	0	0	111.2	E1211 K1217 L1218 T1219	E1211-M1215 HydrophobicContact CG-CE 4.07Å; E1211-M1215 WeakPolarHBondContact O-CG 3.49Å; E1211-M1215 PolarHBondContact O-N 3.2Å; E1211-M1215 WeakPolarHBondContact OE1-CE 3.34Å; M1215-K1217 VanDerWaalsContact C-N 3.31Å; M1215-K1217 PolarHBondContact O-N 3.07Å; M1215-L1218 PolarHBondContact O-N 3.23Å; M1215-L1218 VanDerWaalsContact O-N 3.13Å; M1215-T1219 PolarHBondContact O-N 2.91Å; M1215-T1219 PolarHBondContact O-OG1 2.97Å; M1215-T1219 VanDerWaalsContact O-OG1 3.07Å
1216	K	73.3	Confident	68.1	Low	147 Å²	147	111.4 Å²	111.4	64%	0.639	53%	0.526	S	S	*	.	H	α-helix	trans	-60.9	-39.4	179.6	-173	179.9	178.9	-173.2	0	112.1	R1212 M1213 L1220	R1212-K1216 VanDerWaalsContact O-CB 3.26Å; R1212-K1216 WeakPolarHBondContact O-CB 3.35Å; R1212-K1216 PolarHBondContact O-N 2.84Å; M1213-K1216 PolarHBondContact O-N 3.16Å; K1216-L1220 HydrophobicContact CG-CD1 4.36Å; K1216-L1220 WeakPolarHBondContact O-CG 3.46Å; K1216-L1220 PolarHBondContact O-N 3.21Å
1217	K	74.1	Confident	67.9	Low	129 Å²	129	112.5 Å²	112.5	56%	0.561	53%	0.531	S	S	*	.	H	α-helix	trans	-64.7	-48.7	172.9	-173.1	-176.6	177.6	-158.5	0	110.8	M1213 R1214 M1215 T1219 L1220 D1221	M1213-K1217 WeakPolarHBondContact O-CB 3.38Å; M1213-K1217 PolarHBondContact O-N 3.27Å; R1214-K1217 PolarHBondContact O-N 3.15Å; M1215-K1217 VanDerWaalsContact C-N 3.31Å; M1215-K1217 PolarHBondContact O-N 3.07Å; K1217-T1219 VanDerWaalsContact C-N 3.31Å; K1217-T1219 PolarHBondContact O-N 3.2Å; K1217-L1220 CarbonylContact O-C 3.58Å; K1217-L1220 WeakPolarHBondContact O-CA 3.3Å; K1217-L1220 WeakPolarHBondContact O-CB 3.5Å; K1217-L1220 PolarHBondContact O-N 3.28Å; K1217-D1221 VanDerWaalsContact CE-OD1 3.3Å; K1217-D1221 WeakPolarHBondContact CE-OD1 3.44Å; K1217-D1221 VanDerWaalsContact CE-OD2 3.24Å; K1217-D1221 WeakPolarHBondContact CE-OD2 3.25Å; K1217-D1221 WeakPolarHBondContact CG-OD1 3.45Å; K1217-D1221 IonicContact NZ-OD2 2.57Å; K1217-D1221 WeakPolarHBondContact O-CB 3.38Å; K1217-D1221 PolarHBondContact O-N 3.36Å
1218	L	65.9	Low	67.7	Low	104 Å²	104	114.8 Å²	114.8	55%	0.545	53%	0.532	S	S	.	.	H	α-helix	trans	-58.5	-41.4	-179.5	-175.8	63.1	0	0	0	112	R1214 M1215 D1221 I1222	R1214-L1218 WeakPolarHBondContact O-CB 3.4Å; R1214-L1218 PolarHBondContact O-N 3.03Å; M1215-L1218 PolarHBondContact O-N 3.23Å; M1215-L1218 VanDerWaalsContact O-N 3.13Å; L1218-D1221 PolarHBondContact O-N 3.49Å; L1218-I1222 HydrophobicContact CD1-CD1 4.24Å; L1218-I1222 HydrophobicContact CG-CD1 3.99Å; L1218-I1222 WeakPolarHBondContact O-CB 3.24Å; L1218-I1222 WeakPolarHBondContact O-CD1 3.37Å; L1218-I1222 WeakPolarHBondContact O-CG1 3.36Å; L1218-I1222 PolarHBondContact O-N 2.93Å
