A0A087X072_HUMAN Loading...

DNA 3'-5' helicase

AlphaFold DB , UniProt , Accession A0A087X072, Species HUMAN (Homo sapiens, Human), Gene RECQL4, Length 851 aa.

						>A0A087X072_HUMAN|A0A087X072|RECQL4
MKQKHYVRGRALRSRLLRKQAWKQKWRKKGECFGGGGATVTTKESCFLNEQFDHWAAQCPRPASEEDTDAVGPEPLVPSPQPVPEVPSLDPTVLPLYSLGPSGQLAETPAEVFQALEQLGHQAFRPGQERAVMRILSGISTLLVLPTGAGKSLCYQLPALLYSRRSPCLTLVVSPLLSLMDDQVSGLPPCLKAACIHSGMTRKQRESVLQKIRAAQVHVLMLTPEALVGAGGLPPAAQLPPVAFACIDEAHCLSQWSHNFRPCYLRVCKVLRERMGVHCFLGLTATATRRTASDVAQHLAVAEEPDLHGPAPVPTNLHLSVSMDRDTDQALLTLLQGKRFQNLDSIIIYCNRREDTERIAALLRTCLHAAWVPGSGGRAPKTTAEAYHAGMCSRERRRVQRAFMQGQLRVVVATVAFGMGLDRPDVRAVLHLGLPPSFESYVQAVGRAGRDGQPAHCHLFLQPQGEDLRELRRHVHADSTDFLAVKRLVQRVFPACTCTCTRPPSEQEGAVGGERPVPKYPPQEAEQLSHQAAPGPRRVCMGHERALPIQLTVQALDMPEEAIETLLCYLELHPHHWLELLATTYTHCRLNCPGGPAQLQALAHRCPPLAVCLAQQLPEDPGQGSSSVEFDMVKLVDSMGWELASVRRALCQLQWDHEPRTGVRRGTGVLVEFSELAFHLRSPGDLTAEEKDQICDFLYGRVQARERQALARLRRTFQAFHSVAFPSCGPCLEQQDEERSTRLKDLLGRYFEEEEGQEPGGMEDAQGPEPGQARLQDWEDQVRCDIRQFLSLRPEEKFSSRAVARIFHGIGSPCYPAQVYGQDRRFWRKYLHLSFHALVGLATEELLQVAR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.7	Very low	29.9	Very low	245 Å²	245	182 Å²	182	100%	1.207	88%	0.875	S	S	*	*				0	120.1	0	-65.5	-179.3	-167.5	0	0	109.5
2	K	27.6	Very low	30.6	Very low	207 Å²	207	181 Å²	181	90%	0.9	88%	0.877	S	S	*	*			trans	-138.1	113.4	162.4	-80.1	-171.8	176.9	179.5	0	106.8
3	Q	25.5	Very low	31.6	Very low	179 Å²	179	182.6 Å²	182.6	84%	0.836	87%	0.868	S	S	*	*			trans	-60.9	134.6	-175.7	-75.7	177.8	-28.4	0	0	111.2
4	K	27.7	Very low	32.6	Very low	175 Å²	175	175.7 Å²	175.7	76%	0.761	85%	0.849	S	S	*	*			trans	-93	128.4	164.3	-72.2	179.7	178.4	176.5	0	107.7
5	H	27.7	Very low	33.4	Very low	161 Å²	161	178.9 Å²	178.9	75%	0.745	85%	0.848	S	S	*	*			trans	-108.8	123.6	163	-78.2	1.9	0	0	0	108.5
6	Y	28.8	Very low	34.1	Very low	215 Å²	215	175.6 Å²	175.6	84%	0.843	84%	0.837	S	S	*	*			trans	-84	134.7	169.9	-81.8	-94.1	0	0	0	108.8
7	V	25.7	Very low	34.9	Very low	140 Å²	140	171.7 Å²	171.7	85%	0.848	82%	0.821	S	S	*	*			trans	-115.3	122.1	166.2	178.8	0	0	0	0	108.2
8	R	29.8	Very low	35.8	Very low	253 Å²	253	172.7 Å²	172.7	96%	0.955	82%	0.815	S	S	*	*			trans	-80.9	127.3	167.3	-81.1	178.7	168.7	176.3	-3.5	108.8
9	G	26.9	Very low	36.7	Very low	75 Å²	75	171.4 Å²	171.4	77%	0.773	81%	0.806	S	S	*	*			trans	167.3	140.9	170.6	0	0	0	0	0	114.4
10	R	28.8	Very low	37.5	Very low	256 Å²	256	169.1 Å²	169.1	97%	0.966	80%	0.795	S	S	*	*			trans	-52.1	143.4	-157.6	-70.5	175.3	178.8	-166.5	-0.7	117.6
11	A	46.5	Very low	38.4	Very low	96 Å²	96	163.8 Å²	163.8	79%	0.793	78%	0.78	S	S	*	*			trans	-61	128	175.4	0	0	0	0	0	112.7
12	L	38.1	Very low	39.5	Very low	170 Å²	170	159.7 Å²	159.7	89%	0.89	75%	0.751	S	S	*	*			trans	169.7	54.5	149	-94.5	162.3	0	0	0	112.4
13	R	43.6	Very low	40.8	Very low	202 Å²	202	156.8 Å²	156.8	76%	0.762	74%	0.739	S	S	*	*			trans	-147.5	31.1	171.6	-72.1	-163.8	-177.8	-179.3	1.5	116.2	R15 L17	R13-R15 PolarHBondContact O-N 2.96Å; R13-L17 HydrophobicContact CB-CD1 4.42Å
14	S	45.5	Very low	42.3	Very low	86 Å²	86	154.8 Å²	154.8	60%	0.601	73%	0.729	S	S	*	*	H	α-helix	trans	-73.1	-24.2	-171.7	-37.4	0	0	0	0	115.2	R18	S14-R18 WeakPolarHBondContact O-CD 3.38Å; S14-R18 VanDerWaalsContact O-CG 3.28Å; S14-R18 WeakPolarHBondContact O-CG 3.4Å
15	R	45.2	Very low	43.5	Very low	223 Å²	223	154.1 Å²	154.1	84%	0.842	73%	0.726	S	S	*	*	H	α-helix	trans	-90.3	-37	-172.5	-149.7	175.9	-176.3	-171.6	1.4	113.6	R13 K19	R13-R15 PolarHBondContact O-N 2.96Å; R15-K19 PolarHBondContact O-N 3.09Å
16	L	45.1	Very low	44.6	Very low	127 Å²	127	153.4 Å²	153.4	67%	0.665	72%	0.717	S	S	*	*	H	α-helix	trans	-73.5	-39.7	179.5	-82.1	159.4	0	0	0	112.3	K19 Q20	L16-K19 PolarHBondContact O-N 3.48Å; L16-Q20 PolarHBondContact O-N 3.13Å
17	L	47.5	Very low	45.3	Very low	109 Å²	109	152.4 Å²	152.4	57%	0.571	71%	0.712	S	S	*	*	H	α-helix	trans	-66.1	-36.7	175.3	-81.6	162.3	0	0	0	112.3	R13 Q20 A21	R13-L17 HydrophobicContact CB-CD1 4.42Å; L17-Q20 PolarHBondContact O-N 2.98Å; L17-A21 VanDerWaalsContact O-CB 3.31Å; L17-A21 WeakPolarHBondContact O-CB 3.12Å; L17-A21 PolarHBondContact O-N 3.22Å
18	R	51.7	Low	46.4	Very low	189 Å²	189	152.9 Å²	152.9	71%	0.713	70%	0.703	S	S	*	*	H	α-helix	trans	-65.7	-38.9	173	-75.1	179.4	-165.7	-178.4	5.1	112.1	S14 W22	S14-R18 WeakPolarHBondContact O-CD 3.38Å; S14-R18 VanDerWaalsContact O-CG 3.28Å; S14-R18 WeakPolarHBondContact O-CG 3.4Å; R18-W22 WeakPolarHBondContact O-CB 3.33Å; R18-W22 PolarHBondContact O-N 3.3Å
19	K	53	Low	47.1	Very low	149 Å²	149	147 Å²	147	65%	0.648	68%	0.684	S	S	*	*	H	α-helix	trans	-65.7	-40.4	174.2	-104.4	-176.5	175.7	-178.7	0	112.3	R15 L16 K23	R15-K19 PolarHBondContact O-N 3.09Å; L16-K19 PolarHBondContact O-N 3.48Å; K19-K23 WeakPolarHBondContact O-CB 3.19Å; K19-K23 WeakPolarHBondContact O-CG 3.28Å; K19-K23 PolarHBondContact O-N 3.24Å
20	Q	52.4	Low	47.7	Very low	124 Å²	124	146 Å²	146	58%	0.579	67%	0.673	S	S	*	*	H	α-helix	trans	-68.6	-43.3	175.9	-96.9	-180	-22.5	0	0	112.5	L16 L17 W22 K23 Q24	L16-Q20 PolarHBondContact O-N 3.13Å; L17-Q20 PolarHBondContact O-N 2.98Å; Q20-W22 VanDerWaalsContact C-N 3.33Å; Q20-W22 PolarHBondContact O-N 2.99Å; Q20-K23 PolarHBondContact O-N 3.07Å; Q20-Q24 WeakPolarHBondContact O-CB 3.36Å; Q20-Q24 PolarHBondContact O-N 2.61Å
21	A	55.6	Low	48.4	Very low	58 Å²	58	140.7 Å²	140.7	48%	0.479	66%	0.659	S	S	.	*	H	α-helix	trans	-64.3	-38	175.4	0	0	0	0	0	111.9	L17 K25	L17-A21 VanDerWaalsContact O-CB 3.31Å; L17-A21 WeakPolarHBondContact O-CB 3.12Å; L17-A21 PolarHBondContact O-N 3.22Å; A21-K25 VanDerWaalsContact O-CB 3.22Å; A21-K25 WeakPolarHBondContact O-CB 3.48Å; A21-K25 PolarHBondContact O-N 2.88Å
22	W	58.1	Low	48.1	Very low	159 Å²	159	141 Å²	141	60%	0.602	66%	0.655	S	S	*	*	H	α-helix	trans	-66.1	-43.7	174.5	-171.9	87.8	0	0	0	111.9	R18 Q20 K25 W26	R18-W22 WeakPolarHBondContact O-CB 3.33Å; R18-W22 PolarHBondContact O-N 3.3Å; Q20-W22 VanDerWaalsContact C-N 3.33Å; Q20-W22 PolarHBondContact O-N 2.99Å; W22-K25 PolarHBondContact O-N 3.37Å; W22-W26 AromaticContact CD2-CD1 3.66Å; W22-W26 AromaticContact CD2-NE1 3.96Å; W22-W26 AromaticContact CE2-CD1 3.47Å; W22-W26 VanDerWaalsContact CE2-CD1 3.47Å; W22-W26 AromaticContact CE2-NE1 3.25Å; W22-W26 AromaticContact CH2-NE1 3.86Å; W22-W26 AromaticContact CZ2-CD1 3.69Å; W22-W26 AromaticContact CZ2-NE1 3.21Å; W22-W26 AromaticContact NE1-CD1 3.88Å; W22-W26 AromaticContact NE1-NE1 3.52Å; W22-W26 PolarHBondContact O-N 3.5Å
23	K	54.6	Low	48.2	Very low	147 Å²	147	140.3 Å²	140.3	64%	0.639	65%	0.645	S	S	*	*	H	α-helix	trans	-63	-43.4	174.1	-80.4	-174.5	174.1	-171.6	0	112.6	K19 Q20 K25 W26 R27	K19-K23 WeakPolarHBondContact O-CB 3.19Å; K19-K23 WeakPolarHBondContact O-CG 3.28Å; K19-K23 PolarHBondContact O-N 3.24Å; Q20-K23 PolarHBondContact O-N 3.07Å; K23-K25 VanDerWaalsContact C-N 3.35Å; K23-W26 PolarHBondContact O-N 3.08Å; K23-R27 WeakPolarHBondContact O-CB 3.49Å; K23-R27 PolarHBondContact O-N 2.68Å
24	Q	55.6	Low	47.6	Very low	136 Å²	136	134.5 Å²	134.5	64%	0.636	65%	0.648	S	S	*	*	H	α-helix	trans	-66.7	-35.6	176.2	-77.3	-173.6	-10.6	0	0	112.5	Q20 R27 K28	Q20-Q24 WeakPolarHBondContact O-CB 3.36Å; Q20-Q24 PolarHBondContact O-N 2.61Å; Q24-R27 PolarHBondContact O-N 2.78Å; Q24-K28 PolarHBondContact O-N 3.38Å
25	K	53.8	Low	47	Very low	162 Å²	162	134.4 Å²	134.4	70%	0.704	66%	0.661	S	S	*	*	H	α-helix	trans	-65.8	-38.8	175.3	-168	176.2	-176.4	179.3	0	111.8	A21 W22 K23 K29	A21-K25 VanDerWaalsContact O-CB 3.22Å; A21-K25 WeakPolarHBondContact O-CB 3.48Å; A21-K25 PolarHBondContact O-N 2.88Å; W22-K25 PolarHBondContact O-N 3.37Å; K23-K25 VanDerWaalsContact C-N 3.35Å; K25-K29 WeakPolarHBondContact O-CB 3.37Å; K25-K29 PolarHBondContact O-N 3.33Å; K25-K29 VanDerWaalsContact O-N 3.1Å
26	W	49.7	Very low	46.2	Very low	145 Å²	145	127.6 Å²	127.6	55%	0.549	66%	0.659	S	S	.	*	H	α-helix	trans	-71.6	-37.4	174.5	-88.7	97.6	0	0	0	113.2	W22 K23 K29 G30	W22-W26 AromaticContact CD2-CD1 3.66Å; W22-W26 AromaticContact CD2-NE1 3.96Å; W22-W26 AromaticContact CE2-CD1 3.47Å; W22-W26 VanDerWaalsContact CE2-CD1 3.47Å; W22-W26 AromaticContact CE2-NE1 3.25Å; W22-W26 AromaticContact CH2-NE1 3.86Å; W22-W26 AromaticContact CZ2-CD1 3.69Å; W22-W26 AromaticContact CZ2-NE1 3.21Å; W22-W26 AromaticContact NE1-CD1 3.88Å; W22-W26 AromaticContact NE1-NE1 3.52Å; W22-W26 PolarHBondContact O-N 3.5Å; K23-W26 PolarHBondContact O-N 3.08Å; W26-K29 PolarHBondContact O-N 3.27Å; W26-K29 VanDerWaalsContact O-N 3.14Å; W26-G30 PolarHBondContact O-N 3.34Å
27	R	44.9	Very low	45.3	Very low	195 Å²	195	124.7 Å²	124.7	74%	0.736	66%	0.661	S	S	*	*	H	α-helix	trans	-63.1	-44.6	175.8	-143.1	174.9	179.6	-173	-1.5	111.7	K23 Q24 K29 G30 E31	K23-R27 WeakPolarHBondContact O-CB 3.49Å; K23-R27 PolarHBondContact O-N 2.68Å; Q24-R27 PolarHBondContact O-N 2.78Å; R27-K29 VanDerWaalsContact C-N 3.29Å; R27-K29 PolarHBondContact O-N 3.14Å; R27-G30 PolarHBondContact O-N 2.76Å; R27-E31 PolarHBondContact O-N 3.38Å
28	K	47.8	Very low	44.6	Very low	150 Å²	150	124.6 Å²	124.6	65%	0.652	68%	0.675	S	S	*	*	H	α-helix	trans	-67.3	-25.2	172.4	-76.1	-171.3	173.7	-173.2	0	114	Q24 C32	Q24-K28 PolarHBondContact O-N 3.38Å; K28-C32 PolarHBondContact O-N 3.47Å
29	K	44.6	Very low	43.4	Very low	130 Å²	130	122.3 Å²	122.3	57%	0.565	68%	0.683	S	S	*	*	H	α-helix	trans	-75.1	-32.4	175.4	-138.9	-177.5	-179	-166.8	0	111.8	K25 W26 R27 F33	K25-K29 WeakPolarHBondContact O-CB 3.37Å; K25-K29 PolarHBondContact O-N 3.33Å; K25-K29 VanDerWaalsContact O-N 3.1Å; W26-K29 PolarHBondContact O-N 3.27Å; W26-K29 VanDerWaalsContact O-N 3.14Å; R27-K29 VanDerWaalsContact C-N 3.29Å; R27-K29 PolarHBondContact O-N 3.14Å; K29-F33 PolarHBondContact O-N 2.9Å
30	G	40.2	Very low	42.1	Very low	52 Å²	52	121.1 Å²	121.1	54%	0.536	69%	0.688	S	S	.	*	H	α-helix	trans	-74.9	-23.9	173.2	0	0	0	0	0	114.2	W26 R27	W26-G30 PolarHBondContact O-N 3.34Å; R27-G30 PolarHBondContact O-N 2.76Å
31	E	43.7	Very low	41.2	Very low	145 Å²	145	121.6 Å²	121.6	68%	0.678	70%	0.699	S	S	*	*	H	α-helix	trans	-79.9	-24.1	175.3	-72.3	166.2	-176.2	0	0	113	R27	R27-E31 PolarHBondContact O-N 3.38Å
32	C	39.8	Very low	39.8	Very low	104 Å²	104	125.3 Å²	125.3	70%	0.703	72%	0.716	S	S	*	*	H	α-helix	trans	-99	-11.7	180	-70.5	0	0	0	0	114.9	K28	K28-C32 PolarHBondContact O-N 3.47Å
33	F	39.3	Very low	38.8	Very low	154 Å²	154	127.1 Å²	127.1	68%	0.675	73%	0.728	S	S	*	*	S	Bend	trans	-133.2	107.9	177.2	-73.7	-86.8	0	0	0	108.1	K29	K29-F33 PolarHBondContact O-N 2.9Å
34	G	32.4	Very low	37.7	Very low	81 Å²	81	129.5 Å²	129.5	84%	0.835	74%	0.741	S	S	*	*			trans	-48.6	139.3	178.6	0	0	0	0	0	112.3
35	G	31.8	Very low	36.4	Very low	84 Å²	84	127.7 Å²	127.7	87%	0.866	74%	0.744	S	S	*	*			trans	-61.6	132.4	-173.3	0	0	0	0	0	113.6
36	G	28.1	Very low	35.3	Very low	79 Å²	79	125.3 Å²	125.3	81%	0.814	75%	0.746	S	S	*	*			trans	-105.6	108.9	161.9	0	0	0	0	0	108.9
37	G	27.1	Very low	34.4	Very low	67 Å²	67	127.6 Å²	127.6	69%	0.691	76%	0.761	S	S	*	*			trans	-67.6	162.2	173	0	0	0	0	0	112.7	T39	G37-T39 PolarHBondContact O-N 3.46Å
38	A	32.3	Very low	33.9	Very low	106 Å²	106	125.3 Å²	125.3	88%	0.876	76%	0.762	S	S	*	*			trans	-52.5	130.5	177.2	0	0	0	0	0	111.9
39	T	27.4	Very low	33	Very low	142 Å²	142	125.7 Å²	125.7	87%	0.871	77%	0.771	S	S	*	*			trans	-124	127.4	163.4	22.1	0	0	0	0	110	G37	G37-T39 PolarHBondContact O-N 3.46Å
40	V	26	Very low	32.5	Very low	124 Å²	124	129.1 Å²	129.1	75%	0.752	79%	0.789	S	S	*	*			trans	-66	146.9	-176.9	167.5	0	0	0	0	110.6	T42	V40-T42 PolarHBondContact O-N 3.05Å
41	T	32.3	Very low	32.1	Very low	134 Å²	134	134.4 Å²	134.4	82%	0.822	80%	0.8	S	S	*	*			trans	-51.5	121.9	167.5	42.7	0	0	0	0	112.3
42	T	26.8	Very low	31.5	Very low	135 Å²	135	137 Å²	137	83%	0.828	81%	0.81	S	S	*	*			trans	-134.3	114.1	155.6	27.6	0	0	0	0	108.5	V40	V40-T42 PolarHBondContact O-N 3.05Å
43	K	36.7	Very low	31.1	Very low	198 Å²	198	139.4 Å²	139.4	86%	0.861	82%	0.815	S	S	*	*			trans	-64.2	129	159.4	-77.2	172.8	170.2	178.5	0	106.7
44	E	30.5	Very low	31	Very low	196 Å²	196	139.4 Å²	139.4	92%	0.916	82%	0.817	S	S	*	*			trans	167.1	95.1	147.7	-94.3	166.6	-152.7	0	0	109.6
45	S	29	Very low	31.2	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	82%	0.82	S	S	*	*			trans	-144.7	125.6	156.1	55.9	0	0	0	0	109.4
46	C	30.1	Very low	31.5	Very low	112 Å²	112	147.3 Å²	147.3	76%	0.757	82%	0.816	S	S	*	*			trans	-79.2	130.6	-178.5	-163.7	0	0	0	0	109.4
47	F	32.2	Very low	32	Very low	193 Å²	193	148.4 Å²	148.4	85%	0.846	82%	0.817	S	S	*	*			trans	-110.9	55.7	-171.1	-101.8	-84.7	0	0	0	112.1
48	L	32.8	Very low	32.6	Very low	146 Å²	146	153.4 Å²	153.4	76%	0.764	82%	0.822	S	S	*	*	S	Bend	trans	-136.1	106.6	172	-89.6	148.4	0	0	0	107.8
49	N	29.4	Very low	32.9	Very low	158 Å²	158	152.9 Å²	152.9	85%	0.845	81%	0.811	S	S	*	*	S	Bend	trans	90.3	106.3	178.2	-56.5	-22.1	0	0	0	116.4	Q51	N49-Q51 VanDerWaalsContact C-N 3.32Å; N49-Q51 PolarHBondContact O-N 3.48Å
50	E	35	Very low	33.3	Very low	202 Å²	202	151.8 Å²	151.8	94%	0.944	81%	0.806	S	S	*	*			trans	-68.4	67.1	-177.7	-60.7	-177.7	147.1	0	0	114.3
51	Q	30.8	Very low	33.7	Very low	163 Å²	163	157.2 Å²	157.2	76%	0.762	81%	0.813	S	S	*	*			trans	-137.4	130.3	165.6	-72.3	-173.4	-15.6	0	0	111.7	N49	N49-Q51 VanDerWaalsContact C-N 3.32Å; N49-Q51 PolarHBondContact O-N 3.48Å
52	F	31.5	Very low	33.8	Very low	201 Å²	201	156.9 Å²	156.9	88%	0.882	81%	0.814	S	S	*	*			trans	-83.2	125.5	175.9	-81	-90.9	0	0	0	110.1
53	D	32.6	Very low	33.8	Very low	153 Å²	153	155.3 Å²	155.3	82%	0.818	81%	0.814	S	S	*	*			trans	133.4	68.5	153.5	-68.2	-21.2	0	0	0	114.8
54	H	35.4	Very low	33.5	Very low	155 Å²	155	151.1 Å²	151.1	72%	0.718	81%	0.81	S	S	*	*			trans	-164.4	152.1	158.6	36.6	-74.4	0	0	0	112.5
55	W	37.4	Very low	33.4	Very low	238 Å²	238	151.1 Å²	151.1	90%	0.902	81%	0.81	S	S	*	*			trans	-88.3	144.6	-178.4	-79.9	60.5	0	0	0	112.2	A57 Q58	W55-A57 PolarHBondContact O-N 3.32Å; W55-Q58 PolarHBondContact O-N 2.87Å
56	A	38.3	Very low	33.4	Very low	93 Å²	93	155.4 Å²	155.4	77%	0.769	82%	0.819	S	S	*	*	G	3₁₀ helix	trans	-60.3	-10.9	-170.2	0	0	0	0	0	116.8	Q58	A56-Q58 PolarHBondContact O-N 3.33Å
57	A	38.5	Very low	33.3	Very low	101 Å²	101	157.7 Å²	157.7	84%	0.835	82%	0.823	S	S	*	*	G	3₁₀ helix	trans	-75.1	-5.2	-178.3	0	0	0	0	0	114.6	W55	W55-A57 PolarHBondContact O-N 3.32Å
58	Q	39	Very low	33.1	Very low	173 Å²	173	155.5 Å²	155.5	81%	0.808	83%	0.826	S	S	*	*	G	3₁₀ helix	trans	-116.5	15.9	-174.6	-64.3	-176.7	-7.4	0	0	114.1	W55 A56	W55-Q58 PolarHBondContact O-N 2.87Å; A56-Q58 PolarHBondContact O-N 3.33Å
59	C	39	Very low	32.9	Very low	95 Å²	95	156.3 Å²	156.3	64%	0.642	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-75.9	124.1	179.9	-139.6	0	0	0	0	111	R61	C59-R61 PolarHBondContact O-N 2.76Å
60	P	36.3	Very low	32.8	Very low	119 Å²	119	153 Å²	153	77%	0.773	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-67.8	125.4	-179.3	25.2	-30.4	0	0	0	110.6
61	R	34.2	Very low	32.6	Very low	237 Å²	237	150 Å²	150	89%	0.894	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-70.2	134.8	176.3	-67.7	178.4	177.8	170.7	-1.4	110.1	C59	C59-R61 PolarHBondContact O-N 2.76Å
62	P	33.6	Very low	32.5	Very low	128 Å²	128	145.2 Å²	145.2	83%	0.831	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-70.1	140.5	167.4	27.7	-29.5	0	0	0	110.2
63	A	28	Very low	32.6	Very low	101 Å²	101	141.6 Å²	141.6	84%	0.835	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-68.2	151.4	-176.6	0	0	0	0	0	112.7
64	S	29	Very low	32.4	Very low	111 Å²	111	143.1 Å²	143.1	78%	0.776	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-63.5	140.6	178.3	44.7	0	0	0	0	113.9
65	E	30.4	Very low	32.2	Very low	196 Å²	196	141.7 Å²	141.7	92%	0.916	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-74.9	137.7	160.4	-70.4	175.7	155.3	0	0	109.6
66	E	27.3	Very low	31.9	Very low	188 Å²	188	138.4 Å²	138.4	88%	0.879	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-91.4	136	167.7	-77.2	-176.6	156.8	0	0	110.1
67	D	28.5	Very low	31.7	Very low	160 Å²	160	140.5 Å²	140.5	86%	0.856	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-59.4	139.3	172.4	-71.4	-51.7	0	0	0	112.7
68	T	28	Very low	31.3	Very low	148 Å²	148	141.3 Å²	141.3	91%	0.908	82%	0.818	S	S	*	*			trans	-149.1	136.8	139.3	35.4	0	0	0	0	111.5
69	D	28.2	Very low	30.9	Very low	163 Å²	163	137.7 Å²	137.7	87%	0.872	81%	0.812	S	S	*	*			trans	-75.6	150.7	-169.5	-89.3	-48.1	0	0	0	116.2
70	A	28.3	Very low	30.6	Very low	88 Å²	88	139.3 Å²	139.3	73%	0.727	82%	0.821	S	S	*	*			trans	89.9	140.2	134.3	0	0	0	0	0	123.7
71	V	29.5	Very low	30.2	Very low	140 Å²	140	142 Å²	142	85%	0.848	82%	0.823	S	S	*	*			trans	96.8	107	152.5	-164.2	0	0	0	0	117.3
72	G	30	Very low	30	Very low	62 Å²	62	136.5 Å²	136.5	64%	0.639	82%	0.818	S	S	*	*			trans	-79.3	161.8	160.9	0	0	0	0	0	112.1
73	P	34.1	Very low	30	Very low	125 Å²	125	136.3 Å²	136.3	81%	0.812	81%	0.814	S	S	*	*				-147	160.8	88.1	35.4	-16.6	0	0	0	116.9
74	E	27.5	Very low	30.1	Very low	185 Å²	185	136.8 Å²	136.8	86%	0.864	81%	0.809	S	S	*	*			trans	46.6	135.1	155.3	-72.1	-172.1	153.4	0	0	123.4	L76	E74-L76 PolarHBondContact O-N 2.97Å
75	P	31.9	Very low	30.1	Very low	125 Å²	125	140.6 Å²	140.6	81%	0.812	81%	0.814	S	S	*	*			trans	-85.6	115	-178.1	33.5	-30.8	0	0	0	112.6
76	L	29.9	Very low	30.2	Very low	168 Å²	168	137.4 Å²	137.4	88%	0.88	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-75.6	122.7	158.6	-80.8	158.3	0	0	0	109.3	E74 P78	E74-L76 PolarHBondContact O-N 2.97Å; L76-P78 VanDerWaalsContact O-CD 3.29Å; L76-P78 WeakPolarHBondContact O-CD 3.41Å
77	V	35.4	Very low	30.4	Very low	138 Å²	138	133.4 Å²	133.4	84%	0.836	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-67.2	120.5	173.3	176.9	0	0	0	0	109.7
78	P	30.2	Very low	30.6	Very low	118 Å²	118	131 Å²	131	77%	0.766	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-90.4	121.3	167.5	0.7	19.8	0	0	0	109.9	L76	L76-P78 VanDerWaalsContact O-CD 3.29Å; L76-P78 WeakPolarHBondContact O-CD 3.41Å
79	S	29.5	Very low	31.1	Very low	97 Å²	97	131.6 Å²	131.6	68%	0.678	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-53.2	145.5	165.3	47.2	0	0	0	0	112.2	Q81	S79-Q81 PolarHBondContact O-N 3.05Å
80	P	31.9	Very low	31.7	Very low	128 Å²	128	130.1 Å²	130.1	83%	0.831	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-68.1	119.4	-177.1	27.6	-32.1	0	0	0	110.6
81	Q	28.8	Very low	32.9	Very low	176 Å²	176	130.7 Å²	130.7	82%	0.822	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-73.4	143.7	163.7	-72.1	-166.4	-10.5	0	0	109.6	S79 V83	S79-Q81 PolarHBondContact O-N 3.05Å; Q81-V83 PolarHBondContact O-N 3.47Å
82	P	29.4	Very low	34.9	Very low	121 Å²	121	127.8 Å²	127.8	79%	0.786	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-64.7	120.1	178.5	25.9	-30.9	0	0	0	109.3
83	V	34.3	Very low	37.6	Very low	124 Å²	124	126.2 Å²	126.2	75%	0.752	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-59.4	130.2	168.3	-169.2	0	0	0	0	106.8	Q81 E85	Q81-V83 PolarHBondContact O-N 3.47Å; V83-E85 PolarHBondContact O-N 3.21Å; V83-E85 VanDerWaalsContact O-N 3.09Å
84	P	30.8	Very low	40.3	Very low	111 Å²	111	126.2 Å²	126.2	72%	0.721	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-58.2	121.8	175.8	22.3	-30.3	0	0	0	108.3	V86	P84-V86 PolarHBondContact O-N 3.38Å
85	E	29.3	Very low	43.4	Very low	191 Å²	191	120.3 Å²	120.3	89%	0.893	71%	0.71	S	S	*	*			trans	-52.7	110.9	172.7	-74.9	179.2	156.9	0	0	108.2	V83 P87	V83-E85 PolarHBondContact O-N 3.21Å; V83-E85 VanDerWaalsContact O-N 3.09Å; E85-P87 WeakPolarHBondContact O-CD 3.41Å
86	V	31.8	Very low	46.3	Very low	129 Å²	129	115.7 Å²	115.7	78%	0.782	68%	0.678	S	S	*	*			trans	-62.4	120.6	161	-179.3	0	0	0	0	104.9	P84 S88	P84-V86 PolarHBondContact O-N 3.38Å; V86-S88 PolarHBondContact O-N 2.99Å
87	P	31.5	Very low	49.4	Very low	104 Å²	104	109.6 Å²	109.6	68%	0.675	64%	0.644	S	S	*	*			trans	-59.1	123	179	13.5	-16.1	0	0	0	107.7	E85 L89	E85-P87 WeakPolarHBondContact O-CD 3.41Å; P87-L89 VanDerWaalsContact C-N 3.27Å; P87-L89 PolarHBondContact O-N 3.13Å
88	S	32	Very low	52.2	Low	110 Å²	110	107.7 Å²	107.7	77%	0.769	64%	0.636	S	S	*	*			trans	-59.9	93.6	169.6	51	0	0	0	0	107.9	V86 D90	V86-S88 PolarHBondContact O-N 2.99Å; S88-D90 PolarHBondContact O-N 3.48Å; S88-D90 VanDerWaalsContact O-N 3.13Å
89	L	38	Very low	55.1	Low	161 Å²	161	105.6 Å²	105.6	84%	0.843	62%	0.619	S	S	*	*			trans	-62.4	112.1	168.4	-83.2	157	0	0	0	107	P87	P87-L89 VanDerWaalsContact C-N 3.27Å; P87-L89 PolarHBondContact O-N 3.13Å
90	D	41.6	Very low	57.9	Low	132 Å²	132	102.2 Å²	102.2	71%	0.706	60%	0.599	S	S	*	*			trans	-50.6	128.7	167.7	-78.9	-41.6	0	0	0	108.8	S88 T92	S88-D90 PolarHBondContact O-N 3.48Å; S88-D90 VanDerWaalsContact O-N 3.13Å; D90-T92 PolarHBondContact O-N 2.84Å
91	P	54.5	Low	60.4	Low	100 Å²	100	103.3 Å²	103.3	65%	0.649	61%	0.606	S	S	*	*	S	Bend	trans	-75.3	20.9	-172.7	30.2	-35	0	0	0	113.5	P241	P91-P241 WeakPolarHBondContact O-CB 3.46Å
92	T	69.6	Low	63.1	Low	79 Å²	79	98.8 Å²	98.8	49%	0.485	59%	0.594	S	S	.	*			trans	-104.5	120.1	-170.5	41.2	0	0	0	0	111.4	D90 L94	D90-T92 PolarHBondContact O-N 2.84Å; T92-L94 PolarHBondContact O-N 2.75Å
93	V	86.9	Confident	65.8	Low	28 Å²	28	95.4 Å²	95.4	17%	0.17	58%	0.581	C	S	.	*	P	Polyproline II helix	trans	-68.1	118.6	169.7	-177.2	0	0	0	0	108	Y162 C168 P241 A243	V93-Y162 HydrophobicContact CG1-CD1 3.93Å; V93-Y162 HydrophobicContact CG1-CE1 4.08Å; V93-C168 HydrophobicContact CG2-CB 3.84Å; V93-P241 HydrophobicContact CG2-CB 3.65Å; V93-P241 HydrophobicContact CG2-CG 3.92Å; V93-A243 HydrophobicContact CB-CB 4.35Å; V93-A243 HydrophobicContact CG1-CB 4.05Å; V93-A243 HydrophobicContact CG2-CB 4.33Å
94	L	91.4	Very high	68.4	Low	125 Å²	125	96 Å²	96	65%	0.654	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-63.9	151.1	174.8	-65	175.6	0	0	0	110.8	T92 R165	T92-L94 PolarHBondContact O-N 2.75Å; L94-R165 PolarHBondContact O-NH1 3.01Å; L94-R165 PolarHBondContact O-NH2 3.25Å
95	P	93.1	Very high	71.2	Confident	61 Å²	61	93.5 Å²	93.5	40%	0.396	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-51.3	145.4	170.9	-28.1	36.7	0	0	0	112.5	Y97 R165	P95-Y97 WeakPolarHBondContact CB-O 3.49Å; P95-R165 PolarHBondContact O-NH1 3.32Å
96	L	93.4	Very high	74.2	Confident	29 Å²	29	86.1 Å²	86.1	15%	0.152	53%	0.528	C	S	.	.	S	Bend	trans	-68.9	-39.8	176.9	-169.4	64.1	0	0	0	111.7	L136 L161 Y162 R165	L96-L136 WeakPolarHBondContact CA-O 3.41Å; L96-L136 HydrophobicContact CB-CB 4.43Å; L96-L136 HydrophobicContact CB-CD2 4.26Å; L96-L136 WeakPolarHBondContact CB-O 3.26Å; L96-L136 HydrophobicContact CD2-CD2 3.72Å; L96-L136 PolarHBondContact N-O 3.04Å; L96-L161 HydrophobicContact CD2-CB 3.6Å; L96-L161 HydrophobicContact CD2-CD1 4.29Å; L96-Y162 HydrophobicContact CB-CD1 4.35Å; L96-Y162 HydrophobicContact CB-CE1 3.9Å; L96-Y162 PolarHBondContact N-OH 2.95Å; L96-R165 VanDerWaalsContact CA-NH1 3.33Å; L96-R165 HydrophobicContact CD1-CB 3.96Å; L96-R165 HydrophobicContact CD1-CG 4.26Å
97	Y	95	Very high	77.1	Confident	40 Å²	40	88.4 Å²	88.4	16%	0.157	53%	0.53	C	S	.	.	S	Bend	trans	-121.4	144.2	177	-56.6	-53.7	0	0	0	110.6	P95 P109 V112 M133 L136 S137	P95-Y97 WeakPolarHBondContact CB-O 3.49Å; Y97-P109 HydrophobicContact CD1-CG 4.42Å; Y97-P109 HydrophobicContact CE1-CG 3.9Å; Y97-P109 HydrophobicContact CE2-CG 4.07Å; Y97-V112 HydrophobicContact CE2-CG2 4.06Å; Y97-M133 HydrophobicContact CD2-CE 3.78Å; Y97-M133 HydrophobicContact CD2-SD 4.3Å; Y97-M133 HydrophobicContact CE2-CE 4.19Å; Y97-M133 HydrophobicContact CE2-SD 4.25Å; Y97-L136 HydrophobicContact CD2-CB 3.63Å; Y97-L136 HydrophobicContact CD2-CD1 4.24Å; Y97-L136 HydrophobicContact CE2-CB 3.96Å; Y97-L136 HydrophobicContact CE2-CD1 3.72Å; Y97-L136 HydrophobicContact CE2-CG 4.37Å; Y97-L136 PolarHBondContact N-O 3.24Å; Y97-S137 WeakPolarHBondContact O-CA 3.34Å
98	S	92.8	Very high	80.2	Confident	97 Å²	97	84.8 Å²	84.8	68%	0.678	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-85.2	150	171.6	53.5	0	0	0	0	110.6
99	L	92.4	Very high	83.2	Confident	75 Å²	75	81.5 Å²	81.5	39%	0.393	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-66	155.2	169.6	-65.9	90	0	0	0	110.5	G103 I139	L99-G103 VanDerWaalsContact CD2-O 3.28Å; L99-G103 WeakPolarHBondContact CD2-O 3.48Å; L99-I139 HydrophobicContact CD1-CD1 4.34Å; L99-I139 HydrophobicContact CD2-CD1 3.73Å; L99-I139 HydrophobicContact CG-CD1 4.17Å
100	G	87.9	Confident	85.9	Confident	26 Å²	26	77.8 Å²	77.8	27%	0.268	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-66.7	173.1	172.7	0	0	0	0	0	112.9	S102 G103 Q104	G100-S102 PolarHBondContact O-N 3.46Å; G100-S102 VanDerWaalsContact O-N 3.09Å; G100-G103 PolarHBondContact O-N 3.46Å; G100-Q104 PolarHBondContact N-O 3.22Å
101	P	83.2	Confident	88.5	Confident	150 Å²	150	75 Å²	75	97%	0.974	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.6	-173.6	24.4	-34.3	0	0	0	114.2
102	S	86.8	Confident	90.6	Very high	81 Å²	81	70.2 Å²	70.2	57%	0.566	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	9	177.5	54.6	0	0	0	0	113.9	G100 Q104	G100-S102 PolarHBondContact O-N 3.46Å; G100-S102 VanDerWaalsContact O-N 3.09Å; S102-Q104 VanDerWaalsContact C-N 3.28Å; S102-Q104 PolarHBondContact O-N 2.97Å; S102-Q104 WeakPolarHBondContact OG-CG 3.41Å
103	G	85.5	Confident	91.8	Very high	50 Å²	50	70.5 Å²	70.5	52%	0.515	42%	0.421	S	S	.	.	S	Bend	trans	75.2	14.3	-174.5	0	0	0	0	0	114.2	L99 G100	L99-G103 VanDerWaalsContact CD2-O 3.28Å; L99-G103 WeakPolarHBondContact CD2-O 3.48Å; G100-G103 PolarHBondContact O-N 3.46Å
104	Q	89.7	Confident	92.2	Very high	137 Å²	137	75 Å²	75	64%	0.64	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-81.2	155.4	173.1	-66.5	175	5.3	0	0	111.1	G100 S102	G100-Q104 PolarHBondContact N-O 3.22Å; S102-Q104 VanDerWaalsContact C-N 3.28Å; S102-Q104 PolarHBondContact O-N 2.97Å; S102-Q104 WeakPolarHBondContact OG-CG 3.41Å
105	L	89.6	Confident	92.3	Very high	59 Å²	59	69 Å²	69	31%	0.309	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-62	141	171.3	-75.4	169.9	0	0	0	110.1	R130 R134 I139	L105-R130 HydrophobicContact CD1-CG 4.3Å; L105-R134 HydrophobicContact CD1-CG 3.66Å; L105-R134 HydrophobicContact CD2-CG 4.14Å; L105-R134 HydrophobicContact CG-CG 4.45Å; L105-I139 HydrophobicContact CD2-CD1 3.96Å
106	A	90.6	Very high	92.3	Very high	36 Å²	36	66.2 Å²	66.2	30%	0.298	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-66	149.4	171.2	0	0	0	0	0	110.7
107	E	93.6	Very high	92.3	Very high	177 Å²	177	71.3 Å²	71.3	83%	0.827	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-54.7	141.7	168.4	-69.7	-63.3	142.6	0	0	110.6	P109	E107-P109 WeakPolarHBondContact O-CD 3.34Å
108	T	95.8	Very high	92	Very high	28 Å²	28	73.8 Å²	73.8	17%	0.172	43%	0.426	C	S	.	.			trans	-64.4	115.4	-175	-54.7	0	0	0	0	111.1	V112 F113 E129 M133	T108-V112 HydrophobicContact CG2-CB 3.72Å; T108-V112 HydrophobicContact CG2-CG1 3.7Å; T108-V112 HydrophobicContact CG2-CG2 4.2Å; T108-F113 HydrophobicContact CG2-CD2 4.19Å; T108-F113 HydrophobicContact CG2-CE2 3.52Å; T108-F113 HydrophobicContact CG2-CZ 3.71Å; T108-E129 WeakPolarHBondContact CB-OE1 3.44Å; T108-E129 HydrophobicContact CG2-CG 4.25Å; T108-E129 PolarHBondContact OG1-OE1 3.4Å; T108-M133 HydrophobicContact CG2-CG 4.28Å; T108-M133 HydrophobicContact CG2-SD 4.07Å
109	P	95.9	Very high	91.8	Very high	41 Å²	41	70 Å²	70	27%	0.266	40%	0.398	S	S	.	.			trans	-70.7	155.6	-178.3	-22.1	36.3	0	0	0	112.8	Y97 E107 E111 V112	Y97-P109 HydrophobicContact CD1-CG 4.42Å; Y97-P109 HydrophobicContact CE1-CG 3.9Å; Y97-P109 HydrophobicContact CE2-CG 4.07Å; E107-P109 WeakPolarHBondContact O-CD 3.34Å; P109-E111 PolarHBondContact O-N 3.14Å; P109-E111 VanDerWaalsContact O-N 3.13Å; P109-V112 WeakPolarHBondContact O-CB 3.33Å; P109-V112 PolarHBondContact O-N 3.42Å
110	A	95.5	Very high	91.6	Very high	82 Å²	82	69.4 Å²	69.4	68%	0.678	41%	0.411	S	S	*	.	H	α-helix	trans	-55.8	-31.8	178.3	0	0	0	0	0	113.8	V112 F113 Q114	A110-V112 PolarHBondContact O-N 3.43Å; A110-F113 PolarHBondContact O-N 3.23Å; A110-Q114 PolarHBondContact O-N 2.85Å
111	E	96.3	Very high	91.6	Very high	74 Å²	74	71.5 Å²	71.5	35%	0.346	41%	0.413	S	S	.	.	H	α-helix	trans	-59.5	-34.3	176.8	-174.6	-179	-173.2	0	0	112.4	P109 Q114 A115 L161	P109-E111 PolarHBondContact O-N 3.14Å; P109-E111 VanDerWaalsContact O-N 3.13Å; E111-Q114 PolarHBondContact O-N 2.91Å; E111-A115 WeakPolarHBondContact O-CB 3.42Å; E111-A115 PolarHBondContact O-N 2.9Å; E111-L161 HydrophobicContact CG-CD2 3.82Å; E111-L161 WeakPolarHBondContact OE1-CD2 3.32Å
112	V	96.6	Very high	91.9	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-66	-43.8	178.8	175.9	0	0	0	0	110.4	Y97 T108 P109 A110 A115 L116 F124 V132 M133 L136 L157 L161	Y97-V112 HydrophobicContact CE2-CG2 4.06Å; T108-V112 HydrophobicContact CG2-CB 3.72Å; T108-V112 HydrophobicContact CG2-CG1 3.7Å; T108-V112 HydrophobicContact CG2-CG2 4.2Å; P109-V112 WeakPolarHBondContact O-CB 3.33Å; P109-V112 PolarHBondContact O-N 3.42Å; A110-V112 PolarHBondContact O-N 3.43Å; V112-A115 PolarHBondContact O-N 3.43Å; V112-L116 WeakPolarHBondContact O-CB 3.39Å; V112-L116 PolarHBondContact O-N 3.23Å; V112-F124 HydrophobicContact CG1-CE2 4.03Å; V112-F124 HydrophobicContact CG1-CZ 3.76Å; V112-V132 HydrophobicContact CG1-CG1 4.19Å; V112-M133 HydrophobicContact CG2-SD 3.99Å; V112-L136 HydrophobicContact CG2-CD1 3.92Å; V112-L157 HydrophobicContact CG1-CD1 4.31Å; V112-L157 HydrophobicContact CG1-CD2 4.09Å; V112-L161 HydrophobicContact CG2-CD1 3.99Å
113	F	96.6	Very high	92.1	Very high	85 Å²	85	72.9 Å²	72.9	37%	0.373	41%	0.41	S	S	.	.	H	α-helix	trans	-67	-38.6	175.5	-63.8	-74.2	0	0	0	112	T108 A110 A115 L116 E117 F124	T108-F113 HydrophobicContact CG2-CD2 4.19Å; T108-F113 HydrophobicContact CG2-CE2 3.52Å; T108-F113 HydrophobicContact CG2-CZ 3.71Å; A110-F113 PolarHBondContact O-N 3.23Å; F113-A115 VanDerWaalsContact C-N 3.35Å; F113-A115 PolarHBondContact O-N 3.16Å; F113-L116 WeakPolarHBondContact O-CB 3.48Å; F113-L116 PolarHBondContact O-N 2.97Å; F113-E117 PolarHBondContact O-N 3.35Å; F113-E117 VanDerWaalsContact O-N 3.07Å; F113-F124 HydrophobicContact CD1-CD2 4.46Å; F113-F124 HydrophobicContact CD1-CE2 4.2Å; F113-F124 HydrophobicContact CE1-CD2 4.02Å; F113-F124 AromaticContact CE1-CE2 3.99Å; F113-F124 HydrophobicContact CE1-CE2 3.99Å
114	Q	94.3	Very high	92.4	Very high	121 Å²	121	72.2 Å²	72.2	57%	0.565	39%	0.393	S	S	*	.	H	α-helix	trans	-63	-41.9	174.7	-169.7	-174.5	16.5	0	0	112	A110 E111 L116 E117 Q118	A110-Q114 PolarHBondContact O-N 2.85Å; E111-Q114 PolarHBondContact O-N 2.91Å; Q114-L116 VanDerWaalsContact C-N 3.34Å; Q114-E117 PolarHBondContact O-N 3.5Å; Q114-Q118 WeakPolarHBondContact O-CB 3.4Å; Q114-Q118 PolarHBondContact O-N 3.26Å
115	A	93.7	Very high	92.4	Very high	0 Å²	0	72 Å²	72	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-65.5	-37.8	175.4	0	0	0	0	0	111.9	E111 V112 F113 Q118 L119 L157 L160 L161	E111-A115 WeakPolarHBondContact O-CB 3.42Å; E111-A115 PolarHBondContact O-N 2.9Å; V112-A115 PolarHBondContact O-N 3.43Å; F113-A115 VanDerWaalsContact C-N 3.35Å; F113-A115 PolarHBondContact O-N 3.16Å; A115-Q118 PolarHBondContact O-N 3.33Å; A115-L119 VanDerWaalsContact O-CG 3.26Å; A115-L119 WeakPolarHBondContact O-CG 3.21Å; A115-L119 PolarHBondContact O-N 3.3Å; A115-L157 HydrophobicContact CB-CD2 4.27Å; A115-L157 HydrophobicContact CB-CG 4.12Å; A115-L160 HydrophobicContact CB-CD2 4.33Å; A115-L161 HydrophobicContact CB-CD2 3.79Å; A115-L161 HydrophobicContact CB-CG 4.27Å
116	L	94.1	Very high	92.2	Very high	3 Å²	3	73.8 Å²	73.8	2%	0.016	40%	0.401	C	S	.	.	H	α-helix	trans	-57.7	-49	174.7	-179.7	69.3	0	0	0	111.8	V112 F113 Q114 Q118 L119 G120 H121 F124 L153 L157	V112-L116 WeakPolarHBondContact O-CB 3.39Å; V112-L116 PolarHBondContact O-N 3.23Å; F113-L116 WeakPolarHBondContact O-CB 3.48Å; F113-L116 PolarHBondContact O-N 2.97Å; Q114-L116 VanDerWaalsContact C-N 3.34Å; L116-Q118 VanDerWaalsContact C-N 3.35Å; L116-Q118 PolarHBondContact O-N 2.88Å; L116-L119 PolarHBondContact O-N 3Å; L116-G120 PolarHBondContact O-N 3.07Å; L116-H121 CarbonylContact C-O 3.44Å; L116-H121 HydrophobicContact CD1-CB 3.56Å; L116-H121 HydrophobicContact CG-CB 3.92Å; L116-H121 PolarHBondContact O-N 3.46Å; L116-H121 VanDerWaalsContact O-N 3.13Å; L116-F124 HydrophobicContact CD1-CD1 4.09Å; L116-F124 HydrophobicContact CD1-CE1 3.84Å; L116-F124 HydrophobicContact CD1-CZ 4.26Å; L116-F124 HydrophobicContact CD2-CD1 4.27Å; L116-F124 HydrophobicContact CD2-CD2 3.96Å; L116-F124 HydrophobicContact CD2-CE1 4.29Å; L116-F124 HydrophobicContact CD2-CE2 3.98Å; L116-F124 HydrophobicContact CD2-CG 4.1Å; L116-F124 HydrophobicContact CD2-CZ 4.15Å; L116-L153 HydrophobicContact CD1-CD1 3.92Å; L116-L153 HydrophobicContact CD1-CD2 3.49Å; L116-L153 VanDerWaalsContact CD1-CD2 3.49Å; L116-L153 HydrophobicContact CD1-CG 4.26Å; L116-L157 HydrophobicContact CB-CD1 3.98Å; L116-L157 HydrophobicContact CD1-CD1 4.2Å
117	E	91.8	Very high	92.1	Very high	136 Å²	136	73.3 Å²	73.3	64%	0.636	40%	0.399	S	S	*	.	H	α-helix	trans	-63.3	-40.2	177.3	-71.5	-175	177.1	0	0	112.2	F113 Q114 L119 G120 H121	F113-E117 PolarHBondContact O-N 3.35Å; F113-E117 VanDerWaalsContact O-N 3.07Å; Q114-E117 PolarHBondContact O-N 3.5Å; E117-L119 PolarHBondContact O-N 2.73Å; E117-G120 WeakPolarHBondContact O-CA 3.42Å; E117-G120 PolarHBondContact O-N 3.06Å; E117-H121 WeakPolarHBondContact CA-O 3.47Å; E117-H121 PolarHBondContact N-O 2.91Å
118	Q	89.9	Confident	92	Very high	91 Å²	91	65 Å²	65	43%	0.425	36%	0.361	S	S	.	.	H	α-helix	trans	-62.8	-31.6	176.5	178.2	170.4	-12.7	0	0	113	Q114 A115 L116 G120 R164	Q114-Q118 WeakPolarHBondContact O-CB 3.4Å; Q114-Q118 PolarHBondContact O-N 3.26Å; A115-Q118 PolarHBondContact O-N 3.33Å; L116-Q118 VanDerWaalsContact C-N 3.35Å; L116-Q118 PolarHBondContact O-N 2.88Å; Q118-G120 PolarHBondContact O-N 2.69Å; Q118-R164 VanDerWaalsContact CD-NH2 3.29Å
119	L	88.3	Confident	92	Very high	17 Å²	17	67 Å²	67	9%	0.089	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-3.9	173.2	-62.5	171.8	0	0	0	112.3	A115 L116 E117 L153 Q156 L157 L160 P188 L191	A115-L119 VanDerWaalsContact O-CG 3.26Å; A115-L119 WeakPolarHBondContact O-CG 3.21Å; A115-L119 PolarHBondContact O-N 3.3Å; L116-L119 PolarHBondContact O-N 3Å; E117-L119 PolarHBondContact O-N 2.73Å; L119-L153 HydrophobicContact CB-CD1 4.5Å; L119-L153 HydrophobicContact CD1-CD1 3.62Å; L119-Q156 HydrophobicContact CD1-CB 4.4Å; L119-L157 HydrophobicContact CD1-CB 3.68Å; L119-L157 HydrophobicContact CD1-CG 4.1Å; L119-L160 HydrophobicContact CD2-CD2 4.18Å; L119-L160 HydrophobicContact CG-CD2 4.47Å; L119-P188 HydrophobicContact CD2-CB 4.06Å; L119-P188 HydrophobicContact CD2-CG 3.56Å; L119-L191 HydrophobicContact CD2-CD1 4.33Å
120	G	87.6	Confident	91.8	Very high	64 Å²	64	69.4 Å²	69.4	66%	0.66	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.5	13.6	175.7	0	0	0	0	0	114.7	L116 E117 Q118	L116-G120 PolarHBondContact O-N 3.07Å; E117-G120 WeakPolarHBondContact O-CA 3.42Å; E117-G120 PolarHBondContact O-N 3.06Å; Q118-G120 PolarHBondContact O-N 2.69Å