1219	T	65.9	Low	67.4	Low	91 Å²	91	113.4 Å²	113.4	56%	0.558	53%	0.525	S	S	*	.	H	α-helix	trans	-64.4	-37.6	174.3	-51.6	0	0	0	0	112.3	M1215 K1217 N1223	M1215-T1219 PolarHBondContact O-N 2.91Å; M1215-T1219 PolarHBondContact O-OG1 2.97Å; M1215-T1219 VanDerWaalsContact O-OG1 3.07Å; K1217-T1219 VanDerWaalsContact C-N 3.31Å; K1217-T1219 PolarHBondContact O-N 3.2Å; T1219-N1223 WeakPolarHBondContact O-CB 3.29Å; T1219-N1223 PolarHBondContact O-N 3.18Å
1220	L	68.6	Low	67.5	Low	102 Å²	102	112.3 Å²	112.3	53%	0.534	52%	0.523	S	S	.	.	H	α-helix	trans	-69.1	-47.9	174.7	-71.5	167	0	0	0	111.6	K1216 K1217 I1222 N1223 E1224	K1216-L1220 HydrophobicContact CG-CD1 4.36Å; K1216-L1220 WeakPolarHBondContact O-CG 3.46Å; K1216-L1220 PolarHBondContact O-N 3.21Å; K1217-L1220 CarbonylContact O-C 3.58Å; K1217-L1220 WeakPolarHBondContact O-CA 3.3Å; K1217-L1220 WeakPolarHBondContact O-CB 3.5Å; K1217-L1220 PolarHBondContact O-N 3.28Å; L1220-I1222 PolarHBondContact O-N 3Å; L1220-N1223 PolarHBondContact O-N 3.06Å; L1220-N1223 VanDerWaalsContact O-N 3.12Å; L1220-E1224 WeakPolarHBondContact O-CB 3.43Å; L1220-E1224 PolarHBondContact O-N 3.39Å
1221	D	70.3	Confident	67.3	Low	57 Å²	57	115 Å²	115	31%	0.305	53%	0.53	S	S	.	.	H	α-helix	trans	-61.2	-25	176.5	-70.5	14	0	0	0	112.5	K1217 L1218 R1225	K1217-D1221 VanDerWaalsContact CE-OD1 3.3Å; K1217-D1221 WeakPolarHBondContact CE-OD1 3.44Å; K1217-D1221 VanDerWaalsContact CE-OD2 3.24Å; K1217-D1221 WeakPolarHBondContact CE-OD2 3.25Å; K1217-D1221 WeakPolarHBondContact CG-OD1 3.45Å; K1217-D1221 IonicContact NZ-OD2 2.57Å; K1217-D1221 WeakPolarHBondContact O-CB 3.38Å; K1217-D1221 PolarHBondContact O-N 3.36Å; L1218-D1221 PolarHBondContact O-N 3.49Å; D1221-R1225 WeakPolarHBondContact O-CB 3.4Å; D1221-R1225 PolarHBondContact O-NH2 3.49Å
1222	I	70.4	Confident	67.1	Low	81 Å²	81	115.2 Å²	115.2	42%	0.415	53%	0.531	S	S	.	.	H	α-helix	trans	-78.5	-50.4	171	-73.4	165.5	0	0	0	110.4	L1218 L1220 E1224 R1225 Q1226	L1218-I1222 HydrophobicContact CD1-CD1 4.24Å; L1218-I1222 HydrophobicContact CG-CD1 3.99Å; L1218-I1222 WeakPolarHBondContact O-CB 3.24Å; L1218-I1222 WeakPolarHBondContact O-CD1 3.37Å; L1218-I1222 WeakPolarHBondContact O-CG1 3.36Å; L1218-I1222 PolarHBondContact O-N 2.93Å; L1220-I1222 PolarHBondContact O-N 3Å; I1222-E1224 PolarHBondContact O-N 3.39Å; I1222-R1225 WeakPolarHBondContact O-CB 3.49Å; I1222-R1225 PolarHBondContact O-N 3.41Å; I1222-R1225 VanDerWaalsContact O-N 3.16Å; I1222-Q1226 PolarHBondContact O-N 2.86Å
1223	N	66.9	Low	66.9	Low	88 Å²	88	111 Å²	111	47%	0.471	52%	0.52	S	S	.	.	H	α-helix	trans	-67.2	-38.1	-175.4	-152.5	95.2	0	0	0	112.2	T1219 L1220 R1225 Q1226 E1227	T1219-N1223 WeakPolarHBondContact O-CB 3.29Å; T1219-N1223 PolarHBondContact O-N 3.18Å; L1220-N1223 PolarHBondContact O-N 3.06Å; L1220-N1223 VanDerWaalsContact O-N 3.12Å; N1223-R1225 VanDerWaalsContact C-N 3.31Å; N1223-R1225 PolarHBondContact O-N 3.49Å; N1223-Q1226 WeakPolarHBondContact O-CB 3.49Å; N1223-Q1226 PolarHBondContact O-N 2.88Å; N1223-E1227 WeakPolarHBondContact O-CG 3.49Å; N1223-E1227 PolarHBondContact O-N 3.29Å
1224	E	66.8	Low	66.9	Low	114 Å²	114	110.1 Å²	110.1	53%	0.533	52%	0.516	S	S	.	.	H	α-helix	trans	-66.1	-33.6	173.6	-176	175.4	-172.5	0	0	111.7	L1220 I1222 Q1228	L1220-E1224 WeakPolarHBondContact O-CB 3.43Å; L1220-E1224 PolarHBondContact O-N 3.39Å; I1222-E1224 PolarHBondContact O-N 3.39Å; E1224-Q1228 WeakPolarHBondContact O-CB 3.49Å; E1224-Q1228 VanDerWaalsContact O-CG 3.26Å; E1224-Q1228 WeakPolarHBondContact O-CG 3.43Å; E1224-Q1228 PolarHBondContact O-N 3.14Å
1225	R	68	Low	66.5	Low	135 Å²	135	107.5 Å²	107.5	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-72.1	-41	174.4	-167.1	-178.3	-49.3	153.4	16.6	111.9	D1221 I1222 N1223 E1227 Q1228 E1229	D1221-R1225 WeakPolarHBondContact O-CB 3.4Å; D1221-R1225 PolarHBondContact O-NH2 3.49Å; I1222-R1225 WeakPolarHBondContact O-CB 3.49Å; I1222-R1225 PolarHBondContact O-N 3.41Å; I1222-R1225 VanDerWaalsContact O-N 3.16Å; N1223-R1225 VanDerWaalsContact C-N 3.31Å; N1223-R1225 PolarHBondContact O-N 3.49Å; R1225-E1227 VanDerWaalsContact C-N 3.35Å; R1225-E1227 PolarHBondContact O-N 2.83Å; R1225-Q1228 PolarHBondContact O-N 3.25Å; R1225-E1229 WeakPolarHBondContact CG-OE1 3.35Å; R1225-E1229 WeakPolarHBondContact O-CB 3.45Å; R1225-E1229 WeakPolarHBondContact O-CG 3.43Å; R1225-E1229 PolarHBondContact O-N 2.97Å
1226	Q	60.8	Low	66.2	Low	106 Å²	106	108.1 Å²	108.1	50%	0.495	51%	0.514	S	S	.	.	H	α-helix	trans	-56.9	-48.3	173.2	-161.6	95.5	52.4	0	0	110.5	I1222 N1223 Q1228 E1229 D1230	I1222-Q1226 PolarHBondContact O-N 2.86Å; N1223-Q1226 WeakPolarHBondContact O-CB 3.49Å; N1223-Q1226 PolarHBondContact O-N 2.88Å; Q1226-Q1228 VanDerWaalsContact C-N 3.34Å; Q1226-Q1228 PolarHBondContact O-N 3.1Å; Q1226-E1229 PolarHBondContact O-N 3.13Å; Q1226-D1230 WeakPolarHBondContact O-CB 3.38Å; Q1226-D1230 PolarHBondContact O-N 3.33Å