121	H	88.3	Confident	91.7	Very high	70 Å²	70	65.5 Å²	65.5	32%	0.324	34%	0.34	S	S	.	.			trans	-107.3	136.3	180	-61.3	-73.6	0	0	0	111	L116 E117	L116-H121 CarbonylContact C-O 3.44Å; L116-H121 HydrophobicContact CD1-CB 3.56Å; L116-H121 HydrophobicContact CG-CB 3.92Å; L116-H121 PolarHBondContact O-N 3.46Å; L116-H121 VanDerWaalsContact O-N 3.13Å; E117-H121 WeakPolarHBondContact CA-O 3.47Å; E117-H121 PolarHBondContact N-O 2.91Å
122	Q	89.5	Confident	91.7	Very high	190 Å²	190	62 Å²	62	89%	0.888	32%	0.323	S	S	*	.	S	Bend	trans	-90	-21.7	-178.8	-66.6	-176.6	-8.2	0	0	113.8
123	A	91.4	Very high	91.7	Very high	70 Å²	70	62.1 Å²	62.1	58%	0.579	32%	0.324	S	S	*	.	S	Bend	trans	-155.4	153.1	-176.8	0	0	0	0	0	111.2
124	F	92.2	Very high	91.7	Very high	35 Å²	35	58.8 Å²	58.8	15%	0.154	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-72.3	142	168.8	-77	-63	0	0	0	111	V112 F113 L116 Q128 E129 V132 L153 L157	V112-F124 HydrophobicContact CG1-CE2 4.03Å; V112-F124 HydrophobicContact CG1-CZ 3.76Å; F113-F124 HydrophobicContact CD1-CD2 4.46Å; F113-F124 HydrophobicContact CD1-CE2 4.2Å; F113-F124 HydrophobicContact CE1-CD2 4.02Å; F113-F124 AromaticContact CE1-CE2 3.99Å; F113-F124 HydrophobicContact CE1-CE2 3.99Å; L116-F124 HydrophobicContact CD1-CD1 4.09Å; L116-F124 HydrophobicContact CD1-CE1 3.84Å; L116-F124 HydrophobicContact CD1-CZ 4.26Å; L116-F124 HydrophobicContact CD2-CD1 4.27Å; L116-F124 HydrophobicContact CD2-CD2 3.96Å; L116-F124 HydrophobicContact CD2-CE1 4.29Å; L116-F124 HydrophobicContact CD2-CE2 3.98Å; L116-F124 HydrophobicContact CD2-CG 4.1Å; L116-F124 HydrophobicContact CD2-CZ 4.15Å; F124-Q128 HydrophobicContact CB-CB 4.44Å; F124-Q128 HydrophobicContact CD1-CB 3.74Å; F124-Q128 HydrophobicContact CE1-CB 4.5Å; F124-Q128 HydrophobicContact CG-CB 4.49Å; F124-E129 HydrophobicContact CB-CB 4.14Å; F124-E129 HydrophobicContact CD1-CB 4.35Å; F124-E129 HydrophobicContact CD2-CB 3.66Å; F124-E129 HydrophobicContact CD2-CG 3.82Å; F124-E129 HydrophobicContact CE2-CB 4.1Å; F124-E129 HydrophobicContact CE2-CG 3.94Å; F124-E129 HydrophobicContact CG-CB 3.8Å; F124-E129 HydrophobicContact CG-CG 4.48Å; F124-V132 HydrophobicContact CE1-CG2 4.33Å; F124-L153 HydrophobicContact CD1-CD2 4.36Å; F124-L153 HydrophobicContact CE1-CD2 4.38Å; F124-L157 HydrophobicContact CE1-CD1 3.96Å; F124-L157 HydrophobicContact CZ-CD1 3.79Å
125	R	88.4	Confident	91.8	Very high	134 Å²	134	53 Å²	53	51%	0.506	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-83.4	160.9	165.4	-61.9	174.7	179.5	-93.9	3.2	109.7	G127 Q128 A149	R125-G127 PolarHBondContact O-N 3.28Å; R125-Q128 HydrophobicContact CB-CG 4.07Å; R125-Q128 WeakPolarHBondContact O-CB 3.26Å; R125-Q128 PolarHBondContact O-N 2.86Å; R125-Q128 VanDerWaalsContact O-N 3.08Å; R125-A149 WeakPolarHBondContact CD-O 3.48Å
126	P	86.4	Confident	91.9	Very high	95 Å²	95	53 Å²	53	62%	0.617	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	133	179.4	-28.8	36.1	0	0	0	112.8	Q128	P126-Q128 PolarHBondContact O-N 3.34Å
127	G	88.1	Confident	92	Very high	26 Å²	26	53 Å²	53	27%	0.268	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	-19.2	-179.9	0	0	0	0	0	116	R125 A131	R125-G127 PolarHBondContact O-N 3.28Å; G127-A131 WeakPolarHBondContact O-CB 3.5Å; G127-A131 PolarHBondContact O-N 3.01Å; G127-A131 VanDerWaalsContact O-N 3.16Å
128	Q	92.2	Very high	92.1	Very high	3 Å²	3	48 Å²	48	1%	0.014	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-47.3	-176	-68	-173.2	-38.6	0	0	112.8	F124 R125 P126 R130 A131 V132 L145 A149 G150	F124-Q128 HydrophobicContact CB-CB 4.44Å; F124-Q128 HydrophobicContact CD1-CB 3.74Å; F124-Q128 HydrophobicContact CE1-CB 4.5Å; F124-Q128 HydrophobicContact CG-CB 4.49Å; R125-Q128 HydrophobicContact CB-CG 4.07Å; R125-Q128 WeakPolarHBondContact O-CB 3.26Å; R125-Q128 PolarHBondContact O-N 2.86Å; R125-Q128 VanDerWaalsContact O-N 3.08Å; P126-Q128 PolarHBondContact O-N 3.34Å; Q128-R130 PolarHBondContact O-N 3.28Å; Q128-A131 PolarHBondContact O-N 3.27Å; Q128-V132 WeakPolarHBondContact O-CB 3.34Å; Q128-V132 VanDerWaalsContact O-CG2 3.32Å; Q128-V132 WeakPolarHBondContact O-CG2 3.47Å; Q128-V132 PolarHBondContact O-N 3.29Å; Q128-L145 HydrophobicContact CG-CD1 4.27Å; Q128-A149 PolarHBondContact NE2-O 3.06Å; Q128-A149 VanDerWaalsContact NE2-O 3.07Å; Q128-G150 PolarHBondContact NE2-O 2.83Å
129	E	94.7	Very high	92.3	Very high	71 Å²	71	45.9 Å²	45.9	33%	0.332	26%	0.258	S	S	.	.	H	α-helix	trans	-58.9	-50.7	-177.3	-175.5	176.1	177.8	0	0	111.6	T108 F124 A131 V132 M133	T108-E129 WeakPolarHBondContact CB-OE1 3.44Å; T108-E129 HydrophobicContact CG2-CG 4.25Å; T108-E129 PolarHBondContact OG1-OE1 3.4Å; F124-E129 HydrophobicContact CB-CB 4.14Å; F124-E129 HydrophobicContact CD1-CB 4.35Å; F124-E129 HydrophobicContact CD2-CB 3.66Å; F124-E129 HydrophobicContact CD2-CG 3.82Å; F124-E129 HydrophobicContact CE2-CB 4.1Å; F124-E129 HydrophobicContact CE2-CG 3.94Å; F124-E129 HydrophobicContact CG-CB 3.8Å; F124-E129 HydrophobicContact CG-CG 4.48Å; E129-A131 PolarHBondContact O-N 3.39Å; E129-V132 PolarHBondContact O-N 2.99Å; E129-M133 PolarHBondContact O-N 3.11Å
130	R	92.9	Very high	92.6	Very high	91 Å²	91	45.7 Å²	45.7	34%	0.343	26%	0.258	S	S	.	.	H	α-helix	trans	-58.1	-46.6	176.7	-177.9	176.1	178.8	157.3	-3.6	111.7	L105 Q128 V132 M133 R134 E304 D306 L307	L105-R130 HydrophobicContact CD1-CG 4.3Å; Q128-R130 PolarHBondContact O-N 3.28Å; R130-V132 PolarHBondContact O-N 3.45Å; R130-M133 PolarHBondContact O-N 3.23Å; R130-R134 WeakPolarHBondContact O-CG 3.24Å; R130-R134 PolarHBondContact O-N 2.9Å; R130-E304 IonicContact CZ-OE2 3.36Å; R130-E304 IonicContact NE-OE2 3.38Å; R130-E304 PolarHBondContact NE-OE2 3.45Å; R130-E304 VanDerWaalsContact NH2-CD 3.34Å; R130-E304 IonicContact NH2-OE1 3.86Å; R130-E304 IonicContact NH2-OE2 2.68Å; R130-E304 PolarHBondContact NH2-OE2 2.84Å; R130-D306 IonicContact CZ-OD2 3.76Å; R130-D306 IonicContact NH1-OD2 2.78Å; R130-D306 PolarHBondContact NH1-OD2 3.18Å; R130-D306 IonicContact NH2-OD2 3.97Å; R130-L307 HydrophobicContact CG-CD2 4.45Å
131	A	93.7	Very high	92.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.1	-42.2	179.2	0	0	0	0	0	112.1	G127 Q128 E129 R134 I135 T141 L143	G127-A131 WeakPolarHBondContact O-CB 3.5Å; G127-A131 PolarHBondContact O-N 3.01Å; G127-A131 VanDerWaalsContact O-N 3.16Å; Q128-A131 PolarHBondContact O-N 3.27Å; E129-A131 PolarHBondContact O-N 3.39Å; A131-R134 PolarHBondContact O-N 2.75Å; A131-I135 WeakPolarHBondContact O-CG1 3.13Å; A131-I135 PolarHBondContact O-N 3.25Å; A131-T141 HydrophobicContact CB-CG2 4.14Å; A131-L143 HydrophobicContact CB-CB 4.49Å; A131-L143 HydrophobicContact CB-CD1 4.39Å; A131-L143 HydrophobicContact CB-CD2 3.86Å; A131-L143 HydrophobicContact CB-CG 4.48Å
132	V	96.3	Very high	93.2	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.4	-48.6	175	163.1	0	0	0	0	110.6	V112 F124 Q128 E129 R130 R134 I135 L136 L157 P158	V112-V132 HydrophobicContact CG1-CG1 4.19Å; F124-V132 HydrophobicContact CE1-CG2 4.33Å; Q128-V132 WeakPolarHBondContact O-CB 3.34Å; Q128-V132 VanDerWaalsContact O-CG2 3.32Å; Q128-V132 WeakPolarHBondContact O-CG2 3.47Å; Q128-V132 PolarHBondContact O-N 3.29Å; E129-V132 PolarHBondContact O-N 2.99Å; R130-V132 PolarHBondContact O-N 3.45Å; V132-R134 VanDerWaalsContact C-N 3.33Å; V132-R134 PolarHBondContact O-N 3.4Å; V132-I135 PolarHBondContact O-N 3.36Å; V132-L136 HydrophobicContact CG1-CD1 3.77Å; V132-L136 HydrophobicContact CG1-CG 4.38Å; V132-L136 WeakPolarHBondContact O-CG 3.22Å; V132-L136 PolarHBondContact O-N 3.38Å; V132-L157 HydrophobicContact CG1-CD2 3.8Å; V132-P158 HydrophobicContact CG1-CG 4.2Å; V132-P158 HydrophobicContact CG2-CG 4.33Å
133	M	96.1	Very high	93.3	Very high	3 Å²	3	31 Å²	31	2%	0.015	17%	0.172	C	C	.	.	H	α-helix	trans	-64.9	-33.9	-179.6	-74.6	-55.5	-65.1	0	0	113.2	Y97 T108 V112 E129 R130 L136 S137	Y97-M133 HydrophobicContact CD2-CE 3.78Å; Y97-M133 HydrophobicContact CD2-SD 4.3Å; Y97-M133 HydrophobicContact CE2-CE 4.19Å; Y97-M133 HydrophobicContact CE2-SD 4.25Å; T108-M133 HydrophobicContact CG2-CG 4.28Å; T108-M133 HydrophobicContact CG2-SD 4.07Å; V112-M133 HydrophobicContact CG2-SD 3.99Å; E129-M133 PolarHBondContact O-N 3.11Å; R130-M133 PolarHBondContact O-N 3.23Å; M133-L136 PolarHBondContact O-N 3.05Å; M133-L136 HydrophobicContact SD-CD1 4.18Å; M133-S137 WeakPolarHBondContact O-CB 3.43Å; M133-S137 PolarHBondContact O-N 3.09Å; M133-S137 PolarHBondContact O-OG 3.43Å
134	R	95.2	Very high	93.2	Very high	14 Å²	14	28.3 Å²	28.3	5%	0.053	15%	0.149	C	C	.	.	H	α-helix	trans	-59.3	-49.9	171.3	-75.7	-174.9	71	134.9	5.8	112	L105 R130 A131 V132 L136 S137 G138 I139 S140 T141 E304	L105-R134 HydrophobicContact CD1-CG 3.66Å; L105-R134 HydrophobicContact CD2-CG 4.14Å; L105-R134 HydrophobicContact CG-CG 4.45Å; R130-R134 WeakPolarHBondContact O-CG 3.24Å; R130-R134 PolarHBondContact O-N 2.9Å; A131-R134 PolarHBondContact O-N 2.75Å; V132-R134 VanDerWaalsContact C-N 3.33Å; V132-R134 PolarHBondContact O-N 3.4Å; R134-L136 PolarHBondContact O-N 3.48Å; R134-S137 CarbonylContact O-C 3.58Å; R134-S137 WeakPolarHBondContact O-CA 3.44Å; R134-S137 PolarHBondContact O-N 2.82Å; R134-G138 PolarHBondContact O-N 3.28Å; R134-G138 VanDerWaalsContact O-N 3.14Å; R134-I139 CarbonylContact C-O 3.55Å; R134-I139 HydrophobicContact CB-CB 4.24Å; R134-I139 VanDerWaalsContact NH2-CG2 3.31Å; R134-I139 PolarHBondContact O-N 2.89Å; R134-S140 PolarHBondContact NE-O 2.78Å; R134-S140 PolarHBondContact NH2-O 2.98Å; R134-T141 HydrophobicContact CB-CG2 4.35Å; R134-T141 WeakPolarHBondContact CD-OG1 3.27Å; R134-E304 IonicContact CZ-OE1 2.73Å; R134-E304 IonicContact NH1-OE1 3.72Å; R134-E304 PolarHBondContact NH1-OE1 3.26Å; R134-E304 IonicContact NH1-OE2 3.81Å; R134-E304 PolarHBondContact NH1-OE2 3.4Å
135	I	96.6	Very high	92.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.6	-40.4	179.9	-63.5	-58.5	0	0	0	111.7	A131 V132 S137 G138 T141 P158 Y162 F244 L281	A131-I135 WeakPolarHBondContact O-CG1 3.13Å; A131-I135 PolarHBondContact O-N 3.25Å; V132-I135 PolarHBondContact O-N 3.36Å; I135-S137 PolarHBondContact O-N 3.12Å; I135-G138 PolarHBondContact O-N 3.09Å; I135-G138 VanDerWaalsContact O-N 3.08Å; I135-T141 HydrophobicContact CD1-CG2 3.96Å; I135-T141 HydrophobicContact CG1-CG2 4.04Å; I135-P158 HydrophobicContact CB-CB 4.43Å; I135-P158 HydrophobicContact CB-CG 4.31Å; I135-P158 HydrophobicContact CG2-CB 3.76Å; I135-P158 HydrophobicContact CG2-CG 4.1Å; I135-Y162 HydrophobicContact CG2-CE2 4.36Å; I135-Y162 PolarHBondContact O-OH 3.18Å; I135-F244 HydrophobicContact CG2-CB 4.27Å; I135-F244 HydrophobicContact CG2-CD1 3.78Å; I135-F244 HydrophobicContact CG2-CD2 3.77Å; I135-F244 HydrophobicContact CG2-CE1 3.98Å; I135-F244 HydrophobicContact CG2-CE2 3.96Å; I135-F244 HydrophobicContact CG2-CG 3.67Å; I135-F244 HydrophobicContact CG2-CZ 4.06Å; I135-L281 HydrophobicContact CD1-CB 3.7Å; I135-L281 HydrophobicContact CD1-CD1 4.28Å; I135-L281 HydrophobicContact CD1-CG 4.48Å; I135-L281 HydrophobicContact CG1-CB 4.09Å; I135-L281 HydrophobicContact CG1-CD1 4.1Å; I135-L281 HydrophobicContact CG1-CD2 4.43Å; I135-L281 HydrophobicContact CG1-CG 4.43Å
136	L	96.8	Very high	92.4	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65.7	-24	174.4	-66.7	176.4	0	0	0	112.6	L96 Y97 V112 V132 M133 R134 P158 L161 Y162	L96-L136 WeakPolarHBondContact CA-O 3.41Å; L96-L136 HydrophobicContact CB-CB 4.43Å; L96-L136 HydrophobicContact CB-CD2 4.26Å; L96-L136 WeakPolarHBondContact CB-O 3.26Å; L96-L136 HydrophobicContact CD2-CD2 3.72Å; L96-L136 PolarHBondContact N-O 3.04Å; Y97-L136 HydrophobicContact CD2-CB 3.63Å; Y97-L136 HydrophobicContact CD2-CD1 4.24Å; Y97-L136 HydrophobicContact CE2-CB 3.96Å; Y97-L136 HydrophobicContact CE2-CD1 3.72Å; Y97-L136 HydrophobicContact CE2-CG 4.37Å; Y97-L136 PolarHBondContact N-O 3.24Å; V112-L136 HydrophobicContact CG2-CD1 3.92Å; V132-L136 HydrophobicContact CG1-CD1 3.77Å; V132-L136 HydrophobicContact CG1-CG 4.38Å; V132-L136 WeakPolarHBondContact O-CG 3.22Å; V132-L136 PolarHBondContact O-N 3.38Å; M133-L136 PolarHBondContact O-N 3.05Å; M133-L136 HydrophobicContact SD-CD1 4.18Å; R134-L136 PolarHBondContact O-N 3.48Å; L136-P158 HydrophobicContact CD2-CB 3.86Å; L136-P158 HydrophobicContact CG-CB 4.32Å; L136-L161 HydrophobicContact CD1-CD1 3.72Å; L136-L161 HydrophobicContact CD2-CB 4.15Å; L136-L161 HydrophobicContact CD2-CD1 4.19Å; L136-Y162 HydrophobicContact CD2-CD2 4.13Å; L136-Y162 HydrophobicContact CD2-CE2 3.95Å; L136-Y162 PolarHBondContact O-OH 3.28Å
137	S	95.4	Very high	91.9	Very high	3 Å²	3	18.6 Å²	18.6	2%	0.021	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	6.5	173.8	-50.1	0	0	0	0	113.7	Y97 M133 R134 I135 I139	Y97-S137 WeakPolarHBondContact O-CA 3.34Å; M133-S137 WeakPolarHBondContact O-CB 3.43Å; M133-S137 PolarHBondContact O-N 3.09Å; M133-S137 PolarHBondContact O-OG 3.43Å; R134-S137 CarbonylContact O-C 3.58Å; R134-S137 WeakPolarHBondContact O-CA 3.44Å; R134-S137 PolarHBondContact O-N 2.82Å; I135-S137 PolarHBondContact O-N 3.12Å; S137-I139 VanDerWaalsContact C-N 3.29Å; S137-I139 PolarHBondContact O-N 2.86Å
138	G	93.6	Very high	91	Very high	30 Å²	30	18.6 Å²	18.6	31%	0.309	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	14.8	179.8	0	0	0	0	0	114.8	R134 I135	R134-G138 PolarHBondContact O-N 3.28Å; R134-G138 VanDerWaalsContact O-N 3.14Å; I135-G138 PolarHBondContact O-N 3.09Å; I135-G138 VanDerWaalsContact O-N 3.08Å
139	I	94.1	Very high	90.1	Very high	47 Å²	47	19 Å²	19	24%	0.241	11%	0.11	C	C	.	.			trans	-99.8	121.4	-177.9	-48.2	178.1	0	0	0	109.3	L99 L105 R134 S137	L99-I139 HydrophobicContact CD1-CD1 4.34Å; L99-I139 HydrophobicContact CD2-CD1 3.73Å; L99-I139 HydrophobicContact CG-CD1 4.17Å; L105-I139 HydrophobicContact CD2-CD1 3.96Å; R134-I139 CarbonylContact C-O 3.55Å; R134-I139 HydrophobicContact CB-CB 4.24Å; R134-I139 VanDerWaalsContact NH2-CG2 3.31Å; R134-I139 PolarHBondContact O-N 2.89Å; S137-I139 VanDerWaalsContact C-N 3.29Å; S137-I139 PolarHBondContact O-N 2.86Å
140	S	94.7	Very high	89.4	Confident	14 Å²	14	16.8 Å²	16.8	10%	0.098	11%	0.106	C	C	.	.			trans	-58.1	146.1	173.7	-60.6	0	0	0	0	111.7	R134 H278 F280	R134-S140 PolarHBondContact NE-O 2.78Å; R134-S140 PolarHBondContact NH2-O 2.98Å; S140-H278 PolarHBondContact OG-O 3.27Å; S140-F280 CarbonylContact C-O 3.39Å; S140-F280 WeakPolarHBondContact CA-O 3.45Å; S140-F280 WeakPolarHBondContact CB-O 3.32Å; S140-F280 PolarHBondContact OG-N 3.42Å
141	T	94.9	Very high	89.1	Confident	0 Å²	0	13.7 Å²	13.7	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	146.6	-179.9	-165	0	0	0	0	111.4	A131 R134 I135 F280 L281 G282 L307	A131-T141 HydrophobicContact CB-CG2 4.14Å; R134-T141 HydrophobicContact CB-CG2 4.35Å; R134-T141 WeakPolarHBondContact CD-OG1 3.27Å; I135-T141 HydrophobicContact CD1-CG2 3.96Å; I135-T141 HydrophobicContact CG1-CG2 4.04Å; T141-F280 PolarHBondContact N-O 3.38Å; T141-L281 HydrophobicContact CG2-CD1 3.45Å; T141-L281 VanDerWaalsContact CG2-CD1 3.45Å; T141-L281 WeakPolarHBondContact O-CA 3.41Å; T141-G282 PolarHBondContact O-N 3.02Å; T141-L307 VanDerWaalsContact OG1-CD1 3.26Å; T141-L307 WeakPolarHBondContact OG1-CD1 3.49Å
142	L	93.4	Very high	88.9	Confident	13 Å²	13	15.7 Å²	15.7	7%	0.068	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	130.6	169.6	174.2	62.6	0	0	0	108	V144 A250 G282 T284 A292 V295 A296 L307	L142-V144 HydrophobicContact CD2-CG2 4.49Å; L142-V144 HydrophobicContact CG-CG2 4.31Å; L142-A250 HydrophobicContact CD1-CB 4.24Å; L142-G282 WeakPolarHBondContact CA-O 3.48Å; L142-T284 HydrophobicContact CD1-CG2 4.42Å; L142-A292 HydrophobicContact CD2-CB 4.11Å; L142-A292 WeakPolarHBondContact CD2-O 3.42Å; L142-V295 HydrophobicContact CD1-CG1 3.72Å; L142-V295 HydrophobicContact CD2-CB 4.04Å; L142-V295 HydrophobicContact CD2-CG1 3.9Å; L142-V295 HydrophobicContact CG-CG1 4.42Å; L142-A296 HydrophobicContact CD2-CB 4.18Å; L142-L307 WeakPolarHBondContact O-CB 3.35Å
143	L	92	Very high	88.6	Confident	1 Å²	1	15.8 Å²	15.8	1%	0.005	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	115.6	179.4	-177.7	63.7	0	0	0	109.7	A131 L145 C154 G282 L283 T284 L307	A131-L143 HydrophobicContact CB-CB 4.49Å; A131-L143 HydrophobicContact CB-CD1 4.39Å; A131-L143 HydrophobicContact CB-CD2 3.86Å; A131-L143 HydrophobicContact CB-CG 4.48Å; L143-L145 HydrophobicContact CD1-CD1 4.17Å; L143-L145 HydrophobicContact CD1-CD2 4.42Å; L143-L145 HydrophobicContact CD1-CG 3.93Å; L143-L145 HydrophobicContact CD2-CD1 3.52Å; L143-L145 HydrophobicContact CD2-CG 4.11Å; L143-L145 HydrophobicContact CG-CD1 3.77Å; L143-L145 HydrophobicContact CG-CG 3.75Å; L143-C154 HydrophobicContact CD2-CB 4.25Å; L143-C154 WeakPolarHBondContact CD2-SG 3.28Å; L143-G282 PolarHBondContact N-O 3Å; L143-L283 HydrophobicContact CB-CD2 3.93Å; L143-L283 HydrophobicContact CD2-CD2 4.12Å; L143-L283 HydrophobicContact CG-CD2 4.49Å; L143-T284 PolarHBondContact O-N 3.07Å; L143-T284 VanDerWaalsContact O-N 3.16Å; L143-L307 HydrophobicContact CD1-CD2 4.33Å
144	V	89.3	Confident	88.5	Confident	15 Å²	15	15.7 Å²	15.7	9%	0.091	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	104.4	178.5	-174.6	0	0	0	0	108.2	L142 T284 A287 A292 L307 G309	L142-V144 HydrophobicContact CD2-CG2 4.49Å; L142-V144 HydrophobicContact CG-CG2 4.31Å; V144-T284 WeakPolarHBondContact CA-O 3.41Å; V144-T284 HydrophobicContact CB-CG2 4.35Å; V144-T284 HydrophobicContact CG1-CG2 4.23Å; V144-T284 HydrophobicContact CG2-CG2 3.82Å; V144-A287 HydrophobicContact CG1-CB 4.4Å; V144-A292 HydrophobicContact CG2-CB 4.16Å; V144-L307 PolarHBondContact N-O 2.86Å; V144-G309 PolarHBondContact O-N 3.05Å
145	L	84.2	Confident	88.5	Confident	4 Å²	4	15.1 Å²	15.1	2%	0.021	11%	0.107	C	C	.	.			trans	-129.1	136.8	-174.9	-81	178.9	0	0	0	111.9	Q128 L143 A149 K151 T284 A285	Q128-L145 HydrophobicContact CG-CD1 4.27Å; L143-L145 HydrophobicContact CD1-CD1 4.17Å; L143-L145 HydrophobicContact CD1-CD2 4.42Å; L143-L145 HydrophobicContact CD1-CG 3.93Å; L143-L145 HydrophobicContact CD2-CD1 3.52Å; L143-L145 HydrophobicContact CD2-CG 4.11Å; L143-L145 HydrophobicContact CG-CD1 3.77Å; L143-L145 HydrophobicContact CG-CG 3.75Å; L145-A149 HydrophobicContact CB-CB 4.09Å; L145-A149 HydrophobicContact CD1-CB 4.46Å; L145-A149 HydrophobicContact CD2-CB 4.43Å; L145-K151 HydrophobicContact CB-CD 4.43Å; L145-K151 HydrophobicContact CB-CG 3.96Å; L145-K151 HydrophobicContact CD1-CG 4.32Å; L145-K151 PolarHBondContact O-NZ 3.24Å; L145-T284 PolarHBondContact N-O 2.95Å; L145-A285 WeakPolarHBondContact O-CA 3.46Å
146	P	80.9	Confident	88.3	Confident	31 Å²	31	16.1 Å²	16.1	20%	0.201	11%	0.112	C	C	.	.			trans	-55.8	161.4	178.8	22	-30.8	0	0	0	112.7	G148 A149 K151	P146-G148 PolarHBondContact O-N 2.88Å; P146-A149 HydrophobicContact CG-CB 4.1Å; P146-A149 VanDerWaalsContact O-CB 3.3Å; P146-A149 WeakPolarHBondContact O-CB 3.45Å; P146-A149 PolarHBondContact O-N 3.38Å; P146-K151 PolarHBondContact O-NZ 3Å
147	T	75.4	Confident	88.2	Confident	25 Å²	25	16.1 Å²	16.1	15%	0.153	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	138.9	178.2	47.4	0	0	0	0	110.5	A149 A285 Q443 G446	T147-A149 VanDerWaalsContact C-N 3.29Å; T147-A149 PolarHBondContact O-N 2.86Å; T147-A285 HydrophobicContact CG2-CB 3.72Å; T147-Q443 HydrophobicContact CG2-CG 3.74Å; T147-G446 VanDerWaalsContact OG1-CA 3.32Å; T147-G446 WeakPolarHBondContact OG1-CA 3.24Å; T147-G446 PolarHBondContact OG1-O 3.49Å
148	G	69.3	Low	88.3	Confident	25 Å²	25	16 Å²	16	26%	0.258	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	80	-5.2	-176.8	0	0	0	0	0	116.1	P146 G150	P146-G148 PolarHBondContact O-N 2.88Å; G148-G150 PolarHBondContact O-N 3.48Å
149	A	73	Confident	88.3	Confident	13 Å²	13	14.6 Å²	14.6	11%	0.107	10%	0.097	C	C	.	.	S	Bend	trans	-75.6	17.5	179.2	0	0	0	0	0	114.9	R125 Q128 L145 P146 T147	R125-A149 WeakPolarHBondContact CD-O 3.48Å; Q128-A149 PolarHBondContact NE2-O 3.06Å; Q128-A149 VanDerWaalsContact NE2-O 3.07Å; L145-A149 HydrophobicContact CB-CB 4.09Å; L145-A149 HydrophobicContact CD1-CB 4.46Å; L145-A149 HydrophobicContact CD2-CB 4.43Å; P146-A149 HydrophobicContact CG-CB 4.1Å; P146-A149 VanDerWaalsContact O-CB 3.3Å; P146-A149 WeakPolarHBondContact O-CB 3.45Å; P146-A149 PolarHBondContact O-N 3.38Å; T147-A149 VanDerWaalsContact C-N 3.29Å; T147-A149 PolarHBondContact O-N 2.86Å
150	G	80.3	Confident	88.4	Confident	24 Å²	24	12.7 Å²	12.7	25%	0.247	9%	0.087	C	C	.	.			trans	73.7	37.2	175	0	0	0	0	0	115.4	Q128 G148 S152 L153	Q128-G150 PolarHBondContact NE2-O 2.83Å; G148-G150 PolarHBondContact O-N 3.48Å; G150-S152 PolarHBondContact O-N 2.93Å; G150-L153 WeakPolarHBondContact O-CB 3.27Å; G150-L153 PolarHBondContact O-N 3.16Å
151	K	86.8	Confident	88.4	Confident	26 Å²	26	12.1 Å²	12.1	11%	0.113	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-38	176.9	-78	-175	-78.1	-74.2	0	113.3	L145 P146 L153 C154 L283 A285	L145-K151 HydrophobicContact CB-CD 4.43Å; L145-K151 HydrophobicContact CB-CG 3.96Å; L145-K151 HydrophobicContact CD1-CG 4.32Å; L145-K151 PolarHBondContact O-NZ 3.24Å; P146-K151 PolarHBondContact O-NZ 3Å; K151-L153 VanDerWaalsContact C-N 3.26Å; K151-L153 PolarHBondContact O-N 3.36Å; K151-C154 VanDerWaalsContact O-CB 3.29Å; K151-C154 WeakPolarHBondContact O-CB 3.47Å; K151-C154 PolarHBondContact O-N 3.07Å; K151-L283 HydrophobicContact CB-CD1 4.32Å; K151-L283 HydrophobicContact CD-CB 4.35Å; K151-L283 WeakPolarHBondContact O-CD1 3.38Å; K151-A285 VanDerWaalsContact NZ-CB 3.31Å
152	S	88.1	Confident	88.4	Confident	41 Å²	41	12.3 Å²	12.3	29%	0.287	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-34.4	-177.8	-50.8	0	0	0	0	113.6	G150 C154 Y155 Q156	G150-S152 PolarHBondContact O-N 2.93Å; S152-C154 PolarHBondContact O-N 3.42Å; S152-C154 VanDerWaalsContact O-N 3.15Å; S152-Y155 VanDerWaalsContact CA-CE1 3.43Å; S152-Y155 WeakPolarHBondContact O-CD1 3.39Å; S152-Y155 PolarHBondContact O-N 2.95Å; S152-Q156 WeakPolarHBondContact O-CB 3.45Å; S152-Q156 WeakPolarHBondContact O-CG 3.36Å; S152-Q156 PolarHBondContact O-N 3.25Å
153	L	91.2	Very high	88.3	Confident	3 Å²	3	12.7 Å²	12.7	2%	0.016	9%	0.087	C	C	.	.	H	α-helix	trans	-55.4	-35	177	176.3	61.3	0	0	0	112	L116 L119 F124 G150 K151 Y155 Q156 L157	L116-L153 HydrophobicContact CD1-CD1 3.92Å; L116-L153 HydrophobicContact CD1-CD2 3.49Å; L116-L153 VanDerWaalsContact CD1-CD2 3.49Å; L116-L153 HydrophobicContact CD1-CG 4.26Å; L119-L153 HydrophobicContact CB-CD1 4.5Å; L119-L153 HydrophobicContact CD1-CD1 3.62Å; F124-L153 HydrophobicContact CD1-CD2 4.36Å; F124-L153 HydrophobicContact CE1-CD2 4.38Å; G150-L153 WeakPolarHBondContact O-CB 3.27Å; G150-L153 PolarHBondContact O-N 3.16Å; K151-L153 VanDerWaalsContact C-N 3.26Å; K151-L153 PolarHBondContact O-N 3.36Å; L153-Y155 PolarHBondContact O-N 3.29Å; L153-Q156 PolarHBondContact O-N 3.41Å; L153-L157 HydrophobicContact CD1-CB 4.03Å; L153-L157 HydrophobicContact CD1-CD1 4.27Å; L153-L157 PolarHBondContact O-N 3.32Å
154	C	93.8	Very high	88.3	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.007	11%	0.105	C	C	.	.	H	α-helix	trans	-66.9	-23.8	-173.6	-57.4	0	0	0	0	113	L143 K151 S152 P158 L281 L283	L143-C154 HydrophobicContact CD2-CB 4.25Å; L143-C154 WeakPolarHBondContact CD2-SG 3.28Å; K151-C154 VanDerWaalsContact O-CB 3.29Å; K151-C154 WeakPolarHBondContact O-CB 3.47Å; K151-C154 PolarHBondContact O-N 3.07Å; S152-C154 PolarHBondContact O-N 3.42Å; S152-C154 VanDerWaalsContact O-N 3.15Å; C154-P158 VanDerWaalsContact O-CD 3.23Å; C154-P158 WeakPolarHBondContact O-CD 3.23Å; C154-P158 VanDerWaalsContact O-CG 3.26Å; C154-P158 WeakPolarHBondContact O-CG 3.28Å; C154-L281 HydrophobicContact CB-CD2 4.13Å; C154-L281 VanDerWaalsContact O-CD2 3.28Å; C154-L281 WeakPolarHBondContact O-CD2 3.14Å; C154-L283 HydrophobicContact CB-CD2 4.08Å
155	Y	94	Very high	88.3	Confident	2 Å²	2	21.4 Å²	21.4	1%	0.008	12%	0.118	C	C	.	.	H	α-helix	trans	-101.7	-29	170.2	69.6	-105.7	0	0	0	112.7	S152 L153 A159 V172 Q183 M221 C246 L283	S152-Y155 VanDerWaalsContact CA-CE1 3.43Å; S152-Y155 WeakPolarHBondContact O-CD1 3.39Å; S152-Y155 PolarHBondContact O-N 2.95Å; L153-Y155 PolarHBondContact O-N 3.29Å; Y155-A159 WeakPolarHBondContact O-CB 3.26Å; Y155-A159 PolarHBondContact O-N 3.33Å; Y155-A159 VanDerWaalsContact O-N 3.09Å; Y155-V172 HydrophobicContact CD2-CG2 3.82Å; Y155-V172 HydrophobicContact CE1-CG1 4.44Å; Y155-V172 HydrophobicContact CE2-CG2 4.1Å; Y155-V172 HydrophobicContact CG-CG2 4.21Å; Y155-Q183 PolarHBondContact OH-OE1 3.12Å; Y155-M221 HydrophobicContact CE2-CE 4.3Å; Y155-C246 HydrophobicContact CG-CB 4.42Å; Y155-L283 HydrophobicContact CD1-CD1 3.92Å
156	Q	93.6	Very high	88.5	Confident	21 Å²	21	23.5 Å²	23.5	10%	0.098	13%	0.133	C	C	.	.	H	α-helix	trans	-67.6	-44.6	-177.6	-71.5	173.1	-1.2	0	0	112.3	L119 S152 L153 A159 L160 L187 L191	L119-Q156 HydrophobicContact CD1-CB 4.4Å; S152-Q156 WeakPolarHBondContact O-CB 3.45Å; S152-Q156 WeakPolarHBondContact O-CG 3.36Å; S152-Q156 PolarHBondContact O-N 3.25Å; L153-Q156 PolarHBondContact O-N 3.41Å; Q156-A159 PolarHBondContact O-N 3.18Å; Q156-L160 PolarHBondContact O-N 3.4Å; Q156-L187 HydrophobicContact CG-CD2 3.64Å; Q156-L191 HydrophobicContact CB-CD1 4.18Å
157	L	95.4	Very high	88.9	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-66.1	-51.1	-178.9	-167.7	169.5	0	0	0	111.2	V112 A115 L116 L119 F124 V132 L153 A159 L160 L161	V112-L157 HydrophobicContact CG1-CD1 4.31Å; V112-L157 HydrophobicContact CG1-CD2 4.09Å; A115-L157 HydrophobicContact CB-CD2 4.27Å; A115-L157 HydrophobicContact CB-CG 4.12Å; L116-L157 HydrophobicContact CB-CD1 3.98Å; L116-L157 HydrophobicContact CD1-CD1 4.2Å; L119-L157 HydrophobicContact CD1-CB 3.68Å; L119-L157 HydrophobicContact CD1-CG 4.1Å; F124-L157 HydrophobicContact CE1-CD1 3.96Å; F124-L157 HydrophobicContact CZ-CD1 3.79Å; V132-L157 HydrophobicContact CG1-CD2 3.8Å; L153-L157 HydrophobicContact CD1-CB 4.03Å; L153-L157 HydrophobicContact CD1-CD1 4.27Å; L153-L157 PolarHBondContact O-N 3.32Å; L157-A159 VanDerWaalsContact C-N 3.33Å; L157-A159 PolarHBondContact O-N 3.09Å; L157-L160 PolarHBondContact O-N 3.44Å; L157-L161 HydrophobicContact CD2-CD1 3.57Å; L157-L161 HydrophobicContact CD2-CG 4.07Å; L157-L161 PolarHBondContact O-N 3.27Å
158	P	96.2	Very high	89.8	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.1	-40.2	175.2	-25.2	35.4	0	0	0	113.4	V132 I135 L136 C154 L160 L161 Y162 F244	V132-P158 HydrophobicContact CG1-CG 4.2Å; V132-P158 HydrophobicContact CG2-CG 4.33Å; I135-P158 HydrophobicContact CB-CB 4.43Å; I135-P158 HydrophobicContact CB-CG 4.31Å; I135-P158 HydrophobicContact CG2-CB 3.76Å; I135-P158 HydrophobicContact CG2-CG 4.1Å; L136-P158 HydrophobicContact CD2-CB 3.86Å; L136-P158 HydrophobicContact CG-CB 4.32Å; C154-P158 VanDerWaalsContact O-CD 3.23Å; C154-P158 WeakPolarHBondContact O-CD 3.23Å; C154-P158 VanDerWaalsContact O-CG 3.26Å; C154-P158 WeakPolarHBondContact O-CG 3.28Å; P158-L160 VanDerWaalsContact C-N 3.3Å; P158-L160 PolarHBondContact O-N 3.42Å; P158-L161 PolarHBondContact O-N 3.27Å; P158-Y162 HydrophobicContact CB-CD2 4.39Å; P158-Y162 WeakPolarHBondContact O-CB 3.28Å; P158-Y162 VanDerWaalsContact O-CD2 3.28Å; P158-Y162 WeakPolarHBondContact O-CD2 3.43Å; P158-Y162 PolarHBondContact O-N 3.28Å; P158-F244 HydrophobicContact CB-CE1 3.8Å; P158-F244 HydrophobicContact CB-CZ 3.87Å
159	A	95	Very high	91	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-60.1	-40	178	0	0	0	0	0	112.4	Y155 Q156 L157 S163 T170 V219 F244	Y155-A159 WeakPolarHBondContact O-CB 3.26Å; Y155-A159 PolarHBondContact O-N 3.33Å; Y155-A159 VanDerWaalsContact O-N 3.09Å; Q156-A159 PolarHBondContact O-N 3.18Å; L157-A159 VanDerWaalsContact C-N 3.33Å; L157-A159 PolarHBondContact O-N 3.09Å; A159-S163 WeakPolarHBondContact O-CB 3.42Å; A159-S163 PolarHBondContact O-N 3.38Å; A159-T170 HydrophobicContact CB-CG2 4.14Å; A159-T170 WeakPolarHBondContact CB-OG1 3.36Å; A159-V219 HydrophobicContact CB-CG2 3.78Å; A159-F244 HydrophobicContact CB-CE1 4.5Å
160	L	94.4	Very high	92	Very high	7 Å²	7	23.7 Å²	23.7	4%	0.037	13%	0.129	C	C	.	.	H	α-helix	trans	-63.4	-47.7	176.7	-179.1	62.7	0	0	0	111.5	A115 L119 Q156 L157 P158 S163 R164 C190 L191	A115-L160 HydrophobicContact CB-CD2 4.33Å; L119-L160 HydrophobicContact CD2-CD2 4.18Å; L119-L160 HydrophobicContact CG-CD2 4.47Å; Q156-L160 PolarHBondContact O-N 3.4Å; L157-L160 PolarHBondContact O-N 3.44Å; P158-L160 VanDerWaalsContact C-N 3.3Å; P158-L160 PolarHBondContact O-N 3.42Å; L160-S163 PolarHBondContact O-N 2.67Å; L160-R164 WeakPolarHBondContact O-CG 3.29Å; L160-R164 PolarHBondContact O-N 3.36Å; L160-R164 VanDerWaalsContact O-N 3.09Å; L160-C190 HydrophobicContact CD1-CB 4.17Å; L160-L191 HydrophobicContact CB-CD1 4.45Å; L160-L191 HydrophobicContact CB-CD2 3.99Å; L160-L191 HydrophobicContact CB-CG 4.36Å; L160-L191 HydrophobicContact CD1-CD2 4.05Å; L160-L191 HydrophobicContact CD1-CG 4.19Å
161	L	95.3	Very high	92.8	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-69.1	-44.5	-177.3	-65.1	-176.1	0	0	0	112.4	L96 E111 V112 A115 L136 L157 P158 S163 R164 R165	L96-L161 HydrophobicContact CD2-CB 3.6Å; L96-L161 HydrophobicContact CD2-CD1 4.29Å; E111-L161 HydrophobicContact CG-CD2 3.82Å; E111-L161 WeakPolarHBondContact OE1-CD2 3.32Å; V112-L161 HydrophobicContact CG2-CD1 3.99Å; A115-L161 HydrophobicContact CB-CD2 3.79Å; A115-L161 HydrophobicContact CB-CG 4.27Å; L136-L161 HydrophobicContact CD1-CD1 3.72Å; L136-L161 HydrophobicContact CD2-CB 4.15Å; L136-L161 HydrophobicContact CD2-CD1 4.19Å; L157-L161 HydrophobicContact CD2-CD1 3.57Å; L157-L161 HydrophobicContact CD2-CG 4.07Å; L157-L161 PolarHBondContact O-N 3.27Å; P158-L161 PolarHBondContact O-N 3.27Å; L161-S163 VanDerWaalsContact C-N 3.31Å; L161-S163 PolarHBondContact O-N 2.91Å; L161-R164 PolarHBondContact O-N 3.09Å; L161-R165 PolarHBondContact O-N 2.79Å
162	Y	95	Very high	93.1	Very high	4 Å²	4	21.3 Å²	21.3	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-58.1	-45.1	174	-87.3	-64.9	0	0	0	111.5	V93 L96 I135 L136 P158 R164 R165 S166 C168 A243 F244	V93-Y162 HydrophobicContact CG1-CD1 3.93Å; V93-Y162 HydrophobicContact CG1-CE1 4.08Å; L96-Y162 HydrophobicContact CB-CD1 4.35Å; L96-Y162 HydrophobicContact CB-CE1 3.9Å; L96-Y162 PolarHBondContact N-OH 2.95Å; I135-Y162 HydrophobicContact CG2-CE2 4.36Å; I135-Y162 PolarHBondContact O-OH 3.18Å; L136-Y162 HydrophobicContact CD2-CD2 4.13Å; L136-Y162 HydrophobicContact CD2-CE2 3.95Å; L136-Y162 PolarHBondContact O-OH 3.28Å; P158-Y162 HydrophobicContact CB-CD2 4.39Å; P158-Y162 WeakPolarHBondContact O-CB 3.28Å; P158-Y162 VanDerWaalsContact O-CD2 3.28Å; P158-Y162 WeakPolarHBondContact O-CD2 3.43Å; P158-Y162 PolarHBondContact O-N 3.28Å; Y162-R164 VanDerWaalsContact C-N 3.27Å; Y162-R164 PolarHBondContact O-N 3.46Å; Y162-R165 PolarHBondContact O-N 3.08Å; Y162-S166 PolarHBondContact O-N 3.23Å; Y162-S166 VanDerWaalsContact O-N 3.12Å; Y162-C168 VanDerWaalsContact C-SG 3.51Å; Y162-A243 HydrophobicContact CD1-CB 3.95Å; Y162-A243 HydrophobicContact CD2-CB 3.98Å; Y162-A243 HydrophobicContact CE1-CB 4.43Å; Y162-A243 HydrophobicContact CE2-CB 4.46Å; Y162-A243 HydrophobicContact CG-CB 3.72Å; Y162-F244 HydrophobicContact CD2-CD1 4.04Å; Y162-F244 HydrophobicContact CD2-CE1 4.13Å; Y162-F244 HydrophobicContact CE2-CD1 4.12Å
163	S	92.1	Very high	93.3	Very high	22 Å²	22	19.3 Å²	19.3	15%	0.154	10%	0.098	C	C	.	.	H	α-helix	trans	-66.4	-24.5	179.4	-178.2	0	0	0	0	114	A159 L160 L161 H218	A159-S163 WeakPolarHBondContact O-CB 3.42Å; A159-S163 PolarHBondContact O-N 3.38Å; L160-S163 PolarHBondContact O-N 2.67Å; L161-S163 VanDerWaalsContact C-N 3.31Å; L161-S163 PolarHBondContact O-N 2.91Å; S163-H218 PolarHBondContact OG-CE1 3.04Å; S163-H218 PolarHBondContact OG-ND1 3.21Å
164	R	91.3	Very high	93.2	Very high	101 Å²	101	19.2 Å²	19.2	38%	0.381	10%	0.098	S	C	.	.	H	α-helix	trans	-72.7	-39.4	174.5	-77.6	174.3	-174.8	-174.8	-1.5	112	Q118 L160 L161 Y162	Q118-R164 VanDerWaalsContact CD-NH2 3.29Å; L160-R164 WeakPolarHBondContact O-CG 3.29Å; L160-R164 PolarHBondContact O-N 3.36Å; L160-R164 VanDerWaalsContact O-N 3.09Å; L161-R164 PolarHBondContact O-N 3.09Å; Y162-R164 VanDerWaalsContact C-N 3.27Å; Y162-R164 PolarHBondContact O-N 3.46Å
165	R	90.2	Very high	92.3	Very high	98 Å²	98	19.6 Å²	19.6	37%	0.37	10%	0.1	S	C	.	.	H	α-helix	trans	-74.3	-43	-178.6	-173.9	-168.9	57.9	-177	-4	111.8	L94 P95 L96 L161 Y162	L94-R165 PolarHBondContact O-NH1 3.01Å; L94-R165 PolarHBondContact O-NH2 3.25Å; P95-R165 PolarHBondContact O-NH1 3.32Å; L96-R165 VanDerWaalsContact CA-NH1 3.33Å; L96-R165 HydrophobicContact CD1-CB 3.96Å; L96-R165 HydrophobicContact CD1-CG 4.26Å; L161-R165 PolarHBondContact O-N 2.79Å; Y162-R165 PolarHBondContact O-N 3.08Å
166	S	88.1	Confident	91	Very high	47 Å²	47	20.1 Å²	20.1	33%	0.329	10%	0.103	S	C	.	.	S	Bend	trans	-149.1	150.3	-174.6	-52.1	0	0	0	0	111.2	Y162 C168	Y162-S166 PolarHBondContact O-N 3.23Å; Y162-S166 VanDerWaalsContact O-N 3.12Å; S166-C168 VanDerWaalsContact C-N 3.31Å; S166-C168 PolarHBondContact O-N 3.19Å; S166-C168 PolarHBondContact O-SG 3.24Å
167	P	89.5	Confident	89.7	Confident	94 Å²	94	22.6 Å²	22.6	61%	0.61	12%	0.116	S	C	*	.	S	Bend	trans	-69.6	89.5	175.7	29.7	-34.2	0	0	0	109.7	A215	P167-A215 HydrophobicContact CB-CB 4.49Å
168	C	92.6	Very high	87.9	Confident	3 Å²	3	24.9 Å²	24.9	2%	0.02	13%	0.132	C	C	.	.			trans	-124.9	167.4	-179.5	63.8	0	0	0	0	111.5	V93 Y162 S166 P241 A243	V93-C168 HydrophobicContact CG2-CB 3.84Å; Y162-C168 VanDerWaalsContact C-SG 3.51Å; S166-C168 VanDerWaalsContact C-N 3.31Å; S166-C168 PolarHBondContact O-N 3.19Å; S166-C168 PolarHBondContact O-SG 3.24Å; C168-P241 CarbonylContact C-O 3.52Å; C168-P241 VanDerWaalsContact CA-O 3.28Å; C168-P241 WeakPolarHBondContact CA-O 3.46Å; C168-P241 VanDerWaalsContact CB-O 3.28Å; C168-P241 WeakPolarHBondContact CB-O 3.42Å; C168-A243 HydrophobicContact CB-CB 4.34Å
169	L	94.7	Very high	86.3	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	138.7	177.8	-171.3	64.2	0	0	0	110.9	L171 I212 V217 L220 P240 P241 V242 A243	L169-L171 HydrophobicContact CD2-CD2 3.65Å; L169-L171 HydrophobicContact CG-CD2 4.01Å; L169-I212 HydrophobicContact CD2-CG2 4.08Å; L169-V217 HydrophobicContact CD1-CG1 4.25Å; L169-L220 HydrophobicContact CD1-CB 3.92Å; L169-L220 HydrophobicContact CD2-CB 4.22Å; L169-L220 HydrophobicContact CD2-CD2 4.16Å; L169-L220 HydrophobicContact CG-CB 4.31Å; L169-P240 HydrophobicContact CB-CB 4.39Å; L169-P241 PolarHBondContact N-O 3.39Å; L169-V242 CarbonylContact O-C 3.56Å; L169-V242 VanDerWaalsContact O-CA 3.27Å; L169-V242 WeakPolarHBondContact O-CA 2.96Å; L169-A243 PolarHBondContact O-N 2.97Å
170	T	95.4	Very high	85.1	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.006	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.6	164.8	-61.2	0	0	0	0	109.2	A159 V172 H218 V219 L220 F244	A159-T170 HydrophobicContact CB-CG2 4.14Å; A159-T170 WeakPolarHBondContact CB-OG1 3.36Å; T170-V172 HydrophobicContact CG2-CG2 4.41Å; T170-H218 PolarHBondContact N-O 3.26Å; T170-V219 WeakPolarHBondContact O-CA 3.16Å; T170-L220 PolarHBondContact O-N 2.95Å; T170-F244 HydrophobicContact CG2-CD1 4.08Å; T170-F244 HydrophobicContact CG2-CD2 4.26Å; T170-F244 HydrophobicContact CG2-CE1 3.52Å; T170-F244 HydrophobicContact CG2-CE2 3.74Å; T170-F244 HydrophobicContact CG2-CG 4.42Å; T170-F244 HydrophobicContact CG2-CZ 3.33Å; T170-F244 WeakPolarHBondContact OG1-CE1 3.32Å