1227	E	67.1	Low	65.1	Low	125 Å²	125	103.9 Å²	103.9	58%	0.584	50%	0.503	S	S	*	.	H	α-helix	trans	-63.7	-34.9	176.1	-73.3	179.4	-179.3	0	0	113	N1223 R1225 Y1231	N1223-E1227 WeakPolarHBondContact O-CG 3.49Å; N1223-E1227 PolarHBondContact O-N 3.29Å; R1225-E1227 VanDerWaalsContact C-N 3.35Å; R1225-E1227 PolarHBondContact O-N 2.83Å; E1227-Y1231 WeakPolarHBondContact O-CB 3.44Å; E1227-Y1231 PolarHBondContact O-N 2.84Å
1228	Q	67.1	Low	63.7	Low	105 Å²	105	104.7 Å²	104.7	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-71.9	-37.1	174.9	-74.2	176.9	31.2	0	0	113	E1224 R1225 Q1226 Q1232	E1224-Q1228 WeakPolarHBondContact O-CB 3.49Å; E1224-Q1228 VanDerWaalsContact O-CG 3.26Å; E1224-Q1228 WeakPolarHBondContact O-CG 3.43Å; E1224-Q1228 PolarHBondContact O-N 3.14Å; R1225-Q1228 PolarHBondContact O-N 3.25Å; Q1226-Q1228 VanDerWaalsContact C-N 3.34Å; Q1226-Q1228 PolarHBondContact O-N 3.1Å; Q1228-Q1232 WeakPolarHBondContact O-CG 3.26Å; Q1228-Q1232 PolarHBondContact O-N 3.49Å
1229	E	61.8	Low	62.8	Low	80 Å²	80	103.9 Å²	103.9	37%	0.374	51%	0.514	S	S	.	.	H	α-helix	trans	-68.7	-47.6	174.8	-74.2	178.8	-149	0	0	110.8	R1225 Q1226 Y1231 Q1232 E1233	R1225-E1229 WeakPolarHBondContact CG-OE1 3.35Å; R1225-E1229 WeakPolarHBondContact O-CB 3.45Å; R1225-E1229 WeakPolarHBondContact O-CG 3.43Å; R1225-E1229 PolarHBondContact O-N 2.97Å; Q1226-E1229 PolarHBondContact O-N 3.13Å; E1229-Y1231 VanDerWaalsContact C-N 3.29Å; E1229-Y1231 PolarHBondContact O-N 2.57Å; E1229-Q1232 PolarHBondContact O-N 2.73Å; E1229-Q1232 VanDerWaalsContact O-N 3.13Å; E1229-E1233 WeakPolarHBondContact O-CB 3.21Å; E1229-E1233 PolarHBondContact O-N 3.37Å
1230	D	65.8	Low	61.8	Low	90 Å²	90	107.5 Å²	107.5	48%	0.481	53%	0.525	S	S	.	.	H	α-helix	trans	-57.4	-40	173.7	-75.4	1.2	0	0	0	111.8	Q1226 E1233 M1234	Q1226-D1230 WeakPolarHBondContact O-CB 3.38Å; Q1226-D1230 PolarHBondContact O-N 3.33Å; D1230-E1233 PolarHBondContact O-N 2.87Å; D1230-M1234 VanDerWaalsContact O-CB 3.29Å; D1230-M1234 WeakPolarHBondContact O-CB 3.37Å; D1230-M1234 PolarHBondContact O-N 2.85Å
1231	Y	69	Low	60.3	Low	152 Å²	152	111.8 Å²	111.8	60%	0.596	53%	0.534	S	S	*	.	H	α-helix	trans	-70.1	-35.8	177.2	-171.2	-96.4	0	0	0	112.7	E1227 E1229 M1235	E1227-Y1231 WeakPolarHBondContact O-CB 3.44Å; E1227-Y1231 PolarHBondContact O-N 2.84Å; E1229-Y1231 VanDerWaalsContact C-N 3.29Å; E1229-Y1231 PolarHBondContact O-N 2.57Å; Y1231-M1235 HydrophobicContact CD1-CG 4.45Å; Y1231-M1235 HydrophobicContact CE1-CG 4.19Å; Y1231-M1235 WeakPolarHBondContact O-CB 3.29Å; Y1231-M1235 WeakPolarHBondContact O-CG 3.46Å; Y1231-M1235 PolarHBondContact O-N 3.27Å
1232	Q	64.9	Low	58.7	Low	117 Å²	117	114.7 Å²	114.7	55%	0.547	56%	0.556	S	S	.	*	H	α-helix	trans	-70	-41	172.4	-75.2	-172.5	31.3	0	0	112.1	Q1228 E1229 M1234 M1235 Q1236	Q1228-Q1232 WeakPolarHBondContact O-CG 3.26Å; Q1228-Q1232 PolarHBondContact O-N 3.49Å; E1229-Q1232 PolarHBondContact O-N 2.73Å; E1229-Q1232 VanDerWaalsContact O-N 3.13Å; Q1232-M1234 VanDerWaalsContact C-N 3.35Å; Q1232-M1235 PolarHBondContact O-N 3.35Å; Q1232-Q1236 WeakPolarHBondContact O-CG 3.39Å; Q1232-Q1236 PolarHBondContact O-N 2.88Å
1233	E	60.6	Low	57.2	Low	105 Å²	105	115.1 Å²	115.1	49%	0.491	57%	0.572	S	S	.	*	H	α-helix	trans	-65.8	-39.3	176.6	-161.2	171.1	-107.4	0	0	110.6	E1229 D1230 Q1236 S1237	E1229-E1233 WeakPolarHBondContact O-CB 3.21Å; E1229-E1233 PolarHBondContact O-N 3.37Å; D1230-E1233 PolarHBondContact O-N 2.87Å; E1233-Q1236 PolarHBondContact O-N 3.24Å; E1233-S1237 WeakPolarHBondContact O-CB 3.36Å; E1233-S1237 PolarHBondContact O-N 3.02Å
1234	M	66.4	Low	55.7	Low	107 Å²	107	116.9 Å²	116.9	53%	0.527	59%	0.588	S	S	.	*	H	α-helix	trans	-58.5	-48.6	170.1	-169.5	-172.4	-54.1	0	0	111.7	D1230 Q1232 Q1236 S1237 F1238	D1230-M1234 VanDerWaalsContact O-CB 3.29Å; D1230-M1234 WeakPolarHBondContact O-CB 3.37Å; D1230-M1234 PolarHBondContact O-N 2.85Å; Q1232-M1234 VanDerWaalsContact C-N 3.35Å; M1234-Q1236 PolarHBondContact O-N 3.03Å; M1234-S1237 PolarHBondContact O-N 3.02Å; M1234-S1237 PolarHBondContact O-OG 3.39Å; M1234-F1238 HydrophobicContact CG-CD2 4.44Å; M1234-F1238 HydrophobicContact CG-CE2 4.44Å; M1234-F1238 WeakPolarHBondContact O-CD2 3.24Å; M1234-F1238 PolarHBondContact O-N 3.2Å
1235	M	60.3	Low	54.1	Low	117 Å²	117	115.8 Å²	115.8	58%	0.576	60%	0.599	S	S	*	*	H	α-helix	trans	-61.5	-40.8	177.4	-80.5	-72.5	-67.6	0	0	112.8	Y1231 Q1232 F1238 A1239	Y1231-M1235 HydrophobicContact CD1-CG 4.45Å; Y1231-M1235 HydrophobicContact CE1-CG 4.19Å; Y1231-M1235 WeakPolarHBondContact O-CB 3.29Å; Y1231-M1235 WeakPolarHBondContact O-CG 3.46Å; Y1231-M1235 PolarHBondContact O-N 3.27Å; Q1232-M1235 PolarHBondContact O-N 3.35Å; M1235-F1238 PolarHBondContact O-N 3.32Å; M1235-A1239 PolarHBondContact O-N 3.47Å
1236	Q	56.3	Low	52.4	Low	119 Å²	119	116.2 Å²	116.2	56%	0.556	61%	0.611	S	S	*	*	H	α-helix	trans	-68.1	-38.1	175.7	-69.8	179.3	23.4	0	0	111.9	Q1232 E1233 M1234 F1238 A1239 Q1240	Q1232-Q1236 WeakPolarHBondContact O-CG 3.39Å; Q1232-Q1236 PolarHBondContact O-N 2.88Å; E1233-Q1236 PolarHBondContact O-N 3.24Å; M1234-Q1236 PolarHBondContact O-N 3.03Å; Q1236-F1238 PolarHBondContact O-N 3.31Å; Q1236-A1239 WeakPolarHBondContact O-CB 3.47Å; Q1236-A1239 PolarHBondContact O-N 3.02Å; Q1236-Q1240 PolarHBondContact O-N 3.27Å