171	L	95.6	Very high	83.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	132	175.6	-58.9	-177.8	0	0	0	109.8	L169 L220 L222 V242 F244 A245 C246 L271 M275	L169-L171 HydrophobicContact CD2-CD2 3.65Å; L169-L171 HydrophobicContact CG-CD2 4.01Å; L171-L220 HydrophobicContact CD2-CB 3.99Å; L171-L220 HydrophobicContact CD2-CD2 3.9Å; L171-L220 HydrophobicContact CD2-CG 4.28Å; L171-L222 HydrophobicContact CD2-CD1 4.1Å; L171-V242 HydrophobicContact CD1-CG1 4.08Å; L171-V242 HydrophobicContact CD1-CG2 4.1Å; L171-V242 HydrophobicContact CG-CG1 3.92Å; L171-V242 HydrophobicContact CG-CG2 4.26Å; L171-F244 PolarHBondContact N-O 3.14Å; L171-A245 HydrophobicContact CB-CB 4.23Å; L171-A245 CarbonylContact O-C 3.5Å; L171-A245 WeakPolarHBondContact O-CA 3.25Å; L171-C246 PolarHBondContact O-N 2.77Å; L171-L271 HydrophobicContact CD1-CD2 3.58Å; L171-M275 HydrophobicContact CD1-CE 4.24Å
172	V	94.1	Very high	82.4	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	105.9	174.7	-178.7	0	0	0	0	108.3	Y155 T170 V219 L220 M221 L222 C246	Y155-V172 HydrophobicContact CD2-CG2 3.82Å; Y155-V172 HydrophobicContact CE1-CG1 4.44Å; Y155-V172 HydrophobicContact CE2-CG2 4.1Å; Y155-V172 HydrophobicContact CG-CG2 4.21Å; T170-V172 HydrophobicContact CG2-CG2 4.41Å; V172-V219 HydrophobicContact CG2-CG1 3.73Å; V172-L220 PolarHBondContact N-O 2.78Å; V172-M221 HydrophobicContact CB-CG 4.07Å; V172-M221 HydrophobicContact CG1-CG 4.42Å; V172-M221 CarbonylContact O-C 3.57Å; V172-M221 VanDerWaalsContact O-CA 3.28Å; V172-M221 WeakPolarHBondContact O-CA 3.19Å; V172-L222 PolarHBondContact O-N 2.91Å; V172-C246 CarbonylContact C-O 3.56Å; V172-C246 WeakPolarHBondContact CA-O 3.44Å; V172-C246 HydrophobicContact CB-CB 4.46Å; V172-C246 HydrophobicContact CG1-CB 4.36Å; V172-C246 HydrophobicContact CG2-CB 4.11Å
173	V	92.6	Very high	81.1	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	118.5	176.7	-175.5	0	0	0	0	108.6	L222 P224 L227 C246 I247 D248 V267 L271	V173-L222 CarbonylContact C-O 3.55Å; V173-L222 WeakPolarHBondContact CA-O 3.37Å; V173-P224 HydrophobicContact CG1-CB 4.38Å; V173-P224 HydrophobicContact CG1-CG 3.88Å; V173-L227 HydrophobicContact CG2-CD2 4.25Å; V173-C246 PolarHBondContact N-O 3Å; V173-I247 HydrophobicContact CB-CD1 4.05Å; V173-I247 HydrophobicContact CG2-CD1 4.04Å; V173-D248 WeakPolarHBondContact O-CB 3.16Å; V173-D248 PolarHBondContact O-N 3.07Å; V173-V267 HydrophobicContact CB-CG1 4.43Å; V173-V267 HydrophobicContact CG1-CG1 4.14Å; V173-V267 HydrophobicContact CG1-CG2 4.25Å; V173-V267 HydrophobicContact CG2-CG1 4Å; V173-L271 HydrophobicContact CG2-CD1 4.3Å
174	S	87.7	Confident	80.3	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.007	18%	0.176	C	C	.	.			trans	-137.5	138.3	179.4	-175.9	0	0	0	0	110.4	L176 L222 T223 D248	S174-L176 PolarHBondContact O-N 3.2Å; S174-L176 VanDerWaalsContact O-N 3.13Å; S174-L222 PolarHBondContact N-O 2.9Å; S174-T223 WeakPolarHBondContact O-CA 3.49Å; S174-D248 PolarHBondContact OG-OD2 2.91Å
175	P	75.2	Confident	79.3	Confident	8 Å²	8	32.9 Å²	32.9	5%	0.052	19%	0.189	C	C	.	.	S	Bend	trans	-75.4	-1.3	-173.5	21.4	-15.5	0	0	0	113.7	E249 Y264	P175-E249 HydrophobicContact CG-CB 3.98Å; P175-E249 HydrophobicContact CG-CG 4.16Å; P175-Y264 HydrophobicContact CB-CE2 4.25Å; P175-Y264 WeakPolarHBondContact CB-OH 3.43Å; P175-Y264 WeakPolarHBondContact CD-OH 3.36Å; P175-Y264 WeakPolarHBondContact CG-OH 3.44Å
176	L	67.8	Low	78.2	Confident	13 Å²	13	31 Å²	31	7%	0.068	20%	0.2	C	C	.	.			trans	-121.2	93.7	-154.1	-64.8	160.5	0	0	0	112.4	S174 S178 L179 M180 E249 M419	S174-L176 PolarHBondContact O-N 3.2Å; S174-L176 VanDerWaalsContact O-N 3.13Å; L176-S178 PolarHBondContact O-N 3.01Å; L176-L179 HydrophobicContact CB-CB 3.78Å; L176-L179 HydrophobicContact CB-CD1 3.61Å; L176-L179 HydrophobicContact CB-CG 4.37Å; L176-L179 HydrophobicContact CD1-CD1 3.42Å; L176-L179 VanDerWaalsContact CD1-CD1 3.42Å; L176-L179 HydrophobicContact CG-CD1 4.12Å; L176-L179 WeakPolarHBondContact O-CB 3.2Å; L176-L179 PolarHBondContact O-N 2.85Å; L176-M180 WeakPolarHBondContact O-CG 3.31Å; L176-M180 PolarHBondContact O-N 3.39Å; L176-E249 HydrophobicContact CD1-CG 4.3Å; L176-M419 HydrophobicContact CD1-CB 3.49Å; L176-M419 VanDerWaalsContact CD1-CB 3.49Å; L176-M419 HydrophobicContact CD1-CE 4.44Å; L176-M419 HydrophobicContact CD1-CG 4.06Å; L176-M419 HydrophobicContact CD1-SD 3.59Å; L176-M419 VanDerWaalsContact CD1-SD 3.59Å; L176-M419 HydrophobicContact CD2-CB 4.2Å; L176-M419 HydrophobicContact CD2-CE 3.22Å; L176-M419 HydrophobicContact CD2-CG 4.47Å; L176-M419 HydrophobicContact CD2-SD 3.46Å; L176-M419 WeakPolarHBondContact CD2-SD 3.38Å; L176-M419 HydrophobicContact CG-CB 4.42Å; L176-M419 HydrophobicContact CG-CE 4.44Å; L176-M419 HydrophobicContact CG-SD 4.13Å
177	L	65.3	Low	77.6	Confident	73 Å²	73	29.5 Å²	29.5	38%	0.382	19%	0.189	S	C	.	.	H	α-helix	trans	-56.9	-35.7	179.3	-74.3	79.5	0	0	0	113.1	L179 H197 T223	L177-L179 PolarHBondContact O-N 2.78Å; L177-H197 HydrophobicContact CD2-CB 4.12Å; L177-H197 HydrophobicContact CG-CB 4.12Å; L177-T223 HydrophobicContact CD1-CG2 3.69Å; L177-T223 HydrophobicContact CG-CG2 3.94Å
178	S	57.3	Low	76.8	Confident	48 Å²	48	26 Å²	26	34%	0.336	17%	0.166	S	C	.	.	H	α-helix	trans	-66.2	-16.3	178.7	51.2	0	0	0	0	113.7	L176	L176-S178 PolarHBondContact O-N 3.01Å
179	L	63.5	Low	75.9	Confident	11 Å²	11	31.3 Å²	31.3	6%	0.058	20%	0.2	C	C	.	.	H	α-helix	trans	-100.1	-30.2	-172.8	-120.2	158	0	0	0	112	L176 L177 D181 D182 Q183 M419 G420	L176-L179 HydrophobicContact CB-CB 3.78Å; L176-L179 HydrophobicContact CB-CD1 3.61Å; L176-L179 HydrophobicContact CB-CG 4.37Å; L176-L179 HydrophobicContact CD1-CD1 3.42Å; L176-L179 VanDerWaalsContact CD1-CD1 3.42Å; L176-L179 HydrophobicContact CG-CD1 4.12Å; L176-L179 WeakPolarHBondContact O-CB 3.2Å; L176-L179 PolarHBondContact O-N 2.85Å; L177-L179 PolarHBondContact O-N 2.78Å; L179-D181 PolarHBondContact O-N 3.48Å; L179-D182 PolarHBondContact O-N 3.18Å; L179-Q183 HydrophobicContact CD2-CG 3.74Å; L179-Q183 VanDerWaalsContact CD2-NE2 3.34Å; L179-Q183 WeakPolarHBondContact O-CB 3.35Å; L179-Q183 VanDerWaalsContact O-CG 3.32Å; L179-Q183 WeakPolarHBondContact O-CG 3.44Å; L179-Q183 PolarHBondContact O-N 3.35Å; L179-M419 HydrophobicContact CD1-CB 3.87Å; L179-M419 WeakPolarHBondContact CD1-O 3.3Å; L179-M419 WeakPolarHBondContact CG-O 3.41Å; L179-G420 VanDerWaalsContact CG-CA 3.47Å
180	M	69.7	Low	75.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63	-45	-176.9	-61.5	173.1	91.9	0	0	111.4	L176 D182 V184 C195 H197 M221 L222 T223	L176-M180 WeakPolarHBondContact O-CG 3.31Å; L176-M180 PolarHBondContact O-N 3.39Å; M180-D182 PolarHBondContact O-N 3.48Å; M180-V184 VanDerWaalsContact O-CB 3.31Å; M180-V184 WeakPolarHBondContact O-CB 3.37Å; M180-V184 WeakPolarHBondContact O-CG2 3.16Å; M180-V184 PolarHBondContact O-N 3.18Å; M180-C195 HydrophobicContact CB-CB 4.1Å; M180-C195 HydrophobicContact CE-CB 3.85Å; M180-H197 HydrophobicContact SD-CB 4.26Å; M180-M221 HydrophobicContact CE-CB 3.61Å; M180-M221 WeakPolarHBondContact CE-O 3.49Å; M180-L222 VanDerWaalsContact CE-C 3.5Å; M180-L222 VanDerWaalsContact CE-N 3.32Å; M180-T223 HydrophobicContact CE-CG2 4.16Å; M180-T223 HydrophobicContact SD-CG2 3.55Å; M180-T223 VanDerWaalsContact SD-CG2 3.55Å
181	D	67	Low	74.5	Confident	76 Å²	76	33.7 Å²	33.7	41%	0.406	22%	0.216	S	C	.	.	H	α-helix	trans	-63.2	-43.3	178.7	-74	-16.1	0	0	0	111.5	L179 S185	L179-D181 PolarHBondContact O-N 3.48Å; D181-S185 WeakPolarHBondContact O-CB 3.43Å; D181-S185 PolarHBondContact O-N 2.82Å; D181-S185 PolarHBondContact O-OG 2.79Å
182	D	65.6	Low	74.2	Confident	52 Å²	52	38.8 Å²	38.8	28%	0.278	24%	0.238	S	C	.	.	H	α-helix	trans	-68	-44.4	-179.3	-73.1	-15	0	0	0	110.9	L179 M180 S185 G186 Q400	L179-D182 PolarHBondContact O-N 3.18Å; M180-D182 PolarHBondContact O-N 3.48Å; D182-S185 PolarHBondContact O-N 2.85Å; D182-S185 PolarHBondContact O-OG 3.35Å; D182-G186 PolarHBondContact O-N 3.23Å; D182-Q400 PolarHBondContact OD2-NE2 3.22Å
183	Q	68.8	Low	74	Confident	28 Å²	28	40 Å²	40	13%	0.131	25%	0.248	C	C	.	.	H	α-helix	trans	-64.7	-43.7	175.8	-72.1	-174.7	-8.3	0	0	111.7	Y155 L179 S185 G186 L187 M221	Y155-Q183 PolarHBondContact OH-OE1 3.12Å; L179-Q183 HydrophobicContact CD2-CG 3.74Å; L179-Q183 VanDerWaalsContact CD2-NE2 3.34Å; L179-Q183 WeakPolarHBondContact O-CB 3.35Å; L179-Q183 VanDerWaalsContact O-CG 3.32Å; L179-Q183 WeakPolarHBondContact O-CG 3.44Å; L179-Q183 PolarHBondContact O-N 3.35Å; Q183-S185 PolarHBondContact O-N 3.16Å; Q183-G186 PolarHBondContact O-N 2.92Å; Q183-L187 VanDerWaalsContact O-CG 3.3Å; Q183-L187 WeakPolarHBondContact O-CG 3.39Å; Q183-L187 PolarHBondContact O-N 3.47Å; Q183-M221 HydrophobicContact CB-CE 3.62Å; Q183-M221 HydrophobicContact CB-SD 3.85Å; Q183-M221 VanDerWaalsContact OE1-CE 3.32Å
184	V	74.6	Confident	73.9	Confident	43 Å²	43	40.5 Å²	40.5	26%	0.261	25%	0.253	S	S	.	.	H	α-helix	trans	-59.3	-39.2	175.2	170.6	0	0	0	0	110.9	M180 A193 C195 M221	M180-V184 VanDerWaalsContact O-CB 3.31Å; M180-V184 WeakPolarHBondContact O-CB 3.37Å; M180-V184 WeakPolarHBondContact O-CG2 3.16Å; M180-V184 PolarHBondContact O-N 3.18Å; V184-A193 HydrophobicContact CG1-CB 4.34Å; V184-A193 HydrophobicContact CG2-CB 4.18Å; V184-C195 HydrophobicContact CG2-CB 4.31Å; V184-M221 HydrophobicContact CG2-SD 3.78Å
185	S	69.3	Low	74	Confident	94 Å²	94	41.3 Å²	41.3	66%	0.657	26%	0.258	S	S	*	.	H	α-helix	trans	-75.1	-28.6	178.2	74.3	0	0	0	0	114.4	D181 D182 Q183	D181-S185 WeakPolarHBondContact O-CB 3.43Å; D181-S185 PolarHBondContact O-N 2.82Å; D181-S185 PolarHBondContact O-OG 2.79Å; D182-S185 PolarHBondContact O-N 2.85Å; D182-S185 PolarHBondContact O-OG 3.35Å; Q183-S185 PolarHBondContact O-N 3.16Å
186	G	68.4	Low	74.7	Confident	59 Å²	59	41 Å²	41	61%	0.608	26%	0.255	S	S	*	.	H	α-helix	trans	-89.7	-2.9	-179.9	0	0	0	0	0	114.2	D182 Q183	D182-G186 PolarHBondContact O-N 3.23Å; Q183-G186 PolarHBondContact O-N 2.92Å
187	L	75.3	Confident	75.6	Confident	15 Å²	15	42 Å²	42	8%	0.079	26%	0.26	C	S	.	.	S	Bend	trans	-67.9	140.3	175.8	-83.1	167.3	0	0	0	110.8	Q156 Q183 L191 A193 M221	Q156-L187 HydrophobicContact CG-CD2 3.64Å; Q183-L187 VanDerWaalsContact O-CG 3.3Å; Q183-L187 WeakPolarHBondContact O-CG 3.39Å; Q183-L187 PolarHBondContact O-N 3.47Å; L187-L191 HydrophobicContact CD2-CB 4.47Å; L187-L191 HydrophobicContact CD2-CD1 4.01Å; L187-A193 HydrophobicContact CD1-CB 3.16Å; L187-M221 HydrophobicContact CD1-CE 4.18Å
188	P	71.7	Confident	76.1	Confident	20 Å²	20	42.4 Å²	42.4	13%	0.13	27%	0.269	C	S	.	.			trans	-57.3	147.8	178.8	-33.1	43.3	0	0	0	112	L119 C190 L191	L119-P188 HydrophobicContact CD2-CB 4.06Å; L119-P188 HydrophobicContact CD2-CG 3.56Å; P188-C190 PolarHBondContact O-N 3.01Å; P188-L191 PolarHBondContact O-N 3.36Å
189	P	75.3	Confident	77	Confident	115 Å²	115	43 Å²	43	75%	0.747	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-24.2	-174.9	-28	34.6	0	0	0	115.2	L191 K192	P189-L191 VanDerWaalsContact C-N 3.35Å; P189-K192 PolarHBondContact O-NZ 3.03Å
190	C	77.1	Confident	77.9	Confident	43 Å²	43	44 Å²	44	29%	0.291	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-16.9	177.1	58.9	0	0	0	0	114.3	L160 P188	L160-C190 HydrophobicContact CD1-CB 4.17Å; P188-C190 PolarHBondContact O-N 3.01Å
191	L	83.1	Confident	78.6	Confident	8 Å²	8	47.8 Å²	47.8	4%	0.042	31%	0.31	C	S	.	.	S	Bend	trans	-104	124.2	173.4	-76.5	172.1	0	0	0	109.6	L119 Q156 L160 L187 P188 P189 H218 V219	L119-L191 HydrophobicContact CD2-CD1 4.33Å; Q156-L191 HydrophobicContact CB-CD1 4.18Å; L160-L191 HydrophobicContact CB-CD1 4.45Å; L160-L191 HydrophobicContact CB-CD2 3.99Å; L160-L191 HydrophobicContact CB-CG 4.36Å; L160-L191 HydrophobicContact CD1-CD2 4.05Å; L160-L191 HydrophobicContact CD1-CG 4.19Å; L187-L191 HydrophobicContact CD2-CB 4.47Å; L187-L191 HydrophobicContact CD2-CD1 4.01Å; P188-L191 PolarHBondContact O-N 3.36Å; P189-L191 VanDerWaalsContact C-N 3.35Å; L191-H218 HydrophobicContact CD2-CB 4.4Å; L191-V219 HydrophobicContact CD2-CG2 4.32Å
192	K	88.9	Confident	79.5	Confident	107 Å²	107	53.9 Å²	53.9	47%	0.465	33%	0.328	S	S	.	.			trans	-95.8	123	171.1	-57.2	-51.8	-176.4	-157.4	0	108.8	P189 Q216 H218 V219	P189-K192 PolarHBondContact O-NZ 3.03Å; K192-Q216 WeakPolarHBondContact CB-O 3.43Å; K192-H218 PolarHBondContact O-N 2.83Å; K192-V219 PolarHBondContact O-N 3.43Å; K192-V219 VanDerWaalsContact O-N 3.11Å
193	A	89.9	Confident	80.5	Confident	26 Å²	26	60 Å²	60	22%	0.215	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	154	178.2	0	0	0	0	0	113	V184 L187 V219	V184-A193 HydrophobicContact CG1-CB 4.34Å; V184-A193 HydrophobicContact CG2-CB 4.18Å; L187-A193 HydrophobicContact CD1-CB 3.16Å; A193-V219 WeakPolarHBondContact CA-O 3.44Å; A193-V219 HydrophobicContact CB-CB 4.03Å; A193-V219 WeakPolarHBondContact CB-O 3.45Å
194	A	90.9	Very high	81.5	Confident	11 Å²	11	63.5 Å²	63.5	9%	0.091	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	160.1	169.9	0	0	0	0	0	109.4	V208 V217 V219 L220 M221	A194-V208 HydrophobicContact CB-CG1 3.58Å; A194-V208 HydrophobicContact CB-CG2 4.39Å; A194-V217 HydrophobicContact CB-CG1 3.97Å; A194-V217 HydrophobicContact CB-CG2 4.05Å; A194-V219 PolarHBondContact N-O 3.35Å; A194-L220 HydrophobicContact CB-CD1 4.5Å; A194-L220 WeakPolarHBondContact O-CA 3.45Å; A194-M221 PolarHBondContact O-N 3.3Å
195	C	90.4	Very high	82.2	Confident	17 Å²	17	63 Å²	63	12%	0.115	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	147.1	174.1	62.3	0	0	0	0	110.7	M180 V184 M200 M221	M180-C195 HydrophobicContact CB-CB 4.1Å; M180-C195 HydrophobicContact CE-CB 3.85Å; V184-C195 HydrophobicContact CG2-CB 4.31Å; C195-M200 VanDerWaalsContact O-SD 3.4Å; C195-M221 CarbonylContact C-O 3.52Å; C195-M221 VanDerWaalsContact CA-O 3.24Å; C195-M221 WeakPolarHBondContact CA-O 3.35Å; C195-M221 HydrophobicContact CB-CB 4.22Å
196	I	89.1	Confident	83.2	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	121.1	165.6	-62.6	170.7	0	0	0	108.9	M200 R205 V208 L209 I212 L220 M221 L222 T223 A226 L233	I196-M200 VanDerWaalsContact CA-SD 3.57Å; I196-M200 HydrophobicContact CB-SD 4.42Å; I196-R205 HydrophobicContact CG2-CG 4.3Å; I196-V208 HydrophobicContact CD1-CG1 3.96Å; I196-V208 HydrophobicContact CG1-CB 4.33Å; I196-V208 HydrophobicContact CG1-CG1 3.79Å; I196-L209 HydrophobicContact CD1-CD2 4.08Å; I196-L209 HydrophobicContact CD1-CG 4.48Å; I196-I212 HydrophobicContact CD1-CD1 4.49Å; I196-L220 HydrophobicContact CD1-CD1 4.03Å; I196-L220 HydrophobicContact CD1-CD2 4.4Å; I196-L220 HydrophobicContact CG1-CD1 3.99Å; I196-M221 PolarHBondContact N-O 2.84Å; I196-L222 HydrophobicContact CB-CD2 3.63Å; I196-L222 HydrophobicContact CD1-CD2 4.42Å; I196-L222 HydrophobicContact CG1-CD2 4.45Å; I196-L222 HydrophobicContact CG2-CD2 4.23Å; I196-L222 WeakPolarHBondContact O-CA 3.18Å; I196-T223 PolarHBondContact O-N 2.86Å; I196-A226 HydrophobicContact CG2-CB 4.36Å; I196-L233 HydrophobicContact CD1-CD2 4.19Å
197	H	85.8	Confident	84.3	Confident	36 Å²	36	63 Å²	63	17%	0.167	34%	0.341	C	S	.	.			trans	-134.2	166.9	177	62.1	77.7	0	0	0	111.5	L177 M180 G199 M200 R205 T223	L177-H197 HydrophobicContact CD2-CB 4.12Å; L177-H197 HydrophobicContact CG-CB 4.12Å; M180-H197 HydrophobicContact SD-CB 4.26Å; H197-G199 VanDerWaalsContact C-N 3.3Å; H197-G199 PolarHBondContact ND1-N 2.88Å; H197-G199 PolarHBondContact O-N 2.98Å; H197-M200 VanDerWaalsContact CE1-CG 3.42Å; H197-M200 WeakPolarHBondContact CE1-CG 3.39Å; H197-M200 PolarHBondContact N-SD 2.82Å; H197-M200 PolarHBondContact O-N 2.98Å; H197-R205 PolarHBondContact O-NH2 2.85Å; H197-T223 HydrophobicContact CB-CG2 3.57Å
198	S	76.4	Confident	85.1	Confident	80 Å²	80	63 Å²	63	56%	0.559	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-32.6	-176.4	55.6	0	0	0	0	113.7	M200	S198-M200 PolarHBondContact O-N 3.45Å
199	G	76.6	Confident	86.1	Confident	60 Å²	60	63.1 Å²	63.1	62%	0.619	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	0.5	177.9	0	0	0	0	0	116.9	H197	H197-G199 VanDerWaalsContact C-N 3.3Å; H197-G199 PolarHBondContact ND1-N 2.88Å; H197-G199 PolarHBondContact O-N 2.98Å
200	M	82.6	Confident	86.9	Confident	32 Å²	32	63.9 Å²	63.9	16%	0.158	34%	0.335	C	S	.	.	S	Bend	trans	-83.1	142.9	179.9	-64.9	177.4	75.8	0	0	112.1	C195 I196 H197 S198 Q204 V208	C195-M200 VanDerWaalsContact O-SD 3.4Å; I196-M200 VanDerWaalsContact CA-SD 3.57Å; I196-M200 HydrophobicContact CB-SD 4.42Å; H197-M200 VanDerWaalsContact CE1-CG 3.42Å; H197-M200 WeakPolarHBondContact CE1-CG 3.39Å; H197-M200 PolarHBondContact N-SD 2.82Å; H197-M200 PolarHBondContact O-N 2.98Å; S198-M200 PolarHBondContact O-N 3.45Å; M200-Q204 HydrophobicContact CB-CB 4.37Å; M200-Q204 HydrophobicContact CE-CB 3.78Å; M200-V208 HydrophobicContact CE-CG2 3.98Å
201	T	85	Confident	87.6	Confident	81 Å²	81	66.5 Å²	66.5	50%	0.497	34%	0.341	S	S	.	.			trans	-68.6	155.8	169.5	64.7	0	0	0	0	111	K203 Q204 R205	T201-K203 VanDerWaalsContact C-N 3.26Å; T201-K203 PolarHBondContact O-N 3.18Å; T201-Q204 PolarHBondContact O-N 2.94Å; T201-Q204 VanDerWaalsContact O-N 3.08Å; T201-Q204 VanDerWaalsContact OG1-CG 3.28Å; T201-Q204 WeakPolarHBondContact OG1-CG 3.49Å; T201-Q204 PolarHBondContact OG1-N 3.15Å; T201-Q204 PolarHBondContact OG1-OE1 3.19Å; T201-R205 PolarHBondContact O-N 3.49Å
202	R	84.4	Confident	88.1	Confident	204 Å²	204	66.1 Å²	66.1	77%	0.77	34%	0.339	S	S	*	.	H	α-helix	trans	-52.4	-44.3	175.6	-177.4	177.7	171.1	175.9	-0.1	112.3	Q204 R205 E206	R202-Q204 PolarHBondContact O-N 3.03Å; R202-R205 PolarHBondContact O-N 2.54Å; R202-E206 IonicContact NE-OE2 3.21Å; R202-E206 WeakPolarHBondContact O-CB 3.47Å; R202-E206 PolarHBondContact O-N 3.34Å
203	K	88	Confident	88.1	Confident	180 Å²	180	66.7 Å²	66.7	78%	0.783	34%	0.338	S	S	*	.	H	α-helix	trans	-61.2	-40.7	178.5	-172.4	177.2	-179.3	178.3	0	112.5	T201 S207	T201-K203 VanDerWaalsContact C-N 3.26Å; T201-K203 PolarHBondContact O-N 3.18Å; K203-S207 WeakPolarHBondContact O-CB 3.18Å; K203-S207 PolarHBondContact O-N 2.85Å
204	Q	89.3	Confident	88.1	Confident	101 Å²	101	68.1 Å²	68.1	47%	0.472	35%	0.351	S	S	.	.	H	α-helix	trans	-67.1	-45.7	176.6	-72.6	166.6	-49.7	0	0	111.5	M200 T201 R202 E206 S207 V208	M200-Q204 HydrophobicContact CB-CB 4.37Å; M200-Q204 HydrophobicContact CE-CB 3.78Å; T201-Q204 PolarHBondContact O-N 2.94Å; T201-Q204 VanDerWaalsContact O-N 3.08Å; T201-Q204 VanDerWaalsContact OG1-CG 3.28Å; T201-Q204 WeakPolarHBondContact OG1-CG 3.49Å; T201-Q204 PolarHBondContact OG1-N 3.15Å; T201-Q204 PolarHBondContact OG1-OE1 3.19Å; R202-Q204 PolarHBondContact O-N 3.03Å; Q204-E206 VanDerWaalsContact C-N 3.33Å; Q204-E206 PolarHBondContact O-N 3.21Å; Q204-S207 PolarHBondContact O-N 3.05Å; Q204-V208 PolarHBondContact O-N 3.27Å
205	R	89.3	Confident	87.9	Confident	33 Å²	33	69.8 Å²	69.8	13%	0.125	36%	0.364	C	S	.	.	H	α-helix	trans	-58.6	-46.5	176.6	-178	179.3	-69.8	-112.7	-4.2	111	I196 H197 T201 R202 S207 V208 L209 G232	I196-R205 HydrophobicContact CG2-CG 4.3Å; H197-R205 PolarHBondContact O-NH2 2.85Å; T201-R205 PolarHBondContact O-N 3.49Å; R202-R205 PolarHBondContact O-N 2.54Å; R205-S207 PolarHBondContact O-N 3.3Å; R205-V208 PolarHBondContact O-N 2.85Å; R205-L209 HydrophobicContact CG-CD1 4.27Å; R205-L209 WeakPolarHBondContact O-CG 3.3Å; R205-L209 PolarHBondContact O-N 2.72Å; R205-G232 PolarHBondContact NH1-O 3.33Å
206	E	89.2	Confident	87.8	Confident	100 Å²	100	74.5 Å²	74.5	47%	0.467	39%	0.385	S	S	.	.	H	α-helix	trans	-65.6	-37.8	-179.8	-167.5	148.3	-159.1	0	0	112.3	R202 Q204 V208 L209 Q210	R202-E206 IonicContact NE-OE2 3.21Å; R202-E206 WeakPolarHBondContact O-CB 3.47Å; R202-E206 PolarHBondContact O-N 3.34Å; Q204-E206 VanDerWaalsContact C-N 3.33Å; Q204-E206 PolarHBondContact O-N 3.21Å; E206-V208 PolarHBondContact O-N 2.93Å; E206-L209 PolarHBondContact O-N 3.44Å; E206-Q210 WeakPolarHBondContact O-CB 3.43Å; E206-Q210 PolarHBondContact O-N 3.25Å
207	S	92.8	Very high	88	Confident	52 Å²	52	74.8 Å²	74.8	36%	0.364	39%	0.386	S	S	.	.	H	α-helix	trans	-61.4	-41.4	171.5	-179	0	0	0	0	112.5	K203 Q204 R205 Q210 K211	K203-S207 WeakPolarHBondContact O-CB 3.18Å; K203-S207 PolarHBondContact O-N 2.85Å; Q204-S207 PolarHBondContact O-N 3.05Å; R205-S207 PolarHBondContact O-N 3.3Å; S207-Q210 PolarHBondContact O-N 3.26Å; S207-K211 WeakPolarHBondContact O-CG 3.5Å; S207-K211 PolarHBondContact O-N 3.2Å; S207-K211 VanDerWaalsContact O-N 3.15Å
208	V	91.8	Very high	88.3	Confident	17 Å²	17	75 Å²	75	10%	0.103	39%	0.387	C	S	.	.	H	α-helix	trans	-65.4	-45.1	175.1	171.7	0	0	0	0	110.9	A194 I196 M200 Q204 R205 E206 Q210 K211 I212 L220	A194-V208 HydrophobicContact CB-CG1 3.58Å; A194-V208 HydrophobicContact CB-CG2 4.39Å; I196-V208 HydrophobicContact CD1-CG1 3.96Å; I196-V208 HydrophobicContact CG1-CB 4.33Å; I196-V208 HydrophobicContact CG1-CG1 3.79Å; M200-V208 HydrophobicContact CE-CG2 3.98Å; Q204-V208 PolarHBondContact O-N 3.27Å; R205-V208 PolarHBondContact O-N 2.85Å; E206-V208 PolarHBondContact O-N 2.93Å; V208-Q210 VanDerWaalsContact C-N 3.29Å; V208-Q210 PolarHBondContact O-N 3.2Å; V208-K211 WeakPolarHBondContact O-CB 3.32Å; V208-K211 PolarHBondContact O-N 3.04Å; V208-K211 VanDerWaalsContact O-N 3.14Å; V208-I212 HydrophobicContact CG1-CD1 3.76Å; V208-I212 HydrophobicContact CG1-CG1 4.38Å; V208-I212 WeakPolarHBondContact O-CG1 3.4Å; V208-I212 PolarHBondContact O-N 3.3Å; V208-L220 HydrophobicContact CG1-CD1 4.39Å
209	L	91.6	Very high	89.1	Confident	21 Å²	21	71.2 Å²	71.2	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-60.7	-37.9	176.6	-69.4	176	0	0	0	112.5	I196 R205 E206 I212 R213 P234 L239	I196-L209 HydrophobicContact CD1-CD2 4.08Å; I196-L209 HydrophobicContact CD1-CG 4.48Å; R205-L209 HydrophobicContact CG-CD1 4.27Å; R205-L209 WeakPolarHBondContact O-CG 3.3Å; R205-L209 PolarHBondContact O-N 2.72Å; E206-L209 PolarHBondContact O-N 3.44Å; L209-I212 HydrophobicContact CD2-CD1 4.18Å; L209-I212 PolarHBondContact O-N 2.98Å; L209-R213 WeakPolarHBondContact O-CB 3.39Å; L209-R213 WeakPolarHBondContact O-CG 3.29Å; L209-R213 PolarHBondContact O-N 3.04Å; L209-P234 HydrophobicContact CD1-CG 4.4Å; L209-P234 HydrophobicContact CD2-CG 3.84Å; L209-L239 HydrophobicContact CD2-CD2 4.49Å
210	Q	92.3	Very high	89.9	Confident	131 Å²	131	68.4 Å²	68.4	61%	0.612	33%	0.331	S	S	*	.	H	α-helix	trans	-63.7	-41.2	175.1	-168.2	178.6	5.6	0	0	111.7	E206 S207 V208 R213 A214	E206-Q210 WeakPolarHBondContact O-CB 3.43Å; E206-Q210 PolarHBondContact O-N 3.25Å; S207-Q210 PolarHBondContact O-N 3.26Å; V208-Q210 VanDerWaalsContact C-N 3.29Å; V208-Q210 PolarHBondContact O-N 3.2Å; Q210-R213 PolarHBondContact O-N 3.24Å; Q210-A214 WeakPolarHBondContact O-CB 3.15Å; Q210-A214 PolarHBondContact O-N 3.45Å
211	K	92.8	Very high	90.4	Very high	99 Å²	99	66.9 Å²	66.9	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-65	-38.6	174.4	-68.4	175.7	-179.2	-176.1	0	112.5	S207 V208 A214 A215 Q216 V217	S207-K211 WeakPolarHBondContact O-CG 3.5Å; S207-K211 PolarHBondContact O-N 3.2Å; S207-K211 VanDerWaalsContact O-N 3.15Å; V208-K211 WeakPolarHBondContact O-CB 3.32Å; V208-K211 PolarHBondContact O-N 3.04Å; V208-K211 VanDerWaalsContact O-N 3.14Å; K211-A214 CarbonylContact O-C 3.55Å; K211-A214 PolarHBondContact O-N 2.97Å; K211-A215 PolarHBondContact O-N 3.31Å; K211-Q216 HydrophobicContact CB-CB 4.37Å; K211-Q216 WeakPolarHBondContact O-CB 3.39Å; K211-Q216 PolarHBondContact O-N 2.63Å; K211-V217 HydrophobicContact CB-CG2 3.89Å
212	I	92.7	Very high	90.7	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.5	-47	175.7	-65.9	159	0	0	0	110.5	L169 I196 V208 L209 A214 A215 V217 L220 L239 P240	L169-I212 HydrophobicContact CD2-CG2 4.08Å; I196-I212 HydrophobicContact CD1-CD1 4.49Å; V208-I212 HydrophobicContact CG1-CD1 3.76Å; V208-I212 HydrophobicContact CG1-CG1 4.38Å; V208-I212 WeakPolarHBondContact O-CG1 3.4Å; V208-I212 PolarHBondContact O-N 3.3Å; L209-I212 HydrophobicContact CD2-CD1 4.18Å; L209-I212 PolarHBondContact O-N 2.98Å; I212-A214 PolarHBondContact O-N 2.66Å; I212-A215 WeakPolarHBondContact O-CA 3.28Å; I212-A215 PolarHBondContact O-N 3.09Å; I212-V217 HydrophobicContact CG1-CB 3.85Å; I212-V217 HydrophobicContact CG1-CG1 4.11Å; I212-V217 HydrophobicContact CG1-CG2 3.95Å; I212-L220 HydrophobicContact CD1-CD1 4.02Å; I212-L220 HydrophobicContact CD1-CD2 3.77Å; I212-L220 HydrophobicContact CD1-CG 4.4Å; I212-L239 HydrophobicContact CG2-CD2 3.78Å; I212-P240 HydrophobicContact CG2-CG 4.17Å; I212-P240 WeakPolarHBondContact O-CG 3.43Å
213	R	90.1	Very high	90.9	Very high	118 Å²	118	53.3 Å²	53.3	45%	0.445	26%	0.264	S	S	.	.	H	α-helix	trans	-60.1	-34	175.7	-73.4	171.5	-174.5	151.1	-3.1	112.5	L209 Q210 A215 Q238	L209-R213 WeakPolarHBondContact O-CB 3.39Å; L209-R213 WeakPolarHBondContact O-CG 3.29Å; L209-R213 PolarHBondContact O-N 3.04Å; Q210-R213 PolarHBondContact O-N 3.24Å; R213-A215 PolarHBondContact O-N 2.92Å; R213-Q238 WeakPolarHBondContact CG-O 3.28Å
214	A	89.4	Confident	91	Very high	57 Å²	57	44.7 Å²	44.7	47%	0.471	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	9.3	174.6	0	0	0	0	0	113.9	Q210 K211 I212 Q216	Q210-A214 WeakPolarHBondContact O-CB 3.15Å; Q210-A214 PolarHBondContact O-N 3.45Å; K211-A214 CarbonylContact O-C 3.55Å; K211-A214 PolarHBondContact O-N 2.97Å; I212-A214 PolarHBondContact O-N 2.66Å; A214-Q216 HydrophobicContact CB-CG 4.08Å; A214-Q216 PolarHBondContact O-N 2.95Å; A214-Q216 VanDerWaalsContact O-N 3.11Å
215	A	85.6	Confident	90.7	Very high	46 Å²	46	43.1 Å²	43.1	38%	0.38	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	24.8	-177.1	0	0	0	0	0	114.8	P167 K211 I212 R213 V217	P167-A215 HydrophobicContact CB-CB 4.49Å; K211-A215 PolarHBondContact O-N 3.31Å; I212-A215 WeakPolarHBondContact O-CA 3.28Å; I212-A215 PolarHBondContact O-N 3.09Å; R213-A215 PolarHBondContact O-N 2.92Å; A215-V217 VanDerWaalsContact C-N 3.27Å; A215-V217 PolarHBondContact O-N 2.88Å
216	Q	89.6	Confident	90.6	Very high	116 Å²	116	41.8 Å²	41.8	54%	0.542	22%	0.215	S	C	.	.			trans	-87.3	4.7	178	-63	-179.1	-11.2	0	0	113	K192 K211 A214	K192-Q216 WeakPolarHBondContact CB-O 3.43Å; K211-Q216 HydrophobicContact CB-CB 4.37Å; K211-Q216 WeakPolarHBondContact O-CB 3.39Å; K211-Q216 PolarHBondContact O-N 2.63Å; A214-Q216 HydrophobicContact CB-CG 4.08Å; A214-Q216 PolarHBondContact O-N 2.95Å; A214-Q216 VanDerWaalsContact O-N 3.11Å
217	V	92.5	Very high	90.6	Very high	6 Å²	6	37.3 Å²	37.3	4%	0.036	19%	0.194	C	C	.	.			trans	-133.3	123.8	-177.6	-178.7	0	0	0	0	108.3	L169 A194 K211 I212 A215 V219	L169-V217 HydrophobicContact CD1-CG1 4.25Å; A194-V217 HydrophobicContact CB-CG1 3.97Å; A194-V217 HydrophobicContact CB-CG2 4.05Å; K211-V217 HydrophobicContact CB-CG2 3.89Å; I212-V217 HydrophobicContact CG1-CB 3.85Å; I212-V217 HydrophobicContact CG1-CG1 4.11Å; I212-V217 HydrophobicContact CG1-CG2 3.95Å; A215-V217 VanDerWaalsContact C-N 3.27Å; A215-V217 PolarHBondContact O-N 2.88Å; V217-V219 WeakPolarHBondContact CG1-O 3.4Å
218	H	92.2	Very high	90.2	Very high	42 Å²	42	35.1 Å²	35.1	19%	0.194	18%	0.179	C	C	.	.	S	Bend	trans	-102.2	-31.1	178.5	-52.1	-46.2	0	0	0	111.4	S163 T170 L191 K192	S163-H218 PolarHBondContact OG-CE1 3.04Å; S163-H218 PolarHBondContact OG-ND1 3.21Å; T170-H218 PolarHBondContact N-O 3.26Å; L191-H218 HydrophobicContact CD2-CB 4.4Å; K192-H218 PolarHBondContact O-N 2.83Å
219	V	94.2	Very high	89.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	121.2	178.1	-179.1	0	0	0	0	109.9	A159 T170 V172 L191 K192 A193 A194 V217 M221	A159-V219 HydrophobicContact CB-CG2 3.78Å; T170-V219 WeakPolarHBondContact O-CA 3.16Å; V172-V219 HydrophobicContact CG2-CG1 3.73Å; L191-V219 HydrophobicContact CD2-CG2 4.32Å; K192-V219 PolarHBondContact O-N 3.43Å; K192-V219 VanDerWaalsContact O-N 3.11Å; A193-V219 WeakPolarHBondContact CA-O 3.44Å; A193-V219 HydrophobicContact CB-CB 4.03Å; A193-V219 WeakPolarHBondContact CB-O 3.45Å; A194-V219 PolarHBondContact N-O 3.35Å; V217-V219 WeakPolarHBondContact CG1-O 3.4Å; V219-M221 HydrophobicContact CG1-CE 4.44Å
220	L	93.8	Very high	88.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	112.8	174.2	176.2	60.1	0	0	0	110.2	L169 T170 L171 V172 A194 I196 V208 I212 L222 L233	L169-L220 HydrophobicContact CD1-CB 3.92Å; L169-L220 HydrophobicContact CD2-CB 4.22Å; L169-L220 HydrophobicContact CD2-CD2 4.16Å; L169-L220 HydrophobicContact CG-CB 4.31Å; T170-L220 PolarHBondContact O-N 2.95Å; L171-L220 HydrophobicContact CD2-CB 3.99Å; L171-L220 HydrophobicContact CD2-CD2 3.9Å; L171-L220 HydrophobicContact CD2-CG 4.28Å; V172-L220 PolarHBondContact N-O 2.78Å; A194-L220 HydrophobicContact CB-CD1 4.5Å; A194-L220 WeakPolarHBondContact O-CA 3.45Å; I196-L220 HydrophobicContact CD1-CD1 4.03Å; I196-L220 HydrophobicContact CD1-CD2 4.4Å; I196-L220 HydrophobicContact CG1-CD1 3.99Å; V208-L220 HydrophobicContact CG1-CD1 4.39Å; I212-L220 HydrophobicContact CD1-CD1 4.02Å; I212-L220 HydrophobicContact CD1-CD2 3.77Å; I212-L220 HydrophobicContact CD1-CG 4.4Å; L220-L222 HydrophobicContact CD1-CD2 4.33Å; L220-L222 HydrophobicContact CD2-CD1 4.1Å; L220-L222 HydrophobicContact CD2-CD2 4.13Å; L220-L222 HydrophobicContact CD2-CG 4.27Å; L220-L222 HydrophobicContact CG-CD1 4.18Å; L220-L222 HydrophobicContact CG-CD2 4.06Å; L220-L222 HydrophobicContact CG-CG 3.95Å; L220-L233 HydrophobicContact CD2-CD2 4.01Å
221	M	92.4	Very high	87.1	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	132.1	173.4	-67.7	178.2	178.3	0	0	110.6	Y155 V172 M180 Q183 V184 L187 A194 C195 I196 V219	Y155-M221 HydrophobicContact CE2-CE 4.3Å; V172-M221 HydrophobicContact CB-CG 4.07Å; V172-M221 HydrophobicContact CG1-CG 4.42Å; V172-M221 CarbonylContact O-C 3.57Å; V172-M221 VanDerWaalsContact O-CA 3.28Å; V172-M221 WeakPolarHBondContact O-CA 3.19Å; M180-M221 HydrophobicContact CE-CB 3.61Å; M180-M221 WeakPolarHBondContact CE-O 3.49Å; Q183-M221 HydrophobicContact CB-CE 3.62Å; Q183-M221 HydrophobicContact CB-SD 3.85Å; Q183-M221 VanDerWaalsContact OE1-CE 3.32Å; V184-M221 HydrophobicContact CG2-SD 3.78Å; L187-M221 HydrophobicContact CD1-CE 4.18Å; A194-M221 PolarHBondContact O-N 3.3Å; C195-M221 CarbonylContact C-O 3.52Å; C195-M221 VanDerWaalsContact CA-O 3.24Å; C195-M221 WeakPolarHBondContact CA-O 3.35Å; C195-M221 HydrophobicContact CB-CB 4.22Å; I196-M221 PolarHBondContact N-O 2.84Å; V219-M221 HydrophobicContact CG1-CE 4.44Å
222	L	91.3	Very high	86.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	140.4	-176.4	-64.7	162.6	0	0	0	110.6	L171 V172 V173 S174 M180 I196 L220 L227 L233	L171-L222 HydrophobicContact CD2-CD1 4.1Å; V172-L222 PolarHBondContact O-N 2.91Å; V173-L222 CarbonylContact C-O 3.55Å; V173-L222 WeakPolarHBondContact CA-O 3.37Å; S174-L222 PolarHBondContact N-O 2.9Å; M180-L222 VanDerWaalsContact CE-C 3.5Å; M180-L222 VanDerWaalsContact CE-N 3.32Å; I196-L222 HydrophobicContact CB-CD2 3.63Å; I196-L222 HydrophobicContact CD1-CD2 4.42Å; I196-L222 HydrophobicContact CG1-CD2 4.45Å; I196-L222 HydrophobicContact CG2-CD2 4.23Å; I196-L222 WeakPolarHBondContact O-CA 3.18Å; L220-L222 HydrophobicContact CD1-CD2 4.33Å; L220-L222 HydrophobicContact CD2-CD1 4.1Å; L220-L222 HydrophobicContact CD2-CD2 4.13Å; L220-L222 HydrophobicContact CD2-CG 4.27Å; L220-L222 HydrophobicContact CG-CD1 4.18Å; L220-L222 HydrophobicContact CG-CD2 4.06Å; L220-L222 HydrophobicContact CG-CG 3.95Å; L222-L227 HydrophobicContact CD1-CD1 4.2Å; L222-L233 HydrophobicContact CD1-CD1 3.79Å; L222-L233 HydrophobicContact CD1-CD2 4.38Å; L222-L233 HydrophobicContact CD1-CG 4.37Å; L222-L233 HydrophobicContact CD2-CD2 4.02Å
223	T	89.3	Confident	85.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.191	C	C	.	.			trans	-78.7	148.3	160.8	82.6	0	0	0	0	109.2	S174 L177 M180 I196 H197 E225 A226 L227	S174-T223 WeakPolarHBondContact O-CA 3.49Å; L177-T223 HydrophobicContact CD1-CG2 3.69Å; L177-T223 HydrophobicContact CG-CG2 3.94Å; M180-T223 HydrophobicContact CE-CG2 4.16Å; M180-T223 HydrophobicContact SD-CG2 3.55Å; M180-T223 VanDerWaalsContact SD-CG2 3.55Å; I196-T223 PolarHBondContact O-N 2.86Å; H197-T223 HydrophobicContact CB-CG2 3.57Å; T223-E225 WeakPolarHBondContact CB-OE2 3.48Å; T223-E225 PolarHBondContact O-N 3.04Å; T223-E225 PolarHBondContact OG1-OE2 3.27Å; T223-A226 PolarHBondContact O-N 3.07Å; T223-A226 WeakPolarHBondContact OG1-CB 3.47Å; T223-A226 PolarHBondContact OG1-N 3.15Å; T223-L227 PolarHBondContact O-N 3.2Å
224	P	88.3	Confident	85.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-50.9	-44.7	176.2	-25.1	30.7	0	0	0	112.4	V173 A226 L227 V228 C263 Y264 V267	V173-P224 HydrophobicContact CG1-CB 4.38Å; V173-P224 HydrophobicContact CG1-CG 3.88Å; P224-A226 VanDerWaalsContact C-N 3.31Å; P224-A226 PolarHBondContact O-N 3.36Å; P224-L227 WeakPolarHBondContact O-CB 3.47Å; P224-L227 PolarHBondContact O-N 2.9Å; P224-L227 VanDerWaalsContact O-N 3.15Å; P224-V228 WeakPolarHBondContact O-CG2 3.33Å; P224-V228 PolarHBondContact O-N 3.06Å; P224-C263 HydrophobicContact CB-CB 4.29Å; P224-Y264 HydrophobicContact CB-CD2 4.19Å; P224-Y264 HydrophobicContact CB-CE2 4.05Å; P224-Y264 HydrophobicContact CG-CD2 3.84Å; P224-Y264 HydrophobicContact CG-CE1 4.38Å; P224-Y264 HydrophobicContact CG-CE2 3.21Å; P224-Y264 VanDerWaalsContact CG-CZ 3.49Å; P224-V267 HydrophobicContact CB-CG2 3.81Å
225	E	84.9	Confident	85.4	Confident	67 Å²	67	27 Å²	27	31%	0.313	18%	0.178	S	C	.	.	H	α-helix	trans	-67	-32.6	-177.9	-48.3	81	-178.3	0	0	111.6	T223 L227 G229 R261	T223-E225 WeakPolarHBondContact CB-OE2 3.48Å; T223-E225 PolarHBondContact O-N 3.04Å; T223-E225 PolarHBondContact OG1-OE2 3.27Å; E225-L227 VanDerWaalsContact C-N 3.32Å; E225-G229 WeakPolarHBondContact O-CA 3.34Å; E225-G229 PolarHBondContact O-N 2.86Å; E225-R261 IonicContact OE1-NH1 2.81Å; E225-R261 PolarHBondContact OE1-NH1 2.91Å
226	A	86.5	Confident	85.4	Confident	5 Å²	5	26.3 Å²	26.3	4%	0.041	17%	0.173	C	C	.	.	H	α-helix	trans	-73.1	-26.4	176.5	0	0	0	0	0	112.9	I196 T223 P224	I196-A226 HydrophobicContact CG2-CB 4.36Å; T223-A226 PolarHBondContact O-N 3.07Å; T223-A226 WeakPolarHBondContact OG1-CB 3.47Å; T223-A226 PolarHBondContact OG1-N 3.15Å; P224-A226 VanDerWaalsContact C-N 3.31Å; P224-A226 PolarHBondContact O-N 3.36Å
227	L	88.4	Confident	85.2	Confident	6 Å²	6	25.7 Å²	25.7	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-78.7	-44.9	175.7	-178	65.4	0	0	0	111.7	V173 L222 T223 P224 E225 L233 V267 V270 L271	V173-L227 HydrophobicContact CG2-CD2 4.25Å; L222-L227 HydrophobicContact CD1-CD1 4.2Å; T223-L227 PolarHBondContact O-N 3.2Å; P224-L227 WeakPolarHBondContact O-CB 3.47Å; P224-L227 PolarHBondContact O-N 2.9Å; P224-L227 VanDerWaalsContact O-N 3.15Å; E225-L227 VanDerWaalsContact C-N 3.32Å; L227-L233 HydrophobicContact CD1-CD1 3.52Å; L227-L233 HydrophobicContact CD1-CG 3.84Å; L227-V267 HydrophobicContact CD2-CB 4.34Å; L227-V267 HydrophobicContact CD2-CG1 3.9Å; L227-V267 HydrophobicContact CD2-CG2 4.18Å; L227-V270 HydrophobicContact CD1-CG1 4.21Å; L227-V270 HydrophobicContact CD2-CG1 4.48Å; L227-V270 HydrophobicContact CG-CG1 4.06Å; L227-L271 HydrophobicContact CD1-CD2 4.49Å; L227-L271 HydrophobicContact CD2-CD1 4.38Å; L227-L271 HydrophobicContact CD2-CD2 3.93Å; L227-L271 HydrophobicContact CD2-CG 3.94Å