1237	S	50.3	Low	51.3	Low	58 Å²	58	117.3 Å²	117.3	41%	0.406	63%	0.625	S	S	.	*	H	α-helix	trans	-62.9	-27.7	176.1	82.7	0	0	0	0	113.4	E1233 M1234	E1233-S1237 WeakPolarHBondContact O-CB 3.36Å; E1233-S1237 PolarHBondContact O-N 3.02Å; M1234-S1237 PolarHBondContact O-N 3.02Å; M1234-S1237 PolarHBondContact O-OG 3.39Å
1238	F	44.2	Very low	49.9	Very low	146 Å²	146	118.1 Å²	118.1	64%	0.64	63%	0.633	S	S	*	*	H	α-helix	trans	-77.7	-29.1	172.2	-92.3	-78.6	0	0	0	113.2	M1234 M1235 Q1236	M1234-F1238 HydrophobicContact CG-CD2 4.44Å; M1234-F1238 HydrophobicContact CG-CE2 4.44Å; M1234-F1238 WeakPolarHBondContact O-CD2 3.24Å; M1234-F1238 PolarHBondContact O-N 3.2Å; M1235-F1238 PolarHBondContact O-N 3.32Å; Q1236-F1238 PolarHBondContact O-N 3.31Å
1239	A	47	Very low	48.3	Very low	86 Å²	86	124.7 Å²	124.7	71%	0.711	65%	0.654	S	S	*	*	H	α-helix	trans	-73.5	-27.6	179.3	0	0	0	0	0	113.6	M1235 Q1236	M1235-A1239 PolarHBondContact O-N 3.47Å; Q1236-A1239 WeakPolarHBondContact O-CB 3.47Å; Q1236-A1239 PolarHBondContact O-N 3.02Å
1240	Q	44.8	Very low	47	Very low	167 Å²	167	129.7 Å²	129.7	78%	0.78	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	5	-175.3	-68.1	-171.4	-10.6	0	0	115.5	Q1236 P1242	Q1236-Q1240 PolarHBondContact O-N 3.27Å; Q1240-P1242 VanDerWaalsContact O-CD 3.24Å; Q1240-P1242 WeakPolarHBondContact O-CD 3.49Å
1241	R	37.6	Very low	45.5	Very low	192 Å²	192	136.5 Å²	136.5	73%	0.725	70%	0.696	S	S	*	*			trans	-84.5	113.9	176.5	-74.9	-173.9	178.5	-166.3	0	111.8	A1243	R1241-A1243 PolarHBondContact O-N 3.12Å
1242	P	37.4	Very low	43.7	Very low	119 Å²	119	140.5 Å²	140.5	77%	0.773	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-63.2	134.4	164.1	27.8	-33.4	0	0	0	109.3	Q1240	Q1240-P1242 VanDerWaalsContact O-CD 3.24Å; Q1240-P1242 WeakPolarHBondContact O-CD 3.49Å
1243	A	37.3	Very low	42.4	Very low	90 Å²	90	140.9 Å²	140.9	74%	0.744	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-62.4	136.8	178.5	0	0	0	0	0	110.4	R1241 A1245	R1241-A1243 PolarHBondContact O-N 3.12Å; A1243-A1245 PolarHBondContact O-N 3.43Å; A1243-A1245 VanDerWaalsContact O-N 3.12Å
1244	P	35.9	Very low	41.2	Very low	125 Å²	125	147.8 Å²	147.8	81%	0.812	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-63.3	118	-174.1	24.2	-33.7	0	0	0	111.2	N1246	P1244-N1246 PolarHBondContact O-N 3.15Å
1245	A	32.8	Very low	39.4	Very low	91 Å²	91	153.7 Å²	153.7	75%	0.752	76%	0.762	S	S	*	*			trans	-66.4	92.3	-178.6	0	0	0	0	0	111.1	A1243 T1247	A1243-A1245 PolarHBondContact O-N 3.43Å; A1243-A1245 VanDerWaalsContact O-N 3.12Å; A1245-T1247 PolarHBondContact O-N 2.88Å; A1245-T1247 VanDerWaalsContact O-N 3.15Å