228	V	84.2	Confident	85	Confident	7 Å²	7	30 Å²	30	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-95.3	-17.9	-173.1	-51.3	0	0	0	0	114.4	P224 C263 R266 V267 V270	P224-V228 WeakPolarHBondContact O-CG2 3.33Å; P224-V228 PolarHBondContact O-N 3.06Å; V228-C263 HydrophobicContact CG2-CB 4.28Å; V228-R266 HydrophobicContact CB-CB 4.45Å; V228-R266 HydrophobicContact CG1-CB 3.92Å; V228-V267 HydrophobicContact CG1-CG2 4.14Å; V228-V270 HydrophobicContact CG1-CG2 4.2Å
229	G	76.1	Confident	84.9	Confident	20 Å²	20	28.8 Å²	28.8	21%	0.206	20%	0.202	C	C	.	.	S	Bend	trans	-83	-176.2	-176.6	0	0	0	0	0	115	E225 G231 G232	E225-G229 WeakPolarHBondContact O-CA 3.34Å; E225-G229 PolarHBondContact O-N 2.86Å; G229-G231 PolarHBondContact O-N 2.68Å; G229-G232 PolarHBondContact O-N 2.97Å
230	A	65.3	Low	84.7	Confident	51 Å²	51	29.7 Å²	29.7	42%	0.421	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.1	-170.9	0	0	0	0	0	116.8	T583 L676	A230-T583 WeakPolarHBondContact CA-O 3.03Å; A230-T583 WeakPolarHBondContact CB-O 3.37Å; A230-T583 PolarHBondContact N-O 2.77Å; A230-L676 HydrophobicContact CB-CD1 3.82Å
231	G	69.4	Low	84.6	Confident	54 Å²	54	32.1 Å²	32.1	56%	0.557	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-30.4	174.6	0	0	0	0	0	113.9	G229	G229-G231 PolarHBondContact O-N 2.68Å
232	G	77.8	Confident	84.7	Confident	17 Å²	17	33 Å²	33	18%	0.175	23%	0.229	C	C	.	.			trans	43.4	-170.8	-179.8	0	0	0	0	0	117.2	R205 G229	R205-G232 PolarHBondContact NH1-O 3.33Å; G229-G232 PolarHBondContact O-N 2.97Å
233	L	83.6	Confident	84.9	Confident	30 Å²	30	33.6 Å²	33.6	16%	0.157	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-97.4	152.8	156.3	-71.8	179.7	0	0	0	109.5	I196 L220 L222 L227 M275	I196-L233 HydrophobicContact CD1-CD2 4.19Å; L220-L233 HydrophobicContact CD2-CD2 4.01Å; L222-L233 HydrophobicContact CD1-CD1 3.79Å; L222-L233 HydrophobicContact CD1-CD2 4.38Å; L222-L233 HydrophobicContact CD1-CG 4.37Å; L222-L233 HydrophobicContact CD2-CD2 4.02Å; L227-L233 HydrophobicContact CD1-CD1 3.52Å; L227-L233 HydrophobicContact CD1-CG 3.84Å; L233-M275 HydrophobicContact CB-SD 4.35Å; L233-M275 HydrophobicContact CD1-CE 3.86Å; L233-M275 HydrophobicContact CD1-SD 4.14Å
234	P	84.5	Confident	85.2	Confident	18 Å²	18	33.6 Å²	33.6	12%	0.117	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-63.5	164.2	168.5	30.7	-35.7	0	0	0	110.6	L209 Q238 L239	L209-P234 HydrophobicContact CD1-CG 4.4Å; L209-P234 HydrophobicContact CD2-CG 3.84Å; P234-Q238 HydrophobicContact CB-CB 4.41Å; P234-L239 HydrophobicContact CG-CD1 4.01Å; P234-L239 HydrophobicContact CG-CD2 3.68Å; P234-L239 HydrophobicContact CG-CG 3.89Å
235	P	84.7	Confident	85.6	Confident	81 Å²	81	33.6 Å²	33.6	53%	0.526	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-52.9	145.2	176.8	-24.8	33.9	0	0	0	112.1	A237 Q238	P235-A237 PolarHBondContact O-N 2.92Å; P235-A237 VanDerWaalsContact O-N 3.1Å; P235-Q238 PolarHBondContact O-N 3.29Å
236	A	85.4	Confident	86.1	Confident	33 Å²	33	30.4 Å²	30.4	27%	0.273	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-53	-34.5	-179	0	0	0	0	0	113.2	Q238 L239	A236-Q238 PolarHBondContact O-N 3.38Å; A236-Q238 VanDerWaalsContact O-N 3.11Å; A236-L239 PolarHBondContact O-N 2.76Å; A236-L239 VanDerWaalsContact O-O 3.06Å
237	A	85	Confident	86.5	Confident	103 Å²	103	30.1 Å²	30.1	85%	0.851	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-60.7	-19.4	176.3	0	0	0	0	0	114.7	P235	P235-A237 PolarHBondContact O-N 2.92Å; P235-A237 VanDerWaalsContact O-N 3.1Å
238	Q	87.7	Confident	86.6	Confident	97 Å²	97	30.4 Å²	30.4	45%	0.453	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-96.3	2.2	175.8	-61.2	-174.9	16.5	0	0	113.2	R213 P234 P235 A236	R213-Q238 WeakPolarHBondContact CG-O 3.28Å; P234-Q238 HydrophobicContact CB-CB 4.41Å; P235-Q238 PolarHBondContact O-N 3.29Å; A236-Q238 PolarHBondContact O-N 3.38Å; A236-Q238 VanDerWaalsContact O-N 3.11Å
239	L	89.9	Confident	86.8	Confident	16 Å²	16	30.9 Å²	30.9	8%	0.084	22%	0.22	C	C	.	.	S	Bend	trans	-119.1	154.3	-176.7	-63.8	174.5	0	0	0	109.4	L209 I212 P234 A236 M275	L209-L239 HydrophobicContact CD2-CD2 4.49Å; I212-L239 HydrophobicContact CG2-CD2 3.78Å; P234-L239 HydrophobicContact CG-CD1 4.01Å; P234-L239 HydrophobicContact CG-CD2 3.68Å; P234-L239 HydrophobicContact CG-CG 3.89Å; A236-L239 PolarHBondContact O-N 2.76Å; A236-L239 VanDerWaalsContact O-O 3.06Å; L239-M275 HydrophobicContact CD1-CE 3.52Å; L239-M275 HydrophobicContact CD1-SD 4.49Å
240	P	90.9	Very high	87.5	Confident	19 Å²	19	29.9 Å²	29.9	12%	0.123	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-55.8	148.2	164.8	-21.3	32.8	0	0	0	110.4	L169 I212 V242	L169-P240 HydrophobicContact CB-CB 4.39Å; I212-P240 HydrophobicContact CG2-CG 4.17Å; I212-P240 WeakPolarHBondContact O-CG 3.43Å; P240-V242 PolarHBondContact O-N 2.63Å
241	P	92	Very high	88.6	Confident	51 Å²	51	27.6 Å²	27.6	33%	0.331	19%	0.191	S	C	.	.	P	Polyproline II helix	trans	-61	140.3	-179	29.7	-37.6	0	0	0	110	P91 V93 C168 L169	P91-P241 WeakPolarHBondContact O-CB 3.46Å; V93-P241 HydrophobicContact CG2-CB 3.65Å; V93-P241 HydrophobicContact CG2-CG 3.92Å; C168-P241 CarbonylContact C-O 3.52Å; C168-P241 VanDerWaalsContact CA-O 3.28Å; C168-P241 WeakPolarHBondContact CA-O 3.46Å; C168-P241 VanDerWaalsContact CB-O 3.28Å; C168-P241 WeakPolarHBondContact CB-O 3.42Å; L169-P241 PolarHBondContact N-O 3.39Å
242	V	94.3	Very high	89.6	Confident	19 Å²	19	25 Å²	25	12%	0.115	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	123.6	-175.2	-179.9	0	0	0	0	109.4	L169 L171 P240 M275 V277	L169-V242 CarbonylContact O-C 3.56Å; L169-V242 VanDerWaalsContact O-CA 3.27Å; L169-V242 WeakPolarHBondContact O-CA 2.96Å; L171-V242 HydrophobicContact CD1-CG1 4.08Å; L171-V242 HydrophobicContact CD1-CG2 4.1Å; L171-V242 HydrophobicContact CG-CG1 3.92Å; L171-V242 HydrophobicContact CG-CG2 4.26Å; P240-V242 PolarHBondContact O-N 2.63Å; V242-M275 HydrophobicContact CG2-CE 4.19Å; V242-V277 HydrophobicContact CB-CG2 3.93Å; V242-V277 HydrophobicContact CG1-CG2 3.57Å; V242-V277 HydrophobicContact CG2-CG2 4.47Å
243	A	94.4	Very high	90	Very high	11 Å²	11	24.3 Å²	24.3	9%	0.091	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	-48.9	179.3	0	0	0	0	0	112.2	V93 Y162 C168 L169	V93-A243 HydrophobicContact CB-CB 4.35Å; V93-A243 HydrophobicContact CG1-CB 4.05Å; V93-A243 HydrophobicContact CG2-CB 4.33Å; Y162-A243 HydrophobicContact CD1-CB 3.95Å; Y162-A243 HydrophobicContact CD2-CB 3.98Å; Y162-A243 HydrophobicContact CE1-CB 4.43Å; Y162-A243 HydrophobicContact CE2-CB 4.46Å; Y162-A243 HydrophobicContact CG-CB 3.72Å; C168-A243 HydrophobicContact CB-CB 4.34Å; L169-A243 PolarHBondContact O-N 2.97Å
244	F	96.3	Very high	90.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	166.4	175.8	70.5	-79.7	0	0	0	109.8	I135 P158 A159 Y162 T170 L171 C246 C279 L281	I135-F244 HydrophobicContact CG2-CB 4.27Å; I135-F244 HydrophobicContact CG2-CD1 3.78Å; I135-F244 HydrophobicContact CG2-CD2 3.77Å; I135-F244 HydrophobicContact CG2-CE1 3.98Å; I135-F244 HydrophobicContact CG2-CE2 3.96Å; I135-F244 HydrophobicContact CG2-CG 3.67Å; I135-F244 HydrophobicContact CG2-CZ 4.06Å; P158-F244 HydrophobicContact CB-CE1 3.8Å; P158-F244 HydrophobicContact CB-CZ 3.87Å; A159-F244 HydrophobicContact CB-CE1 4.5Å; Y162-F244 HydrophobicContact CD2-CD1 4.04Å; Y162-F244 HydrophobicContact CD2-CE1 4.13Å; Y162-F244 HydrophobicContact CE2-CD1 4.12Å; T170-F244 HydrophobicContact CG2-CD1 4.08Å; T170-F244 HydrophobicContact CG2-CD2 4.26Å; T170-F244 HydrophobicContact CG2-CE1 3.52Å; T170-F244 HydrophobicContact CG2-CE2 3.74Å; T170-F244 HydrophobicContact CG2-CG 4.42Å; T170-F244 HydrophobicContact CG2-CZ 3.33Å; T170-F244 WeakPolarHBondContact OG1-CE1 3.32Å; L171-F244 PolarHBondContact N-O 3.14Å; F244-C246 HydrophobicContact CE2-CB 4.31Å; F244-C279 WeakPolarHBondContact CA-O 3.36Å; F244-C279 HydrophobicContact CB-CB 4.02Å; F244-C279 WeakPolarHBondContact CB-O 3.43Å; F244-L281 HydrophobicContact CD2-CB 4.29Å; F244-L281 HydrophobicContact CE2-CB 4.35Å; F244-L281 HydrophobicContact CE2-CD2 4.28Å
245	A	96.5	Very high	89.8	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.3	170.5	0	0	0	0	0	111.6	L171 L271 V277 C279 F280 L281	L171-A245 HydrophobicContact CB-CB 4.23Å; L171-A245 CarbonylContact O-C 3.5Å; L171-A245 WeakPolarHBondContact O-CA 3.25Å; A245-L271 HydrophobicContact CB-CD1 3.84Å; A245-V277 HydrophobicContact CB-CG1 3.76Å; A245-C279 PolarHBondContact N-O 3.38Å; A245-F280 HydrophobicContact CB-CD1 4.11Å; A245-F280 HydrophobicContact CB-CE1 4.18Å; A245-F280 CarbonylContact O-C 3.34Å; A245-F280 WeakPolarHBondContact O-CA 3.31Å; A245-L281 PolarHBondContact O-N 3.21Å
246	C	95.6	Very high	89.3	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	127.4	168.7	-179	0	0	0	0	109.8	Y155 L171 V172 V173 F244 L281 L283	Y155-C246 HydrophobicContact CG-CB 4.42Å; L171-C246 PolarHBondContact O-N 2.77Å; V172-C246 CarbonylContact C-O 3.56Å; V172-C246 WeakPolarHBondContact CA-O 3.44Å; V172-C246 HydrophobicContact CB-CB 4.46Å; V172-C246 HydrophobicContact CG1-CB 4.36Å; V172-C246 HydrophobicContact CG2-CB 4.11Å; V173-C246 PolarHBondContact N-O 3Å; F244-C246 HydrophobicContact CE2-CB 4.31Å; C246-L281 CarbonylContact C-O 3.39Å; C246-L281 WeakPolarHBondContact CA-O 3.46Å; C246-L281 HydrophobicContact CB-CB 4.4Å; C246-L281 HydrophobicContact CB-CD2 4.49Å; C246-L283 VanDerWaalsContact SG-CD1 3.54Å
247	I	94.1	Very high	89.1	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	99.9	171.5	-48.6	-56.2	0	0	0	107.3	V173 A250 L253 Y264 V267 L271 F280 L281 L283 L299	V173-I247 HydrophobicContact CB-CD1 4.05Å; V173-I247 HydrophobicContact CG2-CD1 4.04Å; I247-A250 HydrophobicContact CG2-CB 4.29Å; I247-L253 HydrophobicContact CG2-CD1 4.22Å; I247-Y264 HydrophobicContact CG2-CD1 3.96Å; I247-Y264 HydrophobicContact CG2-CE1 3.75Å; I247-V267 HydrophobicContact CD1-CG1 3.9Å; I247-L271 HydrophobicContact CD1-CD1 3.88Å; I247-F280 HydrophobicContact CG1-CD1 4.37Å; I247-L281 PolarHBondContact N-O 2.81Å; I247-L283 PolarHBondContact O-N 2.97Å; I247-L299 HydrophobicContact CG1-CD2 4.2Å
248	D	90.9	Very high	88.6	Confident	12 Å²	12	19.4 Å²	19.4	6%	0.064	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	148.3	174.2	-171.5	29.2	0	0	0	110.2	V173 S174 A250	V173-D248 WeakPolarHBondContact O-CB 3.16Å; V173-D248 PolarHBondContact O-N 3.07Å; S174-D248 PolarHBondContact OG-OD2 2.91Å; D248-A250 VanDerWaalsContact C-N 3.26Å; D248-A250 PolarHBondContact O-N 2.85Å
249	E	87.9	Confident	88.4	Confident	16 Å²	16	17.7 Å²	17.7	8%	0.075	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	46.6	-168.9	-57.5	-65.3	-176	0	0	112.8	P175 L176 H251 C252 L283 Q443	P175-E249 HydrophobicContact CG-CB 3.98Å; P175-E249 HydrophobicContact CG-CG 4.16Å; L176-E249 HydrophobicContact CD1-CG 4.3Å; E249-H251 PolarHBondContact O-N 2.92Å; E249-H251 IonicContact OE2-CE1 3.28Å; E249-H251 PolarHBondContact OE2-CE1 3.11Å; E249-H251 IonicContact OE2-ND1 3.74Å; E249-H251 PolarHBondContact OE2-ND1 2.94Å; E249-C252 WeakPolarHBondContact O-CB 3.4Å; E249-C252 PolarHBondContact O-N 2.96Å; E249-L283 WeakPolarHBondContact CA-O 3.3Å; E249-L283 PolarHBondContact N-O 3.21Å; E249-Q443 PolarHBondContact OE1-NE2 2.92Å
250	A	91.4	Very high	88	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-55.4	-20.3	-174.2	0	0	0	0	0	114.4	L142 I247 D248 C252 L253 L283 V295	L142-A250 HydrophobicContact CD1-CB 4.24Å; I247-A250 HydrophobicContact CG2-CB 4.29Å; D248-A250 VanDerWaalsContact C-N 3.26Å; D248-A250 PolarHBondContact O-N 2.85Å; A250-C252 PolarHBondContact O-N 3.29Å; A250-C252 VanDerWaalsContact O-N 3.11Å; A250-L253 WeakPolarHBondContact O-CB 3.49Å; A250-L253 PolarHBondContact O-N 3.09Å; A250-L253 VanDerWaalsContact O-N 3.07Å; A250-L283 PolarHBondContact N-O 3.16Å; A250-V295 HydrophobicContact CB-CG1 3.86Å; A250-V295 VanDerWaalsContact O-CG2 3.26Å; A250-V295 WeakPolarHBondContact O-CG2 3.29Å
251	H	89.3	Confident	87.5	Confident	3 Å²	3	20.1 Å²	20.1	1%	0.014	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-55.5	-26.1	172.5	66.3	-101.1	0	0	0	112.9	E249 L253 S254 S257 H258 T284 T291	E249-H251 PolarHBondContact O-N 2.92Å; E249-H251 IonicContact OE2-CE1 3.28Å; E249-H251 PolarHBondContact OE2-CE1 3.11Å; E249-H251 IonicContact OE2-ND1 3.74Å; E249-H251 PolarHBondContact OE2-ND1 2.94Å; H251-L253 PolarHBondContact O-N 3.18Å; H251-L253 VanDerWaalsContact O-N 3.13Å; H251-S254 PolarHBondContact O-N 3.16Å; H251-S257 WeakPolarHBondContact O-CB 3.13Å; H251-S257 PolarHBondContact O-OG 3.32Å; H251-H258 AromaticContact CD2-CE1 3.67Å; H251-H258 AromaticContact NE2-CE1 3.59Å; H251-H258 AromaticContact NE2-NE2 3.81Å; H251-T284 WeakPolarHBondContact CB-OG1 3.28Å; H251-T284 PolarHBondContact ND1-OG1 3.31Å; H251-T291 HydrophobicContact CB-CG2 3.98Å
252	C	89	Confident	86.8	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-60.1	-19.7	176.5	-74.2	0	0	0	0	114.2	E249 A250 S254 N259 F260 R261 Y264	E249-C252 WeakPolarHBondContact O-CB 3.4Å; E249-C252 PolarHBondContact O-N 2.96Å; A250-C252 PolarHBondContact O-N 3.29Å; A250-C252 VanDerWaalsContact O-N 3.11Å; C252-S254 VanDerWaalsContact C-N 3.35Å; C252-N259 PolarHBondContact SG-O 3.36Å; C252-F260 WeakPolarHBondContact O-CD2 3.34Å; C252-R261 HydrophobicContact CB-CB 4.36Å; C252-R261 PolarHBondContact O-N 2.85Å; C252-R261 VanDerWaalsContact O-N 3.07Å; C252-Y264 HydrophobicContact CB-CD1 4.02Å; C252-Y264 HydrophobicContact CB-CD2 3.73Å; C252-Y264 HydrophobicContact CB-CE1 4.09Å; C252-Y264 HydrophobicContact CB-CE2 3.75Å; C252-Y264 HydrophobicContact CB-CG 3.85Å
253	L	86.8	Confident	86	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.005	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-68.1	-33.8	173.7	-74.4	160.5	0	0	0	112.4	I247 A250 H251 Y264 L265 V295 L299	I247-L253 HydrophobicContact CG2-CD1 4.22Å; A250-L253 WeakPolarHBondContact O-CB 3.49Å; A250-L253 PolarHBondContact O-N 3.09Å; A250-L253 VanDerWaalsContact O-N 3.07Å; H251-L253 PolarHBondContact O-N 3.18Å; H251-L253 VanDerWaalsContact O-N 3.13Å; L253-Y264 HydrophobicContact CD2-CD1 4.38Å; L253-Y264 WeakPolarHBondContact CD2-O 3.18Å; L253-Y264 HydrophobicContact CG-CD1 4.11Å; L253-L265 WeakPolarHBondContact O-CD2 3.27Å; L253-V295 HydrophobicContact CB-CG2 4.27Å; L253-V295 HydrophobicContact CD1-CG1 4.15Å; L253-L299 HydrophobicContact CD1-CD2 3.92Å; L253-L299 HydrophobicContact CD1-CG 4.19Å
254	S	86	Confident	85.4	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.079	C	C	.	.			trans	-85.3	130.6	-173.5	176.2	0	0	0	0	111.5	H251 C252 W256 S257 F260 D294	H251-S254 PolarHBondContact O-N 3.16Å; C252-S254 VanDerWaalsContact C-N 3.35Å; S254-W256 PolarHBondContact O-N 3.19Å; S254-W256 PolarHBondContact OG-N 3.12Å; S254-W256 VanDerWaalsContact OG-N 3.15Å; S254-S257 WeakPolarHBondContact O-CB 3.43Å; S254-S257 PolarHBondContact O-N 2.78Å; S254-S257 VanDerWaalsContact O-N 3.15Å; S254-S257 PolarHBondContact O-OG 3.22Å; S254-F260 WeakPolarHBondContact O-CB 3.34Å; S254-F260 WeakPolarHBondContact O-CD2 3.3Å; S254-D294 VanDerWaalsContact CA-OD2 3.24Å; S254-D294 WeakPolarHBondContact CA-OD2 3.25Å; S254-D294 WeakPolarHBondContact CB-OD2 3.44Å; S254-D294 PolarHBondContact OG-OD2 3.38Å
255	Q	77.8	Confident	84.4	Confident	49 Å²	49	18 Å²	18	23%	0.229	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-23.4	172.2	62.6	176.1	-24.8	0	0	112.3	S257 F260	Q255-S257 VanDerWaalsContact C-N 3.28Å; Q255-F260 HydrophobicContact CB-CD2 4.43Å
256	W	74.3	Confident	83.7	Confident	69 Å²	69	18.4 Å²	18.4	26%	0.261	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-12.7	-179.6	-51.7	111.9	0	0	0	112.8	S254 R290 Q708	S254-W256 PolarHBondContact O-N 3.19Å; S254-W256 PolarHBondContact OG-N 3.12Å; S254-W256 VanDerWaalsContact OG-N 3.15Å; W256-R290 HydrophobicContact CG-CG 4.23Å; W256-Q708 PolarHBondContact O-NE2 2.96Å
257	S	81.8	Confident	83.3	Confident	5 Å²	5	18.4 Å²	18.4	4%	0.035	9%	0.085	C	C	.	.	S	Bend	trans	-70.3	156.8	179.9	76.4	0	0	0	0	112.7	H251 S254 Q255 N259 F260	H251-S257 WeakPolarHBondContact O-CB 3.13Å; H251-S257 PolarHBondContact O-OG 3.32Å; S254-S257 WeakPolarHBondContact O-CB 3.43Å; S254-S257 PolarHBondContact O-N 2.78Å; S254-S257 VanDerWaalsContact O-N 3.15Å; S254-S257 PolarHBondContact O-OG 3.22Å; Q255-S257 VanDerWaalsContact C-N 3.28Å; S257-N259 PolarHBondContact O-N 3.5Å; S257-N259 PolarHBondContact OG-N 2.98Å; S257-F260 WeakPolarHBondContact OG-CA 3.43Å; S257-F260 PolarHBondContact OG-N 3.29Å
258	H	75.1	Confident	82.8	Confident	40 Å²	40	18.6 Å²	18.6	19%	0.185	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-15.5	172.2	63.4	-72.3	0	0	0	114.3	H251 S437 E439	H251-H258 AromaticContact CD2-CE1 3.67Å; H251-H258 AromaticContact NE2-CE1 3.59Å; H251-H258 AromaticContact NE2-NE2 3.81Å; H258-S437 WeakPolarHBondContact CB-OG 3.36Å; H258-E439 HydrophobicContact CB-CB 4.34Å; H258-E439 WeakPolarHBondContact CE1-CB 3.37Å; H258-E439 IonicContact CG-OE1 3.94Å; H258-E439 WeakPolarHBondContact ND1-CB 3.27Å; H258-E439 WeakPolarHBondContact ND1-CG 3.49Å; H258-E439 IonicContact ND1-OE1 2.78Å
259	N	82.1	Confident	82.5	Confident	60 Å²	60	21.1 Å²	21.1	32%	0.321	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.4	45.9	-173.5	-172.2	39	0	0	0	111.8	C252 S257 R261	C252-N259 PolarHBondContact SG-O 3.36Å; S257-N259 PolarHBondContact O-N 3.5Å; S257-N259 PolarHBondContact OG-N 2.98Å; N259-R261 PolarHBondContact O-N 3.21Å
260	F	81.8	Confident	82.4	Confident	14 Å²	14	21.2 Å²	21.2	6%	0.061	10%	0.098	C	C	.	.			trans	-57.7	132.3	176.8	170.5	-111.8	0	0	0	111.6	C252 S254 Q255 S257 P262 L265 T565 Y569	C252-F260 WeakPolarHBondContact O-CD2 3.34Å; S254-F260 WeakPolarHBondContact O-CB 3.34Å; S254-F260 WeakPolarHBondContact O-CD2 3.3Å; Q255-F260 HydrophobicContact CB-CD2 4.43Å; S257-F260 WeakPolarHBondContact OG-CA 3.43Å; S257-F260 PolarHBondContact OG-N 3.29Å; F260-P262 HydrophobicContact CE1-CG 3.98Å; F260-P262 HydrophobicContact CZ-CG 4.38Å; F260-L265 HydrophobicContact CE2-CD1 3.76Å; F260-L265 HydrophobicContact CE2-CD2 4.3Å; F260-L265 HydrophobicContact CE2-CG 4.02Å; F260-L265 HydrophobicContact CZ-CD1 3.54Å; F260-L265 HydrophobicContact CZ-CG 4.29Å; F260-T565 HydrophobicContact CE1-CG2 4.22Å; F260-Y569 HydrophobicContact CE1-CE1 4.39Å; F260-Y569 HydrophobicContact CZ-CE1 4.29Å
261	R	81.1	Confident	82.4	Confident	72 Å²	72	21.2 Å²	21.2	27%	0.272	10%	0.098	S	C	.	.			trans	-127.5	114.3	178	-73.9	-171.2	176.6	-151.5	4.1	110.5	E225 C252 N259 C263 Y264	E225-R261 IonicContact OE1-NH1 2.81Å; E225-R261 PolarHBondContact OE1-NH1 2.91Å; C252-R261 HydrophobicContact CB-CB 4.36Å; C252-R261 PolarHBondContact O-N 2.85Å; C252-R261 VanDerWaalsContact O-N 3.07Å; N259-R261 PolarHBondContact O-N 3.21Å; R261-C263 PolarHBondContact O-N 3.45Å; R261-C263 VanDerWaalsContact O-N 3.14Å; R261-Y264 HydrophobicContact CB-CD2 3.66Å; R261-Y264 HydrophobicContact CB-CE2 4.22Å; R261-Y264 WeakPolarHBondContact O-CB 3.17Å; R261-Y264 PolarHBondContact O-N 2.83Å
262	P	76.6	Confident	82.4	Confident	14 Å²	14	24.8 Å²	24.8	9%	0.091	11%	0.111	C	C	.	.	H	α-helix	trans	-54.4	-37.6	-177.3	-25	30.8	0	0	0	114.1	F260 Y264 L265 E564 T565 C568	F260-P262 HydrophobicContact CE1-CG 3.98Å; F260-P262 HydrophobicContact CZ-CG 4.38Å; P262-Y264 PolarHBondContact O-N 3.11Å; P262-Y264 VanDerWaalsContact O-N 3.09Å; P262-L265 WeakPolarHBondContact O-CB 3.21Å; P262-L265 PolarHBondContact O-N 2.93Å; P262-E564 HydrophobicContact CB-CG 4.34Å; P262-T565 HydrophobicContact CG-CG2 4.14Å; P262-T565 WeakPolarHBondContact CG-OG1 3.28Å; P262-C568 HydrophobicContact CB-CB 4.45Å
263	C	78	Confident	82.2	Confident	7 Å²	7	31.2 Å²	31.2	5%	0.047	14%	0.141	C	C	.	.	H	α-helix	trans	-57	-27.1	178.8	60.9	0	0	0	0	113.2	P224 V228 R261 L265 R266 V267	P224-C263 HydrophobicContact CB-CB 4.29Å; V228-C263 HydrophobicContact CG2-CB 4.28Å; R261-C263 PolarHBondContact O-N 3.45Å; R261-C263 VanDerWaalsContact O-N 3.14Å; C263-L265 PolarHBondContact O-N 3.46Å; C263-R266 PolarHBondContact O-N 2.91Å; C263-V267 WeakPolarHBondContact O-CG2 3.43Å; C263-V267 PolarHBondContact O-N 2.94Å; C263-V267 VanDerWaalsContact O-N 3.08Å
264	Y	82.4	Confident	82.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67	-32.9	175.7	-88.1	-103.2	0	0	0	113.2	P175 P224 I247 C252 L253 R261 P262 R266 V267	P175-Y264 HydrophobicContact CB-CE2 4.25Å; P175-Y264 WeakPolarHBondContact CB-OH 3.43Å; P175-Y264 WeakPolarHBondContact CD-OH 3.36Å; P175-Y264 WeakPolarHBondContact CG-OH 3.44Å; P224-Y264 HydrophobicContact CB-CD2 4.19Å; P224-Y264 HydrophobicContact CB-CE2 4.05Å; P224-Y264 HydrophobicContact CG-CD2 3.84Å; P224-Y264 HydrophobicContact CG-CE1 4.38Å; P224-Y264 HydrophobicContact CG-CE2 3.21Å; P224-Y264 VanDerWaalsContact CG-CZ 3.49Å; I247-Y264 HydrophobicContact CG2-CD1 3.96Å; I247-Y264 HydrophobicContact CG2-CE1 3.75Å; C252-Y264 HydrophobicContact CB-CD1 4.02Å; C252-Y264 HydrophobicContact CB-CD2 3.73Å; C252-Y264 HydrophobicContact CB-CE1 4.09Å; C252-Y264 HydrophobicContact CB-CE2 3.75Å; C252-Y264 HydrophobicContact CB-CG 3.85Å; L253-Y264 HydrophobicContact CD2-CD1 4.38Å; L253-Y264 WeakPolarHBondContact CD2-O 3.18Å; L253-Y264 HydrophobicContact CG-CD1 4.11Å; R261-Y264 HydrophobicContact CB-CD2 3.66Å; R261-Y264 HydrophobicContact CB-CE2 4.22Å; R261-Y264 WeakPolarHBondContact O-CB 3.17Å; R261-Y264 PolarHBondContact O-N 2.83Å; P262-Y264 PolarHBondContact O-N 3.11Å; P262-Y264 VanDerWaalsContact O-N 3.09Å; Y264-R266 PolarHBondContact O-N 3.39Å; Y264-V267 WeakPolarHBondContact O-CB 3.46Å; Y264-V267 PolarHBondContact O-N 2.86Å; Y264-V267 VanDerWaalsContact O-N 3.15Å
265	L	75	Confident	82.2	Confident	17 Å²	17	38.5 Å²	38.5	9%	0.089	17%	0.17	C	C	.	.	H	α-helix	trans	-61.1	-38.4	176.4	-61.7	167.8	0	0	0	110.5	L253 F260 P262 C263 C568 L572	L253-L265 WeakPolarHBondContact O-CD2 3.27Å; F260-L265 HydrophobicContact CE2-CD1 3.76Å; F260-L265 HydrophobicContact CE2-CD2 4.3Å; F260-L265 HydrophobicContact CE2-CG 4.02Å; F260-L265 HydrophobicContact CZ-CD1 3.54Å; F260-L265 HydrophobicContact CZ-CG 4.29Å; P262-L265 WeakPolarHBondContact O-CB 3.21Å; P262-L265 PolarHBondContact O-N 2.93Å; C263-L265 PolarHBondContact O-N 3.46Å; L265-C568 HydrophobicContact CD1-CB 4.09Å; L265-L572 HydrophobicContact CB-CD1 4.16Å; L265-L572 HydrophobicContact CD1-CD1 3.51Å; L265-L572 HydrophobicContact CD2-CD1 3.84Å; L265-L572 HydrophobicContact CG-CD1 4.03Å
266	R	81.7	Confident	82.7	Confident	8 Å²	8	38 Å²	38	3%	0.03	18%	0.178	C	C	.	.	H	α-helix	trans	-75.3	-29.7	176.8	-57.8	-178	71.3	-159.8	0.7	113.1	V228 C263 Y264 C268 K269 V270 E564 L580 L581	V228-R266 HydrophobicContact CB-CB 4.45Å; V228-R266 HydrophobicContact CG1-CB 3.92Å; C263-R266 PolarHBondContact O-N 2.91Å; Y264-R266 PolarHBondContact O-N 3.39Å; R266-C268 VanDerWaalsContact C-N 3.34Å; R266-C268 PolarHBondContact O-N 3.37Å; R266-K269 PolarHBondContact O-N 3.07Å; R266-V270 WeakPolarHBondContact O-CB 3.49Å; R266-V270 WeakPolarHBondContact O-CG2 3.39Å; R266-V270 PolarHBondContact O-N 2.97Å; R266-E564 IonicContact NH1-OE1 2.76Å; R266-L580 HydrophobicContact CG-CD2 4.45Å; R266-L580 PolarHBondContact NH2-O 3.28Å; R266-L580 VanDerWaalsContact NH2-O 3.09Å; R266-L581 PolarHBondContact NH2-O 3.35Å
267	V	86.8	Confident	83.5	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-54.7	-51.1	178.4	164.3	0	0	0	0	110.4	V173 P224 L227 V228 I247 C263 Y264 K269 V270 L271	V173-V267 HydrophobicContact CB-CG1 4.43Å; V173-V267 HydrophobicContact CG1-CG1 4.14Å; V173-V267 HydrophobicContact CG1-CG2 4.25Å; V173-V267 HydrophobicContact CG2-CG1 4Å; P224-V267 HydrophobicContact CB-CG2 3.81Å; L227-V267 HydrophobicContact CD2-CB 4.34Å; L227-V267 HydrophobicContact CD2-CG1 3.9Å; L227-V267 HydrophobicContact CD2-CG2 4.18Å; V228-V267 HydrophobicContact CG1-CG2 4.14Å; I247-V267 HydrophobicContact CD1-CG1 3.9Å; C263-V267 WeakPolarHBondContact O-CG2 3.43Å; C263-V267 PolarHBondContact O-N 2.94Å; C263-V267 VanDerWaalsContact O-N 3.08Å; Y264-V267 WeakPolarHBondContact O-CB 3.46Å; Y264-V267 PolarHBondContact O-N 2.86Å; Y264-V267 VanDerWaalsContact O-N 3.15Å; V267-K269 VanDerWaalsContact C-N 3.34Å; V267-K269 PolarHBondContact O-N 3.16Å; V267-V270 PolarHBondContact O-N 2.88Å; V267-L271 HydrophobicContact CG1-CD1 3.6Å; V267-L271 HydrophobicContact CG1-CG 4.28Å; V267-L271 WeakPolarHBondContact O-CB 3.44Å; V267-L271 VanDerWaalsContact O-CG 3.23Å; V267-L271 WeakPolarHBondContact O-CG 3.13Å; V267-L271 PolarHBondContact O-N 3.38Å
268	C	83.5	Confident	83.8	Confident	4 Å²	4	41.1 Å²	41.1	3%	0.027	20%	0.195	C	C	.	.	H	α-helix	trans	-64	-40.5	-177.7	-62.7	0	0	0	0	111.7	R266 L271 R272	R266-C268 VanDerWaalsContact C-N 3.34Å; R266-C268 PolarHBondContact O-N 3.37Å; C268-L271 PolarHBondContact O-N 3.22Å; C268-R272 WeakPolarHBondContact O-CG 3.44Å; C268-R272 PolarHBondContact O-N 3.47Å
269	K	83.9	Confident	84.7	Confident	64 Å²	64	39.7 Å²	39.7	28%	0.278	19%	0.189	S	C	.	.	H	α-helix	trans	-59.6	-52.9	174.5	-178.2	177.9	174.9	172.6	0	111.5	R266 V267 L271 R272 E273 E571	R266-K269 PolarHBondContact O-N 3.07Å; V267-K269 VanDerWaalsContact C-N 3.34Å; V267-K269 PolarHBondContact O-N 3.16Å; K269-L271 VanDerWaalsContact C-N 3.31Å; K269-L271 PolarHBondContact O-N 3.04Å; K269-R272 PolarHBondContact O-N 3.09Å; K269-E273 VanDerWaalsContact CE-CD 3.45Å; K269-E273 WeakPolarHBondContact CE-OE1 3.45Å; K269-E273 WeakPolarHBondContact CE-OE2 3.44Å; K269-E273 VanDerWaalsContact CG-CD 3.45Å; K269-E273 HydrophobicContact CG-CG 4.29Å; K269-E273 WeakPolarHBondContact CG-OE1 3.42Å; K269-E273 WeakPolarHBondContact CG-OE2 3.49Å; K269-E273 WeakPolarHBondContact O-CB 3.33Å; K269-E273 WeakPolarHBondContact O-CG 3.22Å; K269-E273 PolarHBondContact O-N 3.26Å; K269-E571 IonicContact NZ-OE1 2.66Å; K269-E571 PolarHBondContact NZ-OE1 3.23Å
270	V	86.8	Confident	85.3	Confident	18 Å²	18	36.9 Å²	36.9	11%	0.109	17%	0.174	C	C	.	.	H	α-helix	trans	-60.1	-41.1	179.6	168.7	0	0	0	0	111.5	L227 V228 R266 V267 R274 M275	L227-V270 HydrophobicContact CD1-CG1 4.21Å; L227-V270 HydrophobicContact CD2-CG1 4.48Å; L227-V270 HydrophobicContact CG-CG1 4.06Å; V228-V270 HydrophobicContact CG1-CG2 4.2Å; R266-V270 WeakPolarHBondContact O-CB 3.49Å; R266-V270 WeakPolarHBondContact O-CG2 3.39Å; R266-V270 PolarHBondContact O-N 2.97Å; V267-V270 PolarHBondContact O-N 2.88Å; V270-R274 HydrophobicContact CG1-CB 4.43Å; V270-R274 HydrophobicContact CG1-CG 4.49Å; V270-R274 WeakPolarHBondContact O-CA 3.2Å; V270-R274 VanDerWaalsContact O-CB 3.27Å; V270-R274 WeakPolarHBondContact O-CB 3.13Å; V270-R274 PolarHBondContact O-N 3.38Å; V270-M275 PolarHBondContact O-N 3Å
271	L	90.4	Very high	86	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.3	-40.6	177.8	-70.8	173.7	0	0	0	112.4	L171 V173 L227 A245 I247 V267 C268 K269 M275 G276 V277 F280	L171-L271 HydrophobicContact CD1-CD2 3.58Å; V173-L271 HydrophobicContact CG2-CD1 4.3Å; L227-L271 HydrophobicContact CD1-CD2 4.49Å; L227-L271 HydrophobicContact CD2-CD1 4.38Å; L227-L271 HydrophobicContact CD2-CD2 3.93Å; L227-L271 HydrophobicContact CD2-CG 3.94Å; A245-L271 HydrophobicContact CB-CD1 3.84Å; I247-L271 HydrophobicContact CD1-CD1 3.88Å; V267-L271 HydrophobicContact CG1-CD1 3.6Å; V267-L271 HydrophobicContact CG1-CG 4.28Å; V267-L271 WeakPolarHBondContact O-CB 3.44Å; V267-L271 VanDerWaalsContact O-CG 3.23Å; V267-L271 WeakPolarHBondContact O-CG 3.13Å; V267-L271 PolarHBondContact O-N 3.38Å; C268-L271 PolarHBondContact O-N 3.22Å; K269-L271 VanDerWaalsContact C-N 3.31Å; K269-L271 PolarHBondContact O-N 3.04Å; L271-M275 HydrophobicContact CD2-CB 4.47Å; L271-M275 HydrophobicContact CD2-CG 4.22Å; L271-M275 CarbonylContact O-C 3.52Å; L271-M275 WeakPolarHBondContact O-CA 3.35Å; L271-M275 WeakPolarHBondContact O-CB 3.29Å; L271-M275 PolarHBondContact O-N 3.05Å; L271-G276 PolarHBondContact O-N 3.12Å; L271-V277 HydrophobicContact CB-CB 4.26Å; L271-V277 HydrophobicContact CD2-CG2 4.5Å; L271-V277 WeakPolarHBondContact O-CB 3.32Å; L271-V277 PolarHBondContact O-N 2.87Å; L271-F280 HydrophobicContact CB-CE1 3.87Å; L271-F280 HydrophobicContact CB-CZ 4.04Å; L271-F280 HydrophobicContact CD1-CE1 3.8Å; L271-F280 HydrophobicContact CG-CE1 4.5Å
272	R	89.1	Confident	86.6	Confident	79 Å²	79	32.8 Å²	32.8	30%	0.298	16%	0.158	S	C	.	.	H	α-helix	trans	-70	-53.8	177.1	-70.7	-179.3	-174.7	116.4	2.7	111.9	C268 K269 G276 V277 F280 H298	C268-R272 WeakPolarHBondContact O-CG 3.44Å; C268-R272 PolarHBondContact O-N 3.47Å; K269-R272 PolarHBondContact O-N 3.09Å; R272-G276 WeakPolarHBondContact O-CA 3.28Å; R272-G276 PolarHBondContact O-N 3.46Å; R272-V277 WeakPolarHBondContact CG-O 3.47Å; R272-F280 HydrophobicContact CG-CE2 3.86Å; R272-F280 HydrophobicContact CG-CZ 3.72Å; R272-H298 PolarHBondContact NH1-O 2.94Å; R272-H298 PolarHBondContact NH2-O 2.91Å
273	E	86.3	Confident	87.4	Confident	135 Å²	135	32.1 Å²	32.1	63%	0.631	15%	0.154	S	C	*	.	H	α-helix	trans	-79.4	-40.9	-169.8	-65.8	175.7	-177.8	0	0	113.2	K269	K269-E273 VanDerWaalsContact CE-CD 3.45Å; K269-E273 WeakPolarHBondContact CE-OE1 3.45Å; K269-E273 WeakPolarHBondContact CE-OE2 3.44Å; K269-E273 VanDerWaalsContact CG-CD 3.45Å; K269-E273 HydrophobicContact CG-CG 4.29Å; K269-E273 WeakPolarHBondContact CG-OE1 3.42Å; K269-E273 WeakPolarHBondContact CG-OE2 3.49Å; K269-E273 WeakPolarHBondContact O-CB 3.33Å; K269-E273 WeakPolarHBondContact O-CG 3.22Å; K269-E273 PolarHBondContact O-N 3.26Å
274	R	85.3	Confident	87.9	Confident	138 Å²	138	31.8 Å²	31.8	52%	0.521	15%	0.152	S	C	.	.	H	α-helix	trans	-96.2	-27.4	-175.1	-57.2	-167	-179.5	-164.1	-2.8	113.8	V270	V270-R274 HydrophobicContact CG1-CB 4.43Å; V270-R274 HydrophobicContact CG1-CG 4.49Å; V270-R274 WeakPolarHBondContact O-CA 3.2Å; V270-R274 VanDerWaalsContact O-CB 3.27Å; V270-R274 WeakPolarHBondContact O-CB 3.13Å; V270-R274 PolarHBondContact O-N 3.38Å
275	M	87.3	Confident	88.1	Confident	15 Å²	15	32.3 Å²	32.3	7%	0.074	16%	0.156	C	C	.	.	H	α-helix	trans	-110.4	-6.5	-174.4	-53.4	-64	-60.5	0	0	113.5	L171 L233 L239 V242 V270 L271 V277	L171-M275 HydrophobicContact CD1-CE 4.24Å; L233-M275 HydrophobicContact CB-SD 4.35Å; L233-M275 HydrophobicContact CD1-CE 3.86Å; L233-M275 HydrophobicContact CD1-SD 4.14Å; L239-M275 HydrophobicContact CD1-CE 3.52Å; L239-M275 HydrophobicContact CD1-SD 4.49Å; V242-M275 HydrophobicContact CG2-CE 4.19Å; V270-M275 PolarHBondContact O-N 3Å; L271-M275 HydrophobicContact CD2-CB 4.47Å; L271-M275 HydrophobicContact CD2-CG 4.22Å; L271-M275 CarbonylContact O-C 3.52Å; L271-M275 WeakPolarHBondContact O-CA 3.35Å; L271-M275 WeakPolarHBondContact O-CB 3.29Å; L271-M275 PolarHBondContact O-N 3.05Å; M275-V277 HydrophobicContact CB-CG2 3.87Å; M275-V277 PolarHBondContact O-N 3.5Å
276	G	87.3	Confident	88.5	Confident	40 Å²	40	31.7 Å²	31.7	41%	0.412	15%	0.153	S	C	.	.			trans	65.7	22.3	-179.8	0	0	0	0	0	113.9	L271 R272	L271-G276 PolarHBondContact O-N 3.12Å; R272-G276 WeakPolarHBondContact O-CA 3.28Å; R272-G276 PolarHBondContact O-N 3.46Å
277	V	91.3	Very high	88.7	Confident	3 Å²	3	31.7 Å²	31.7	2%	0.018	16%	0.155	C	C	.	.			trans	-84.4	123.8	-176.9	-177	0	0	0	0	110	V242 A245 L271 R272 M275 C279 F280	V242-V277 HydrophobicContact CB-CG2 3.93Å; V242-V277 HydrophobicContact CG1-CG2 3.57Å; V242-V277 HydrophobicContact CG2-CG2 4.47Å; A245-V277 HydrophobicContact CB-CG1 3.76Å; L271-V277 HydrophobicContact CB-CB 4.26Å; L271-V277 HydrophobicContact CD2-CG2 4.5Å; L271-V277 WeakPolarHBondContact O-CB 3.32Å; L271-V277 PolarHBondContact O-N 2.87Å; R272-V277 WeakPolarHBondContact CG-O 3.47Å; M275-V277 HydrophobicContact CB-CG2 3.87Å; M275-V277 PolarHBondContact O-N 3.5Å; V277-C279 WeakPolarHBondContact CG1-O 3.28Å; V277-F280 HydrophobicContact CB-CZ 4.21Å; V277-F280 HydrophobicContact CG1-CE1 4.09Å; V277-F280 HydrophobicContact CG1-CE2 4.38Å; V277-F280 HydrophobicContact CG1-CZ 3.98Å; V277-F280 WeakPolarHBondContact O-CE2 3.42Å; V277-F280 WeakPolarHBondContact O-CZ 3.11Å
278	H	87.4	Confident	88.8	Confident	136 Å²	136	32.3 Å²	32.3	63%	0.63	16%	0.159	S	C	*	.			trans	-119.3	-18.1	178.7	-60.7	-10.6	0	0	0	113.3	S140	S140-H278 PolarHBondContact OG-O 3.27Å
279	C	94.3	Very high	88.8	Confident	10 Å²	10	37 Å²	37	7%	0.068	18%	0.176	C	C	.	.			trans	-97.9	118.2	174.1	-176.2	0	0	0	0	110.6	F244 A245 V277	F244-C279 WeakPolarHBondContact CA-O 3.36Å; F244-C279 HydrophobicContact CB-CB 4.02Å; F244-C279 WeakPolarHBondContact CB-O 3.43Å; A245-C279 PolarHBondContact N-O 3.38Å; V277-C279 WeakPolarHBondContact CG1-O 3.28Å
280	F	95.4	Very high	88.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	133.6	-178.6	-65.9	-87.2	0	0	0	111.9	S140 T141 A245 I247 L271 R272 V277 L299	S140-F280 CarbonylContact C-O 3.39Å; S140-F280 WeakPolarHBondContact CA-O 3.45Å; S140-F280 WeakPolarHBondContact CB-O 3.32Å; S140-F280 PolarHBondContact OG-N 3.42Å; T141-F280 PolarHBondContact N-O 3.38Å; A245-F280 HydrophobicContact CB-CD1 4.11Å; A245-F280 HydrophobicContact CB-CE1 4.18Å; A245-F280 CarbonylContact O-C 3.34Å; A245-F280 WeakPolarHBondContact O-CA 3.31Å; I247-F280 HydrophobicContact CG1-CD1 4.37Å; L271-F280 HydrophobicContact CB-CE1 3.87Å; L271-F280 HydrophobicContact CB-CZ 4.04Å; L271-F280 HydrophobicContact CD1-CE1 3.8Å; L271-F280 HydrophobicContact CG-CE1 4.5Å; R272-F280 HydrophobicContact CG-CE2 3.86Å; R272-F280 HydrophobicContact CG-CZ 3.72Å; V277-F280 HydrophobicContact CB-CZ 4.21Å; V277-F280 HydrophobicContact CG1-CE1 4.09Å; V277-F280 HydrophobicContact CG1-CE2 4.38Å; V277-F280 HydrophobicContact CG1-CZ 3.98Å; V277-F280 WeakPolarHBondContact O-CE2 3.42Å; V277-F280 WeakPolarHBondContact O-CZ 3.11Å; F280-L299 HydrophobicContact CB-CD2 4.07Å; F280-L299 HydrophobicContact CD1-CD2 4.4Å; F280-L299 HydrophobicContact CG-CD2 4.29Å
281	L	96.2	Very high	88.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	106.4	168.4	176.4	60.1	0	0	0	109.2	I135 T141 C154 F244 A245 C246 I247 L283	I135-L281 HydrophobicContact CD1-CB 3.7Å; I135-L281 HydrophobicContact CD1-CD1 4.28Å; I135-L281 HydrophobicContact CD1-CG 4.48Å; I135-L281 HydrophobicContact CG1-CB 4.09Å; I135-L281 HydrophobicContact CG1-CD1 4.1Å; I135-L281 HydrophobicContact CG1-CD2 4.43Å; I135-L281 HydrophobicContact CG1-CG 4.43Å; T141-L281 HydrophobicContact CG2-CD1 3.45Å; T141-L281 VanDerWaalsContact CG2-CD1 3.45Å; T141-L281 WeakPolarHBondContact O-CA 3.41Å; C154-L281 HydrophobicContact CB-CD2 4.13Å; C154-L281 VanDerWaalsContact O-CD2 3.28Å; C154-L281 WeakPolarHBondContact O-CD2 3.14Å; F244-L281 HydrophobicContact CD2-CB 4.29Å; F244-L281 HydrophobicContact CE2-CB 4.35Å; F244-L281 HydrophobicContact CE2-CD2 4.28Å; A245-L281 PolarHBondContact O-N 3.21Å; C246-L281 CarbonylContact C-O 3.39Å; C246-L281 WeakPolarHBondContact CA-O 3.46Å; C246-L281 HydrophobicContact CB-CB 4.4Å; C246-L281 HydrophobicContact CB-CD2 4.49Å; I247-L281 PolarHBondContact N-O 2.81Å; L281-L283 HydrophobicContact CD1-CD2 3.82Å; L281-L283 HydrophobicContact CD1-CG 4.45Å; L281-L283 HydrophobicContact CD2-CD1 4.29Å; L281-L283 HydrophobicContact CD2-CD2 4.18Å; L281-L283 HydrophobicContact CD2-CG 4.29Å; L281-L283 HydrophobicContact CG-CD2 3.89Å; L281-L283 HydrophobicContact CG-CG 4Å
282	G	94.5	Very high	88.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	126.4	171	0	0	0	0	0	110.8	T141 L142 L143	T141-G282 PolarHBondContact O-N 3.02Å; L142-G282 WeakPolarHBondContact CA-O 3.48Å; L143-G282 PolarHBondContact N-O 3Å
283	L	92.1	Very high	88.9	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.9	175.1	-59.7	-180	0	0	0	109.9	L143 K151 C154 Y155 C246 I247 E249 A250 L281	L143-L283 HydrophobicContact CB-CD2 3.93Å; L143-L283 HydrophobicContact CD2-CD2 4.12Å; L143-L283 HydrophobicContact CG-CD2 4.49Å; K151-L283 HydrophobicContact CB-CD1 4.32Å; K151-L283 HydrophobicContact CD-CB 4.35Å; K151-L283 WeakPolarHBondContact O-CD1 3.38Å; C154-L283 HydrophobicContact CB-CD2 4.08Å; Y155-L283 HydrophobicContact CD1-CD1 3.92Å; C246-L283 VanDerWaalsContact SG-CD1 3.54Å; I247-L283 PolarHBondContact O-N 2.97Å; E249-L283 WeakPolarHBondContact CA-O 3.3Å; E249-L283 PolarHBondContact N-O 3.21Å; A250-L283 PolarHBondContact N-O 3.16Å; L281-L283 HydrophobicContact CD1-CD2 3.82Å; L281-L283 HydrophobicContact CD1-CG 4.45Å; L281-L283 HydrophobicContact CD2-CD1 4.29Å; L281-L283 HydrophobicContact CD2-CD2 4.18Å; L281-L283 HydrophobicContact CD2-CG 4.29Å; L281-L283 HydrophobicContact CG-CD2 3.89Å; L281-L283 HydrophobicContact CG-CG 4Å
284	T	89.6	Confident	88.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	149.8	173.1	-176.5	0	0	0	0	111.7	L142 L143 V144 L145 H251 T286 A287	L142-T284 HydrophobicContact CD1-CG2 4.42Å; L143-T284 PolarHBondContact O-N 3.07Å; L143-T284 VanDerWaalsContact O-N 3.16Å; V144-T284 WeakPolarHBondContact CA-O 3.41Å; V144-T284 HydrophobicContact CB-CG2 4.35Å; V144-T284 HydrophobicContact CG1-CG2 4.23Å; V144-T284 HydrophobicContact CG2-CG2 3.82Å; L145-T284 PolarHBondContact N-O 2.95Å; H251-T284 WeakPolarHBondContact CB-OG1 3.28Å; H251-T284 PolarHBondContact ND1-OG1 3.31Å; T284-T286 PolarHBondContact OG1-N 2.81Å; T284-A287 HydrophobicContact CG2-CB 3.77Å
285	A	85.1	Confident	89.2	Confident	12 Å²	12	23.8 Å²	23.8	10%	0.099	13%	0.126	C	C	.	.	S	Bend	trans	-92.6	-30.8	175.5	0	0	0	0	0	114.3	L145 T147 K151	L145-A285 WeakPolarHBondContact O-CA 3.46Å; T147-A285 HydrophobicContact CG2-CB 3.72Å; K151-A285 VanDerWaalsContact NZ-CB 3.31Å
286	T	83.8	Confident	89.3	Confident	4 Å²	4	23.3 Å²	23.3	3%	0.025	12%	0.124	C	C	.	.	S	Bend	trans	-139.6	88.6	-164.4	43.1	0	0	0	0	109	T284 V442 Q443	T284-T286 PolarHBondContact OG1-N 2.81Å; T286-V442 HydrophobicContact CG2-CG1 4.38Å; T286-Q443 HydrophobicContact CG2-CB 3.86Å; T286-Q443 HydrophobicContact CG2-CG 4.36Å
287	A	87.4	Confident	89.4	Confident	8 Å²	8	28.6 Å²	28.6	7%	0.066	14%	0.138	C	C	.	.			trans	-137.6	130.9	175.5	0	0	0	0	0	109.2	V144 T284 T291 A292	V144-A287 HydrophobicContact CG1-CB 4.4Å; T284-A287 HydrophobicContact CG2-CB 3.77Å; A287-T291 HydrophobicContact CB-CG2 3.94Å; A287-A292 HydrophobicContact CB-CB 4.36Å
288	T	87.3	Confident	89.2	Confident	13 Å²	13	31 Å²	31	8%	0.08	15%	0.149	C	C	.	.			trans	-67.8	163.6	164.7	61.7	0	0	0	0	109.7	R290 T291 A292 Y750 F751	T288-R290 VanDerWaalsContact C-N 3.27Å; T288-R290 PolarHBondContact O-N 3.3Å; T288-T291 WeakPolarHBondContact O-CB 3.41Å; T288-T291 PolarHBondContact O-N 2.98Å; T288-T291 PolarHBondContact OG1-N 3.49Å; T288-T291 PolarHBondContact OG1-OG1 3.32Å; T288-A292 WeakPolarHBondContact O-CB 3.27Å; T288-A292 PolarHBondContact O-N 3.49Å; T288-Y750 HydrophobicContact CG2-CD1 4.26Å; T288-Y750 HydrophobicContact CG2-CE1 3.61Å; T288-Y750 HydrophobicContact CG2-CE2 4.38Å; T288-F751 HydrophobicContact CG2-CD1 4.17Å
289	R	85	Confident	89.2	Confident	101 Å²	101	24.5 Å²	24.5	38%	0.381	12%	0.119	S	C	.	.	H	α-helix	trans	-53.6	-43.8	174.6	-72	-169.8	-179.5	-145.3	2.6	112.9	T291 A292 S293 F751 E752 E754	R289-T291 PolarHBondContact O-N 3.22Å; R289-A292 PolarHBondContact O-N 2.86Å; R289-S293 WeakPolarHBondContact O-CB 3.32Å; R289-S293 PolarHBondContact O-N 3.45Å; R289-F751 PolarHBondContact N-O 3.16Å; R289-E752 VanDerWaalsContact CD-O 3.22Å; R289-E752 WeakPolarHBondContact CD-O 3.36Å; R289-E752 PolarHBondContact NE-O 2.85Å; R289-E754 HydrophobicContact CB-CG 3.88Å; R289-E754 VanDerWaalsContact CD-CG 3.44Å; R289-E754 VanDerWaalsContact CD-OE1 3.27Å; R289-E754 WeakPolarHBondContact CD-OE1 3.5Å; R289-E754 HydrophobicContact CG-CG 4.34Å; R289-E754 IonicContact CZ-OE1 3.88Å; R289-E754 IonicContact NE-OE1 3.15Å; R289-E754 IonicContact NH1-OE1 2.96Å; R289-E754 PolarHBondContact NH1-OE1 2.52Å
290	R	84.6	Confident	88.9	Confident	90 Å²	90	27.9 Å²	27.9	34%	0.34	15%	0.147	S	C	.	.	H	α-helix	trans	-57.9	-45.8	173.7	-177.2	178.5	-177.4	160.3	5.8	113	W256 T288 A292 D294	W256-R290 HydrophobicContact CG-CG 4.23Å; T288-R290 VanDerWaalsContact C-N 3.27Å; T288-R290 PolarHBondContact O-N 3.3Å; R290-A292 VanDerWaalsContact C-N 3.35Å; R290-D294 WeakPolarHBondContact O-CB 3.37Å; R290-D294 PolarHBondContact O-N 3.28Å; R290-D294 VanDerWaalsContact O-N 3.12Å
291	T	88.3	Confident	88.6	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.006	15%	0.151	C	C	.	.	H	α-helix	trans	-64.4	-42.7	177.7	-57.1	0	0	0	0	110.4	H251 A287 T288 R289 D294 V295	H251-T291 HydrophobicContact CB-CG2 3.98Å; A287-T291 HydrophobicContact CB-CG2 3.94Å; T288-T291 WeakPolarHBondContact O-CB 3.41Å; T288-T291 PolarHBondContact O-N 2.98Å; T288-T291 PolarHBondContact OG1-N 3.49Å; T288-T291 PolarHBondContact OG1-OG1 3.32Å; R289-T291 PolarHBondContact O-N 3.22Å; T291-D294 PolarHBondContact O-N 3.36Å; T291-V295 WeakPolarHBondContact O-CG2 3.45Å; T291-V295 PolarHBondContact O-N 2.85Å
292	A	89.4	Confident	87.8	Confident	3 Å²	3	31.6 Å²	31.6	3%	0.025	18%	0.176	C	C	.	.	H	α-helix	trans	-66.7	-42.4	-179.6	0	0	0	0	0	112.4	L142 V144 A287 T288 R289 R290 V295 A296	L142-A292 HydrophobicContact CD2-CB 4.11Å; L142-A292 WeakPolarHBondContact CD2-O 3.42Å; V144-A292 HydrophobicContact CG2-CB 4.16Å; A287-A292 HydrophobicContact CB-CB 4.36Å; T288-A292 WeakPolarHBondContact O-CB 3.27Å; T288-A292 PolarHBondContact O-N 3.49Å; R289-A292 PolarHBondContact O-N 2.86Å; R290-A292 VanDerWaalsContact C-N 3.35Å; A292-V295 PolarHBondContact O-N 3.21Å; A292-A296 WeakPolarHBondContact O-CB 3.39Å; A292-A296 PolarHBondContact O-N 3.32Å
293	S	88.5	Confident	86.8	Confident	45 Å²	45	38.2 Å²	38.2	32%	0.315	21%	0.207	S	C	.	.	H	α-helix	trans	-58.4	-49.2	173.8	172.1	0	0	0	0	111.7	R289 V295 A296 Q297 E303	R289-S293 WeakPolarHBondContact O-CB 3.32Å; R289-S293 PolarHBondContact O-N 3.45Å; S293-V295 VanDerWaalsContact C-N 3.34Å; S293-V295 PolarHBondContact O-N 3.09Å; S293-A296 WeakPolarHBondContact O-CB 3.42Å; S293-A296 PolarHBondContact O-N 2.77Å; S293-A296 VanDerWaalsContact O-N 3.11Å; S293-Q297 PolarHBondContact O-N 3.12Å; S293-E303 WeakPolarHBondContact CB-OE1 3.32Å; S293-E303 PolarHBondContact OG-OE1 3.48Å
294	D	87.9	Confident	85.7	Confident	19 Å²	19	40.8 Å²	40.8	10%	0.102	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-40.6	177.5	-168	41.9	0	0	0	111.9	S254 R290 T291 Q297 H298	S254-D294 VanDerWaalsContact CA-OD2 3.24Å; S254-D294 WeakPolarHBondContact CA-OD2 3.25Å; S254-D294 WeakPolarHBondContact CB-OD2 3.44Å; S254-D294 PolarHBondContact OG-OD2 3.38Å; R290-D294 WeakPolarHBondContact O-CB 3.37Å; R290-D294 PolarHBondContact O-N 3.28Å; R290-D294 VanDerWaalsContact O-N 3.12Å; T291-D294 PolarHBondContact O-N 3.36Å; D294-Q297 PolarHBondContact O-N 3.26Å; D294-H298 PolarHBondContact O-CD2 3.45Å; D294-H298 VanDerWaalsContact O-CD2 3.26Å; D294-H298 PolarHBondContact O-N 2.86Å; D294-H298 VanDerWaalsContact O-N 3.09Å
295	V	90.3	Very high	84.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.4	-43.8	173.3	173	0	0	0	0	111.3	L142 A250 L253 T291 A292 S293 Q297 H298 L299	L142-V295 HydrophobicContact CD1-CG1 3.72Å; L142-V295 HydrophobicContact CD2-CB 4.04Å; L142-V295 HydrophobicContact CD2-CG1 3.9Å; L142-V295 HydrophobicContact CG-CG1 4.42Å; A250-V295 HydrophobicContact CB-CG1 3.86Å; A250-V295 VanDerWaalsContact O-CG2 3.26Å; A250-V295 WeakPolarHBondContact O-CG2 3.29Å; L253-V295 HydrophobicContact CB-CG2 4.27Å; L253-V295 HydrophobicContact CD1-CG1 4.15Å; T291-V295 WeakPolarHBondContact O-CG2 3.45Å; T291-V295 PolarHBondContact O-N 2.85Å; A292-V295 PolarHBondContact O-N 3.21Å; S293-V295 VanDerWaalsContact C-N 3.34Å; S293-V295 PolarHBondContact O-N 3.09Å; V295-Q297 VanDerWaalsContact C-N 3.31Å; V295-Q297 PolarHBondContact O-N 3.41Å; V295-H298 PolarHBondContact O-N 3.21Å; V295-L299 HydrophobicContact CG1-CD1 3.83Å; V295-L299 HydrophobicContact CG1-CG 4.28Å; V295-L299 WeakPolarHBondContact O-CG 3.49Å; V295-L299 PolarHBondContact O-N 3.02Å
296	A	90.4	Very high	83.1	Confident	5 Å²	5	50.3 Å²	50.3	4%	0.041	28%	0.275	C	S	.	.	H	α-helix	trans	-61	-41.9	178.8	0	0	0	0	0	111.1	L142 A292 S293 H298 L299 A300 V301	L142-A296 HydrophobicContact CD2-CB 4.18Å; A292-A296 WeakPolarHBondContact O-CB 3.39Å; A292-A296 PolarHBondContact O-N 3.32Å; S293-A296 WeakPolarHBondContact O-CB 3.42Å; S293-A296 PolarHBondContact O-N 2.77Å; S293-A296 VanDerWaalsContact O-N 3.11Å; A296-H298 PolarHBondContact O-N 2.87Å; A296-L299 CarbonylContact O-C 3.51Å; A296-L299 PolarHBondContact O-N 3.33Å; A296-A300 PolarHBondContact O-N 2.94Å; A296-V301 HydrophobicContact CB-CB 4.23Å; A296-V301 PolarHBondContact O-N 2.83Å
297	Q	88.9	Confident	81.9	Confident	151 Å²	151	50.5 Å²	50.5	71%	0.706	28%	0.275	S	S	*	.	H	α-helix	trans	-58.6	-48.3	173.3	-173.6	-179.3	2.7	0	0	111.6	S293 D294 V295 L299 A300	S293-Q297 PolarHBondContact O-N 3.12Å; D294-Q297 PolarHBondContact O-N 3.26Å; V295-Q297 VanDerWaalsContact C-N 3.31Å; V295-Q297 PolarHBondContact O-N 3.41Å; Q297-L299 VanDerWaalsContact C-N 3.27Å; Q297-L299 PolarHBondContact O-N 3.09Å; Q297-A300 PolarHBondContact O-N 3.06Å; Q297-A300 VanDerWaalsContact O-N 3.12Å
298	H	86.3	Confident	80.9	Confident	53 Å²	53	53.9 Å²	53.9	25%	0.245	29%	0.289	C	S	.	.	H	α-helix	trans	-61.7	-33.7	177.6	-85.8	-64	0	0	0	113.5	R272 D294 V295 A296 A300	R272-H298 PolarHBondContact NH1-O 2.94Å; R272-H298 PolarHBondContact NH2-O 2.91Å; D294-H298 PolarHBondContact O-CD2 3.45Å; D294-H298 VanDerWaalsContact O-CD2 3.26Å; D294-H298 PolarHBondContact O-N 2.86Å; D294-H298 VanDerWaalsContact O-N 3.09Å; V295-H298 PolarHBondContact O-N 3.21Å; A296-H298 PolarHBondContact O-N 2.87Å; H298-A300 VanDerWaalsContact C-N 3.35Å
299	L	88.7	Confident	79.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-86.7	-3.9	178.5	-63.1	-179.2	0	0	0	113.4	I247 L253 F280 V295 A296 Q297 V301	I247-L299 HydrophobicContact CG1-CD2 4.2Å; L253-L299 HydrophobicContact CD1-CD2 3.92Å; L253-L299 HydrophobicContact CD1-CG 4.19Å; F280-L299 HydrophobicContact CB-CD2 4.07Å; F280-L299 HydrophobicContact CD1-CD2 4.4Å; F280-L299 HydrophobicContact CG-CD2 4.29Å; V295-L299 HydrophobicContact CG1-CD1 3.83Å; V295-L299 HydrophobicContact CG1-CG 4.28Å; V295-L299 WeakPolarHBondContact O-CG 3.49Å; V295-L299 PolarHBondContact O-N 3.02Å; A296-L299 CarbonylContact O-C 3.51Å; A296-L299 PolarHBondContact O-N 3.33Å; Q297-L299 VanDerWaalsContact C-N 3.27Å; Q297-L299 PolarHBondContact O-N 3.09Å; L299-V301 VanDerWaalsContact C-N 3.31Å; L299-V301 HydrophobicContact CB-CG2 3.71Å
300	A	87.9	Confident	78.2	Confident	80 Å²	80	53.7 Å²	53.7	66%	0.661	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	44.8	-171.9	0	0	0	0	0	112.5	A296 Q297 H298	A296-A300 PolarHBondContact O-N 2.94Å; Q297-A300 PolarHBondContact O-N 3.06Å; Q297-A300 VanDerWaalsContact O-N 3.12Å; H298-A300 VanDerWaalsContact C-N 3.35Å
301	V	87.8	Confident	77	Confident	14 Å²	14	52.5 Å²	52.5	9%	0.085	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-102.9	132.7	177.7	178.6	0	0	0	0	108.5	A296 L299	A296-V301 HydrophobicContact CB-CB 4.23Å; A296-V301 PolarHBondContact O-N 2.83Å; L299-V301 VanDerWaalsContact C-N 3.31Å; L299-V301 HydrophobicContact CB-CG2 3.71Å
302	A	81.3	Confident	76.1	Confident	64 Å²	64	54 Å²	54	53%	0.529	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-62.8	138.9	171.4	0	0	0	0	0	110.6	E304	A302-E304 PolarHBondContact O-N 2.81Å
303	E	72.1	Confident	75.8	Confident	139 Å²	139	54.6 Å²	54.6	65%	0.65	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-64.3	123.8	175.5	-70.5	-167.7	163.5	0	0	110.4	S293	S293-E303 WeakPolarHBondContact CB-OE1 3.32Å; S293-E303 PolarHBondContact OG-OE1 3.48Å
304	E	70.1	Confident	75.7	Confident	55 Å²	55	54.7 Å²	54.7	26%	0.257	33%	0.328	S	S	.	.			trans	-134.3	119.8	176.1	-74.3	-175.4	-166.3	0	0	110.1	R130 R134 A302 D306 L307	R130-E304 IonicContact CZ-OE2 3.36Å; R130-E304 IonicContact NE-OE2 3.38Å; R130-E304 PolarHBondContact NE-OE2 3.45Å; R130-E304 VanDerWaalsContact NH2-CD 3.34Å; R130-E304 IonicContact NH2-OE1 3.86Å; R130-E304 IonicContact NH2-OE2 2.68Å; R130-E304 PolarHBondContact NH2-OE2 2.84Å; R134-E304 IonicContact CZ-OE1 2.73Å; R134-E304 IonicContact NH1-OE1 3.72Å; R134-E304 PolarHBondContact NH1-OE1 3.26Å; R134-E304 IonicContact NH1-OE2 3.81Å; R134-E304 PolarHBondContact NH1-OE2 3.4Å; A302-E304 PolarHBondContact O-N 2.81Å; E304-D306 PolarHBondContact O-N 2.86Å; E304-L307 HydrophobicContact CB-CD1 4.09Å; E304-L307 HydrophobicContact CB-CG 4.42Å; E304-L307 PolarHBondContact O-N 3.13Å
305	P	62.4	Low	75.7	Confident	104 Å²	104	59.8 Å²	59.8	68%	0.675	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-66.1	-27.8	-179.6	24.2	-31.6	0	0	0	112.6	L307 H308	P305-L307 PolarHBondContact O-N 2.92Å; P305-L307 VanDerWaalsContact O-N 3.14Å; P305-H308 PolarHBondContact O-N 3.49Å
306	D	56.3	Low	75.9	Confident	108 Å²	108	61 Å²	61	58%	0.578	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-68.8	-7.2	-177.7	-74.5	-16.8	0	0	0	115	R130 E304	R130-D306 IonicContact CZ-OD2 3.76Å; R130-D306 IonicContact NH1-OD2 2.78Å; R130-D306 PolarHBondContact NH1-OD2 3.18Å; R130-D306 IonicContact NH2-OD2 3.97Å; E304-D306 PolarHBondContact O-N 2.86Å
307	L	59.6	Low	76	Confident	8 Å²	8	60.8 Å²	60.8	4%	0.042	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-101.3	6	179.6	-66.2	170.5	0	0	0	113.2	R130 T141 L142 L143 V144 E304 P305	R130-L307 HydrophobicContact CG-CD2 4.45Å; T141-L307 VanDerWaalsContact OG1-CD1 3.26Å; T141-L307 WeakPolarHBondContact OG1-CD1 3.49Å; L142-L307 WeakPolarHBondContact O-CB 3.35Å; L143-L307 HydrophobicContact CD1-CD2 4.33Å; V144-L307 PolarHBondContact N-O 2.86Å; E304-L307 HydrophobicContact CB-CD1 4.09Å; E304-L307 HydrophobicContact CB-CG 4.42Å; E304-L307 PolarHBondContact O-N 3.13Å; P305-L307 PolarHBondContact O-N 2.92Å; P305-L307 VanDerWaalsContact O-N 3.14Å
308	H	65.6	Low	76.4	Confident	78 Å²	78	54.9 Å²	54.9	36%	0.361	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-87.4	117.7	164.2	-69.1	-86.3	0	0	0	109.4	P305	P305-H308 PolarHBondContact O-N 3.49Å
309	G	57.3	Low	76.9	Confident	24 Å²	24	52.5 Å²	52.5	25%	0.247	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-62.5	171.6	172.7	0	0	0	0	0	112.9	V144	V144-G309 PolarHBondContact O-N 3.05Å
310	P	58.1	Low	77.3	Confident	87 Å²	87	52.8 Å²	52.8	57%	0.565	33%	0.328	S	S	*	.	S	Bend	trans	-60.6	172.7	-179.2	26.6	-35.2	0	0	0	113.1
311	A	61	Low	77.8	Confident	65 Å²	65	49.1 Å²	49.1	54%	0.537	30%	0.297	S	S	.	.			trans	-34.6	135.5	-175.2	0	0	0	0	0	114.3	V313	A311-V313 PolarHBondContact O-N 3.11Å
312	P	68.9	Low	78.3	Confident	33 Å²	33	48.4 Å²	48.4	21%	0.214	29%	0.293	C	S	.	.	S	Bend	trans	-59.2	-25	-170.3	-21.3	28.3	0	0	0	114.9	V442 F751	P312-V442 HydrophobicContact CB-CG1 4.23Å; P312-V442 WeakPolarHBondContact O-CG1 3.39Å; P312-F751 HydrophobicContact CB-CD2 3.67Å; P312-F751 HydrophobicContact CB-CE2 4.11Å; P312-F751 HydrophobicContact CB-CG 4.18Å; P312-F751 HydrophobicContact CG-CB 3.62Å; P312-F751 HydrophobicContact CG-CD2 3.5Å; P312-F751 VanDerWaalsContact CG-CD2 3.5Å; P312-F751 HydrophobicContact CG-CE2 4.41Å; P312-F751 HydrophobicContact CG-CG 3.71Å
313	V	83.4	Confident	79	Confident	15 Å²	15	47.3 Å²	47.3	9%	0.091	28%	0.277	C	S	.	.	S	Bend	trans	-120.5	120.2	-178.2	-172.6	0	0	0	0	109.9	A311 L317 V442 K744 L747	A311-V313 PolarHBondContact O-N 3.11Å; V313-L317 HydrophobicContact CG1-CB 4.31Å; V313-L317 HydrophobicContact CG1-CD2 4.28Å; V313-V442 HydrophobicContact CG2-CG1 4.45Å; V313-V442 HydrophobicContact CG2-CG2 3.99Å; V313-K744 HydrophobicContact CB-CG 4.36Å; V313-K744 HydrophobicContact CG1-CD 4.13Å; V313-K744 HydrophobicContact CG1-CG 3.97Å; V313-L747 HydrophobicContact CG2-CB 4.28Å; V313-L747 HydrophobicContact CG2-CD1 3.94Å
314	P	85.8	Confident	80.1	Confident	47 Å²	47	41.3 Å²	41.3	31%	0.305	25%	0.25	S	C	.	.			trans	-63.9	151.2	178.5	-20.1	30.6	0	0	0	113.2	N316 L317	P314-N316 VanDerWaalsContact C-N 3.32Å; P314-N316 WeakPolarHBondContact CB-OD1 3.36Å; P314-N316 PolarHBondContact O-N 3.05Å; P314-L317 HydrophobicContact CB-CD1 4.02Å; P314-L317 HydrophobicContact CG-CD1 4.12Å; P314-L317 PolarHBondContact O-N 3.34Å
315	T	88.4	Confident	81.2	Confident	125 Å²	125	50 Å²	50	77%	0.767	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-29.1	-176.6	52.1	0	0	0	0	113.5	L317	T315-L317 PolarHBondContact O-N 3.2Å
316	N	92.7	Very high	82.8	Confident	27 Å²	27	48.9 Å²	48.9	14%	0.144	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-5.1	178.1	64.5	-58.6	0	0	0	114	P314 H318 G449 G452 Q453 A455	P314-N316 VanDerWaalsContact C-N 3.32Å; P314-N316 WeakPolarHBondContact CB-OD1 3.36Å; P314-N316 PolarHBondContact O-N 3.05Å; N316-H318 PolarHBondContact O-CE1 3.26Å; N316-H318 PolarHBondContact O-ND1 2.96Å; N316-G449 WeakPolarHBondContact ND2-CA 3.44Å; N316-G449 PolarHBondContact ND2-O 3.34Å; N316-G452 WeakPolarHBondContact CB-O 3.35Å; N316-Q453 PolarHBondContact ND2-O 2.99Å; N316-A455 PolarHBondContact O-N 2.87Å
317	L	94.4	Very high	84.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	130.3	172.4	-87.6	67.1	0	0	0	110.8	V313 P314 T315 L319 V445 A455 K744	V313-L317 HydrophobicContact CG1-CB 4.31Å; V313-L317 HydrophobicContact CG1-CD2 4.28Å; P314-L317 HydrophobicContact CB-CD1 4.02Å; P314-L317 HydrophobicContact CG-CD1 4.12Å; P314-L317 PolarHBondContact O-N 3.34Å; T315-L317 PolarHBondContact O-N 3.2Å; L317-L319 HydrophobicContact CB-CD2 4.37Å; L317-V445 HydrophobicContact CD2-CB 4.05Å; L317-V445 HydrophobicContact CD2-CG2 4.06Å; L317-V445 WeakPolarHBondContact CD2-O 3.41Å; L317-A455 HydrophobicContact CD1-CB 4.45Å; L317-K744 PolarHBondContact O-NZ 3.2Å
318	H	96.3	Very high	86.3	Confident	27 Å²	27	46.1 Å²	46.1	13%	0.125	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	118.6	176.8	-50	96.3	0	0	0	110.7	N316 R339 A455 H456 C457 Q735 E737	N316-H318 PolarHBondContact O-CE1 3.26Å; N316-H318 PolarHBondContact O-ND1 2.96Å; H318-R339 PolarHBondContact O-NH2 3.36Å; H318-A455 PolarHBondContact N-O 2.98Å; H318-A455 PolarHBondContact ND1-O 3.3Å; H318-A455 VanDerWaalsContact ND1-O 3.11Å; H318-H456 AromaticContact ND1-CE1 3.92Å; H318-H456 AromaticContact ND1-ND1 3.83Å; H318-C457 PolarHBondContact O-N 2.85Å; H318-Q735 HydrophobicContact CB-CG 3.81Å; H318-Q735 VanDerWaalsContact CD2-CD 3.48Å; H318-Q735 PolarHBondContact CD2-NE2 3.35Å; H318-Q735 PolarHBondContact NE2-NE2 2.8Å; H318-E737 IonicContact CD2-OE1 3.13Å; H318-E737 PolarHBondContact CD2-OE1 3.05Å; H318-E737 VanDerWaalsContact CD2-OE1 3.28Å; H318-E737 IonicContact CD2-OE2 2.82Å; H318-E737 IonicContact NE2-OE1 2.69Å
319	L	97.2	Very high	87.7	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	134.6	-170.9	-46.7	-177.5	0	0	0	110.3	L317 Y441 C457 S740 L743 K744 L747	L317-L319 HydrophobicContact CB-CD2 4.37Å; L319-Y441 HydrophobicContact CD1-CE1 4.42Å; L319-C457 HydrophobicContact CD2-CB 3.72Å; L319-S740 PolarHBondContact N-OG 3.05Å; L319-S740 WeakPolarHBondContact O-CB 3.33Å; L319-L743 HydrophobicContact CB-CD2 3.91Å; L319-L743 HydrophobicContact CD1-CB 4.42Å; L319-L743 HydrophobicContact CD1-CD2 3.84Å; L319-L743 HydrophobicContact CD1-CG 3.98Å; L319-K744 HydrophobicContact CD1-CG 3.77Å; L319-K744 HydrophobicContact CG-CG 4.33Å; L319-L747 HydrophobicContact CD1-CD1 4.18Å
320	S	97.7	Very high	89.6	Confident	7 Å²	7	46.7 Å²	46.7	5%	0.049	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	157.1	166.3	62.7	0	0	0	0	112.1	R339 C457 H458 L459 C731	S320-R339 PolarHBondContact OG-NH1 3.37Å; S320-C457 PolarHBondContact N-O 3.26Å; S320-H458 VanDerWaalsContact O-CA 3.29Å; S320-H458 WeakPolarHBondContact O-CA 3.47Å; S320-H458 PolarHBondContact O-ND1 3.46Å; S320-H458 PolarHBondContact OG-ND1 3.33Å; S320-L459 PolarHBondContact O-N 2.96Å; S320-C731 PolarHBondContact OG-SG 3.32Å
321	V	98.1	Very high	91.5	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	141	-176.8	-173	0	0	0	0	109.1	L459 L461 F720 V723 A724 F725 L743	V321-L459 WeakPolarHBondContact CA-O 3.17Å; V321-L459 HydrophobicContact CG1-CB 4.24Å; V321-L459 HydrophobicContact CG1-CD2 4.14Å; V321-L459 HydrophobicContact CG1-CG 4.14Å; V321-L459 HydrophobicContact CG2-CB 4.24Å; V321-L459 HydrophobicContact CG2-CD2 4.46Å; V321-L461 HydrophobicContact CG1-CD1 3.76Å; V321-L461 HydrophobicContact CG1-CG 3.88Å; V321-F720 HydrophobicContact CG1-CB 4.36Å; V321-F720 HydrophobicContact CG2-CD1 4.19Å; V321-V723 HydrophobicContact CB-CG2 4.41Å; V321-V723 HydrophobicContact CG2-CG2 3.91Å; V321-A724 HydrophobicContact CB-CB 4.23Å; V321-A724 HydrophobicContact CG1-CB 3.82Å; V321-A724 WeakPolarHBondContact O-CA 3.44Å; V321-F725 PolarHBondContact O-N 3.05Å; V321-L743 HydrophobicContact CG2-CD2 4.09Å
322	S	97.3	Very high	93.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	165	173.1	61.3	0	0	0	0	113.5	D324 H458 L459 L461 F725 S727	S322-D324 WeakPolarHBondContact CB-OD2 3.39Å; S322-D324 PolarHBondContact OG-OD2 2.85Å; S322-H458 PolarHBondContact OG-CE1 3.03Å; S322-H458 VanDerWaalsContact OG-CE1 3.31Å; S322-H458 PolarHBondContact OG-NE2 3.21Å; S322-L459 PolarHBondContact N-O 2.86Å; S322-L461 PolarHBondContact O-N 2.82Å; S322-F725 CarbonylContact C-O 3.59Å; S322-F725 WeakPolarHBondContact CA-O 3.45Å; S322-S727 VanDerWaalsContact CB-C 3.41Å
323	M	96.2	Very high	94.4	Very high	40 Å²	40	41.7 Å²	41.7	20%	0.197	21%	0.212	C	C	.	.			trans	-121.5	54.2	-179	-67.4	177.8	68.5	0	0	111.4	L461 H721 A724 F725 P726	M323-L461 HydrophobicContact CG-CB 3.87Å; M323-L461 HydrophobicContact CG-CD1 4.35Å; M323-H721 VanDerWaalsContact SD-CD2 3.57Å; M323-A724 HydrophobicContact CG-CB 4.15Å; M323-A724 HydrophobicContact SD-CB 4.26Å; M323-F725 PolarHBondContact N-O 3.05Å; M323-P726 CarbonylContact C-O 3.53Å
324	D	95.9	Very high	95	Very high	13 Å²	13	41 Å²	41	7%	0.07	21%	0.208	C	C	.	.			trans	-62.7	140.4	-176.2	-62.7	-97.7	0	0	0	112.8	S322 D326 A330 F460 P463 S727 C728	S322-D324 WeakPolarHBondContact CB-OD2 3.39Å; S322-D324 PolarHBondContact OG-OD2 2.85Å; D324-D326 VanDerWaalsContact C-N 3.32Å; D324-D326 PolarHBondContact O-N 2.96Å; D324-A330 HydrophobicContact CB-CB 3.42Å; D324-A330 VanDerWaalsContact CB-CB 3.42Å; D324-A330 WeakPolarHBondContact OD1-CB 3.39Å; D324-F460 WeakPolarHBondContact OD2-CD1 3.36Å; D324-P463 WeakPolarHBondContact O-CG 3.43Å; D324-S727 VanDerWaalsContact OD1-CA 3.27Å; D324-S727 WeakPolarHBondContact OD1-CA 3.41Å; D324-S727 WeakPolarHBondContact OD1-CB 3.34Å; D324-C728 PolarHBondContact OD1-N 3.1Å; D324-C728 PolarHBondContact OD1-SG 3.17Å; D324-C728 VanDerWaalsContact OD1-SG 3.33Å; D324-C728 PolarHBondContact OD2-N 3.23Å
325	R	93.2	Very high	95.5	Very high	238 Å²	238	38.9 Å²	38.9	90%	0.898	19%	0.194	S	C	*	.	S	Bend	trans	-59.8	-39.9	178.7	-178.4	-178.6	172.1	-168.8	-1.6	113.1
326	D	94.8	Very high	95.7	Very high	81 Å²	81	37.7 Å²	37.7	43%	0.433	18%	0.18	S	C	.	.			trans	-127	103.5	177.1	-174.9	-30.4	0	0	0	108.3	D324 D328 Q329 A330	D324-D326 VanDerWaalsContact C-N 3.32Å; D324-D326 PolarHBondContact O-N 2.96Å; D326-D328 VanDerWaalsContact C-N 3.29Å; D326-D328 PolarHBondContact O-N 3.46Å; D326-D328 WeakPolarHBondContact OD1-CB 3.28Å; D326-D328 PolarHBondContact OD1-N 3.29Å; D326-Q329 HydrophobicContact CB-CB 4.17Å; D326-Q329 HydrophobicContact CB-CG 4.29Å; D326-Q329 PolarHBondContact O-N 2.86Å; D326-Q329 PolarHBondContact OD1-N 3.46Å; D326-Q329 VanDerWaalsContact OD1-N 3.16Å; D326-A330 VanDerWaalsContact O-CB 3.29Å; D326-A330 WeakPolarHBondContact O-CB 3.32Å; D326-A330 PolarHBondContact O-N 3.32Å
327	T	94.5	Very high	95.7	Very high	17 Å²	17	37 Å²	37	10%	0.104	18%	0.179	C	C	.	.	H	α-helix	trans	-63.4	-33.9	-176.2	-48.5	0	0	0	0	112.5	L331 L432 F460 Q462	T327-L331 VanDerWaalsContact O-CB 3.27Å; T327-L331 WeakPolarHBondContact O-CB 3.43Å; T327-L331 PolarHBondContact O-N 3.19Å; T327-L432 HydrophobicContact CG2-CD2 4.05Å; T327-F460 HydrophobicContact CG2-CB 3.75Å; T327-F460 HydrophobicContact CG2-CD1 4.42Å; T327-F460 HydrophobicContact CG2-CD2 4.47Å; T327-F460 HydrophobicContact CG2-CG 3.99Å; T327-Q462 PolarHBondContact OG1-NE2 2.94Å
328	D	95.4	Very high	95.5	Very high	40 Å²	40	43.3 Å²	43.3	21%	0.214	21%	0.206	C	C	.	.	H	α-helix	trans	-70.4	-44.5	-178	-72.1	-6.2	0	0	0	110.6	D326 L331 L332 R358 I359 L362	D326-D328 VanDerWaalsContact C-N 3.29Å; D326-D328 PolarHBondContact O-N 3.46Å; D326-D328 WeakPolarHBondContact OD1-CB 3.28Å; D326-D328 PolarHBondContact OD1-N 3.29Å; D328-L331 PolarHBondContact O-N 3.41Å; D328-L332 WeakPolarHBondContact O-CG 3.37Å; D328-L332 PolarHBondContact O-N 3.29Å; D328-R358 VanDerWaalsContact CG-NH1 3.28Å; D328-R358 IonicContact OD1-CZ 3.81Å; D328-R358 IonicContact OD1-NH1 3.84Å; D328-R358 PolarHBondContact OD1-NH1 2.81Å; D328-R358 IonicContact OD1-NH2 3.9Å; D328-R358 PolarHBondContact OD1-NH2 3.06Å; D328-R358 IonicContact OD2-CZ 2.68Å; D328-R358 IonicContact OD2-NH1 2.92Å; D328-R358 PolarHBondContact OD2-NH1 2.99Å; D328-R358 IonicContact OD2-NH2 2.95Å; D328-R358 PolarHBondContact OD2-NH2 3.45Å; D328-I359 VanDerWaalsContact OD1-CD1 3.28Å; D328-I359 WeakPolarHBondContact OD1-CD1 3.36Å; D328-L362 HydrophobicContact CB-CD2 3.87Å
329	Q	95.4	Very high	95.4	Very high	108 Å²	108	42.7 Å²	42.7	51%	0.505	20%	0.203	S	C	.	.	H	α-helix	trans	-65.8	-45.5	175.4	-68.5	-59.4	-41.4	0	0	111.2	D326 L331 L332 T333	D326-Q329 HydrophobicContact CB-CB 4.17Å; D326-Q329 HydrophobicContact CB-CG 4.29Å; D326-Q329 PolarHBondContact O-N 2.86Å; D326-Q329 PolarHBondContact OD1-N 3.46Å; D326-Q329 VanDerWaalsContact OD1-N 3.16Å; Q329-L331 VanDerWaalsContact C-N 3.29Å; Q329-L331 PolarHBondContact O-N 2.72Å; Q329-L332 WeakPolarHBondContact O-CB 3.17Å; Q329-L332 PolarHBondContact O-N 3.21Å; Q329-L332 VanDerWaalsContact O-N 3.13Å; Q329-T333 PolarHBondContact O-N 3.28Å; Q329-T333 PolarHBondContact O-OG1 2.95Å; Q329-T333 VanDerWaalsContact O-OG1 3.08Å
330	A	96.7	Very high	95.3	Very high	7 Å²	7	42.6 Å²	42.6	6%	0.058	20%	0.202	C	C	.	.	H	α-helix	trans	-60.8	-38.3	178	0	0	0	0	0	112.5	D324 D326 L332 T333 L334 F460	D324-A330 HydrophobicContact CB-CB 3.42Å; D324-A330 VanDerWaalsContact CB-CB 3.42Å; D324-A330 WeakPolarHBondContact OD1-CB 3.39Å; D326-A330 VanDerWaalsContact O-CB 3.29Å; D326-A330 WeakPolarHBondContact O-CB 3.32Å; D326-A330 PolarHBondContact O-N 3.32Å; A330-L332 PolarHBondContact O-N 3.28Å; A330-T333 PolarHBondContact O-N 3.26Å; A330-L334 VanDerWaalsContact O-CB 3.25Å; A330-L334 WeakPolarHBondContact O-CB 3.26Å; A330-L334 PolarHBondContact O-N 2.9Å; A330-F460 HydrophobicContact CB-CD1 4.31Å; A330-F460 HydrophobicContact CB-CE1 3.74Å
331	L	97.3	Very high	94.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-45.2	174	176.6	63.1	0	0	0	111.7	T327 D328 Q329 L334 L335 I348 I359 L363 L430 L432 F460	T327-L331 VanDerWaalsContact O-CB 3.27Å; T327-L331 WeakPolarHBondContact O-CB 3.43Å; T327-L331 PolarHBondContact O-N 3.19Å; D328-L331 PolarHBondContact O-N 3.41Å; Q329-L331 VanDerWaalsContact C-N 3.29Å; Q329-L331 PolarHBondContact O-N 2.72Å; L331-L334 PolarHBondContact O-N 2.95Å; L331-L335 HydrophobicContact CD1-CD1 3.92Å; L331-L335 HydrophobicContact CD1-CG 4.09Å; L331-L335 HydrophobicContact CG-CD1 4.07Å; L331-L335 WeakPolarHBondContact O-CB 3.43Å; L331-L335 VanDerWaalsContact O-CG 3.27Å; L331-L335 WeakPolarHBondContact O-CG 3.32Å; L331-L335 PolarHBondContact O-N 3.39Å; L331-I348 HydrophobicContact CD1-CD1 4.06Å; L331-I348 HydrophobicContact CD2-CD1 4.21Å; L331-I359 HydrophobicContact CD2-CD1 4.34Å; L331-I359 HydrophobicContact CD2-CG2 3.79Å; L331-L363 HydrophobicContact CD2-CD2 4.27Å; L331-L363 HydrophobicContact CG-CD2 4.48Å; L331-L430 HydrophobicContact CD1-CD1 3.6Å; L331-L432 HydrophobicContact CD1-CD2 4.41Å; L331-L432 HydrophobicContact CD2-CD1 4.15Å; L331-L432 HydrophobicContact CD2-CD2 4.36Å; L331-F460 HydrophobicContact CB-CE2 4.41Å; L331-F460 HydrophobicContact CB-CZ 4.38Å; L331-F460 HydrophobicContact CD1-CE2 4Å; L331-F460 HydrophobicContact CD1-CZ 4.47Å
332	L	96.1	Very high	94.6	Very high	13 Å²	13	51.2 Å²	51.2	7%	0.068	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-46.3	177	-68	172.5	0	0	0	111.4	D328 Q329 A330 L334 L335 Q336 L362 L363 C366	D328-L332 WeakPolarHBondContact O-CG 3.37Å; D328-L332 PolarHBondContact O-N 3.29Å; Q329-L332 WeakPolarHBondContact O-CB 3.17Å; Q329-L332 PolarHBondContact O-N 3.21Å; Q329-L332 VanDerWaalsContact O-N 3.13Å; A330-L332 PolarHBondContact O-N 3.28Å; L332-L334 VanDerWaalsContact C-N 3.34Å; L332-L334 PolarHBondContact O-N 3.22Å; L332-L335 PolarHBondContact O-N 2.81Å; L332-Q336 WeakPolarHBondContact O-CB 3.41Å; L332-Q336 VanDerWaalsContact O-CG 3.29Å; L332-Q336 WeakPolarHBondContact O-CG 3.44Å; L332-Q336 PolarHBondContact O-N 2.85Å; L332-Q336 VanDerWaalsContact O-N 3.09Å; L332-L362 HydrophobicContact CD1-CD1 4.41Å; L332-L362 HydrophobicContact CD1-CD2 4.46Å; L332-L362 HydrophobicContact CD1-CG 4.45Å; L332-L363 HydrophobicContact CD2-CD2 3.77Å; L332-C366 HydrophobicContact CD1-CB 4.1Å; L332-C366 HydrophobicContact CD2-CB 3.7Å
333	T	96.1	Very high	94.3	Very high	67 Å²	67	52.4 Å²	52.4	41%	0.411	25%	0.252	S	S	.	.	H	α-helix	trans	-59.4	-44.8	176.8	-55.6	0	0	0	0	111.5	Q329 A330 Q336 G337 L732	Q329-T333 PolarHBondContact O-N 3.28Å; Q329-T333 PolarHBondContact O-OG1 2.95Å; Q329-T333 VanDerWaalsContact O-OG1 3.08Å; A330-T333 PolarHBondContact O-N 3.26Å; T333-Q336 PolarHBondContact O-N 2.93Å; T333-G337 PolarHBondContact O-N 2.86Å; T333-L732 HydrophobicContact CG2-CD1 4Å; T333-L732 HydrophobicContact CG2-CD2 4.16Å
334	L	96.4	Very high	94	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.8	-48.6	178.7	-174.5	66.6	0	0	0	111.5	A330 L331 L332 Q336 G337 F340 L430 H458 F460 C728 L732	A330-L334 VanDerWaalsContact O-CB 3.25Å; A330-L334 WeakPolarHBondContact O-CB 3.26Å; A330-L334 PolarHBondContact O-N 2.9Å; L331-L334 PolarHBondContact O-N 2.95Å; L332-L334 VanDerWaalsContact C-N 3.34Å; L332-L334 PolarHBondContact O-N 3.22Å; L334-Q336 PolarHBondContact O-N 2.94Å; L334-G337 PolarHBondContact O-N 3.06Å; L334-F340 HydrophobicContact CD1-CD2 3.71Å; L334-F340 HydrophobicContact CD1-CE2 3.55Å; L334-F340 HydrophobicContact CD2-CD2 4.42Å; L334-F340 HydrophobicContact CD2-CE2 4.06Å; L334-F340 HydrophobicContact CD2-CZ 4.32Å; L334-F340 HydrophobicContact CG-CD2 3.72Å; L334-F340 HydrophobicContact CG-CE2 3.76Å; L334-F340 HydrophobicContact CG-CG 4.39Å; L334-F340 HydrophobicContact CG-CZ 4.46Å; L334-F340 WeakPolarHBondContact O-CB 3.39Å; L334-L430 HydrophobicContact CD2-CD2 4.39Å; L334-H458 HydrophobicContact CD2-CB 3.89Å; L334-H458 WeakPolarHBondContact CD2-CD2 3.33Å; L334-F460 HydrophobicContact CB-CZ 4.16Å; L334-F460 HydrophobicContact CD2-CE1 4.42Å; L334-F460 HydrophobicContact CD2-CE2 3.98Å; L334-F460 HydrophobicContact CD2-CZ 3.51Å; L334-F460 HydrophobicContact CG-CZ 4.47Å; L334-C728 HydrophobicContact CD1-CB 4.32Å; L334-L732 HydrophobicContact CB-CD2 4.42Å; L334-L732 HydrophobicContact CD1-CD2 3.9Å
335	L	95.1	Very high	93.9	Very high	3 Å²	3	52.8 Å²	52.8	2%	0.016	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-23	-179.5	-73.1	176.8	0	0	0	113.7	L331 L332 F340 Q341 I346 I348 L363 L367 L430	L331-L335 HydrophobicContact CD1-CD1 3.92Å; L331-L335 HydrophobicContact CD1-CG 4.09Å; L331-L335 HydrophobicContact CG-CD1 4.07Å; L331-L335 WeakPolarHBondContact O-CB 3.43Å; L331-L335 VanDerWaalsContact O-CG 3.27Å; L331-L335 WeakPolarHBondContact O-CG 3.32Å; L331-L335 PolarHBondContact O-N 3.39Å; L332-L335 PolarHBondContact O-N 2.81Å; L335-F340 HydrophobicContact CD2-CB 4.42Å; L335-Q341 VanDerWaalsContact O-CA 3.29Å; L335-Q341 WeakPolarHBondContact O-CA 3.29Å; L335-Q341 PolarHBondContact O-N 2.93Å; L335-I346 HydrophobicContact CD2-CD1 3.58Å; L335-I348 HydrophobicContact CD1-CD1 4.48Å; L335-L363 HydrophobicContact CD1-CD1 4.27Å; L335-L363 HydrophobicContact CD1-CD2 3.56Å; L335-L367 HydrophobicContact CD1-CD1 4.42Å; L335-L430 HydrophobicContact CD2-CD1 3.91Å; L335-L430 HydrophobicContact CG-CD1 4.46Å
336	Q	92.4	Very high	94.1	Very high	100 Å²	100	41.5 Å²	41.5	47%	0.467	21%	0.212	S	C	.	.	H	α-helix	trans	-91.9	-10.8	174.4	-68.2	173.2	-1	0	0	113	L332 T333 L334 Q341 L367	L332-Q336 WeakPolarHBondContact O-CB 3.41Å; L332-Q336 VanDerWaalsContact O-CG 3.29Å; L332-Q336 WeakPolarHBondContact O-CG 3.44Å; L332-Q336 PolarHBondContact O-N 2.85Å; L332-Q336 VanDerWaalsContact O-N 3.09Å; T333-Q336 PolarHBondContact O-N 2.93Å; L334-Q336 PolarHBondContact O-N 2.94Å; Q336-Q341 PolarHBondContact O-OE1 3.07Å; Q336-L367 HydrophobicContact CG-CD2 4.12Å
337	G	92.4	Very high	94.2	Very high	11 Å²	11	37.6 Å²	37.6	11%	0.113	19%	0.191	C	C	.	.	S	Bend	trans	-67.6	155	175.9	0	0	0	0	0	112.4	T333 L334 R339 F340 Q341	T333-G337 PolarHBondContact O-N 2.86Å; L334-G337 PolarHBondContact O-N 3.06Å; G337-R339 PolarHBondContact O-N 3.21Å; G337-F340 PolarHBondContact O-N 3.49Å; G337-Q341 WeakPolarHBondContact O-CB 3.45Å; G337-Q341 WeakPolarHBondContact O-CG 3.14Å; G337-Q341 PolarHBondContact O-N 2.88Å
338	K	91.8	Very high	94.3	Very high	133 Å²	133	36.8 Å²	36.8	58%	0.578	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-35.2	-178.5	-69.9	178.6	-177.4	163.1	0	112.9	L732 E733	K338-L732 PolarHBondContact N-O 2.99Å; K338-E733 HydrophobicContact CD-CG 4.27Å; K338-E733 WeakPolarHBondContact CE-OE1 3.42Å; K338-E733 IonicContact NZ-OE1 2.65Å; K338-E733 PolarHBondContact NZ-OE1 3.07Å
339	R	93.6	Very high	94.4	Very high	14 Å²	14	35.3 Å²	35.3	5%	0.053	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-33.2	179.2	-173.4	176.4	177.4	-145.5	-1.1	114.3	H318 S320 G337 H456 C731 L732 Q735	H318-R339 PolarHBondContact O-NH2 3.36Å; S320-R339 PolarHBondContact OG-NH1 3.37Å; G337-R339 PolarHBondContact O-N 3.21Å; R339-H456 PolarHBondContact NE-ND1 3.48Å; R339-H456 VanDerWaalsContact NE-ND1 3.18Å; R339-H456 PolarHBondContact NH2-ND1 3.44Å; R339-C731 WeakPolarHBondContact CD-O 3.42Å; R339-L732 VanDerWaalsContact CB-O 3.3Å; R339-L732 WeakPolarHBondContact CB-O 3.27Å; R339-L732 PolarHBondContact N-O 3.45Å; R339-Q735 VanDerWaalsContact NH2-OE1 3.08Å