1246	N	33.9	Very low	38.1	Very low	143 Å²	143	156.4 Å²	156.4	77%	0.765	77%	0.773	S	S	*	*			trans	-78.8	98.3	-176.4	-168.5	-14.1	0	0	0	110.7	P1244 N1248	P1244-N1246 PolarHBondContact O-N 3.15Å; N1246-N1248 PolarHBondContact O-N 2.85Å
1247	T	37.3	Very low	37.1	Very low	130 Å²	130	158.5 Å²	158.5	80%	0.798	78%	0.783	S	S	*	*	S	Bend	trans	-72.1	29.9	-166.3	49.1	0	0	0	0	115.9	A1245	A1245-T1247 PolarHBondContact O-N 2.88Å; A1245-T1247 VanDerWaalsContact O-N 3.15Å
1248	N	38	Very low	36.5	Very low	142 Å²	142	160.4 Å²	160.4	76%	0.759	79%	0.794	S	S	*	*			trans	-145.3	52.8	-173	-105.2	-60	0	0	0	114.6	N1246	N1246-N1248 PolarHBondContact O-N 2.85Å
1249	R	33.1	Very low	36.1	Very low	242 Å²	242	162.8 Å²	162.8	91%	0.913	80%	0.804	S	S	*	*			trans	-147.1	40.2	173.5	-141.1	175.9	-178.3	172	1.2	119.2	R1251	R1249-R1251 PolarHBondContact O-N 2.83Å
1250	E	35.1	Very low	35.5	Very low	186 Å²	186	162.5 Å²	162.5	87%	0.869	81%	0.809	S	S	*	*			trans	-76	105.5	155.3	-75.2	-153.3	137	0	0	111.2
1251	R	33.3	Very low	34.9	Very low	232 Å²	232	159.3 Å²	159.3	88%	0.875	81%	0.812	S	S	*	*			trans	175.5	110.9	141.8	-95.5	150.3	-162.7	-127.4	0.7	114	R1249	R1249-R1251 PolarHBondContact O-N 2.83Å
1252	R	31.9	Very low	35.1	Very low	237 Å²	237	156.3 Å²	156.3	89%	0.894	82%	0.817	S	S	*	*			trans	68.7	165.8	155.4	-52.7	-174.5	167.8	-168.5	-4.2	115.7
1253	P	37.6	Very low	34.9	Very low	124 Å²	124	157 Å²	157	81%	0.805	81%	0.814	S	S	*	*				-127.4	179.9	-82.1	33.4	-14.2	0	0	0	113.9
1254	R	35.3	Very low	34.8	Very low	250 Å²	250	156.4 Å²	156.4	94%	0.943	81%	0.809	S	S	*	*			trans	-50.1	140.7	-176.5	-68.6	179.6	173.9	177	-3.1	114.4
1255	Y	28.6	Very low	35.1	Very low	231 Å²	231	156.8 Å²	156.8	91%	0.906	80%	0.804	S	S	*	*			trans	-119.3	159.6	154.2	-157.2	-99	0	0	0	109.4
1256	Q	32.6	Very low	35.4	Very low	174 Å²	174	160 Å²	160	81%	0.813	81%	0.808	S	S	*	*			trans	-125.3	132.9	-162.3	-165.2	172.2	14	0	0	112.2
1257	H	34.4	Very low	35.7	Very low	164 Å²	164	159 Å²	159	76%	0.759	80%	0.801	S	S	*	*			trans	-86.8	130.7	-177.3	-167	-72.1	0	0	0	112.2	K1259	H1257-K1259 PolarHBondContact CE1-O 3.46Å
1258	P	38.3	Very low	35.8	Very low	98 Å²	98	162 Å²	162	64%	0.636	80%	0.804	S	S	*	*			trans	-98.9	115	176.2	34.5	-28.8	0	0	0	113
1259	K	35	Very low	35.6	Very low	196 Å²	196	163.6 Å²	163.6	85%	0.852	80%	0.804	S	S	*	*			trans	68	147.6	164.8	-47.7	169.2	-175.1	177.1	0	115.4	H1257	H1257-K1259 PolarHBondContact CE1-O 3.46Å
1260	G	34.9	Very low	35.6	Very low	80 Å²	80	158.6 Å²	158.6	83%	0.825	80%	0.8	S	S	*	*			cis	155.5	97.8	-12.1	0	0	0	0	0	113.8