340	F	94.7	Very high	94.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-17.7	-173.3	-69.8	-92.5	0	0	0	114.8	L334 L335 G337 N342 L343 R409 A428 L430 H456 H458	L334-F340 HydrophobicContact CD1-CD2 3.71Å; L334-F340 HydrophobicContact CD1-CE2 3.55Å; L334-F340 HydrophobicContact CD2-CD2 4.42Å; L334-F340 HydrophobicContact CD2-CE2 4.06Å; L334-F340 HydrophobicContact CD2-CZ 4.32Å; L334-F340 HydrophobicContact CG-CD2 3.72Å; L334-F340 HydrophobicContact CG-CE2 3.76Å; L334-F340 HydrophobicContact CG-CG 4.39Å; L334-F340 HydrophobicContact CG-CZ 4.46Å; L334-F340 WeakPolarHBondContact O-CB 3.39Å; L335-F340 HydrophobicContact CD2-CB 4.42Å; G337-F340 PolarHBondContact O-N 3.49Å; F340-N342 PolarHBondContact O-N 2.64Å; F340-N342 VanDerWaalsContact O-N 3.16Å; F340-L343 HydrophobicContact CB-CD1 4.45Å; F340-L343 HydrophobicContact CD1-CD1 3.74Å; F340-L343 HydrophobicContact CE1-CD1 4.32Å; F340-L343 HydrophobicContact CG-CD1 4.3Å; F340-L343 PolarHBondContact O-N 3.13Å; F340-L343 VanDerWaalsContact O-N 3.09Å; F340-R409 PolarHBondContact O-NH2 3.02Å; F340-A428 HydrophobicContact CD1-CB 3.96Å; F340-A428 HydrophobicContact CE1-CB 3.74Å; F340-L430 HydrophobicContact CD1-CD2 4.37Å; F340-L430 HydrophobicContact CE1-CD2 3.65Å; F340-L430 HydrophobicContact CZ-CD2 4.1Å; F340-H456 HydrophobicContact CE1-CB 3.78Å; F340-H456 HydrophobicContact CZ-CB 3.69Å; F340-H458 HydrophobicContact CZ-CB 4.36Å
341	Q	90.6	Very high	93.8	Very high	77 Å²	77	33.8 Å²	33.8	36%	0.36	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-33.8	-173.5	64	177.6	7.1	0	0	113.9	L335 Q336 G337 R409	L335-Q341 VanDerWaalsContact O-CA 3.29Å; L335-Q341 WeakPolarHBondContact O-CA 3.29Å; L335-Q341 PolarHBondContact O-N 2.93Å; Q336-Q341 PolarHBondContact O-OE1 3.07Å; G337-Q341 WeakPolarHBondContact O-CB 3.45Å; G337-Q341 WeakPolarHBondContact O-CG 3.14Å; G337-Q341 PolarHBondContact O-N 2.88Å; Q341-R409 PolarHBondContact O-NH2 2.92Å
342	N	90.3	Very high	93.3	Very high	114 Å²	114	38.5 Å²	38.5	61%	0.61	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	8.5	-176.6	-65.1	-22.4	0	0	0	113.3	F340	F340-N342 PolarHBondContact O-N 2.64Å; F340-N342 VanDerWaalsContact O-N 3.16Å
343	L	91.8	Very high	93	Very high	25 Å²	25	44.2 Å²	44.2	13%	0.131	21%	0.211	C	C	.	.			trans	-89.7	123.4	178.6	-53.6	-175.9	0	0	0	110.4	F340 I346 R409 R427 A428	F340-L343 HydrophobicContact CB-CD1 4.45Å; F340-L343 HydrophobicContact CD1-CD1 3.74Å; F340-L343 HydrophobicContact CE1-CD1 4.32Å; F340-L343 HydrophobicContact CG-CD1 4.3Å; F340-L343 PolarHBondContact O-N 3.13Å; F340-L343 VanDerWaalsContact O-N 3.09Å; L343-I346 HydrophobicContact CB-CD1 4.26Å; L343-I346 HydrophobicContact CB-CG1 4.33Å; L343-R409 PolarHBondContact O-NE 3.11Å; L343-R409 PolarHBondContact O-NH2 2.96Å; L343-R427 HydrophobicContact CB-CB 3.99Å; L343-R427 HydrophobicContact CD1-CB 4.24Å; L343-R427 HydrophobicContact CD2-CB 3.99Å; L343-R427 HydrophobicContact CD2-CG 4.36Å; L343-R427 HydrophobicContact CG-CB 4.27Å; L343-A428 HydrophobicContact CD1-CB 3.9Å
344	D	89.3	Confident	92.8	Very high	58 Å²	58	47.3 Å²	47.3	31%	0.31	22%	0.221	S	C	.	.			trans	-100.7	2.6	-172	-70	-30.7	0	0	0	114.8	W371 R409	D344-W371 WeakPolarHBondContact OD1-CZ2 3.45Å; D344-W371 WeakPolarHBondContact OD2-CZ2 3.43Å; D344-R409 WeakPolarHBondContact O-CA 3.24Å
345	S	94.2	Very high	92.7	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.021	23%	0.234	C	C	.	.			trans	-143.4	94.8	-177.8	54.3	0	0	0	0	110.5	R409 D425 V426 R427 A428	S345-R409 WeakPolarHBondContact CA-O 3.35Å; S345-D425 PolarHBondContact OG-O 3.15Å; S345-V426 WeakPolarHBondContact OG-CA 3.08Å; S345-R427 PolarHBondContact O-N 2.91Å; S345-R427 WeakPolarHBondContact OG-CG 3.48Å; S345-R427 PolarHBondContact OG-N 2.92Å; S345-A428 PolarHBondContact O-N 3.09Å; S345-A428 VanDerWaalsContact O-N 3.11Å
346	I	96.4	Very high	92.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	134.2	-173.2	-48.1	-176.2	0	0	0	109.7	L335 L343 I348 R409 V410 V411 A428 L430	L335-I346 HydrophobicContact CD2-CD1 3.58Å; L343-I346 HydrophobicContact CB-CD1 4.26Å; L343-I346 HydrophobicContact CB-CG1 4.33Å; I346-I348 HydrophobicContact CG2-CG1 4.09Å; I346-R409 PolarHBondContact N-O 2.94Å; I346-V410 HydrophobicContact CB-CG1 4.38Å; I346-V410 HydrophobicContact CB-CG2 4.18Å; I346-V410 HydrophobicContact CD1-CG2 4.45Å; I346-V410 CarbonylContact O-C 3.55Å; I346-V410 VanDerWaalsContact O-CA 3.32Å; I346-V410 WeakPolarHBondContact O-CA 3.23Å; I346-V411 PolarHBondContact O-N 3.01Å; I346-A428 WeakPolarHBondContact CA-O 3.16Å; I346-A428 HydrophobicContact CB-CB 4.44Å; I346-A428 HydrophobicContact CG1-CB 4.16Å; I346-A428 HydrophobicContact CG2-CB 4.01Å; I346-L430 HydrophobicContact CG2-CD1 4.12Å; I346-L430 HydrophobicContact CG2-CG 4.14Å
347	I	97.1	Very high	92.9	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	132	169.6	-55.2	176.3	0	0	0	108.1	Y349 F403 V411 F417 L421 V426 A428 V429 L430 R447	I347-Y349 HydrophobicContact CG2-CD2 4.19Å; I347-Y349 HydrophobicContact CG2-CE1 4.25Å; I347-Y349 HydrophobicContact CG2-CE2 3.72Å; I347-F403 HydrophobicContact CD1-CE1 4.29Å; I347-F403 HydrophobicContact CD1-CZ 4.36Å; I347-F403 HydrophobicContact CG1-CE1 4.27Å; I347-F403 HydrophobicContact CG1-CZ 3.89Å; I347-V411 CarbonylContact C-O 3.54Å; I347-V411 WeakPolarHBondContact CA-O 3.42Å; I347-F417 HydrophobicContact CD1-CE1 4.15Å; I347-F417 HydrophobicContact CG1-CE1 4.26Å; I347-F417 HydrophobicContact CG2-CD1 4.1Å; I347-F417 HydrophobicContact CG2-CE1 4.46Å; I347-L421 HydrophobicContact CD1-CD2 3.67Å; I347-V426 HydrophobicContact CD1-CG1 4.1Å; I347-V426 HydrophobicContact CG1-CG1 4.23Å; I347-A428 PolarHBondContact N-O 3.15Å; I347-V429 HydrophobicContact CB-CG2 4.36Å; I347-V429 CarbonylContact O-C 3.53Å; I347-V429 WeakPolarHBondContact O-CA 3.37Å; I347-L430 PolarHBondContact O-N 3.36Å; I347-R447 HydrophobicContact CD1-CB 4.48Å
348	I	97.8	Very high	93.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	116.3	176.9	-54.9	-176.8	0	0	0	108.4	L331 L335 I346 L363 V410 V411 V412 A413 L430 L432	L331-I348 HydrophobicContact CD1-CD1 4.06Å; L331-I348 HydrophobicContact CD2-CD1 4.21Å; L335-I348 HydrophobicContact CD1-CD1 4.48Å; I346-I348 HydrophobicContact CG2-CG1 4.09Å; I348-L363 HydrophobicContact CD1-CD1 3.66Å; I348-V410 HydrophobicContact CD1-CG1 3.58Å; I348-V410 HydrophobicContact CG1-CG1 3.8Å; I348-V411 PolarHBondContact N-O 2.97Å; I348-V412 HydrophobicContact CB-CG1 4.25Å; I348-V412 HydrophobicContact CB-CG2 4.38Å; I348-V412 HydrophobicContact CD1-CG2 4.41Å; I348-V412 HydrophobicContact CG2-CG1 4.33Å; I348-V412 CarbonylContact O-C 3.49Å; I348-V412 WeakPolarHBondContact O-CA 3.18Å; I348-A413 PolarHBondContact O-N 2.94Å; I348-L430 CarbonylContact C-O 3.58Å; I348-L430 WeakPolarHBondContact CA-O 3.1Å; I348-L430 HydrophobicContact CD1-CD1 4.13Å; I348-L430 HydrophobicContact CG1-CB 4.17Å; I348-L430 HydrophobicContact CG1-CD1 4.03Å; I348-L430 HydrophobicContact CG1-CG 4.32Å; I348-L430 HydrophobicContact CG2-CB 4.39Å; I348-L432 HydrophobicContact CG2-CD1 3.83Å; I348-L432 HydrophobicContact CG2-CD2 4.22Å; I348-L432 HydrophobicContact CG2-CG 3.69Å
349	Y	96.8	Very high	93.4	Very high	8 Å²	8	48.1 Å²	48.1	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.1	178.3	-75.6	-65.5	0	0	0	112	I347 A413 F417 V429 L430 H431 L432 A444 R447	I347-Y349 HydrophobicContact CG2-CD2 4.19Å; I347-Y349 HydrophobicContact CG2-CE1 4.25Å; I347-Y349 HydrophobicContact CG2-CE2 3.72Å; Y349-A413 CarbonylContact C-O 3.46Å; Y349-A413 VanDerWaalsContact CA-O 3.26Å; Y349-A413 WeakPolarHBondContact CA-O 3.5Å; Y349-F417 WeakPolarHBondContact CE1-O 3.5Å; Y349-F417 VanDerWaalsContact CZ-O 3.27Å; Y349-F417 PolarHBondContact OH-O 2.94Å; Y349-V429 HydrophobicContact CD2-CG1 3.82Å; Y349-V429 HydrophobicContact CE2-CG1 3.84Å; Y349-L430 PolarHBondContact N-O 3.33Å; Y349-H431 AromaticContact CD2-CE1 3.71Å; Y349-H431 AromaticContact CD2-NE2 3.69Å; Y349-L432 PolarHBondContact O-N 3.49Å; Y349-A444 HydrophobicContact CD2-CB 3.92Å; Y349-A444 HydrophobicContact CE2-CB 3.54Å; Y349-R447 VanDerWaalsContact OH-CD 3.28Å; Y349-R447 WeakPolarHBondContact OH-CD 3.48Å; Y349-R447 PolarHBondContact OH-NE 3.46Å
350	C	93.4	Very high	93.5	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.02	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	149.7	172.9	-53	0	0	0	0	110.4	D355 T356 A413 T414	C350-D355 HydrophobicContact CB-CB 3.95Å; C350-T356 HydrophobicContact CB-CG2 3.85Å; C350-A413 PolarHBondContact N-O 2.92Å; C350-T414 WeakPolarHBondContact O-CA 3.02Å
351	N	86.4	Confident	93.6	Very high	81 Å²	81	49.2 Å²	49.2	43%	0.433	23%	0.233	S	C	.	.	S	Bend	trans	-72.3	-37.9	177.9	-71.3	-22.2	0	0	0	112.8
352	R	86.1	Confident	93.8	Very high	99 Å²	99	47.4 Å²	47.4	37%	0.374	23%	0.226	S	C	.	.	S	Bend	trans	-111.3	154	-177.6	-56.1	-177.2	175.4	149.6	4.6	112.8	D355 T356 E470	R352-D355 WeakPolarHBondContact CB-OD2 3.27Å; R352-D355 PolarHBondContact O-N 3.34Å; R352-T356 PolarHBondContact O-N 2.77Å; R352-E470 IonicContact CZ-OE1 3.63Å; R352-E470 IonicContact NE-OE1 2.65Å; R352-E470 IonicContact NH2-OE1 3.43Å; R352-E470 PolarHBondContact NH2-OE1 3.14Å; R352-E470 IonicContact NH2-OE2 3.9Å; R352-E470 PolarHBondContact NH2-OE2 2.8Å
353	R	90.9	Very high	94	Very high	132 Å²	132	42 Å²	42	50%	0.498	20%	0.197	S	C	.	.	H	α-helix	trans	-67.7	-41.4	-179.7	-58.8	178.7	-175.6	171.8	2.6	111	D355 T356 E357 H388 T414	R353-D355 PolarHBondContact O-N 3.36Å; R353-T356 PolarHBondContact O-N 3.39Å; R353-T356 VanDerWaalsContact O-N 3.09Å; R353-T356 PolarHBondContact O-OG1 2.57Å; R353-E357 PolarHBondContact O-N 3.09Å; R353-H388 HydrophobicContact CB-CB 4.29Å; R353-H388 HydrophobicContact CG-CB 4Å; R353-T414 HydrophobicContact CG-CG2 4.13Å
354	E	91.4	Very high	94.1	Very high	133 Å²	133	44.7 Å²	44.7	62%	0.621	21%	0.205	S	C	*	.	H	α-helix	trans	-60.9	-35.9	179.2	-56.8	87.1	-177.8	0	0	111.6	T356 E357 R358	E354-T356 VanDerWaalsContact C-N 3.32Å; E354-T356 PolarHBondContact O-N 2.99Å; E354-E357 PolarHBondContact O-N 3.15Å; E354-R358 WeakPolarHBondContact O-CB 3.25Å; E354-R358 PolarHBondContact O-N 3.04Å
355	D	93.3	Very high	94.2	Very high	50 Å²	50	46.9 Å²	46.9	27%	0.267	22%	0.221	S	C	.	.	H	α-helix	trans	-66.3	-33.8	177.8	-65.9	-39.2	0	0	0	112.1	C350 R352 R353 R358 I359	C350-D355 HydrophobicContact CB-CB 3.95Å; R352-D355 WeakPolarHBondContact CB-OD2 3.27Å; R352-D355 PolarHBondContact O-N 3.34Å; R353-D355 PolarHBondContact O-N 3.36Å; D355-R358 PolarHBondContact O-N 3.28Å; D355-R358 IonicContact OD1-NE 3.21Å; D355-I359 VanDerWaalsContact O-CB 3.3Å; D355-I359 WeakPolarHBondContact O-CB 3.04Å; D355-I359 VanDerWaalsContact O-CG1 3.22Å; D355-I359 WeakPolarHBondContact O-CG1 3.42Å; D355-I359 PolarHBondContact O-N 3.15Å
356	T	96.1	Very high	94	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-44	177.3	65.7	0	0	0	0	112.2	C350 R352 R353 E354 A360 H388 V412 T414	C350-T356 HydrophobicContact CB-CG2 3.85Å; R352-T356 PolarHBondContact O-N 2.77Å; R353-T356 PolarHBondContact O-N 3.39Å; R353-T356 VanDerWaalsContact O-N 3.09Å; R353-T356 PolarHBondContact O-OG1 2.57Å; E354-T356 VanDerWaalsContact C-N 3.32Å; E354-T356 PolarHBondContact O-N 2.99Å; T356-A360 VanDerWaalsContact O-CB 3.23Å; T356-A360 WeakPolarHBondContact O-CB 3.21Å; T356-A360 PolarHBondContact O-N 3.24Å; T356-H388 PolarHBondContact OG1-CD2 3.49Å; T356-V412 HydrophobicContact CG2-CG1 4.47Å; T356-T414 HydrophobicContact CG2-CG2 3.87Å
357	E	96.1	Very high	93.5	Very high	108 Å²	108	50.2 Å²	50.2	51%	0.505	24%	0.242	S	C	.	.	H	α-helix	trans	-67	-43.9	177.7	-64.1	-176.3	-177.9	0	0	111.2	R353 E354 A361 A386 H388	R353-E357 PolarHBondContact O-N 3.09Å; E354-E357 PolarHBondContact O-N 3.15Å; E357-A361 WeakPolarHBondContact O-CB 3.24Å; E357-A361 PolarHBondContact O-N 3.45Å; E357-A386 HydrophobicContact CG-CB 4.16Å; E357-H388 IonicContact OE1-CE1 3.45Å; E357-H388 PolarHBondContact OE1-CE1 2.97Å; E357-H388 IonicContact OE1-NE2 3.29Å; E357-H388 PolarHBondContact OE1-NE2 3.25Å; E357-H388 VanDerWaalsContact OE1-NE2 3.15Å
358	R	96.9	Very high	92.1	Very high	105 Å²	105	57.5 Å²	57.5	40%	0.396	28%	0.276	S	S	.	.	H	α-helix	trans	-61.9	-50.1	179.8	-171.6	-172.2	67.4	71.8	-7	112	D328 E354 D355 A361 L362	D328-R358 VanDerWaalsContact CG-NH1 3.28Å; D328-R358 IonicContact OD1-CZ 3.81Å; D328-R358 IonicContact OD1-NH1 3.84Å; D328-R358 PolarHBondContact OD1-NH1 2.81Å; D328-R358 IonicContact OD1-NH2 3.9Å; D328-R358 PolarHBondContact OD1-NH2 3.06Å; D328-R358 IonicContact OD2-CZ 2.68Å; D328-R358 IonicContact OD2-NH1 2.92Å; D328-R358 PolarHBondContact OD2-NH1 2.99Å; D328-R358 IonicContact OD2-NH2 2.95Å; D328-R358 PolarHBondContact OD2-NH2 3.45Å; E354-R358 WeakPolarHBondContact O-CB 3.25Å; E354-R358 PolarHBondContact O-N 3.04Å; D355-R358 PolarHBondContact O-N 3.28Å; D355-R358 IonicContact OD1-NE 3.21Å; R358-A361 PolarHBondContact O-N 3.16Å; R358-L362 PolarHBondContact O-N 3.46Å
359	I	97.6	Very high	90.1	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-68	-41.5	179.9	-66.7	-69.4	0	0	0	110.7	D328 L331 D355 A361 L362 L363 V412 L432	D328-I359 VanDerWaalsContact OD1-CD1 3.28Å; D328-I359 WeakPolarHBondContact OD1-CD1 3.36Å; L331-I359 HydrophobicContact CD2-CD1 4.34Å; L331-I359 HydrophobicContact CD2-CG2 3.79Å; D355-I359 VanDerWaalsContact O-CB 3.3Å; D355-I359 WeakPolarHBondContact O-CB 3.04Å; D355-I359 VanDerWaalsContact O-CG1 3.22Å; D355-I359 WeakPolarHBondContact O-CG1 3.42Å; D355-I359 PolarHBondContact O-N 3.15Å; I359-A361 VanDerWaalsContact C-N 3.28Å; I359-A361 PolarHBondContact O-N 2.87Å; I359-L362 HydrophobicContact CD1-CD2 4.34Å; I359-L362 WeakPolarHBondContact O-CB 3.49Å; I359-L362 PolarHBondContact O-N 3.48Å; I359-L363 HydrophobicContact CG2-CD1 4.09Å; I359-L363 HydrophobicContact CG2-CG 4.28Å; I359-L363 WeakPolarHBondContact O-CG 3.39Å; I359-L363 PolarHBondContact O-N 2.81Å; I359-V412 HydrophobicContact CB-CG1 3.91Å; I359-V412 HydrophobicContact CG2-CG1 3.79Å; I359-V412 HydrophobicContact CG2-CG2 4.03Å; I359-L432 HydrophobicContact CD1-CD1 3.87Å; I359-L432 HydrophobicContact CG1-CD1 3.8Å; I359-L432 HydrophobicContact CG2-CD1 4.25Å
360	A	96.4	Very high	87.8	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-59.5	-40.9	174.9	0	0	0	0	0	111.8	T356 R364 A386 V412	T356-A360 VanDerWaalsContact O-CB 3.23Å; T356-A360 WeakPolarHBondContact O-CB 3.21Å; T356-A360 PolarHBondContact O-N 3.24Å; A360-R364 WeakPolarHBondContact O-CG 3.27Å; A360-R364 PolarHBondContact O-N 3.2Å; A360-A386 HydrophobicContact CB-CB 4.09Å; A360-V412 HydrophobicContact CB-CB 4.23Å; A360-V412 HydrophobicContact CB-CG2 4Å
361	A	95.8	Very high	85.7	Confident	38 Å²	38	69 Å²	69	31%	0.314	36%	0.356	S	S	.	.	H	α-helix	trans	-65.8	-42	175.2	0	0	0	0	0	112.7	E357 R358 I359 R364 T365	E357-A361 WeakPolarHBondContact O-CB 3.24Å; E357-A361 PolarHBondContact O-N 3.45Å; R358-A361 PolarHBondContact O-N 3.16Å; I359-A361 VanDerWaalsContact C-N 3.28Å; I359-A361 PolarHBondContact O-N 2.87Å; A361-R364 PolarHBondContact O-N 3.47Å; A361-T365 WeakPolarHBondContact O-CB 3.34Å; A361-T365 PolarHBondContact O-N 2.92Å; A361-T365 VanDerWaalsContact O-N 3.08Å; A361-T365 PolarHBondContact O-OG1 2.9Å
362	L	96.1	Very high	83.8	Confident	39 Å²	39	71.2 Å²	71.2	20%	0.204	37%	0.372	C	S	.	.	H	α-helix	trans	-57.1	-52.8	174.9	178.7	68	0	0	0	110.9	D328 L332 R358 I359 R364 T365 C366	D328-L362 HydrophobicContact CB-CD2 3.87Å; L332-L362 HydrophobicContact CD1-CD1 4.41Å; L332-L362 HydrophobicContact CD1-CD2 4.46Å; L332-L362 HydrophobicContact CD1-CG 4.45Å; R358-L362 PolarHBondContact O-N 3.46Å; I359-L362 HydrophobicContact CD1-CD2 4.34Å; I359-L362 WeakPolarHBondContact O-CB 3.49Å; I359-L362 PolarHBondContact O-N 3.48Å; L362-R364 PolarHBondContact O-N 3.08Å; L362-T365 PolarHBondContact O-N 3.39Å; L362-T365 VanDerWaalsContact O-N 3.09Å; L362-C366 PolarHBondContact O-N 2.69Å; L362-C366 PolarHBondContact O-SG 3.23Å
363	L	94.8	Very high	81.9	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-62	-42	-178.8	-65.9	-179.9	0	0	0	112.4	L331 L332 L335 I348 I359 T365 L367 A384 V410 V412	L331-L363 HydrophobicContact CD2-CD2 4.27Å; L331-L363 HydrophobicContact CG-CD2 4.48Å; L332-L363 HydrophobicContact CD2-CD2 3.77Å; L335-L363 HydrophobicContact CD1-CD1 4.27Å; L335-L363 HydrophobicContact CD1-CD2 3.56Å; I348-L363 HydrophobicContact CD1-CD1 3.66Å; I359-L363 HydrophobicContact CG2-CD1 4.09Å; I359-L363 HydrophobicContact CG2-CG 4.28Å; I359-L363 WeakPolarHBondContact O-CG 3.39Å; I359-L363 PolarHBondContact O-N 2.81Å; L363-T365 VanDerWaalsContact C-N 3.25Å; L363-T365 PolarHBondContact O-N 3.36Å; L363-L367 HydrophobicContact CB-CD1 4.43Å; L363-L367 HydrophobicContact CD2-CD1 4.09Å; L363-L367 VanDerWaalsContact O-CB 3.26Å; L363-L367 WeakPolarHBondContact O-CB 3.35Å; L363-L367 WeakPolarHBondContact O-CG 3.31Å; L363-L367 PolarHBondContact O-N 2.84Å; L363-A384 HydrophobicContact CB-CB 3.76Å; L363-A384 HydrophobicContact CD1-CB 4.13Å; L363-V410 HydrophobicContact CD1-CG1 3.95Å; L363-V412 HydrophobicContact CD1-CG2 4.1Å
364	R	93.1	Very high	79.8	Confident	81 Å²	81	66.6 Å²	66.6	31%	0.306	38%	0.38	S	S	.	.	H	α-helix	trans	-61	-35	174.8	-76.1	-172.3	-62.3	-104.3	5.4	112.8	A360 A361 L362 H368 A384 E385	A360-R364 WeakPolarHBondContact O-CG 3.27Å; A360-R364 PolarHBondContact O-N 3.2Å; A361-R364 PolarHBondContact O-N 3.47Å; L362-R364 PolarHBondContact O-N 3.08Å; R364-H368 WeakPolarHBondContact O-CB 3.29Å; R364-A384 VanDerWaalsContact CD-O 3.26Å; R364-A384 WeakPolarHBondContact CD-O 3.46Å; R364-A384 HydrophobicContact CG-CB 4.27Å; R364-A384 WeakPolarHBondContact CG-O 3.28Å; R364-A384 PolarHBondContact NH1-O 2.67Å; R364-E385 IonicContact NH1-OE2 3.5Å; R364-E385 PolarHBondContact NH1-OE2 3.42Å
365	T	91.6	Very high	77.4	Confident	105 Å²	105	66.8 Å²	66.8	64%	0.644	40%	0.396	S	S	*	.	H	α-helix	trans	-78.2	-46.9	-177.6	-53.1	0	0	0	0	111.1	A361 L362 L363	A361-T365 WeakPolarHBondContact O-CB 3.34Å; A361-T365 PolarHBondContact O-N 2.92Å; A361-T365 VanDerWaalsContact O-N 3.08Å; A361-T365 PolarHBondContact O-OG1 2.9Å; L362-T365 PolarHBondContact O-N 3.39Å; L362-T365 VanDerWaalsContact O-N 3.09Å; L363-T365 VanDerWaalsContact C-N 3.25Å; L363-T365 PolarHBondContact O-N 3.36Å
366	C	90.5	Very high	75.1	Confident	59 Å²	59	68.5 Å²	68.5	40%	0.399	43%	0.426	S	S	.	.	H	α-helix	trans	-80.9	-26	-173.9	-63	0	0	0	0	113.7	L332 L362	L332-C366 HydrophobicContact CD1-CB 4.1Å; L332-C366 HydrophobicContact CD2-CB 3.7Å; L362-C366 PolarHBondContact O-N 2.69Å; L362-C366 PolarHBondContact O-SG 3.23Å
367	L	84.4	Confident	72.9	Confident	13 Å²	13	71.1 Å²	71.1	7%	0.068	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	17.4	-178.4	-52.1	176.4	0	0	0	112.7	L335 Q336 L363 A369 T383	L335-L367 HydrophobicContact CD1-CD1 4.42Å; Q336-L367 HydrophobicContact CG-CD2 4.12Å; L363-L367 HydrophobicContact CB-CD1 4.43Å; L363-L367 HydrophobicContact CD2-CD1 4.09Å; L363-L367 VanDerWaalsContact O-CB 3.26Å; L363-L367 WeakPolarHBondContact O-CB 3.35Å; L363-L367 WeakPolarHBondContact O-CG 3.31Å; L363-L367 PolarHBondContact O-N 2.84Å; L367-A369 PolarHBondContact O-N 2.87Å; L367-A369 VanDerWaalsContact O-N 3.15Å; L367-T383 HydrophobicContact CB-CG2 3.8Å; L367-T383 HydrophobicContact CD1-CG2 4.17Å
368	H	67.8	Low	70.8	Confident	153 Å²	153	78 Å²	78	71%	0.708	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.2	-174.3	-155	-42.4	0	0	0	113.9	R364	R364-H368 WeakPolarHBondContact O-CB 3.29Å
369	A	56.3	Low	68.8	Low	102 Å²	102	75.4 Å²	75.4	84%	0.843	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.4	8.8	-168.9	0	0	0	0	0	115.6	L367	L367-A369 PolarHBondContact O-N 2.87Å; L367-A369 VanDerWaalsContact O-N 3.15Å
370	A	49.3	Very low	67	Low	70 Å²	70	76.6 Å²	76.6	58%	0.579	48%	0.483	S	S	*	.			trans	-103.2	3.9	-169	0	0	0	0	0	115.5
371	W	49.2	Very low	65.5	Low	81 Å²	81	85.7 Å²	85.7	31%	0.307	52%	0.523	S	S	.	.			trans	-111.3	102.1	-174.4	-145.9	78.2	0	0	0	111.6	D344 P373 A379	D344-W371 WeakPolarHBondContact OD1-CZ2 3.45Å; D344-W371 WeakPolarHBondContact OD2-CZ2 3.43Å; W371-P373 HydrophobicContact CZ3-CB 4.32Å; W371-A379 HydrophobicContact CE3-CB 4.02Å; W371-A379 HydrophobicContact CZ3-CB 3.56Å
372	V	46.9	Very low	64.5	Low	128 Å²	128	86.2 Å²	86.2	78%	0.776	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-83	125.7	168.9	-178.4	0	0	0	0	107	G374	V372-G374 PolarHBondContact O-N 3.33Å; V372-G374 VanDerWaalsContact O-N 3.14Å
373	P	46.2	Very low	64	Low	84 Å²	84	86.1 Å²	86.1	55%	0.545	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-58.4	121.6	-179.3	20.6	-29.8	0	0	0	110.3	W371	W371-P373 HydrophobicContact CZ3-CB 4.32Å
374	G	45.7	Very low	64	Low	49 Å²	49	86.1 Å²	86.1	51%	0.505	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-56	138.1	166.4	0	0	0	0	0	110	V372 G376	V372-G374 PolarHBondContact O-N 3.33Å; V372-G374 VanDerWaalsContact O-N 3.14Å; G374-G376 VanDerWaalsContact C-N 3.32Å; G374-G376 PolarHBondContact O-N 2.54Å
375	S	41.8	Very low	64.2	Low	137 Å²	137	84.9 Å²	84.9	96%	0.958	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	85.9	178.3	40.5	0	0	0	0	111.2
376	G	43.3	Very low	64.5	Low	87 Å²	87	80.3 Å²	80.3	90%	0.897	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	148	-9.3	169.2	0	0	0	0	0	117.8	G374	G374-G376 VanDerWaalsContact C-N 3.32Å; G374-G376 PolarHBondContact O-N 2.54Å
377	G	50.1	Low	64.6	Low	54 Å²	54	77.9 Å²	77.9	56%	0.557	48%	0.476	S	S	*	.	S	Bend	trans	-126.8	146.2	-174.7	0	0	0	0	0	115	A379	G377-A379 PolarHBondContact O-N 2.9Å
378	R	52.8	Low	64.9	Low	252 Å²	252	77.7 Å²	77.7	95%	0.951	48%	0.475	S	S	*	.			trans	-64.6	113.4	169.5	-73.4	178.6	178.9	173	0.4	108.8
379	A	55.5	Low	65.7	Low	51 Å²	51	72.9 Å²	72.9	42%	0.421	46%	0.462	S	S	.	.			trans	-56.8	137.7	177.1	0	0	0	0	0	111.6	W371 G377 K381	W371-A379 HydrophobicContact CE3-CB 4.02Å; W371-A379 HydrophobicContact CZ3-CB 3.56Å; G377-A379 PolarHBondContact O-N 2.9Å; A379-K381 PolarHBondContact O-N 3.48Å
380	P	58.4	Low	67.1	Low	25 Å²	25	70.4 Å²	70.4	16%	0.162	45%	0.446	C	S	.	.			trans	-61.6	127.7	172.4	22.9	-29.7	0	0	0	109.6	T382 Q407 R409	P380-T382 PolarHBondContact O-N 3.49Å; P380-Q407 CarbonylContact C-O 3.58Å; P380-R409 HydrophobicContact CB-CB 4.24Å; P380-R409 HydrophobicContact CG-CB 3.95Å
381	K	64.9	Low	68.9	Low	191 Å²	191	68.6 Å²	68.6	83%	0.83	43%	0.426	S	S	*	.	S	Bend	trans	-68.1	-16.4	-175.3	-167.1	173.9	-178.9	176.1	0	113.1	A379 Q407	A379-K381 PolarHBondContact O-N 3.48Å; K381-Q407 PolarHBondContact N-O 3.42Å
382	T	76.1	Confident	70.6	Confident	50 Å²	50	67.3 Å²	67.3	31%	0.307	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	131.1	-173.8	-53.7	0	0	0	0	111	P380 E385 Q407 L408 R409	P380-T382 PolarHBondContact O-N 3.49Å; T382-E385 HydrophobicContact CG2-CG 4.08Å; T382-Q407 PolarHBondContact N-O 2.94Å; T382-Q407 VanDerWaalsContact N-O 3.09Å; T382-L408 HydrophobicContact CG2-CD1 3.81Å; T382-L408 WeakPolarHBondContact O-CA 3.39Å; T382-R409 PolarHBondContact O-N 3.45Å
383	T	86	Confident	72.2	Confident	36 Å²	36	63.9 Å²	63.9	22%	0.221	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	-57.7	-177.1	-48	0	0	0	0	112.5	L367 V410	L367-T383 HydrophobicContact CB-CG2 3.8Å; L367-T383 HydrophobicContact CD1-CG2 4.17Å; T383-V410 WeakPolarHBondContact O-CB 3.33Å; T383-V410 WeakPolarHBondContact O-CG2 3.49Å; T383-V410 PolarHBondContact O-N 3.48Å
384	A	94.8	Very high	74	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	141.5	-173.8	0	0	0	0	0	112.3	L363 R364 V410	L363-A384 HydrophobicContact CB-CB 3.76Å; L363-A384 HydrophobicContact CD1-CB 4.13Å; R364-A384 VanDerWaalsContact CD-O 3.26Å; R364-A384 WeakPolarHBondContact CD-O 3.46Å; R364-A384 HydrophobicContact CG-CB 4.27Å; R364-A384 WeakPolarHBondContact CG-O 3.28Å; R364-A384 PolarHBondContact NH1-O 2.67Å; A384-V410 VanDerWaalsContact CA-O 3.27Å; A384-V410 WeakPolarHBondContact CA-O 3.48Å; A384-V410 HydrophobicContact CB-CB 3.9Å; A384-V410 HydrophobicContact CB-CG1 4.43Å
385	E	96.7	Very high	76.1	Confident	56 Å²	56	70.5 Å²	70.5	26%	0.262	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	149.7	172	-72.4	-71	-167.3	0	0	111.7	R364 T382 V399 L408 V410 V412	R364-E385 IonicContact NH1-OE2 3.5Å; R364-E385 PolarHBondContact NH1-OE2 3.42Å; T382-E385 HydrophobicContact CG2-CG 4.08Å; E385-V399 HydrophobicContact CB-CG1 4Å; E385-V399 HydrophobicContact CB-CG2 4.04Å; E385-V399 HydrophobicContact CG-CG2 4.46Å; E385-L408 HydrophobicContact CB-CD1 4.14Å; E385-L408 HydrophobicContact CB-CD2 3.83Å; E385-L408 HydrophobicContact CG-CD1 3.92Å; E385-L408 HydrophobicContact CG-CD2 4.15Å; E385-V410 PolarHBondContact N-O 3.21Å; E385-V410 VanDerWaalsContact N-O 3.09Å; E385-V412 PolarHBondContact O-N 3.09Å
386	A	96.8	Very high	78.2	Confident	9 Å²	9	66.3 Å²	66.3	7%	0.074	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	149.1	175.8	0	0	0	0	0	111.2	E357 A360 M391 V412	E357-A386 HydrophobicContact CG-CB 4.16Å; A360-A386 HydrophobicContact CB-CB 4.09Å; A386-M391 WeakPolarHBondContact O-CE 3.47Å; A386-V412 CarbonylContact C-O 3.6Å; A386-V412 VanDerWaalsContact CA-O 3.23Å; A386-V412 WeakPolarHBondContact CA-O 3.38Å
387	Y	93.3	Very high	80.1	Confident	8 Å²	8	68 Å²	68	3%	0.031	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	117.4	171.3	-170.5	-72.7	0	0	0	111.6	M391 R396 V399 Q400 V412 A413 T414 F417	Y387-M391 VanDerWaalsContact CA-SD 3.54Å; Y387-R396 HydrophobicContact CD2-CB 4.24Å; Y387-R396 HydrophobicContact CD2-CG 4.36Å; Y387-R396 HydrophobicContact CE2-CB 3.5Å; Y387-R396 HydrophobicContact CE2-CG 3.92Å; Y387-R396 WeakPolarHBondContact CE2-O 3.35Å; Y387-V399 HydrophobicContact CD2-CB 4.28Å; Y387-V399 HydrophobicContact CD2-CG1 4.15Å; Y387-Q400 HydrophobicContact CE2-CB 4.41Å; Y387-V412 PolarHBondContact N-O 3.39Å; Y387-A413 WeakPolarHBondContact O-CA 3.18Å; Y387-A413 VanDerWaalsContact O-CB 3.28Å; Y387-A413 WeakPolarHBondContact O-CB 3.4Å; Y387-T414 PolarHBondContact O-N 2.9Å; Y387-F417 HydrophobicContact CD1-CB 3.4Å; Y387-F417 VanDerWaalsContact CD1-CB 3.4Å; Y387-F417 AromaticContact CD1-CD2 3.51Å; Y387-F417 HydrophobicContact CD1-CD2 3.51Å; Y387-F417 AromaticContact CD1-CG 3.87Å; Y387-F417 HydrophobicContact CD1-CG 3.87Å; Y387-F417 AromaticContact CD2-CD2 3.42Å; Y387-F417 HydrophobicContact CD2-CD2 3.42Å; Y387-F417 VanDerWaalsContact CD2-CD2 3.42Å; Y387-F417 AromaticContact CD2-CE2 3.8Å; Y387-F417 HydrophobicContact CD2-CE2 3.8Å; Y387-F417 HydrophobicContact CD2-CG 4.4Å; Y387-F417 HydrophobicContact CE1-CB 3.88Å; Y387-F417 AromaticContact CE1-CD2 3.71Å; Y387-F417 HydrophobicContact CE1-CD2 3.71Å; Y387-F417 HydrophobicContact CE1-CG 4.3Å; Y387-F417 AromaticContact CE2-CD2 3.63Å; Y387-F417 HydrophobicContact CE2-CD2 3.63Å; Y387-F417 HydrophobicContact CE2-CE2 4Å; Y387-F417 HydrophobicContact CG-CB 3.89Å; Y387-F417 AromaticContact CG-CD2 3.34Å; Y387-F417 HydrophobicContact CG-CD2 3.34Å; Y387-F417 HydrophobicContact CG-CE2 4.13Å; Y387-F417 AromaticContact CG-CG 3.9Å; Y387-F417 HydrophobicContact CG-CG 3.9Å; Y387-F417 AromaticContact CZ-CD2 3.76Å
388	H	90.9	Very high	82	Confident	9 Å²	9	74 Å²	74	4%	0.042	36%	0.361	C	S	.	.			trans	-153.6	164.4	174	52.8	95.6	0	0	0	111.9	R353 T356 E357 G390 M391 R396 T414	R353-H388 HydrophobicContact CB-CB 4.29Å; R353-H388 HydrophobicContact CG-CB 4Å; T356-H388 PolarHBondContact OG1-CD2 3.49Å; E357-H388 IonicContact OE1-CE1 3.45Å; E357-H388 PolarHBondContact OE1-CE1 2.97Å; E357-H388 IonicContact OE1-NE2 3.29Å; E357-H388 PolarHBondContact OE1-NE2 3.25Å; E357-H388 VanDerWaalsContact OE1-NE2 3.15Å; H388-G390 PolarHBondContact ND1-N 3.27Å; H388-G390 PolarHBondContact O-N 2.94Å; H388-G390 VanDerWaalsContact O-N 3.08Å; H388-M391 PolarHBondContact N-SD 3.44Å; H388-M391 WeakPolarHBondContact NE2-CG 3.37Å; H388-M391 PolarHBondContact O-N 3.48Å; H388-M391 VanDerWaalsContact O-N 3.12Å; H388-R396 WeakPolarHBondContact O-CD 3.48Å; H388-T414 HydrophobicContact CB-CG2 4.21Å
389	A	84	Confident	83.8	Confident	52 Å²	52	62.4 Å²	62.4	43%	0.43	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-20.2	-178.5	0	0	0	0	0	114.4
390	G	85.4	Confident	85.4	Confident	50 Å²	50	61.4 Å²	61.4	52%	0.515	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-18.1	177.4	0	0	0	0	0	114.9	H388	H388-G390 PolarHBondContact ND1-N 3.27Å; H388-G390 PolarHBondContact O-N 2.94Å; H388-G390 VanDerWaalsContact O-N 3.08Å
391	M	87.3	Confident	86.7	Confident	31 Å²	31	68 Å²	68	15%	0.153	33%	0.327	C	S	.	.	S	Bend	trans	-73	156.7	177.1	-60	172.4	74.1	0	0	110.9	A386 Y387 H388 E395 R396 V399	A386-M391 WeakPolarHBondContact O-CE 3.47Å; Y387-M391 VanDerWaalsContact CA-SD 3.54Å; H388-M391 PolarHBondContact N-SD 3.44Å; H388-M391 WeakPolarHBondContact NE2-CG 3.37Å; H388-M391 PolarHBondContact O-N 3.48Å; H388-M391 VanDerWaalsContact O-N 3.12Å; M391-E395 HydrophobicContact CE-CB 3.91Å; M391-R396 HydrophobicContact CB-CG 3.88Å; M391-R396 PolarHBondContact O-NH1 2.95Å; M391-V399 HydrophobicContact CE-CG2 4.37Å
392	C	86.1	Confident	88	Confident	55 Å²	55	60 Å²	60	37%	0.372	30%	0.296	S	S	.	.			trans	-71.2	152.4	175.6	76.8	0	0	0	0	111.4	R394 E395 R396	C392-R394 PolarHBondContact O-N 2.88Å; C392-R394 VanDerWaalsContact O-N 3.08Å; C392-E395 PolarHBondContact N-OE2 3.06Å; C392-E395 PolarHBondContact O-N 2.89Å; C392-E395 VanDerWaalsContact SG-CG 3.5Å; C392-E395 PolarHBondContact SG-OE2 3.43Å; C392-R396 PolarHBondContact O-N 2.96Å; C392-R396 VanDerWaalsContact O-N 3.14Å
393	S	80	Confident	88.7	Confident	56 Å²	56	57.6 Å²	57.6	39%	0.392	28%	0.281	S	S	.	.	H	α-helix	trans	-57.2	-30.4	-177.3	-50.8	0	0	0	0	113.4	R396 R397	S393-R396 PolarHBondContact OG-NH2 3.36Å; S393-R397 WeakPolarHBondContact O-CG 3.47Å; S393-R397 PolarHBondContact O-N 2.83Å; S393-R397 VanDerWaalsContact O-N 3.15Å
394	R	84	Confident	88.8	Confident	186 Å²	186	59.7 Å²	59.7	70%	0.702	29%	0.29	S	S	*	.	H	α-helix	trans	-65.1	-44.2	176.1	-178.9	-179.8	65.6	167.2	0.5	112.1	C392 R398	C392-R394 PolarHBondContact O-N 2.88Å; C392-R394 VanDerWaalsContact O-N 3.08Å; R394-R398 PolarHBondContact O-N 3.2Å; R394-R398 VanDerWaalsContact O-N 3.11Å
395	E	89	Confident	88.6	Confident	85 Å²	85	65.1 Å²	65.1	40%	0.397	32%	0.315	S	S	.	.	H	α-helix	trans	-69.9	-43.7	-179.6	-72	159.4	167.5	0	0	111.1	M391 C392 R397 R398 V399	M391-E395 HydrophobicContact CE-CB 3.91Å; C392-E395 PolarHBondContact N-OE2 3.06Å; C392-E395 PolarHBondContact O-N 2.89Å; C392-E395 VanDerWaalsContact SG-CG 3.5Å; C392-E395 PolarHBondContact SG-OE2 3.43Å; E395-R397 VanDerWaalsContact C-N 3.35Å; E395-R397 PolarHBondContact O-N 2.97Å; E395-R398 WeakPolarHBondContact O-CB 3.14Å; E395-R398 PolarHBondContact O-N 3.11Å; E395-R398 VanDerWaalsContact O-N 3.07Å; E395-V399 WeakPolarHBondContact O-CG2 3.32Å; E395-V399 PolarHBondContact O-N 2.94Å
396	R	86.7	Confident	88.2	Confident	50 Å²	50	63.8 Å²	63.8	19%	0.189	32%	0.316	C	S	.	.	H	α-helix	trans	-54.6	-49.8	174.9	-67.4	-162.6	-51.1	-98.9	2.9	111.8	Y387 H388 M391 C392 S393 R398 V399 Q400	Y387-R396 HydrophobicContact CD2-CB 4.24Å; Y387-R396 HydrophobicContact CD2-CG 4.36Å; Y387-R396 HydrophobicContact CE2-CB 3.5Å; Y387-R396 HydrophobicContact CE2-CG 3.92Å; Y387-R396 WeakPolarHBondContact CE2-O 3.35Å; H388-R396 WeakPolarHBondContact O-CD 3.48Å; M391-R396 HydrophobicContact CB-CG 3.88Å; M391-R396 PolarHBondContact O-NH1 2.95Å; C392-R396 PolarHBondContact O-N 2.96Å; C392-R396 VanDerWaalsContact O-N 3.14Å; S393-R396 PolarHBondContact OG-NH2 3.36Å; R396-R398 VanDerWaalsContact C-N 3.31Å; R396-R398 PolarHBondContact O-N 3.33Å; R396-V399 PolarHBondContact O-N 3.36Å; R396-Q400 WeakPolarHBondContact O-CB 3.37Å; R396-Q400 PolarHBondContact O-N 3.32Å
397	R	83.3	Confident	87.9	Confident	121 Å²	121	67.5 Å²	67.5	46%	0.457	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-38.6	175.9	-76.1	-171.3	-65.1	-101.2	4.2	113	S393 E395 R401	S393-R397 WeakPolarHBondContact O-CG 3.47Å; S393-R397 PolarHBondContact O-N 2.83Å; S393-R397 VanDerWaalsContact O-N 3.15Å; E395-R397 VanDerWaalsContact C-N 3.35Å; E395-R397 PolarHBondContact O-N 2.97Å; R397-R401 WeakPolarHBondContact O-CB 3.24Å; R397-R401 PolarHBondContact O-N 3.34Å
398	R	89.6	Confident	87.9	Confident	180 Å²	180	67.2 Å²	67.2	68%	0.679	33%	0.331	S	S	*	.	H	α-helix	trans	-64.4	-49.1	177.2	179.9	-173	170.7	-157.8	-5.2	111.3	R394 E395 R396 R401 A402	R394-R398 PolarHBondContact O-N 3.2Å; R394-R398 VanDerWaalsContact O-N 3.11Å; E395-R398 WeakPolarHBondContact O-CB 3.14Å; E395-R398 PolarHBondContact O-N 3.11Å; E395-R398 VanDerWaalsContact O-N 3.07Å; R396-R398 VanDerWaalsContact C-N 3.31Å; R396-R398 PolarHBondContact O-N 3.33Å; R398-R401 PolarHBondContact O-N 3.42Å; R398-A402 WeakPolarHBondContact O-CB 3.31Å; R398-A402 PolarHBondContact O-N 2.95Å
399	V	91.3	Very high	88	Confident	10 Å²	10	67.6 Å²	67.6	6%	0.061	33%	0.332	C	S	.	.	H	α-helix	trans	-62.4	-48.7	-179.6	172.1	0	0	0	0	110.5	E385 Y387 M391 E395 R396 R401 A402 F403 L408 V411	E385-V399 HydrophobicContact CB-CG1 4Å; E385-V399 HydrophobicContact CB-CG2 4.04Å; E385-V399 HydrophobicContact CG-CG2 4.46Å; Y387-V399 HydrophobicContact CD2-CB 4.28Å; Y387-V399 HydrophobicContact CD2-CG1 4.15Å; M391-V399 HydrophobicContact CE-CG2 4.37Å; E395-V399 WeakPolarHBondContact O-CG2 3.32Å; E395-V399 PolarHBondContact O-N 2.94Å; R396-V399 PolarHBondContact O-N 3.36Å; V399-R401 PolarHBondContact O-N 2.91Å; V399-A402 PolarHBondContact O-N 3.31Å; V399-F403 PolarHBondContact O-N 2.96Å; V399-L408 HydrophobicContact CG1-CD2 3.88Å; V399-V411 HydrophobicContact CG1-CG1 4.33Å; V399-V411 HydrophobicContact CG1-CG2 4.3Å
400	Q	88	Confident	88.6	Confident	30 Å²	30	65.1 Å²	65.1	14%	0.14	31%	0.312	C	S	.	.	H	α-helix	trans	-59.4	-48.2	177.2	-176.2	-179.9	-19.8	0	0	111.7	D182 Y387 R396 A402 F403 M404 F417 L421	D182-Q400 PolarHBondContact OD2-NE2 3.22Å; Y387-Q400 HydrophobicContact CE2-CB 4.41Å; R396-Q400 WeakPolarHBondContact O-CB 3.37Å; R396-Q400 PolarHBondContact O-N 3.32Å; Q400-A402 PolarHBondContact O-N 3.1Å; Q400-F403 PolarHBondContact O-N 2.98Å; Q400-M404 HydrophobicContact CG-CG 4.41Å; Q400-M404 VanDerWaalsContact O-CG 3.25Å; Q400-M404 WeakPolarHBondContact O-CG 3.14Å; Q400-M404 PolarHBondContact O-N 2.86Å; Q400-F417 HydrophobicContact CB-CE2 4.28Å; Q400-F417 HydrophobicContact CG-CE2 4.4Å; Q400-L421 HydrophobicContact CG-CD1 4.3Å
401	R	87.6	Confident	89.1	Confident	164 Å²	164	62.8 Å²	62.8	62%	0.619	29%	0.287	S	S	*	.	H	α-helix	trans	-59.7	-43.8	177.3	-177.7	-178.9	-67.1	177.1	-3.5	112.2	R397 R398 V399 F403 M404 Q405	R397-R401 WeakPolarHBondContact O-CB 3.24Å; R397-R401 PolarHBondContact O-N 3.34Å; R398-R401 PolarHBondContact O-N 3.42Å; V399-R401 PolarHBondContact O-N 2.91Å; R401-F403 VanDerWaalsContact C-N 3.31Å; R401-F403 PolarHBondContact O-N 2.94Å; R401-M404 PolarHBondContact O-N 2.82Å; R401-Q405 HydrophobicContact CG-CG 4.37Å; R401-Q405 WeakPolarHBondContact O-CB 3.28Å; R401-Q405 VanDerWaalsContact O-CG 3.28Å; R401-Q405 WeakPolarHBondContact O-CG 3.18Å; R401-Q405 PolarHBondContact O-N 2.85Å
402	A	91.1	Very high	89.6	Confident	21 Å²	21	61.3 Å²	61.3	17%	0.174	28%	0.28	C	S	.	.	H	α-helix	trans	-62.6	-39.5	178.1	0	0	0	0	0	111.7	R398 V399 Q400 Q405 G406 Q407 L408	R398-A402 WeakPolarHBondContact O-CB 3.31Å; R398-A402 PolarHBondContact O-N 2.95Å; V399-A402 PolarHBondContact O-N 3.31Å; Q400-A402 PolarHBondContact O-N 3.1Å; A402-Q405 PolarHBondContact O-N 3.5Å; A402-G406 PolarHBondContact O-N 3.31Å; A402-Q407 HydrophobicContact CB-CB 4.43Å; A402-Q407 PolarHBondContact O-N 2.71Å; A402-L408 HydrophobicContact CB-CB 4.07Å; A402-L408 PolarHBondContact O-N 3.29Å
403	F	91.6	Very high	90	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.3	-44.6	173.9	-171.4	-108.8	0	0	0	112	I347 V399 Q400 R401 Q405 G406 L408 V411 F417 L421 R423 V426	I347-F403 HydrophobicContact CD1-CE1 4.29Å; I347-F403 HydrophobicContact CD1-CZ 4.36Å; I347-F403 HydrophobicContact CG1-CE1 4.27Å; I347-F403 HydrophobicContact CG1-CZ 3.89Å; V399-F403 PolarHBondContact O-N 2.96Å; Q400-F403 PolarHBondContact O-N 2.98Å; R401-F403 VanDerWaalsContact C-N 3.31Å; R401-F403 PolarHBondContact O-N 2.94Å; F403-Q405 VanDerWaalsContact C-N 3.25Å; F403-Q405 PolarHBondContact O-N 3.48Å; F403-G406 PolarHBondContact O-N 3.36Å; F403-L408 HydrophobicContact CB-CB 4.49Å; F403-L408 HydrophobicContact CB-CD2 4.32Å; F403-L408 WeakPolarHBondContact CD2-O 3.27Å; F403-V411 HydrophobicContact CB-CG2 3.76Å; F403-V411 HydrophobicContact CD1-CG2 4.35Å; F403-V411 HydrophobicContact CD2-CG2 3.43Å; F403-V411 VanDerWaalsContact CD2-CG2 3.43Å; F403-V411 HydrophobicContact CE2-CG2 4.06Å; F403-V411 HydrophobicContact CG-CG2 3.59Å; F403-F417 HydrophobicContact CD1-CE1 4.48Å; F403-F417 HydrophobicContact CD1-CZ 4.11Å; F403-F417 HydrophobicContact CG-CZ 4.48Å; F403-L421 HydrophobicContact CD1-CD1 4.33Å; F403-L421 HydrophobicContact CD1-CD2 4.27Å; F403-L421 HydrophobicContact CE1-CD2 3.98Å; F403-R423 PolarHBondContact O-NH1 3.11Å; F403-V426 HydrophobicContact CE1-CG2 3.97Å; F403-V426 HydrophobicContact CZ-CG2 4.1Å
404	M	87.8	Confident	90.4	Very high	81 Å²	81	56.9 Å²	56.9	40%	0.399	25%	0.249	S	C	.	.	H	α-helix	trans	-62.1	-32.2	177	-68	-62.3	-66.3	0	0	112.8	Q400 R401 G406 L421 D422 R423	Q400-M404 HydrophobicContact CG-CG 4.41Å; Q400-M404 VanDerWaalsContact O-CG 3.25Å; Q400-M404 WeakPolarHBondContact O-CG 3.14Å; Q400-M404 PolarHBondContact O-N 2.86Å; R401-M404 PolarHBondContact O-N 2.82Å; M404-G406 VanDerWaalsContact C-N 3.31Å; M404-L421 HydrophobicContact CG-CD1 4.39Å; M404-L421 HydrophobicContact SD-CD1 3.55Å; M404-L421 VanDerWaalsContact SD-CD1 3.55Å; M404-D422 WeakPolarHBondContact CE-O 3.39Å; M404-R423 HydrophobicContact CE-CB 4.31Å; M404-R423 HydrophobicContact SD-CB 3.75Å
405	Q	89.5	Confident	90.1	Very high	114 Å²	114	51 Å²	51	53%	0.533	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	5	179.8	-69	178.1	-5.6	0	0	113.9	R401 A402 F403 Q407	R401-Q405 HydrophobicContact CG-CG 4.37Å; R401-Q405 WeakPolarHBondContact O-CB 3.28Å; R401-Q405 VanDerWaalsContact O-CG 3.28Å; R401-Q405 WeakPolarHBondContact O-CG 3.18Å; R401-Q405 PolarHBondContact O-N 2.85Å; A402-Q405 PolarHBondContact O-N 3.5Å; F403-Q405 VanDerWaalsContact C-N 3.25Å; F403-Q405 PolarHBondContact O-N 3.48Å; Q405-Q407 HydrophobicContact CB-CG 4.11Å; Q405-Q407 PolarHBondContact O-N 3.42Å
406	G	89.1	Confident	89.3	Confident	27 Å²	27	48.5 Å²	48.5	28%	0.278	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	16.7	-176.6	0	0	0	0	0	114.4	A402 F403 M404	A402-G406 PolarHBondContact O-N 3.31Å; F403-G406 PolarHBondContact O-N 3.36Å; M404-G406 VanDerWaalsContact C-N 3.31Å
407	Q	91.1	Very high	88.8	Confident	88 Å²	88	46.3 Å²	46.3	41%	0.411	22%	0.219	S	C	.	.			trans	-88.3	-15.4	179.6	-65.3	170.7	10.6	0	0	112.9	P380 K381 T382 A402 Q405	P380-Q407 CarbonylContact C-O 3.58Å; K381-Q407 PolarHBondContact N-O 3.42Å; T382-Q407 PolarHBondContact N-O 2.94Å; T382-Q407 VanDerWaalsContact N-O 3.09Å; A402-Q407 HydrophobicContact CB-CB 4.43Å; A402-Q407 PolarHBondContact O-N 2.71Å; Q405-Q407 HydrophobicContact CB-CG 4.11Å; Q405-Q407 PolarHBondContact O-N 3.42Å
408	L	92.3	Very high	87.7	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.4	179.7	174.8	62.2	0	0	0	109.3	T382 E385 V399 A402 F403 V410 V411	T382-L408 HydrophobicContact CG2-CD1 3.81Å; T382-L408 WeakPolarHBondContact O-CA 3.39Å; E385-L408 HydrophobicContact CB-CD1 4.14Å; E385-L408 HydrophobicContact CB-CD2 3.83Å; E385-L408 HydrophobicContact CG-CD1 3.92Å; E385-L408 HydrophobicContact CG-CD2 4.15Å; V399-L408 HydrophobicContact CG1-CD2 3.88Å; A402-L408 HydrophobicContact CB-CB 4.07Å; A402-L408 PolarHBondContact O-N 3.29Å; F403-L408 HydrophobicContact CB-CB 4.49Å; F403-L408 HydrophobicContact CB-CD2 4.32Å; F403-L408 WeakPolarHBondContact CD2-O 3.27Å; L408-V410 WeakPolarHBondContact CD1-O 3.45Å; L408-V411 HydrophobicContact CD2-CG2 3.54Å; L408-V411 HydrophobicContact CG-CG2 4.26Å
409	R	93.3	Very high	86.5	Confident	18 Å²	18	34.2 Å²	34.2	7%	0.068	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	-51.6	-179	178.9	177.7	178.7	-150.6	-2.2	112.6	F340 Q341 L343 D344 S345 I346 P380 T382	F340-R409 PolarHBondContact O-NH2 3.02Å; Q341-R409 PolarHBondContact O-NH2 2.92Å; L343-R409 PolarHBondContact O-NE 3.11Å; L343-R409 PolarHBondContact O-NH2 2.96Å; D344-R409 WeakPolarHBondContact O-CA 3.24Å; S345-R409 WeakPolarHBondContact CA-O 3.35Å; I346-R409 PolarHBondContact N-O 2.94Å; P380-R409 HydrophobicContact CB-CB 4.24Å; P380-R409 HydrophobicContact CG-CB 3.95Å; T382-R409 PolarHBondContact O-N 3.45Å
410	V	95.9	Very high	85	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	130.1	-174.3	-171	0	0	0	0	111.1	I346 I348 L363 T383 A384 E385 L408 V412	I346-V410 HydrophobicContact CB-CG1 4.38Å; I346-V410 HydrophobicContact CB-CG2 4.18Å; I346-V410 HydrophobicContact CD1-CG2 4.45Å; I346-V410 CarbonylContact O-C 3.55Å; I346-V410 VanDerWaalsContact O-CA 3.32Å; I346-V410 WeakPolarHBondContact O-CA 3.23Å; I348-V410 HydrophobicContact CD1-CG1 3.58Å; I348-V410 HydrophobicContact CG1-CG1 3.8Å; L363-V410 HydrophobicContact CD1-CG1 3.95Å; T383-V410 WeakPolarHBondContact O-CB 3.33Å; T383-V410 WeakPolarHBondContact O-CG2 3.49Å; T383-V410 PolarHBondContact O-N 3.48Å; A384-V410 VanDerWaalsContact CA-O 3.27Å; A384-V410 WeakPolarHBondContact CA-O 3.48Å; A384-V410 HydrophobicContact CB-CB 3.9Å; A384-V410 HydrophobicContact CB-CG1 4.43Å; E385-V410 PolarHBondContact N-O 3.21Å; E385-V410 VanDerWaalsContact N-O 3.09Å; L408-V410 WeakPolarHBondContact CD1-O 3.45Å; V410-V412 HydrophobicContact CG1-CG2 4.04Å
411	V	96.4	Very high	84.3	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	121.3	163.6	-179.6	0	0	0	0	108.7	I346 I347 I348 V399 F403 L408 A413 F417	I346-V411 PolarHBondContact O-N 3.01Å; I347-V411 CarbonylContact C-O 3.54Å; I347-V411 WeakPolarHBondContact CA-O 3.42Å; I348-V411 PolarHBondContact N-O 2.97Å; V399-V411 HydrophobicContact CG1-CG1 4.33Å; V399-V411 HydrophobicContact CG1-CG2 4.3Å; F403-V411 HydrophobicContact CB-CG2 3.76Å; F403-V411 HydrophobicContact CD1-CG2 4.35Å; F403-V411 HydrophobicContact CD2-CG2 3.43Å; F403-V411 VanDerWaalsContact CD2-CG2 3.43Å; F403-V411 HydrophobicContact CE2-CG2 4.06Å; F403-V411 HydrophobicContact CG-CG2 3.59Å; L408-V411 HydrophobicContact CD2-CG2 3.54Å; L408-V411 HydrophobicContact CG-CG2 4.26Å; V411-A413 HydrophobicContact CG1-CB 4.24Å; V411-F417 HydrophobicContact CB-CD1 4.14Å; V411-F417 HydrophobicContact CB-CE1 3.61Å; V411-F417 HydrophobicContact CB-CZ 3.99Å; V411-F417 HydrophobicContact CG1-CD1 3.54Å; V411-F417 HydrophobicContact CG1-CD2 4.18Å; V411-F417 HydrophobicContact CG1-CE1 3.4Å; V411-F417 VanDerWaalsContact CG1-CE1 3.4Å; V411-F417 HydrophobicContact CG1-CE2 4.05Å; V411-F417 HydrophobicContact CG1-CG 3.94Å; V411-F417 HydrophobicContact CG1-CZ 3.67Å; V411-F417 HydrophobicContact CG2-CE1 3.92Å; V411-F417 HydrophobicContact CG2-CZ 3.81Å
412	V	97.6	Very high	83.7	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119.6	175.5	-169.8	0	0	0	0	108.1	I348 T356 I359 A360 L363 E385 A386 Y387 V410	I348-V412 HydrophobicContact CB-CG1 4.25Å; I348-V412 HydrophobicContact CB-CG2 4.38Å; I348-V412 HydrophobicContact CD1-CG2 4.41Å; I348-V412 HydrophobicContact CG2-CG1 4.33Å; I348-V412 CarbonylContact O-C 3.49Å; I348-V412 WeakPolarHBondContact O-CA 3.18Å; T356-V412 HydrophobicContact CG2-CG1 4.47Å; I359-V412 HydrophobicContact CB-CG1 3.91Å; I359-V412 HydrophobicContact CG2-CG1 3.79Å; I359-V412 HydrophobicContact CG2-CG2 4.03Å; A360-V412 HydrophobicContact CB-CB 4.23Å; A360-V412 HydrophobicContact CB-CG2 4Å; L363-V412 HydrophobicContact CD1-CG2 4.1Å; E385-V412 PolarHBondContact O-N 3.09Å; A386-V412 CarbonylContact C-O 3.6Å; A386-V412 VanDerWaalsContact CA-O 3.23Å; A386-V412 WeakPolarHBondContact CA-O 3.38Å; Y387-V412 PolarHBondContact N-O 3.39Å; V410-V412 HydrophobicContact CG1-CG2 4.04Å
413	A	94.6	Very high	83.5	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	161	-167.1	0	0	0	0	0	115.1	I348 Y349 C350 Y387 V411 F417	I348-A413 PolarHBondContact O-N 2.94Å; Y349-A413 CarbonylContact C-O 3.46Å; Y349-A413 VanDerWaalsContact CA-O 3.26Å; Y349-A413 WeakPolarHBondContact CA-O 3.5Å; C350-A413 PolarHBondContact N-O 2.92Å; Y387-A413 WeakPolarHBondContact O-CA 3.18Å; Y387-A413 VanDerWaalsContact O-CB 3.28Å; Y387-A413 WeakPolarHBondContact O-CB 3.4Å; V411-A413 HydrophobicContact CG1-CB 4.24Å; A413-F417 HydrophobicContact CB-CB 3.15Å; A413-F417 HydrophobicContact CB-CD1 4.06Å; A413-F417 HydrophobicContact CB-CG 3.86Å
414	T	89.8	Confident	83.2	Confident	18 Å²	18	34.7 Å²	34.7	11%	0.11	20%	0.202	C	C	.	.			trans	-80.7	174.7	160.1	67.4	0	0	0	0	109.8	C350 R353 T356 Y387 H388 A416 F417	C350-T414 WeakPolarHBondContact O-CA 3.02Å; R353-T414 HydrophobicContact CG-CG2 4.13Å; T356-T414 HydrophobicContact CG2-CG2 3.87Å; Y387-T414 PolarHBondContact O-N 2.9Å; H388-T414 HydrophobicContact CB-CG2 4.21Å; T414-A416 PolarHBondContact O-N 3.13Å; T414-A416 WeakPolarHBondContact OG1-CB 3.43Å; T414-A416 PolarHBondContact OG1-N 3.21Å; T414-F417 PolarHBondContact O-N 2.97Å
415	V	77.4	Confident	83.4	Confident	64 Å²	64	33.5 Å²	33.5	39%	0.388	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-19.1	174.1	-176.5	0	0	0	0	112.9	F417	V415-F417 PolarHBondContact O-N 3.2Å
416	A	72.1	Confident	83.6	Confident	32 Å²	32	28.1 Å²	28.1	26%	0.264	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-26.9	172.4	0	0	0	0	0	114.5	T414	T414-A416 PolarHBondContact O-N 3.13Å; T414-A416 WeakPolarHBondContact OG1-CB 3.43Å; T414-A416 PolarHBondContact OG1-N 3.21Å
417	F	74.6	Confident	84	Confident	3 Å²	3	29 Å²	29	1%	0.013	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	100.9	171.2	-169.9	-111	0	0	0	109.3	I347 Y349 Y387 Q400 F403 V411 A413 T414 V415 L421	I347-F417 HydrophobicContact CD1-CE1 4.15Å; I347-F417 HydrophobicContact CG1-CE1 4.26Å; I347-F417 HydrophobicContact CG2-CD1 4.1Å; I347-F417 HydrophobicContact CG2-CE1 4.46Å; Y349-F417 WeakPolarHBondContact CE1-O 3.5Å; Y349-F417 VanDerWaalsContact CZ-O 3.27Å; Y349-F417 PolarHBondContact OH-O 2.94Å; Y387-F417 HydrophobicContact CD1-CB 3.4Å; Y387-F417 VanDerWaalsContact CD1-CB 3.4Å; Y387-F417 AromaticContact CD1-CD2 3.51Å; Y387-F417 HydrophobicContact CD1-CD2 3.51Å; Y387-F417 AromaticContact CD1-CG 3.87Å; Y387-F417 HydrophobicContact CD1-CG 3.87Å; Y387-F417 AromaticContact CD2-CD2 3.42Å; Y387-F417 HydrophobicContact CD2-CD2 3.42Å; Y387-F417 VanDerWaalsContact CD2-CD2 3.42Å; Y387-F417 AromaticContact CD2-CE2 3.8Å; Y387-F417 HydrophobicContact CD2-CE2 3.8Å; Y387-F417 HydrophobicContact CD2-CG 4.4Å; Y387-F417 HydrophobicContact CE1-CB 3.88Å; Y387-F417 AromaticContact CE1-CD2 3.71Å; Y387-F417 HydrophobicContact CE1-CD2 3.71Å; Y387-F417 HydrophobicContact CE1-CG 4.3Å; Y387-F417 AromaticContact CE2-CD2 3.63Å; Y387-F417 HydrophobicContact CE2-CD2 3.63Å; Y387-F417 HydrophobicContact CE2-CE2 4Å; Y387-F417 HydrophobicContact CG-CB 3.89Å; Y387-F417 AromaticContact CG-CD2 3.34Å; Y387-F417 HydrophobicContact CG-CD2 3.34Å; Y387-F417 HydrophobicContact CG-CE2 4.13Å; Y387-F417 AromaticContact CG-CG 3.9Å; Y387-F417 HydrophobicContact CG-CG 3.9Å; Y387-F417 AromaticContact CZ-CD2 3.76Å; Q400-F417 HydrophobicContact CB-CE2 4.28Å; Q400-F417 HydrophobicContact CG-CE2 4.4Å; F403-F417 HydrophobicContact CD1-CE1 4.48Å; F403-F417 HydrophobicContact CD1-CZ 4.11Å; F403-F417 HydrophobicContact CG-CZ 4.48Å; V411-F417 HydrophobicContact CB-CD1 4.14Å; V411-F417 HydrophobicContact CB-CE1 3.61Å; V411-F417 HydrophobicContact CB-CZ 3.99Å; V411-F417 HydrophobicContact CG1-CD1 3.54Å; V411-F417 HydrophobicContact CG1-CD2 4.18Å; V411-F417 HydrophobicContact CG1-CE1 3.4Å; V411-F417 VanDerWaalsContact CG1-CE1 3.4Å; V411-F417 HydrophobicContact CG1-CE2 4.05Å; V411-F417 HydrophobicContact CG1-CG 3.94Å; V411-F417 HydrophobicContact CG1-CZ 3.67Å; V411-F417 HydrophobicContact CG2-CE1 3.92Å; V411-F417 HydrophobicContact CG2-CZ 3.81Å; A413-F417 HydrophobicContact CB-CB 3.15Å; A413-F417 HydrophobicContact CB-CD1 4.06Å; A413-F417 HydrophobicContact CB-CG 3.86Å; T414-F417 PolarHBondContact O-N 2.97Å; V415-F417 PolarHBondContact O-N 3.2Å; F417-L421 HydrophobicContact CD1-CD2 4.46Å; F417-L421 HydrophobicContact CE1-CD2 3.71Å; F417-L421 HydrophobicContact CZ-CD1 4.15Å; F417-L421 HydrophobicContact CZ-CD2 3.91Å
418	G	61.7	Low	84.3	Confident	3 Å²	3	24.8 Å²	24.8	3%	0.031	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	166.2	-54.3	173.8	0	0	0	0	0	112.1	G420 L421 R447	G418-G420 PolarHBondContact O-N 2.86Å; G418-L421 WeakPolarHBondContact O-CB 3.45Å; G418-L421 PolarHBondContact O-N 3.36Å; G418-R447 VanDerWaalsContact CA-NE 3.26Å; G418-R447 PolarHBondContact O-NH1 3.39Å; G418-R447 PolarHBondContact O-NH2 2.8Å
419	M	63.2	Low	84.5	Confident	45 Å²	45	24.7 Å²	24.7	22%	0.222	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	115.6	-178	-55.4	175	-82.5	0	0	108.3	L176 L179	L176-M419 HydrophobicContact CD1-CB 3.49Å; L176-M419 VanDerWaalsContact CD1-CB 3.49Å; L176-M419 HydrophobicContact CD1-CE 4.44Å; L176-M419 HydrophobicContact CD1-CG 4.06Å; L176-M419 HydrophobicContact CD1-SD 3.59Å; L176-M419 VanDerWaalsContact CD1-SD 3.59Å; L176-M419 HydrophobicContact CD2-CB 4.2Å; L176-M419 HydrophobicContact CD2-CE 3.22Å; L176-M419 HydrophobicContact CD2-CG 4.47Å; L176-M419 HydrophobicContact CD2-SD 3.46Å; L176-M419 WeakPolarHBondContact CD2-SD 3.38Å; L176-M419 HydrophobicContact CG-CB 4.42Å; L176-M419 HydrophobicContact CG-CE 4.44Å; L176-M419 HydrophobicContact CG-SD 4.13Å; L179-M419 HydrophobicContact CD1-CB 3.87Å; L179-M419 WeakPolarHBondContact CD1-O 3.3Å; L179-M419 WeakPolarHBondContact CG-O 3.41Å
420	G	60.4	Low	84.7	Confident	41 Å²	41	23.9 Å²	23.9	42%	0.423	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.7	-3.5	-175.1	0	0	0	0	0	118.3	L179 G418 D422	L179-G420 VanDerWaalsContact CG-CA 3.47Å; G418-G420 PolarHBondContact O-N 2.86Å; G420-D422 PolarHBondContact O-N 3.33Å
421	L	72.5	Confident	84.8	Confident	9 Å²	9	24.4 Å²	24.4	5%	0.047	15%	0.146	C	C	.	.			trans	-70.8	121.4	169.3	-172.4	71.5	0	0	0	109.2	I347 Q400 F403 M404 F417 G418 R450	I347-L421 HydrophobicContact CD1-CD2 3.67Å; Q400-L421 HydrophobicContact CG-CD1 4.3Å; F403-L421 HydrophobicContact CD1-CD1 4.33Å; F403-L421 HydrophobicContact CD1-CD2 4.27Å; F403-L421 HydrophobicContact CE1-CD2 3.98Å; M404-L421 HydrophobicContact CG-CD1 4.39Å; M404-L421 HydrophobicContact SD-CD1 3.55Å; M404-L421 VanDerWaalsContact SD-CD1 3.55Å; F417-L421 HydrophobicContact CD1-CD2 4.46Å; F417-L421 HydrophobicContact CE1-CD2 3.71Å; F417-L421 HydrophobicContact CZ-CD1 4.15Å; F417-L421 HydrophobicContact CZ-CD2 3.91Å; G418-L421 WeakPolarHBondContact O-CB 3.45Å; G418-L421 PolarHBondContact O-N 3.36Å; L421-R450 PolarHBondContact O-NH1 3.07Å; L421-R450 PolarHBondContact O-NH2 2.89Å
422	D	75.7	Confident	84.8	Confident	101 Å²	101	25.4 Å²	25.4	54%	0.54	15%	0.151	S	C	.	.			trans	-126.6	61.9	178.2	-160.4	18.8	0	0	0	112.5	M404 G420 R450	M404-D422 WeakPolarHBondContact CE-O 3.39Å; G420-D422 PolarHBondContact O-N 3.33Å; D422-R450 IonicContact OD1-CZ 3.69Å; D422-R450 IonicContact OD1-NH1 2.91Å; D422-R450 PolarHBondContact OD1-NH1 3.39Å
423	R	86.4	Confident	84.6	Confident	13 Å²	13	25.6 Å²	25.6	5%	0.049	15%	0.153	C	C	.	.			trans	-94.4	119.6	168.9	-177.8	171.1	177.6	-170.3	-6.7	108.7	F403 M404 D425 V426	F403-R423 PolarHBondContact O-NH1 3.11Å; M404-R423 HydrophobicContact CE-CB 4.31Å; M404-R423 HydrophobicContact SD-CB 3.75Å; R423-D425 WeakPolarHBondContact CG-OD1 3.36Å; R423-D425 IonicContact CZ-OD1 3.88Å; R423-D425 IonicContact CZ-OD2 3.35Å; R423-D425 IonicContact NE-OD1 2.72Å; R423-D425 PolarHBondContact NE-OD1 2.62Å; R423-D425 IonicContact NE-OD2 3.81Å; R423-D425 PolarHBondContact NE-OD2 2.86Å; R423-D425 IonicContact NH2-OD1 3.46Å; R423-D425 IonicContact NH2-OD2 2.91Å; R423-D425 PolarHBondContact NH2-OD2 3.27Å; R423-D425 PolarHBondContact O-N 3.42Å; R423-V426 HydrophobicContact CB-CG2 3.89Å; R423-V426 HydrophobicContact CG-CG2 4.03Å
424	P	86.8	Confident	84.6	Confident	70 Å²	70	25.6 Å²	25.6	46%	0.455	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-33.1	-174.3	25.7	-33.4	0	0	0	113.1	V426 R450 D451	P424-V426 PolarHBondContact O-N 3.42Å; P424-R450 PolarHBondContact O-N 3.27Å; P424-D451 HydrophobicContact CB-CB 4.49Å; P424-D451 PolarHBondContact O-N 3.04Å
425	D	91	Very high	84.8	Confident	56 Å²	56	24.8 Å²	24.8	30%	0.299	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	31.8	-167.6	66.4	-51.4	0	0	0	113.7	S345 R423 R427	S345-D425 PolarHBondContact OG-O 3.15Å; R423-D425 WeakPolarHBondContact CG-OD1 3.36Å; R423-D425 IonicContact CZ-OD1 3.88Å; R423-D425 IonicContact CZ-OD2 3.35Å; R423-D425 IonicContact NE-OD1 2.72Å; R423-D425 PolarHBondContact NE-OD1 2.62Å; R423-D425 IonicContact NE-OD2 3.81Å; R423-D425 PolarHBondContact NE-OD2 2.86Å; R423-D425 IonicContact NH2-OD1 3.46Å; R423-D425 IonicContact NH2-OD2 2.91Å; R423-D425 PolarHBondContact NH2-OD2 3.27Å; R423-D425 PolarHBondContact O-N 3.42Å; D425-R427 VanDerWaalsContact C-CZ 3.49Å; D425-R427 VanDerWaalsContact CA-NH1 3.31Å; D425-R427 PolarHBondContact O-N 3.08Å; D425-R427 PolarHBondContact O-NH1 2.85Å
426	V	94.6	Very high	85.4	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.006	15%	0.146	C	C	.	.			trans	-71.8	122	173	177.3	0	0	0	0	109.6	S345 I347 F403 R423 P424 V429 R447 A448 G449	S345-V426 WeakPolarHBondContact OG-CA 3.08Å; I347-V426 HydrophobicContact CD1-CG1 4.1Å; I347-V426 HydrophobicContact CG1-CG1 4.23Å; F403-V426 HydrophobicContact CE1-CG2 3.97Å; F403-V426 HydrophobicContact CZ-CG2 4.1Å; R423-V426 HydrophobicContact CB-CG2 3.89Å; R423-V426 HydrophobicContact CG-CG2 4.03Å; P424-V426 PolarHBondContact O-N 3.42Å; V426-V429 HydrophobicContact CG1-CG2 4.38Å; V426-R447 WeakPolarHBondContact CB-O 3.45Å; V426-A448 HydrophobicContact CG1-CB 4.24Å; V426-A448 CarbonylContact O-C 3.35Å; V426-A448 VanDerWaalsContact O-CA 3.31Å; V426-A448 WeakPolarHBondContact O-CA 3.38Å; V426-G449 PolarHBondContact O-N 3.35Å
427	R	96	Very high	86.3	Confident	45 Å²	45	22.8 Å²	22.8	17%	0.17	13%	0.134	C	C	.	.			trans	-95.2	-28.1	-172.4	-65.7	-66.1	75.5	97.1	2.5	114.4	L343 S345 D425 D451 A455 H456	L343-R427 HydrophobicContact CB-CB 3.99Å; L343-R427 HydrophobicContact CD1-CB 4.24Å; L343-R427 HydrophobicContact CD2-CB 3.99Å; L343-R427 HydrophobicContact CD2-CG 4.36Å; L343-R427 HydrophobicContact CG-CB 4.27Å; S345-R427 PolarHBondContact O-N 2.91Å; S345-R427 WeakPolarHBondContact OG-CG 3.48Å; S345-R427 PolarHBondContact OG-N 2.92Å; D425-R427 VanDerWaalsContact C-CZ 3.49Å; D425-R427 VanDerWaalsContact CA-NH1 3.31Å; D425-R427 PolarHBondContact O-N 3.08Å; D425-R427 PolarHBondContact O-NH1 2.85Å; R427-D451 IonicContact CZ-OD1 3.69Å; R427-D451 IonicContact CZ-OD2 3.71Å; R427-D451 VanDerWaalsContact CZ-OD2 3.23Å; R427-D451 IonicContact NH1-OD2 3.63Å; R427-D451 PolarHBondContact NH1-OD2 3.5Å; R427-D451 IonicContact NH2-OD1 3.9Å; R427-D451 PolarHBondContact NH2-OD1 3.26Å; R427-D451 IonicContact NH2-OD2 3.82Å; R427-D451 PolarHBondContact NH2-OD2 2.91Å; R427-A455 WeakPolarHBondContact O-CA 3.02Å; R427-H456 PolarHBondContact O-N 2.87Å
428	A	97.1	Very high	87.2	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	146.8	178	0	0	0	0	0	114.5	F340 L343 S345 I346 I347 H456	F340-A428 HydrophobicContact CD1-CB 3.96Å; F340-A428 HydrophobicContact CE1-CB 3.74Å; L343-A428 HydrophobicContact CD1-CB 3.9Å; S345-A428 PolarHBondContact O-N 3.09Å; S345-A428 VanDerWaalsContact O-N 3.11Å; I346-A428 WeakPolarHBondContact CA-O 3.16Å; I346-A428 HydrophobicContact CB-CB 4.44Å; I346-A428 HydrophobicContact CG1-CB 4.16Å; I346-A428 HydrophobicContact CG2-CB 4.01Å; I347-A428 PolarHBondContact N-O 3.15Å; A428-H456 WeakPolarHBondContact CA-O 3.46Å; A428-H456 VanDerWaalsContact CB-O 3.3Å; A428-H456 WeakPolarHBondContact CB-O 3.37Å
429	V	97.3	Very high	88.6	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	118.1	171.4	174.1	0	0	0	0	108.7	I347 Y349 V426 V445 A448 H456 C457 H458	I347-V429 HydrophobicContact CB-CG2 4.36Å; I347-V429 CarbonylContact O-C 3.53Å; I347-V429 WeakPolarHBondContact O-CA 3.37Å; Y349-V429 HydrophobicContact CD2-CG1 3.82Å; Y349-V429 HydrophobicContact CE2-CG1 3.84Å; V426-V429 HydrophobicContact CG1-CG2 4.38Å; V429-V445 HydrophobicContact CG1-CG1 4.27Å; V429-A448 HydrophobicContact CG2-CB 3.95Å; V429-H456 PolarHBondContact N-O 3.35Å; V429-C457 WeakPolarHBondContact O-CA 3.46Å; V429-H458 PolarHBondContact O-N 2.98Å; V429-H458 VanDerWaalsContact O-N 3.16Å
430	L	98.2	Very high	89.8	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	143.3	-179.9	-47.2	-178.3	0	0	0	109.8	L331 L334 L335 F340 I346 I347 I348 Y349 H458	L331-L430 HydrophobicContact CD1-CD1 3.6Å; L334-L430 HydrophobicContact CD2-CD2 4.39Å; L335-L430 HydrophobicContact CD2-CD1 3.91Å; L335-L430 HydrophobicContact CG-CD1 4.46Å; F340-L430 HydrophobicContact CD1-CD2 4.37Å; F340-L430 HydrophobicContact CE1-CD2 3.65Å; F340-L430 HydrophobicContact CZ-CD2 4.1Å; I346-L430 HydrophobicContact CG2-CD1 4.12Å; I346-L430 HydrophobicContact CG2-CG 4.14Å; I347-L430 PolarHBondContact O-N 3.36Å; I348-L430 CarbonylContact C-O 3.58Å; I348-L430 WeakPolarHBondContact CA-O 3.1Å; I348-L430 HydrophobicContact CD1-CD1 4.13Å; I348-L430 HydrophobicContact CG1-CB 4.17Å; I348-L430 HydrophobicContact CG1-CD1 4.03Å; I348-L430 HydrophobicContact CG1-CG 4.32Å; I348-L430 HydrophobicContact CG2-CB 4.39Å; Y349-L430 PolarHBondContact N-O 3.33Å; L430-H458 CarbonylContact C-O 3.59Å; L430-H458 VanDerWaalsContact CA-O 3.27Å; L430-H458 WeakPolarHBondContact CA-O 3.39Å; L430-H458 HydrophobicContact CD2-CB 3.74Å
431	H	97.7	Very high	91.4	Very high	11 Å²	11	19.3 Å²	19.3	5%	0.051	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.7	173.3	-79.3	-98.6	0	0	0	110.1	Y349 Y441 A444 H458 L459 F460	Y349-H431 AromaticContact CD2-CE1 3.71Å; Y349-H431 AromaticContact CD2-NE2 3.69Å; H431-Y441 AromaticContact CD2-CD2 3.93Å; H431-Y441 AromaticContact CD2-CE2 3.92Å; H431-Y441 AromaticContact NE2-CD2 3.86Å; H431-A444 WeakPolarHBondContact NE2-CB 3.37Å; H431-H458 PolarHBondContact N-O 3.29Å; H431-L459 HydrophobicContact CB-CB 4.45Å; H431-L459 HydrophobicContact CB-CD1 3.47Å; H431-L459 VanDerWaalsContact CB-CD1 3.47Å; H431-F460 PolarHBondContact O-N 2.99Å
432	L	96.1	Very high	92.3	Very high	21 Å²	21	19.3 Å²	19.3	11%	0.11	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	90.9	172.5	-54	-169.7	0	0	0	108.9	T327 L331 I348 Y349 I359 F460	T327-L432 HydrophobicContact CG2-CD2 4.05Å; L331-L432 HydrophobicContact CD1-CD2 4.41Å; L331-L432 HydrophobicContact CD2-CD1 4.15Å; L331-L432 HydrophobicContact CD2-CD2 4.36Å; I348-L432 HydrophobicContact CG2-CD1 3.83Å; I348-L432 HydrophobicContact CG2-CD2 4.22Å; I348-L432 HydrophobicContact CG2-CG 3.69Å; Y349-L432 PolarHBondContact O-N 3.49Å; I359-L432 HydrophobicContact CD1-CD1 3.87Å; I359-L432 HydrophobicContact CG1-CD1 3.8Å; I359-L432 HydrophobicContact CG2-CD1 4.25Å; L432-F460 HydrophobicContact CD2-CD2 3.47Å; L432-F460 VanDerWaalsContact CD2-CD2 3.47Å; L432-F460 HydrophobicContact CD2-CE2 3.95Å; L432-F460 HydrophobicContact CD2-CG 4.31Å
433	G	93.6	Very high	92.9	Very high	4 Å²	4	15 Å²	15	4%	0.041	8%	0.084	C	C	.	.	S	Bend	trans	103.6	157.1	-175.4	0	0	0	0	0	113.5	L459 F460	G433-L459 WeakPolarHBondContact O-CD1 3.35Å; G433-F460 VanDerWaalsContact CA-O 3.24Å; G433-F460 WeakPolarHBondContact CA-O 3.46Å; G433-F460 PolarHBondContact N-O 3.38Å
434	L	94.1	Very high	93.1	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.084	C	C	.	.			trans	-50.9	127.8	178.4	-175.7	67.8	0	0	0	112.4	L461 D467 L468 L471 T716 F717 F720	L434-L461 HydrophobicContact CB-CD2 4.07Å; L434-L461 HydrophobicContact CD1-CD2 3.75Å; L434-D467 HydrophobicContact CB-CB 4.09Å; L434-D467 WeakPolarHBondContact CB-OD2 3.28Å; L434-D467 PolarHBondContact N-OD2 2.98Å; L434-L468 HydrophobicContact CD2-CB 4.02Å; L434-L468 HydrophobicContact CD2-CD1 3.89Å; L434-L471 HydrophobicContact CB-CD1 4.16Å; L434-L471 HydrophobicContact CD2-CD1 4.02Å; L434-L471 HydrophobicContact CG-CD1 4.13Å; L434-L471 WeakPolarHBondContact O-CD1 3.34Å; L434-T716 HydrophobicContact CD1-CG2 4.19Å; L434-F717 HydrophobicContact CD1-CB 4.35Å; L434-F717 HydrophobicContact CD1-CD2 4.37Å; L434-F717 HydrophobicContact CD2-CB 3.93Å; L434-F717 HydrophobicContact CD2-CD2 4.08Å; L434-F717 HydrophobicContact CD2-CG 4.49Å; L434-F720 HydrophobicContact CD1-CD2 3.72Å; L434-F720 HydrophobicContact CD1-CE2 4.36Å
435	P	93.7	Very high	93.4	Very high	2 Å²	2	11.4 Å²	11.4	1%	0.013	6%	0.063	C	C	.	.			trans	-66.7	146.3	168	-18.5	31.8	0	0	0	111.3	S437 Y441 L459 F720	P435-S437 PolarHBondContact O-N 3.09Å; P435-Y441 HydrophobicContact CB-CD2 4.48Å; P435-Y441 HydrophobicContact CG-CD2 3.63Å; P435-Y441 HydrophobicContact CG-CG 4.2Å; P435-L459 HydrophobicContact CG-CD1 4.32Å; P435-F720 HydrophobicContact CG-CE2 4.09Å; P435-F720 HydrophobicContact CG-CZ 4.34Å
436	P	90.6	Very high	93.4	Very high	51 Å²	51	9.1 Å²	9.1	33%	0.331	5%	0.052	S	C	.	.	S	Bend	trans	-69.3	-18.3	-176.9	28.8	-36.2	0	0	0	114	L471 L713	P436-L471 HydrophobicContact CB-CD2 4.12Å; P436-L713 WeakPolarHBondContact O-CD2 3.4Å
437	S	91.9	Very high	93.1	Very high	3 Å²	3	9.5 Å²	9.5	2%	0.021	5%	0.053	C	C	.	.			trans	-162.4	166.5	176.1	82.9	0	0	0	0	111.8	H258 P435 E439 S440 Y441	H258-S437 WeakPolarHBondContact CB-OG 3.36Å; P435-S437 PolarHBondContact O-N 3.09Å; S437-E439 VanDerWaalsContact C-N 3.33Å; S437-E439 WeakPolarHBondContact CB-OE2 3.26Å; S437-E439 PolarHBondContact OG-N 3.2Å; S437-E439 PolarHBondContact OG-OE2 2.83Å; S437-S440 PolarHBondContact O-N 2.77Å; S437-S440 PolarHBondContact OG-N 3.5Å; S437-Y441 PolarHBondContact O-N 2.91Å; S437-Y441 VanDerWaalsContact O-N 3.16Å
438	F	92.4	Very high	93	Very high	6 Å²	6	7.4 Å²	7.4	3%	0.026	5%	0.046	C	C	.	.	H	α-helix	trans	-64.2	-37.7	173.8	-66.2	-44.6	0	0	0	112.6	Y441 V442 R715 T716 A719 F720 L747 Y750	F438-Y441 PolarHBondContact O-N 3.14Å; F438-V442 WeakPolarHBondContact O-CB 3.17Å; F438-V442 WeakPolarHBondContact O-CG2 3.35Å; F438-V442 PolarHBondContact O-N 3.07Å; F438-R715 HydrophobicContact CE2-CG 4.13Å; F438-T716 HydrophobicContact CD1-CG2 4.11Å; F438-T716 HydrophobicContact CE1-CG2 4.06Å; F438-A719 HydrophobicContact CE1-CB 3.69Å; F438-A719 HydrophobicContact CZ-CB 3.47Å; F438-A719 VanDerWaalsContact CZ-CB 3.47Å; F438-F720 HydrophobicContact CD1-CE2 4.31Å; F438-F720 HydrophobicContact CD1-CZ 4.23Å; F438-F720 HydrophobicContact CE1-CE2 4.27Å; F438-F720 HydrophobicContact CE1-CZ 4.38Å; F438-L747 HydrophobicContact CB-CD2 3.93Å; F438-L747 HydrophobicContact CD1-CD2 3.37Å; F438-L747 HydrophobicContact CE1-CD2 3.98Å; F438-L747 HydrophobicContact CG-CD2 3.75Å; F438-Y750 HydrophobicContact CB-CD1 3.84Å; F438-Y750 HydrophobicContact CB-CE1 3.79Å; F438-Y750 AromaticContact CD2-CD1 3.61Å; F438-Y750 HydrophobicContact CD2-CD1 3.61Å; F438-Y750 AromaticContact CD2-CD2 3.7Å; F438-Y750 HydrophobicContact CD2-CD2 3.7Å; F438-Y750 AromaticContact CD2-CE1 3.84Å; F438-Y750 HydrophobicContact CD2-CE1 3.84Å; F438-Y750 AromaticContact CD2-CE2 3.94Å; F438-Y750 HydrophobicContact CD2-CE2 3.94Å; F438-Y750 AromaticContact CD2-CG 3.52Å; F438-Y750 HydrophobicContact CD2-CG 3.52Å; F438-Y750 HydrophobicContact CE2-CD2 4.05Å; F438-Y750 HydrophobicContact CE2-CE2 4.49Å; F438-Y750 HydrophobicContact CE2-CG 4.09Å; F438-Y750 HydrophobicContact CG-CD1 4.16Å; F438-Y750 HydrophobicContact CG-CE1 4.33Å; F438-Y750 HydrophobicContact CG-CG 4.44Å
439	E	90.5	Very high	92.7	Very high	1 Å²	1	7.6 Å²	7.6	1%	0.005	5%	0.048	C	C	.	.	H	α-helix	trans	-60.9	-46.7	176.9	-55.2	99	129.7	0	0	111.3	H258 S437 Y441 V442 Q443 Y750 F751	H258-E439 HydrophobicContact CB-CB 4.34Å; H258-E439 WeakPolarHBondContact CE1-CB 3.37Å; H258-E439 IonicContact CG-OE1 3.94Å; H258-E439 WeakPolarHBondContact ND1-CB 3.27Å; H258-E439 WeakPolarHBondContact ND1-CG 3.49Å; H258-E439 IonicContact ND1-OE1 2.78Å; S437-E439 VanDerWaalsContact C-N 3.33Å; S437-E439 WeakPolarHBondContact CB-OE2 3.26Å; S437-E439 PolarHBondContact OG-N 3.2Å; S437-E439 PolarHBondContact OG-OE2 2.83Å; E439-Y441 VanDerWaalsContact C-N 3.28Å; E439-Y441 PolarHBondContact O-N 2.85Å; E439-V442 PolarHBondContact O-N 3.5Å; E439-Q443 VanDerWaalsContact O-CB 3.27Å; E439-Q443 WeakPolarHBondContact O-CB 3.34Å; E439-Q443 PolarHBondContact O-N 2.96Å; E439-Y750 HydrophobicContact CG-CE1 4.4Å; E439-Y750 PolarHBondContact OE1-OH 3.04Å; E439-F751 HydrophobicContact CB-CZ 4.49Å; E439-F751 HydrophobicContact CG-CE1 3.83Å; E439-F751 HydrophobicContact CG-CZ 4.01Å
440	S	90.2	Very high	92.3	Very high	11 Å²	11	10.3 Å²	10.3	8%	0.077	6%	0.058	C	C	.	.	H	α-helix	trans	-61.6	-38.5	176.3	-179.9	0	0	0	0	111.8	S437 A444	S437-S440 PolarHBondContact O-N 2.77Å; S437-S440 PolarHBondContact OG-N 3.5Å; S440-A444 WeakPolarHBondContact O-CB 3.47Å; S440-A444 PolarHBondContact O-N 3.43Å
441	Y	93.1	Very high	91.9	Very high	1 Å²	1	13.2 Å²	13.2	0%	0.004	7%	0.074	C	C	.	.	H	α-helix	trans	-67.5	-51.9	176.9	179.8	-105.8	0	0	0	111.8	L319 H431 P435 S437 F438 E439 Q443 A444 V445 F720 L747	L319-Y441 HydrophobicContact CD1-CE1 4.42Å; H431-Y441 AromaticContact CD2-CD2 3.93Å; H431-Y441 AromaticContact CD2-CE2 3.92Å; H431-Y441 AromaticContact NE2-CD2 3.86Å; P435-Y441 HydrophobicContact CB-CD2 4.48Å; P435-Y441 HydrophobicContact CG-CD2 3.63Å; P435-Y441 HydrophobicContact CG-CG 4.2Å; S437-Y441 PolarHBondContact O-N 2.91Å; S437-Y441 VanDerWaalsContact O-N 3.16Å; F438-Y441 PolarHBondContact O-N 3.14Å; E439-Y441 VanDerWaalsContact C-N 3.28Å; E439-Y441 PolarHBondContact O-N 2.85Å; Y441-Q443 VanDerWaalsContact C-N 3.33Å; Y441-Q443 PolarHBondContact O-N 3.46Å; Y441-A444 WeakPolarHBondContact O-CB 3.26Å; Y441-A444 PolarHBondContact O-N 3.28Å; Y441-V445 HydrophobicContact CD1-CG1 4.43Å; Y441-V445 HydrophobicContact CD1-CG2 4.41Å; Y441-V445 HydrophobicContact CD2-CG1 4.08Å; Y441-V445 HydrophobicContact CE1-CG1 4.03Å; Y441-V445 HydrophobicContact CE1-CG2 4.25Å; Y441-V445 HydrophobicContact CE2-CG1 3.67Å; Y441-V445 HydrophobicContact CG-CG1 4.47Å; Y441-V445 WeakPolarHBondContact O-CG2 3.33Å; Y441-V445 PolarHBondContact O-N 2.9Å; Y441-F720 AromaticContact CD1-CE1 3.94Å; Y441-F720 HydrophobicContact CD1-CE1 3.94Å; Y441-F720 AromaticContact CD1-CZ 3.71Å; Y441-F720 HydrophobicContact CD1-CZ 3.71Å; Y441-F720 HydrophobicContact CD2-CE1 4.35Å; Y441-F720 AromaticContact CD2-CZ 3.95Å; Y441-F720 HydrophobicContact CD2-CZ 3.95Å; Y441-F720 AromaticContact CE1-CE1 3.81Å; Y441-F720 HydrophobicContact CE1-CE1 3.81Å; Y441-F720 HydrophobicContact CE1-CZ 4.07Å; Y441-F720 HydrophobicContact CE2-CE1 4.21Å; Y441-F720 HydrophobicContact CE2-CZ 4.27Å; Y441-F720 HydrophobicContact CG-CE1 4.2Å; Y441-F720 AromaticContact CG-CZ 3.63Å; Y441-F720 HydrophobicContact CG-CZ 3.63Å; Y441-F720 AromaticContact CZ-CE1 3.93Å; Y441-L747 HydrophobicContact CD1-CD1 4.14Å; Y441-L747 HydrophobicContact CE1-CD1 4.02Å
442	V	91.8	Very high	91.4	Very high	8 Å²	8	14.9 Å²	14.9	5%	0.048	9%	0.094	C	C	.	.	H	α-helix	trans	-60.4	-42.1	-179.8	170.4	0	0	0	0	111.4	T286 P312 V313 F438 E439 A444 G446 L747 F751	T286-V442 HydrophobicContact CG2-CG1 4.38Å; P312-V442 HydrophobicContact CB-CG1 4.23Å; P312-V442 WeakPolarHBondContact O-CG1 3.39Å; V313-V442 HydrophobicContact CG2-CG1 4.45Å; V313-V442 HydrophobicContact CG2-CG2 3.99Å; F438-V442 WeakPolarHBondContact O-CB 3.17Å; F438-V442 WeakPolarHBondContact O-CG2 3.35Å; F438-V442 PolarHBondContact O-N 3.07Å; E439-V442 PolarHBondContact O-N 3.5Å; V442-A444 VanDerWaalsContact C-N 3.28Å; V442-A444 PolarHBondContact O-N 2.84Å; V442-G446 PolarHBondContact O-N 3.36Å; V442-L747 HydrophobicContact CG2-CD1 4.17Å; V442-L747 HydrophobicContact CG2-CD2 4.29Å; V442-F751 HydrophobicContact CB-CE2 4.32Å; V442-F751 HydrophobicContact CB-CZ 4.31Å; V442-F751 HydrophobicContact CG2-CE2 3.79Å; V442-F751 HydrophobicContact CG2-CZ 4.21Å
443	Q	88.4	Confident	91.3	Very high	11 Å²	11	19.2 Å²	19.2	5%	0.051	11%	0.113	C	C	.	.	H	α-helix	trans	-61.8	-37.9	176	-160	-171.1	20.1	0	0	111.9	T147 E249 T286 E439 Y441	T147-Q443 HydrophobicContact CG2-CG 3.74Å; E249-Q443 PolarHBondContact OE1-NE2 2.92Å; T286-Q443 HydrophobicContact CG2-CB 3.86Å; T286-Q443 HydrophobicContact CG2-CG 4.36Å; E439-Q443 VanDerWaalsContact O-CB 3.27Å; E439-Q443 WeakPolarHBondContact O-CB 3.34Å; E439-Q443 PolarHBondContact O-N 2.96Å; Y441-Q443 VanDerWaalsContact C-N 3.33Å; Y441-Q443 PolarHBondContact O-N 3.46Å
444	A	90.4	Very high	91.4	Very high	6 Å²	6	22.5 Å²	22.5	5%	0.05	13%	0.134	C	C	.	.	H	α-helix	trans	-72	-49.7	178.6	0	0	0	0	0	112.2	Y349 H431 S440 Y441 V442 R447	Y349-A444 HydrophobicContact CD2-CB 3.92Å; Y349-A444 HydrophobicContact CE2-CB 3.54Å; H431-A444 WeakPolarHBondContact NE2-CB 3.37Å; S440-A444 WeakPolarHBondContact O-CB 3.47Å; S440-A444 PolarHBondContact O-N 3.43Å; Y441-A444 WeakPolarHBondContact O-CB 3.26Å; Y441-A444 PolarHBondContact O-N 3.28Å; V442-A444 VanDerWaalsContact C-N 3.28Å; V442-A444 PolarHBondContact O-N 2.84Å; A444-R447 VanDerWaalsContact O-CB 3.31Å; A444-R447 WeakPolarHBondContact O-CB 3.33Å; A444-R447 VanDerWaalsContact O-CG 3.25Å; A444-R447 WeakPolarHBondContact O-CG 3.27Å; A444-R447 PolarHBondContact O-N 3.25Å
445	V	92.8	Very high	91.5	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-70.4	-32.7	-178.3	-60.5	0	0	0	0	112.6	L317 V429 Y441 R447 A448 C457	L317-V445 HydrophobicContact CD2-CB 4.05Å; L317-V445 HydrophobicContact CD2-CG2 4.06Å; L317-V445 WeakPolarHBondContact CD2-O 3.41Å; V429-V445 HydrophobicContact CG1-CG1 4.27Å; Y441-V445 HydrophobicContact CD1-CG1 4.43Å; Y441-V445 HydrophobicContact CD1-CG2 4.41Å; Y441-V445 HydrophobicContact CD2-CG1 4.08Å; Y441-V445 HydrophobicContact CE1-CG1 4.03Å; Y441-V445 HydrophobicContact CE1-CG2 4.25Å; Y441-V445 HydrophobicContact CE2-CG1 3.67Å; Y441-V445 HydrophobicContact CG-CG1 4.47Å; Y441-V445 WeakPolarHBondContact O-CG2 3.33Å; Y441-V445 PolarHBondContact O-N 2.9Å; V445-R447 PolarHBondContact O-N 3.16Å; V445-A448 WeakPolarHBondContact O-CB 3.5Å; V445-A448 PolarHBondContact O-N 3.07Å; V445-C457 HydrophobicContact CB-CB 4.39Å; V445-C457 HydrophobicContact CG1-CB 3.89Å
446	G	89.9	Confident	91.7	Very high	7 Å²	7	23.8 Å²	23.8	7%	0.072	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	2.8	174.7	0	0	0	0	0	114.8	T147 V442 R450	T147-G446 VanDerWaalsContact OG1-CA 3.32Å; T147-G446 WeakPolarHBondContact OG1-CA 3.24Å; T147-G446 PolarHBondContact OG1-O 3.49Å; V442-G446 PolarHBondContact O-N 3.36Å; G446-R450 PolarHBondContact O-NE 3.13Å