1261	A	33.1	Very low	35.4	Very low	100 Å²	100	153.5 Å²	153.5	83%	0.826	80%	0.798	S	S	*	*			trans	-147.3	152.2	166.2	0	0	0	0	0	109.6
1262	P	40.5	Very low	35.4	Very low	128 Å²	128	146 Å²	146	83%	0.831	79%	0.793	S	S	*	*			trans	-106	166.5	-158.8	39.6	-35.1	0	0	0	116.5
1263	N	34.9	Very low	35.5	Very low	135 Å²	135	145.8 Å²	145.8	72%	0.722	79%	0.792	S	S	*	*			trans	-60.2	152.9	175.8	-81.3	28.1	0	0	0	114.5	D1265	N1263-D1265 PolarHBondContact ND2-OD2 3.33Å
1264	A	35.1	Very low	35.3	Very low	76 Å²	76	150.9 Å²	150.9	63%	0.628	80%	0.795	S	S	*	*			trans	-101.1	11.3	177.8	0	0	0	0	0	115.1	L1266 I1267	A1264-L1266 PolarHBondContact O-N 2.77Å; A1264-I1267 PolarHBondContact O-N 3.3Å
1265	D	41.9	Very low	35.3	Very low	133 Å²	133	154 Å²	154	71%	0.711	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	14.3	178.7	-62.7	-55.5	0	0	0	115.3	N1263	N1263-D1265 PolarHBondContact ND2-OD2 3.33Å
1266	L	39.1	Very low	35.7	Very low	159 Å²	159	150.2 Å²	150.2	83%	0.832	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.4	1	-168.6	-99.8	165	0	0	0	114.7	A1264	A1264-L1266 PolarHBondContact O-N 2.77Å
1267	I	38.8	Very low	35.8	Very low	121 Å²	121	148.9 Å²	148.9	62%	0.621	80%	0.801	S	S	*	*	S	Bend	trans	-85.9	-49.7	-177.2	-48.2	-171.9	0	0	0	112.2	A1264	A1264-I1267 PolarHBondContact O-N 3.3Å
1268	F	40.3	Very low	35.9	Very low	194 Å²	194	148.1 Å²	148.1	85%	0.851	80%	0.804	S	S	*	*			trans	-135.3	95.4	-177.1	-66.6	-60.8	0	0	0	115.8
1269	K	33.8	Very low	35.8	Very low	175 Å²	175	151 Å²	151	76%	0.761	81%	0.813	S	S	*	*			trans	-75.2	169.7	139.9	-60.6	175.7	179	174.5	0	107.4
1270	T	33.7	Very low	35.8	Very low	137 Å²	137	148.2 Å²	148.2	84%	0.84	81%	0.811	S	S	*	*			cis	-167.5	153.1	31.5	-37	0	0	0	0	110.8
1271	G	31.1	Very low	35.9	Very low	79 Å²	79	152.7 Å²	152.7	81%	0.814	81%	0.81	S	S	*	*			trans	94.7	140.5	146.7	0	0	0	0	0	116.5
1272	G	32.4	Very low	36.1	Very low	75 Å²	75	156.5 Å²	156.5	77%	0.773	81%	0.809	S	S	*	*			trans	-156.8	164.4	172.9	0	0	0	0	0	111.3
1273	R	33.2	Very low	35.7	Very low	232 Å²	232	158.7 Å²	158.7	88%	0.875	81%	0.807	S	S	*	*			trans	-173.8	138.8	164.1	-111.1	173.6	-175.5	-169.9	1.9	110
1274	R	35	Very low	35.8	Very low	232 Å²	232	160.7 Å²	160.7	88%	0.875	81%	0.814	S	S	*	*			trans	27.8	117.5	147.8	-61.8	177.8	177	179.7	-4.4	117.2
1275	R	35.5	Very low	35.9	Very low	315 Å²	315	168.4 Å²	168.4	100%	1.189	83%	0.831	S	S	*	*				-138.3	0	82.1	-148.1	170.8	-169.7	171.5	1.3	110.7

Retrieved 1,275 of 1,275 residues in 1163.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).