447	R	89.4	Confident	92	Very high	9 Å²	9	21.3 Å²	21.3	3%	0.034	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-24.6	166.3	-59.6	-178	-166.1	-55.8	-4	112.3	I347 Y349 G418 V426 A444 V445	I347-R447 HydrophobicContact CD1-CB 4.48Å; Y349-R447 VanDerWaalsContact OH-CD 3.28Å; Y349-R447 WeakPolarHBondContact OH-CD 3.48Å; Y349-R447 PolarHBondContact OH-NE 3.46Å; G418-R447 VanDerWaalsContact CA-NE 3.26Å; G418-R447 PolarHBondContact O-NH1 3.39Å; G418-R447 PolarHBondContact O-NH2 2.8Å; V426-R447 WeakPolarHBondContact CB-O 3.45Å; A444-R447 VanDerWaalsContact O-CB 3.31Å; A444-R447 WeakPolarHBondContact O-CB 3.33Å; A444-R447 VanDerWaalsContact O-CG 3.25Å; A444-R447 WeakPolarHBondContact O-CG 3.27Å; A444-R447 PolarHBondContact O-N 3.25Å; V445-R447 PolarHBondContact O-N 3.16Å
448	A	92.9	Very high	92.3	Very high	2 Å²	2	21.2 Å²	21.2	2%	0.017	12%	0.123	C	C	.	.	S	Bend	trans	-84.3	152.5	178.1	0	0	0	0	0	111.5	V426 V429 V445 R450 A455	V426-A448 HydrophobicContact CG1-CB 4.24Å; V426-A448 CarbonylContact O-C 3.35Å; V426-A448 VanDerWaalsContact O-CA 3.31Å; V426-A448 WeakPolarHBondContact O-CA 3.38Å; V429-A448 HydrophobicContact CG2-CB 3.95Å; V445-A448 WeakPolarHBondContact O-CB 3.5Å; V445-A448 PolarHBondContact O-N 3.07Å; A448-R450 VanDerWaalsContact C-N 3.34Å; A448-R450 PolarHBondContact O-N 3.22Å; A448-A455 HydrophobicContact CB-CB 3.68Å
449	G	91.8	Very high	92.6	Very high	4 Å²	4	20.9 Å²	20.9	4%	0.041	12%	0.122	C	C	.	.			trans	63.4	31.1	168.7	0	0	0	0	0	115.3	N316 V426 D451 G452	N316-G449 WeakPolarHBondContact ND2-CA 3.44Å; N316-G449 PolarHBondContact ND2-O 3.34Å; V426-G449 PolarHBondContact O-N 3.35Å; G449-D451 PolarHBondContact O-N 2.96Å; G449-G452 PolarHBondContact O-N 3.44Å
450	R	88.4	Confident	92.9	Very high	56 Å²	56	20.9 Å²	20.9	21%	0.211	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-21.5	-179.9	-72.7	-173.2	177.7	173.9	12.4	113.6	L421 D422 P424 G446 A448 G452	L421-R450 PolarHBondContact O-NH1 3.07Å; L421-R450 PolarHBondContact O-NH2 2.89Å; D422-R450 IonicContact OD1-CZ 3.69Å; D422-R450 IonicContact OD1-NH1 2.91Å; D422-R450 PolarHBondContact OD1-NH1 3.39Å; P424-R450 PolarHBondContact O-N 3.27Å; G446-R450 PolarHBondContact O-NE 3.13Å; A448-R450 VanDerWaalsContact C-N 3.34Å; A448-R450 PolarHBondContact O-N 3.22Å; R450-G452 PolarHBondContact O-N 2.95Å
451	D	89.3	Confident	93.2	Very high	62 Å²	62	20.3 Å²	20.3	33%	0.332	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	0.9	169.5	59	1.8	0	0	0	113.6	P424 R427 G449 Q453	P424-D451 HydrophobicContact CB-CB 4.49Å; P424-D451 PolarHBondContact O-N 3.04Å; R427-D451 IonicContact CZ-OD1 3.69Å; R427-D451 IonicContact CZ-OD2 3.71Å; R427-D451 VanDerWaalsContact CZ-OD2 3.23Å; R427-D451 IonicContact NH1-OD2 3.63Å; R427-D451 PolarHBondContact NH1-OD2 3.5Å; R427-D451 IonicContact NH2-OD1 3.9Å; R427-D451 PolarHBondContact NH2-OD1 3.26Å; R427-D451 IonicContact NH2-OD2 3.82Å; R427-D451 PolarHBondContact NH2-OD2 2.91Å; G449-D451 PolarHBondContact O-N 2.96Å; D451-Q453 PolarHBondContact O-N 3.37Å; D451-Q453 WeakPolarHBondContact OD1-CB 3.45Å; D451-Q453 PolarHBondContact OD1-N 3.04Å
452	G	88.9	Confident	93	Very high	46 Å²	46	22.7 Å²	22.7	47%	0.474	13%	0.129	S	C	.	.	S	Bend	trans	78.5	-2.5	-177.8	0	0	0	0	0	114.3	N316 G449 R450	N316-G452 WeakPolarHBondContact CB-O 3.35Å; G449-G452 PolarHBondContact O-N 3.44Å; R450-G452 PolarHBondContact O-N 2.95Å
453	Q	93.8	Very high	92.5	Very high	111 Å²	111	24 Å²	24	52%	0.519	14%	0.138	S	C	.	.	S	Bend	trans	-76	156.7	177.2	-62	-59.2	-42.7	0	0	111.1	N316 D451 A455	N316-Q453 PolarHBondContact ND2-O 2.99Å; D451-Q453 PolarHBondContact O-N 3.37Å; D451-Q453 WeakPolarHBondContact OD1-CB 3.45Å; D451-Q453 PolarHBondContact OD1-N 3.04Å; Q453-A455 PolarHBondContact O-N 3.4Å
454	P	94.8	Very high	92	Very high	73 Å²	73	29.4 Å²	29.4	47%	0.474	16%	0.163	S	C	.	.			trans	-51.3	131.9	176.4	-29.1	36.7	0	0	0	112.6
455	A	96.4	Very high	91.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	150.6	173.9	0	0	0	0	0	110.9	N316 L317 H318 R427 A448 Q453	N316-A455 PolarHBondContact O-N 2.87Å; L317-A455 HydrophobicContact CD1-CB 4.45Å; H318-A455 PolarHBondContact N-O 2.98Å; H318-A455 PolarHBondContact ND1-O 3.3Å; H318-A455 VanDerWaalsContact ND1-O 3.11Å; R427-A455 WeakPolarHBondContact O-CA 3.02Å; A448-A455 HydrophobicContact CB-CB 3.68Å; Q453-A455 PolarHBondContact O-N 3.4Å
456	H	97.3	Very high	91.2	Very high	29 Å²	29	34 Å²	34	13%	0.134	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	125.8	-175.1	-57.4	-67.8	0	0	0	111.2	H318 R339 F340 R427 A428 V429 Q735	H318-H456 AromaticContact ND1-CE1 3.92Å; H318-H456 AromaticContact ND1-ND1 3.83Å; R339-H456 PolarHBondContact NE-ND1 3.48Å; R339-H456 VanDerWaalsContact NE-ND1 3.18Å; R339-H456 PolarHBondContact NH2-ND1 3.44Å; F340-H456 HydrophobicContact CE1-CB 3.78Å; F340-H456 HydrophobicContact CZ-CB 3.69Å; R427-H456 PolarHBondContact O-N 2.87Å; A428-H456 WeakPolarHBondContact CA-O 3.46Å; A428-H456 VanDerWaalsContact CB-O 3.3Å; A428-H456 WeakPolarHBondContact CB-O 3.37Å; V429-H456 PolarHBondContact N-O 3.35Å; H456-Q735 PolarHBondContact CE1-OE1 3.32Å; H456-Q735 PolarHBondContact ND1-OE1 3.01Å
457	C	97.7	Very high	91.2	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138	176.6	-56.6	0	0	0	0	110.2	H318 L319 S320 V429 V445	H318-C457 PolarHBondContact O-N 2.85Å; L319-C457 HydrophobicContact CD2-CB 3.72Å; S320-C457 PolarHBondContact N-O 3.26Å; V429-C457 WeakPolarHBondContact O-CA 3.46Å; V445-C457 HydrophobicContact CB-CB 4.39Å; V445-C457 HydrophobicContact CG1-CB 3.89Å
458	H	98.3	Very high	91.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	135.8	179.7	-169.2	72.3	0	0	0	111.9	S320 S322 L334 F340 V429 L430 H431 F460	S320-H458 VanDerWaalsContact O-CA 3.29Å; S320-H458 WeakPolarHBondContact O-CA 3.47Å; S320-H458 PolarHBondContact O-ND1 3.46Å; S320-H458 PolarHBondContact OG-ND1 3.33Å; S322-H458 PolarHBondContact OG-CE1 3.03Å; S322-H458 VanDerWaalsContact OG-CE1 3.31Å; S322-H458 PolarHBondContact OG-NE2 3.21Å; L334-H458 HydrophobicContact CD2-CB 3.89Å; L334-H458 WeakPolarHBondContact CD2-CD2 3.33Å; F340-H458 HydrophobicContact CZ-CB 4.36Å; V429-H458 PolarHBondContact O-N 2.98Å; V429-H458 VanDerWaalsContact O-N 3.16Å; L430-H458 CarbonylContact C-O 3.59Å; L430-H458 VanDerWaalsContact CA-O 3.27Å; L430-H458 WeakPolarHBondContact CA-O 3.39Å; L430-H458 HydrophobicContact CD2-CB 3.74Å; H431-H458 PolarHBondContact N-O 3.29Å; H458-F460 AromaticContact CD2-CD1 3.95Å; H458-F460 AromaticContact CD2-CD2 3.75Å; H458-F460 AromaticContact CD2-CE1 3.65Å; H458-F460 AromaticContact CD2-CE2 3.49Å; H458-F460 VanDerWaalsContact CD2-CE2 3.49Å; H458-F460 WeakPolarHBondContact CD2-CE2 3.43Å; H458-F460 AromaticContact CD2-CZ 3.44Å; H458-F460 VanDerWaalsContact CD2-CZ 3.44Å; H458-F460 WeakPolarHBondContact CD2-CZ 3.36Å; H458-F460 AromaticContact NE2-CD1 3.69Å; H458-F460 AromaticContact NE2-CE1 3.44Å; H458-F460 WeakPolarHBondContact NE2-CE1 3.43Å; H458-F460 AromaticContact NE2-CZ 3.74Å
459	L	98.1	Very high	90.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.7	176.9	169.3	62.5	0	0	0	110	S320 V321 S322 H431 G433 P435 L461 F720	S320-L459 PolarHBondContact O-N 2.96Å; V321-L459 WeakPolarHBondContact CA-O 3.17Å; V321-L459 HydrophobicContact CG1-CB 4.24Å; V321-L459 HydrophobicContact CG1-CD2 4.14Å; V321-L459 HydrophobicContact CG1-CG 4.14Å; V321-L459 HydrophobicContact CG2-CB 4.24Å; V321-L459 HydrophobicContact CG2-CD2 4.46Å; S322-L459 PolarHBondContact N-O 2.86Å; H431-L459 HydrophobicContact CB-CB 4.45Å; H431-L459 HydrophobicContact CB-CD1 3.47Å; H431-L459 VanDerWaalsContact CB-CD1 3.47Å; G433-L459 WeakPolarHBondContact O-CD1 3.35Å; P435-L459 HydrophobicContact CG-CD1 4.32Å; L459-L461 HydrophobicContact CD1-CD2 4.42Å; L459-L461 HydrophobicContact CD2-CD2 3.91Å; L459-L461 HydrophobicContact CD2-CG 4.29Å; L459-L461 HydrophobicContact CG-CD2 4.14Å; L459-L461 HydrophobicContact CG-CG 4.28Å; L459-F720 HydrophobicContact CD2-CB 3.84Å; L459-F720 HydrophobicContact CD2-CD1 3.57Å; L459-F720 HydrophobicContact CD2-CD2 3.72Å; L459-F720 HydrophobicContact CD2-CE1 3.99Å; L459-F720 HydrophobicContact CD2-CE2 4.11Å; L459-F720 HydrophobicContact CD2-CG 3.44Å; L459-F720 VanDerWaalsContact CD2-CG 3.44Å; L459-F720 HydrophobicContact CD2-CZ 4.25Å
460	F	97.6	Very high	90.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	109.4	168.8	-63.1	-82.3	0	0	0	109.4	D324 T327 A330 L331 L334 H431 L432 G433 H458 C728	D324-F460 WeakPolarHBondContact OD2-CD1 3.36Å; T327-F460 HydrophobicContact CG2-CB 3.75Å; T327-F460 HydrophobicContact CG2-CD1 4.42Å; T327-F460 HydrophobicContact CG2-CD2 4.47Å; T327-F460 HydrophobicContact CG2-CG 3.99Å; A330-F460 HydrophobicContact CB-CD1 4.31Å; A330-F460 HydrophobicContact CB-CE1 3.74Å; L331-F460 HydrophobicContact CB-CE2 4.41Å; L331-F460 HydrophobicContact CB-CZ 4.38Å; L331-F460 HydrophobicContact CD1-CE2 4Å; L331-F460 HydrophobicContact CD1-CZ 4.47Å; L334-F460 HydrophobicContact CB-CZ 4.16Å; L334-F460 HydrophobicContact CD2-CE1 4.42Å; L334-F460 HydrophobicContact CD2-CE2 3.98Å; L334-F460 HydrophobicContact CD2-CZ 3.51Å; L334-F460 HydrophobicContact CG-CZ 4.47Å; H431-F460 PolarHBondContact O-N 2.99Å; L432-F460 HydrophobicContact CD2-CD2 3.47Å; L432-F460 VanDerWaalsContact CD2-CD2 3.47Å; L432-F460 HydrophobicContact CD2-CE2 3.95Å; L432-F460 HydrophobicContact CD2-CG 4.31Å; G433-F460 VanDerWaalsContact CA-O 3.24Å; G433-F460 WeakPolarHBondContact CA-O 3.46Å; G433-F460 PolarHBondContact N-O 3.38Å; H458-F460 AromaticContact CD2-CD1 3.95Å; H458-F460 AromaticContact CD2-CD2 3.75Å; H458-F460 AromaticContact CD2-CE1 3.65Å; H458-F460 AromaticContact CD2-CE2 3.49Å; H458-F460 VanDerWaalsContact CD2-CE2 3.49Å; H458-F460 WeakPolarHBondContact CD2-CE2 3.43Å; H458-F460 AromaticContact CD2-CZ 3.44Å; H458-F460 VanDerWaalsContact CD2-CZ 3.44Å; H458-F460 WeakPolarHBondContact CD2-CZ 3.36Å; H458-F460 AromaticContact NE2-CD1 3.69Å; H458-F460 AromaticContact NE2-CE1 3.44Å; H458-F460 WeakPolarHBondContact NE2-CE1 3.43Å; H458-F460 AromaticContact NE2-CZ 3.74Å; F460-C728 HydrophobicContact CE1-CB 4.18Å
461	L	95.6	Very high	90.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.197	C	C	.	.			trans	-83	144.7	170.6	-69.7	178.3	0	0	0	110.2	V321 S322 M323 L434 L459 F720 H721 A724	V321-L461 HydrophobicContact CG1-CD1 3.76Å; V321-L461 HydrophobicContact CG1-CG 3.88Å; S322-L461 PolarHBondContact O-N 2.82Å; M323-L461 HydrophobicContact CG-CB 3.87Å; M323-L461 HydrophobicContact CG-CD1 4.35Å; L434-L461 HydrophobicContact CB-CD2 4.07Å; L434-L461 HydrophobicContact CD1-CD2 3.75Å; L459-L461 HydrophobicContact CD1-CD2 4.42Å; L459-L461 HydrophobicContact CD2-CD2 3.91Å; L459-L461 HydrophobicContact CD2-CG 4.29Å; L459-L461 HydrophobicContact CG-CD2 4.14Å; L459-L461 HydrophobicContact CG-CG 4.28Å; L461-F720 HydrophobicContact CD1-CB 4.1Å; L461-F720 HydrophobicContact CD2-CB 4.47Å; L461-H721 HydrophobicContact CD1-CB 4.47Å; L461-A724 HydrophobicContact CD1-CB 4.34Å
462	Q	90.1	Very high	90.5	Very high	50 Å²	50	34.5 Å²	34.5	23%	0.234	18%	0.184	C	C	.	.			trans	-72.3	127	172.4	-71	-64.1	-42.4	0	0	110.2	T327 Q464 G465 E466 D467	T327-Q462 PolarHBondContact OG1-NE2 2.94Å; Q462-Q464 VanDerWaalsContact C-N 3.26Å; Q462-Q464 PolarHBondContact O-N 2.9Å; Q462-G465 PolarHBondContact O-N 3.46Å; Q462-E466 HydrophobicContact CB-CB 4.46Å; Q462-D467 HydrophobicContact CB-CB 4.25Å; Q462-D467 HydrophobicContact CG-CB 3.94Å; Q462-D467 PolarHBondContact N-OD2 3.12Å
463	P	80.9	Confident	90.4	Very high	36 Å²	36	33.7 Å²	33.7	23%	0.234	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-28.5	-172.2	18.1	-26.2	0	0	0	113.6	D324	D324-P463 WeakPolarHBondContact O-CG 3.43Å
464	Q	78.8	Confident	90	Very high	124 Å²	124	32.6 Å²	32.6	58%	0.579	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.6	8	175.6	-58.3	79	21.2	0	0	113.6	Q462 E466	Q462-Q464 VanDerWaalsContact C-N 3.26Å; Q462-Q464 PolarHBondContact O-N 2.9Å; Q464-E466 VanDerWaalsContact C-N 3.27Å; Q464-E466 HydrophobicContact CB-CG 4.12Å; Q464-E466 PolarHBondContact O-N 3.19Å
465	G	81.9	Confident	89.7	Confident	13 Å²	13	30.3 Å²	30.3	13%	0.134	15%	0.146	C	C	.	.			trans	67.8	23	179.5	0	0	0	0	0	114.5	Q462 D467 L468 R469	Q462-G465 PolarHBondContact O-N 3.46Å; G465-D467 PolarHBondContact O-N 2.69Å; G465-L468 PolarHBondContact O-N 2.99Å; G465-R469 PolarHBondContact O-N 3.05Å; G465-R469 VanDerWaalsContact O-N 3.09Å
466	E	84.5	Confident	89.3	Confident	91 Å²	91	31 Å²	31	43%	0.425	15%	0.149	S	C	.	.	H	α-helix	trans	-65.4	-30.5	-177.7	-54.6	-153.2	133.4	0	0	113.1	Q462 Q464 R469 E470	Q462-E466 HydrophobicContact CB-CB 4.46Å; Q464-E466 VanDerWaalsContact C-N 3.27Å; Q464-E466 HydrophobicContact CB-CG 4.12Å; Q464-E466 PolarHBondContact O-N 3.19Å; E466-R469 PolarHBondContact O-N 3.14Å; E466-R469 IonicContact OE1-NH2 2.76Å; E466-R469 PolarHBondContact OE1-NH2 2.82Å; E466-E470 WeakPolarHBondContact O-CB 3.44Å; E466-E470 PolarHBondContact O-N 2.87Å
467	D	88.3	Confident	88.6	Confident	9 Å²	9	30.7 Å²	30.7	5%	0.048	15%	0.152	C	C	.	.	H	α-helix	trans	-65.6	-46.7	175	50.9	0.1	0	0	0	111.8	L434 Q462 G465 R469 E470 L471	L434-D467 HydrophobicContact CB-CB 4.09Å; L434-D467 WeakPolarHBondContact CB-OD2 3.28Å; L434-D467 PolarHBondContact N-OD2 2.98Å; Q462-D467 HydrophobicContact CB-CB 4.25Å; Q462-D467 HydrophobicContact CG-CB 3.94Å; Q462-D467 PolarHBondContact N-OD2 3.12Å; G465-D467 PolarHBondContact O-N 2.69Å; D467-R469 VanDerWaalsContact C-N 3.34Å; D467-R469 PolarHBondContact O-N 3.24Å; D467-E470 PolarHBondContact O-N 3.37Å; D467-L471 WeakPolarHBondContact O-CG 3.47Å; D467-L471 PolarHBondContact O-N 3.48Å
468	L	89.2	Confident	87.9	Confident	4 Å²	4	36.6 Å²	36.6	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-59.4	-45	172.8	176.8	61.5	0	0	0	111.3	L434 G465 E470 L471 R472 L713 F717	L434-L468 HydrophobicContact CD2-CB 4.02Å; L434-L468 HydrophobicContact CD2-CD1 3.89Å; G465-L468 PolarHBondContact O-N 2.99Å; L468-E470 VanDerWaalsContact C-N 3.34Å; L468-E470 PolarHBondContact O-N 3.44Å; L468-L471 PolarHBondContact O-N 3.19Å; L468-R472 HydrophobicContact CD1-CG 4.32Å; L468-R472 VanDerWaalsContact O-CG 3.31Å; L468-R472 WeakPolarHBondContact O-CG 3.32Å; L468-R472 PolarHBondContact O-N 3.04Å; L468-L713 HydrophobicContact CD1-CB 3.99Å; L468-F717 HydrophobicContact CB-CD2 4.35Å; L468-F717 HydrophobicContact CD1-CB 4.29Å; L468-F717 HydrophobicContact CD2-CB 4.18Å; L468-F717 HydrophobicContact CD2-CD1 4.06Å; L468-F717 HydrophobicContact CD2-CD2 4.21Å; L468-F717 HydrophobicContact CD2-CG 3.88Å
469	R	85.3	Confident	87.4	Confident	73 Å²	73	37.1 Å²	37.1	28%	0.275	19%	0.187	S	C	.	.	H	α-helix	trans	-61.1	-42.6	178.2	-176.5	177.6	67.4	-171.2	-5.2	112	G465 E466 D467 R473 L831	G465-R469 PolarHBondContact O-N 3.05Å; G465-R469 VanDerWaalsContact O-N 3.09Å; E466-R469 PolarHBondContact O-N 3.14Å; E466-R469 IonicContact OE1-NH2 2.76Å; E466-R469 PolarHBondContact OE1-NH2 2.82Å; D467-R469 VanDerWaalsContact C-N 3.34Å; D467-R469 PolarHBondContact O-N 3.24Å; R469-R473 WeakPolarHBondContact O-CB 3.39Å; R469-R473 PolarHBondContact O-N 3.36Å; R469-L831 VanDerWaalsContact CD-O 3.25Å; R469-L831 WeakPolarHBondContact CD-O 3.5Å
470	E	86.3	Confident	86.9	Confident	27 Å²	27	37.6 Å²	37.6	13%	0.126	19%	0.189	C	C	.	.	H	α-helix	trans	-66.5	-41.2	177.5	-173.9	70.6	-180	0	0	111.7	R352 E466 D467 L468 R473 H474 R828	R352-E470 IonicContact CZ-OE1 3.63Å; R352-E470 IonicContact NE-OE1 2.65Å; R352-E470 IonicContact NH2-OE1 3.43Å; R352-E470 PolarHBondContact NH2-OE1 3.14Å; R352-E470 IonicContact NH2-OE2 3.9Å; R352-E470 PolarHBondContact NH2-OE2 2.8Å; E466-E470 WeakPolarHBondContact O-CB 3.44Å; E466-E470 PolarHBondContact O-N 2.87Å; D467-E470 PolarHBondContact O-N 3.37Å; L468-E470 VanDerWaalsContact C-N 3.34Å; L468-E470 PolarHBondContact O-N 3.44Å; E470-R473 VanDerWaalsContact O-CB 3.32Å; E470-R473 WeakPolarHBondContact O-CB 3.4Å; E470-R473 PolarHBondContact O-N 3.15Å; E470-R473 IonicContact OE1-CZ 3.88Å; E470-R473 IonicContact OE1-NE 2.72Å; E470-R473 IonicContact OE1-NH2 3.34Å; E470-R473 PolarHBondContact OE1-NH2 3.31Å; E470-R473 IonicContact OE2-CZ 3.19Å; E470-R473 IonicContact OE2-NE 2.82Å; E470-R473 PolarHBondContact OE2-NE 2.92Å; E470-R473 IonicContact OE2-NH2 3.58Å; E470-R473 PolarHBondContact OE2-NH2 3.07Å; E470-H474 PolarHBondContact O-CD2 3.39Å; E470-H474 PolarHBondContact O-N 3.11Å; E470-H474 VanDerWaalsContact O-N 3.15Å; E470-H474 IonicContact OE1-NE2 3.01Å; E470-R828 IonicContact OE1-NH2 3.12Å; E470-R828 IonicContact OE2-NH2 2.77Å; E470-R828 PolarHBondContact OE2-NH2 3.15Å
471	L	89.1	Confident	86.4	Confident	23 Å²	23	39 Å²	39	12%	0.12	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-42.7	175.9	-71.9	170.9	0	0	0	112.3	L434 P436 D467 L468 R473 H474 V475 L713	L434-L471 HydrophobicContact CB-CD1 4.16Å; L434-L471 HydrophobicContact CD2-CD1 4.02Å; L434-L471 HydrophobicContact CG-CD1 4.13Å; L434-L471 WeakPolarHBondContact O-CD1 3.34Å; P436-L471 HydrophobicContact CB-CD2 4.12Å; D467-L471 WeakPolarHBondContact O-CG 3.47Å; D467-L471 PolarHBondContact O-N 3.48Å; L468-L471 PolarHBondContact O-N 3.19Å; L471-R473 VanDerWaalsContact C-N 3.28Å; L471-R473 PolarHBondContact O-N 3.4Å; L471-H474 WeakPolarHBondContact O-CB 3.49Å; L471-H474 PolarHBondContact O-N 3.37Å; L471-H474 VanDerWaalsContact O-N 3.14Å; L471-V475 PolarHBondContact O-N 3.23Å; L471-V475 VanDerWaalsContact O-N 3.15Å; L471-L713 HydrophobicContact CB-CD1 3.86Å; L471-L713 HydrophobicContact CB-CD2 3.8Å; L471-L713 HydrophobicContact CD1-CD2 3.85Å; L471-L713 HydrophobicContact CG-CD2 4.37Å
472	R	88.1	Confident	86.2	Confident	16 Å²	16	42.6 Å²	42.6	6%	0.06	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-40.9	173.6	-73.1	170.5	169.1	-154.3	-21.1	111.8	L468 H474 V475 H476 L710 L713 E769	L468-R472 HydrophobicContact CD1-CG 4.32Å; L468-R472 VanDerWaalsContact O-CG 3.31Å; L468-R472 WeakPolarHBondContact O-CG 3.32Å; L468-R472 PolarHBondContact O-N 3.04Å; R472-H474 VanDerWaalsContact C-N 3.26Å; R472-H474 PolarHBondContact O-N 3.19Å; R472-V475 WeakPolarHBondContact O-CB 3.41Å; R472-V475 PolarHBondContact O-N 3.24Å; R472-V475 VanDerWaalsContact O-N 3.11Å; R472-H476 PolarHBondContact O-CD2 2.89Å; R472-H476 PolarHBondContact O-N 2.99Å; R472-L710 HydrophobicContact CB-CD2 4.2Å; R472-L710 HydrophobicContact CG-CD2 3.94Å; R472-L713 HydrophobicContact CG-CD1 3.98Å; R472-E769 IonicContact CZ-OE1 2.85Å; R472-E769 IonicContact CZ-OE2 3.29Å; R472-E769 VanDerWaalsContact CZ-OE2 3.22Å; R472-E769 IonicContact NH1-OE1 3.28Å; R472-E769 IonicContact NH1-OE2 2.72Å; R472-E769 PolarHBondContact NH1-OE2 2.92Å; R472-E769 IonicContact NH2-OE1 2.78Å; R472-E769 PolarHBondContact NH2-OE1 2.87Å; R472-E769 IonicContact NH2-OE2 3.23Å; R472-E769 PolarHBondContact NH2-OE2 3.49Å
473	R	86.7	Confident	86.1	Confident	28 Å²	28	44.5 Å²	44.5	11%	0.106	22%	0.224	C	C	.	.	H	α-helix	trans	-58.5	-39.1	175.7	-172.4	-179	72.7	139.1	9.3	112.2	R469 E470 L471 H476 A477 H808 G809 I810	R469-R473 WeakPolarHBondContact O-CB 3.39Å; R469-R473 PolarHBondContact O-N 3.36Å; E470-R473 VanDerWaalsContact O-CB 3.32Å; E470-R473 WeakPolarHBondContact O-CB 3.4Å; E470-R473 PolarHBondContact O-N 3.15Å; E470-R473 IonicContact OE1-CZ 3.88Å; E470-R473 IonicContact OE1-NE 2.72Å; E470-R473 IonicContact OE1-NH2 3.34Å; E470-R473 PolarHBondContact OE1-NH2 3.31Å; E470-R473 IonicContact OE2-CZ 3.19Å; E470-R473 IonicContact OE2-NE 2.82Å; E470-R473 PolarHBondContact OE2-NE 2.92Å; E470-R473 IonicContact OE2-NH2 3.58Å; E470-R473 PolarHBondContact OE2-NH2 3.07Å; L471-R473 VanDerWaalsContact C-N 3.28Å; L471-R473 PolarHBondContact O-N 3.4Å; R473-H476 PolarHBondContact O-N 2.83Å; R473-A477 PolarHBondContact O-N 2.78Å; R473-H808 WeakPolarHBondContact CD-O 3.38Å; R473-H808 HydrophobicContact CG-CB 4.47Å; R473-H808 PolarHBondContact NH1-O 3.45Å; R473-H808 VanDerWaalsContact NH1-O 3.07Å; R473-G809 PolarHBondContact NH1-O 2.98Å; R473-I810 HydrophobicContact CG-CD1 3.68Å; R473-I810 HydrophobicContact CG-CG1 3.48Å; R473-I810 VanDerWaalsContact CG-CG1 3.48Å; R473-I810 WeakPolarHBondContact O-CD1 3.44Å
474	H	86	Confident	86.7	Confident	88 Å²	88	43.1 Å²	43.1	41%	0.407	22%	0.216	S	C	.	.	H	α-helix	trans	-65.8	-41.3	174.4	-69.5	-56.9	0	0	0	112.1	E470 L471 R472 H476 A477 D478	E470-H474 PolarHBondContact O-CD2 3.39Å; E470-H474 PolarHBondContact O-N 3.11Å; E470-H474 VanDerWaalsContact O-N 3.15Å; E470-H474 IonicContact OE1-NE2 3.01Å; L471-H474 WeakPolarHBondContact O-CB 3.49Å; L471-H474 PolarHBondContact O-N 3.37Å; L471-H474 VanDerWaalsContact O-N 3.14Å; R472-H474 VanDerWaalsContact C-N 3.26Å; R472-H474 PolarHBondContact O-N 3.19Å; H474-H476 VanDerWaalsContact C-N 3.31Å; H474-H476 PolarHBondContact O-N 3.15Å; H474-A477 VanDerWaalsContact O-CB 3.29Å; H474-A477 WeakPolarHBondContact O-CB 3.43Å; H474-A477 PolarHBondContact O-N 3.06Å; H474-D478 PolarHBondContact O-N 3.29Å; H474-D478 VanDerWaalsContact O-N 3.15Å
475	V	88.3	Confident	87.5	Confident	25 Å²	25	37.2 Å²	37.2	15%	0.152	19%	0.188	C	C	.	.	H	α-helix	trans	-57.2	-44.9	174.6	176.3	0	0	0	0	111.5	L471 R472 A477 D478 S479 E706 A709 L710 L713	L471-V475 PolarHBondContact O-N 3.23Å; L471-V475 VanDerWaalsContact O-N 3.15Å; R472-V475 WeakPolarHBondContact O-CB 3.41Å; R472-V475 PolarHBondContact O-N 3.24Å; R472-V475 VanDerWaalsContact O-N 3.11Å; V475-A477 VanDerWaalsContact C-N 3.27Å; V475-A477 PolarHBondContact O-N 2.85Å; V475-D478 PolarHBondContact O-N 3.35Å; V475-S479 PolarHBondContact O-N 3.14Å; V475-E706 HydrophobicContact CG1-CG 4.05Å; V475-A709 HydrophobicContact CG1-CB 3.72Å; V475-A709 HydrophobicContact CG2-CB 3.95Å; V475-L710 HydrophobicContact CB-CD2 4.16Å; V475-L710 HydrophobicContact CG1-CD2 3.98Å; V475-L710 HydrophobicContact CG1-CG 4Å; V475-L713 HydrophobicContact CG2-CD1 3.77Å
476	H	87.2	Confident	88.1	Confident	15 Å²	15	40 Å²	40	7%	0.069	20%	0.196	C	C	.	.	H	α-helix	trans	-70.1	-22.3	176.7	-61.1	-52.8	0	0	0	113.9	R472 R473 H474 S479 E706 R801 I810 F835 H836	R472-H476 PolarHBondContact O-CD2 2.89Å; R472-H476 PolarHBondContact O-N 2.99Å; R473-H476 PolarHBondContact O-N 2.83Å; H474-H476 VanDerWaalsContact C-N 3.31Å; H474-H476 PolarHBondContact O-N 3.15Å; H476-S479 PolarHBondContact O-OG 2.98Å; H476-E706 IonicContact CE1-OE1 3.22Å; H476-E706 IonicContact CG-OE1 3.7Å; H476-E706 IonicContact ND1-OE1 3.06Å; H476-E706 PolarHBondContact ND1-OE1 3.33Å; H476-R801 PolarHBondContact O-NE 3.04Å; H476-R801 PolarHBondContact O-NH2 3.34Å; H476-I810 HydrophobicContact CB-CD1 4.19Å; H476-F835 HydrophobicContact CB-CD1 4.04Å; H476-F835 HydrophobicContact CB-CD2 4.12Å; H476-F835 HydrophobicContact CB-CE1 4.28Å; H476-F835 HydrophobicContact CB-CE2 4.34Å; H476-F835 HydrophobicContact CB-CG 3.97Å; H476-F835 HydrophobicContact CB-CZ 4.42Å; H476-F835 AromaticContact CD2-CG 3.93Å; H476-F835 AromaticContact CG-CD1 3.92Å; H476-F835 AromaticContact CG-CG 3.8Å; H476-F835 AromaticContact ND1-CD1 4Å; H476-H836 AromaticContact CE1-NE2 3.75Å
477	A	82.9	Confident	88.7	Confident	23 Å²	23	40.9 Å²	40.9	19%	0.19	20%	0.196	C	C	.	.	H	α-helix	trans	-69.6	-43.4	174.6	0	0	0	0	0	111.1	R473 H474 V475 R805 I810	R473-A477 PolarHBondContact O-N 2.78Å; H474-A477 VanDerWaalsContact O-CB 3.29Å; H474-A477 WeakPolarHBondContact O-CB 3.43Å; H474-A477 PolarHBondContact O-N 3.06Å; V475-A477 VanDerWaalsContact C-N 3.27Å; V475-A477 PolarHBondContact O-N 2.85Å; A477-R805 PolarHBondContact O-NH2 3.47Å; A477-R805 VanDerWaalsContact O-NH2 3.08Å; A477-I810 HydrophobicContact CB-CB 4.47Å; A477-I810 HydrophobicContact CB-CD1 4.35Å; A477-I810 HydrophobicContact CB-CG1 4.34Å; A477-I810 HydrophobicContact CB-CG2 3.37Å
478	D	82.9	Confident	89.1	Confident	124 Å²	124	40.4 Å²	40.4	66%	0.663	19%	0.194	S	C	*	.	H	α-helix	trans	-79.6	-19.8	-171.5	-63.2	-14	0	0	0	113.8	H474 V475	H474-D478 PolarHBondContact O-N 3.29Å; H474-D478 VanDerWaalsContact O-N 3.15Å; V475-D478 PolarHBondContact O-N 3.35Å
479	S	86.8	Confident	89.4	Confident	11 Å²	11	40.3 Å²	40.3	8%	0.077	19%	0.193	C	C	.	.	S	Bend	trans	-65.3	151.2	173.8	62.4	0	0	0	0	112.4	V475 H476 R801 R805	V475-S479 PolarHBondContact O-N 3.14Å; H476-S479 PolarHBondContact O-OG 2.98Å; S479-R801 PolarHBondContact OG-NE 3.07Å; S479-R801 PolarHBondContact OG-NH2 3.08Å; S479-R805 PolarHBondContact O-NH2 3.33Å
480	T	88.8	Confident	89.9	Confident	9 Å²	9	41.8 Å²	41.8	6%	0.055	20%	0.203	C	C	.	.			trans	-106.6	142.4	-177.5	-59.7	0	0	0	0	112	A484 V485 M558 L566	T480-A484 HydrophobicContact CG2-CB 3.94Å; T480-V485 HydrophobicContact CG2-CG2 3.89Å; T480-M558 HydrophobicContact CG2-CE 3.8Å; T480-M558 HydrophobicContact CG2-SD 4.41Å; T480-L566 HydrophobicContact CG2-CD1 4.5Å
481	D	87.6	Confident	90.4	Very high	29 Å²	29	45.2 Å²	45.2	16%	0.155	22%	0.215	C	C	.	.			trans	-69.2	141.8	175.6	-79.6	-16.9	0	0	0	112.4	L483 A484 V485 S799 R801	D481-L483 VanDerWaalsContact C-N 3.26Å; D481-L483 PolarHBondContact O-N 3.09Å; D481-A484 HydrophobicContact CB-CB 4.13Å; D481-A484 WeakPolarHBondContact O-CA 3.15Å; D481-A484 WeakPolarHBondContact O-CB 3.47Å; D481-A484 PolarHBondContact O-N 3.41Å; D481-V485 PolarHBondContact O-N 2.65Å; D481-S799 PolarHBondContact OD2-OG 3.46Å; D481-R801 WeakPolarHBondContact OD1-CB 3.22Å; D481-R801 WeakPolarHBondContact OD1-CD 3.47Å; D481-R801 WeakPolarHBondContact OD1-CG 3.47Å
482	F	89.9	Confident	90.7	Very high	76 Å²	76	44.2 Å²	44.2	33%	0.333	21%	0.21	S	C	.	.	H	α-helix	trans	-55.6	-41	174.1	179.6	-104	0	0	0	112.4	A484 V485 K486 C695 Y699	F482-A484 VanDerWaalsContact C-N 3.29Å; F482-A484 PolarHBondContact O-N 2.77Å; F482-V485 WeakPolarHBondContact O-CB 3.26Å; F482-V485 PolarHBondContact O-N 3.09Å; F482-K486 HydrophobicContact CE1-CD 4.36Å; F482-K486 PolarHBondContact O-N 3.1Å; F482-C695 HydrophobicContact CE2-CB 4.03Å; F482-C695 HydrophobicContact CZ-CB 4.29Å; F482-Y699 HydrophobicContact CB-CD1 4.46Å; F482-Y699 HydrophobicContact CB-CD2 3.97Å; F482-Y699 HydrophobicContact CB-CE1 4.24Å; F482-Y699 HydrophobicContact CB-CE2 3.76Å; F482-Y699 HydrophobicContact CB-CG 4.33Å; F482-Y699 AromaticContact CD2-CD1 3.8Å; F482-Y699 HydrophobicContact CD2-CD1 3.8Å; F482-Y699 HydrophobicContact CD2-CD2 4.07Å; F482-Y699 HydrophobicContact CD2-CE1 4.32Å; F482-Y699 AromaticContact CD2-CG 3.65Å; F482-Y699 HydrophobicContact CD2-CG 3.65Å; F482-Y699 HydrophobicContact CG-CG 4.48Å
483	L	89.6	Confident	91.1	Very high	91 Å²	91	43.5 Å²	43.5	48%	0.476	21%	0.207	S	C	.	.	H	α-helix	trans	-63.4	-35.7	177.3	-177.3	61.8	0	0	0	112.2	D481 R487	D481-L483 VanDerWaalsContact C-N 3.26Å; D481-L483 PolarHBondContact O-N 3.09Å; L483-R487 HydrophobicContact CD1-CG 4.37Å; L483-R487 VanDerWaalsContact O-CB 3.31Å; L483-R487 WeakPolarHBondContact O-CB 3.46Å; L483-R487 VanDerWaalsContact O-CG 3.29Å; L483-R487 WeakPolarHBondContact O-CG 3.44Å; L483-R487 PolarHBondContact O-N 3.41Å
484	A	92.3	Very high	91.4	Very high	7 Å²	7	44.4 Å²	44.4	6%	0.058	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-43.1	175.1	0	0	0	0	0	110.8	T480 D481 F482 R487 L488 L556 M558	T480-A484 HydrophobicContact CG2-CB 3.94Å; D481-A484 HydrophobicContact CB-CB 4.13Å; D481-A484 WeakPolarHBondContact O-CA 3.15Å; D481-A484 WeakPolarHBondContact O-CB 3.47Å; D481-A484 PolarHBondContact O-N 3.41Å; F482-A484 VanDerWaalsContact C-N 3.29Å; F482-A484 PolarHBondContact O-N 2.77Å; A484-R487 PolarHBondContact O-N 3.46Å; A484-L488 WeakPolarHBondContact O-CB 3.41Å; A484-L488 PolarHBondContact O-N 2.9Å; A484-L556 WeakPolarHBondContact CB-O 3.45Å; A484-M558 HydrophobicContact CB-SD 4.46Å
485	V	95.6	Very high	91.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.9	-51.1	172.8	177.3	0	0	0	0	110.8	T480 D481 F482 R487 L488 V489 L566 L698 Y699	T480-V485 HydrophobicContact CG2-CG2 3.89Å; D481-V485 PolarHBondContact O-N 2.65Å; F482-V485 WeakPolarHBondContact O-CB 3.26Å; F482-V485 PolarHBondContact O-N 3.09Å; V485-R487 VanDerWaalsContact C-N 3.33Å; V485-R487 PolarHBondContact O-N 3.02Å; V485-L488 WeakPolarHBondContact O-CB 3.4Å; V485-L488 PolarHBondContact O-N 3.44Å; V485-L488 VanDerWaalsContact O-N 3.09Å; V485-V489 HydrophobicContact CG1-CG2 4.47Å; V485-V489 WeakPolarHBondContact O-CG2 3.23Å; V485-V489 PolarHBondContact O-N 2.92Å; V485-L566 HydrophobicContact CG2-CD1 4.01Å; V485-L698 HydrophobicContact CG1-CB 3.71Å; V485-L698 HydrophobicContact CG1-CD1 3.95Å; V485-Y699 HydrophobicContact CG2-CD2 4.39Å
486	K	95.3	Very high	91.7	Very high	70 Å²	70	43.8 Å²	43.8	30%	0.304	23%	0.227	S	C	.	.	H	α-helix	trans	-58.3	-44.4	179.6	-174.2	165.2	-173	148.5	0	112.3	F482 L488 V489 Q490 D692	F482-K486 HydrophobicContact CE1-CD 4.36Å; F482-K486 PolarHBondContact O-N 3.1Å; K486-L488 VanDerWaalsContact C-N 3.33Å; K486-L488 PolarHBondContact O-N 2.64Å; K486-V489 PolarHBondContact O-N 3.2Å; K486-Q490 VanDerWaalsContact O-CG 3.32Å; K486-Q490 WeakPolarHBondContact O-CG 3.34Å; K486-Q490 PolarHBondContact O-N 3.45Å; K486-D692 IonicContact NZ-OD1 3.81Å; K486-D692 PolarHBondContact NZ-OD1 3.25Å
487	R	95.5	Very high	91.6	Very high	110 Å²	110	45.6 Å²	45.6	42%	0.415	24%	0.24	S	C	.	.	H	α-helix	trans	-69.3	-28.1	177	-77.6	-179.7	169.9	-172.6	1.3	113.6	L483 A484 V485 R491 L556	L483-R487 HydrophobicContact CD1-CG 4.37Å; L483-R487 VanDerWaalsContact O-CB 3.31Å; L483-R487 WeakPolarHBondContact O-CB 3.46Å; L483-R487 VanDerWaalsContact O-CG 3.29Å; L483-R487 WeakPolarHBondContact O-CG 3.44Å; L483-R487 PolarHBondContact O-N 3.41Å; A484-R487 PolarHBondContact O-N 3.46Å; V485-R487 VanDerWaalsContact C-N 3.33Å; V485-R487 PolarHBondContact O-N 3.02Å; R487-R491 WeakPolarHBondContact O-CG 3.34Å; R487-R491 PolarHBondContact O-N 2.9Å; R487-R491 PolarHBondContact O-NH1 3.1Å; R487-L556 HydrophobicContact CB-CD2 3.38Å; R487-L556 HydrophobicContact CG-CD2 4.42Å
488	L	96.9	Very high	91.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-69	-50.6	171.2	-179.6	62.6	0	0	0	110.1	A484 V485 K486 Q490 R491 V492 L547 T552 L556 I563 L566	A484-L488 WeakPolarHBondContact O-CB 3.41Å; A484-L488 PolarHBondContact O-N 2.9Å; V485-L488 WeakPolarHBondContact O-CB 3.4Å; V485-L488 PolarHBondContact O-N 3.44Å; V485-L488 VanDerWaalsContact O-N 3.09Å; K486-L488 VanDerWaalsContact C-N 3.33Å; K486-L488 PolarHBondContact O-N 2.64Å; L488-Q490 PolarHBondContact O-N 3.09Å; L488-R491 WeakPolarHBondContact O-CA 3.23Å; L488-R491 WeakPolarHBondContact O-CB 3.15Å; L488-R491 PolarHBondContact O-N 3.44Å; L488-V492 HydrophobicContact CD1-CG2 3.98Å; L488-V492 HydrophobicContact CG-CG2 4.15Å; L488-V492 VanDerWaalsContact O-CG2 3.31Å; L488-V492 WeakPolarHBondContact O-CG2 3.4Å; L488-V492 PolarHBondContact O-N 3.06Å; L488-L547 HydrophobicContact CD1-CD2 3.8Å; L488-T552 HydrophobicContact CD1-CG2 4.39Å; L488-L556 HydrophobicContact CB-CD1 3.78Å; L488-L556 HydrophobicContact CD1-CD1 3.93Å; L488-L556 HydrophobicContact CG-CD1 4.41Å; L488-I563 HydrophobicContact CD1-CG2 4.15Å; L488-L566 HydrophobicContact CD2-CB 3.88Å; L488-L566 HydrophobicContact CD2-CD1 3.64Å; L488-L566 HydrophobicContact CD2-CG 4.4Å
489	V	97	Very high	90.8	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.012	23%	0.23	C	C	.	.	H	α-helix	trans	-55.1	-42.4	177.6	172.3	0	0	0	0	110.8	V485 K486 R491 V492 F493 K691 I694 L698	V485-V489 HydrophobicContact CG1-CG2 4.47Å; V485-V489 WeakPolarHBondContact O-CG2 3.23Å; V485-V489 PolarHBondContact O-N 2.92Å; K486-V489 PolarHBondContact O-N 3.2Å; V489-R491 VanDerWaalsContact C-N 3.33Å; V489-R491 PolarHBondContact O-N 2.93Å; V489-V492 PolarHBondContact O-N 3.34Å; V489-F493 HydrophobicContact CG1-CD2 3.91Å; V489-F493 HydrophobicContact CG1-CE2 4.48Å; V489-F493 WeakPolarHBondContact O-CD2 3.44Å; V489-F493 PolarHBondContact O-N 3.26Å; V489-K691 HydrophobicContact CG1-CB 4.15Å; V489-K691 HydrophobicContact CG1-CG 4.35Å; V489-I694 HydrophobicContact CG1-CB 4.24Å; V489-I694 HydrophobicContact CG1-CG2 4.2Å; V489-I694 HydrophobicContact CG2-CB 4.46Å; V489-I694 HydrophobicContact CG2-CG2 3.78Å; V489-L698 HydrophobicContact CG2-CD1 3.9Å
490	Q	95.8	Very high	89.2	Confident	104 Å²	104	45 Å²	45	49%	0.486	24%	0.24	S	C	.	.	H	α-helix	trans	-61	-37.3	174.9	-73.1	172.2	-19.9	0	0	113.8	K486 L488	K486-Q490 VanDerWaalsContact O-CG 3.32Å; K486-Q490 WeakPolarHBondContact O-CG 3.34Å; K486-Q490 PolarHBondContact O-N 3.45Å; L488-Q490 PolarHBondContact O-N 3.09Å
491	R	95.7	Very high	86.9	Confident	98 Å²	98	49.5 Å²	49.5	37%	0.37	27%	0.268	S	S	.	.	H	α-helix	trans	-75.4	-32.2	177.1	-75.1	171.1	172	69.4	2.1	112.7	R487 L488 V489 L547	R487-R491 WeakPolarHBondContact O-CG 3.34Å; R487-R491 PolarHBondContact O-N 2.9Å; R487-R491 PolarHBondContact O-NH1 3.1Å; L488-R491 WeakPolarHBondContact O-CA 3.23Å; L488-R491 WeakPolarHBondContact O-CB 3.15Å; L488-R491 PolarHBondContact O-N 3.44Å; V489-R491 VanDerWaalsContact C-N 3.33Å; V489-R491 PolarHBondContact O-N 2.93Å; R491-L547 HydrophobicContact CB-CD1 3.97Å
492	V	95.9	Very high	85	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.012	29%	0.286	C	S	.	.	H	α-helix	trans	-78.4	-35.6	-180	174.2	0	0	0	0	111.4	L488 V489 P494 L547 L567 L570 L578 L680 S682	L488-V492 HydrophobicContact CD1-CG2 3.98Å; L488-V492 HydrophobicContact CG-CG2 4.15Å; L488-V492 VanDerWaalsContact O-CG2 3.31Å; L488-V492 WeakPolarHBondContact O-CG2 3.4Å; L488-V492 PolarHBondContact O-N 3.06Å; V489-V492 PolarHBondContact O-N 3.34Å; V492-P494 WeakPolarHBondContact O-CD 3.48Å; V492-L547 HydrophobicContact CG2-CD2 4.39Å; V492-L567 HydrophobicContact CG2-CD2 3.81Å; V492-L570 HydrophobicContact CG1-CD1 4.43Å; V492-L578 HydrophobicContact CG1-CD1 3.24Å; V492-L680 HydrophobicContact CG2-CD1 4.3Å; V492-S682 PolarHBondContact O-OG 2.93Å
493	F	95.7	Very high	82.5	Confident	1 Å²	1	56.1 Å²	56.1	0%	0.004	30%	0.302	C	S	.	.	S	Bend	trans	-122.2	61.1	-178	-54.7	-79.1	0	0	0	112.4	V489 L570 W577 L578 P683 L686 K691 I694	V489-F493 HydrophobicContact CG1-CD2 3.91Å; V489-F493 HydrophobicContact CG1-CE2 4.48Å; V489-F493 WeakPolarHBondContact O-CD2 3.44Å; V489-F493 PolarHBondContact O-N 3.26Å; F493-L570 HydrophobicContact CE2-CD1 3.96Å; F493-L570 HydrophobicContact CZ-CD1 4.18Å; F493-W577 HydrophobicContact CE1-CB 4.49Å; F493-W577 VanDerWaalsContact CE1-O 3.3Å; F493-W577 WeakPolarHBondContact CE1-O 3.29Å; F493-W577 HydrophobicContact CZ-CB 4.13Å; F493-L578 HydrophobicContact CZ-CB 4.48Å; F493-P683 HydrophobicContact CD1-CG 4.26Å; F493-P683 HydrophobicContact CE1-CG 4.23Å; F493-L686 HydrophobicContact CB-CD1 4.1Å; F493-L686 HydrophobicContact CD1-CD1 3.41Å; F493-L686 VanDerWaalsContact CD1-CD1 3.41Å; F493-L686 HydrophobicContact CD1-CG 4.42Å; F493-L686 HydrophobicContact CD2-CD1 4.38Å; F493-L686 HydrophobicContact CE1-CD1 3.82Å; F493-L686 HydrophobicContact CG-CD1 3.72Å; F493-L686 HydrophobicContact CZ-CD1 4.47Å; F493-K691 VanDerWaalsContact O-CE 3.26Å; F493-K691 WeakPolarHBondContact O-CE 3.44Å; F493-K691 PolarHBondContact O-NZ 3.1Å; F493-I694 HydrophobicContact CD2-CD1 4.02Å; F493-I694 HydrophobicContact CE1-CD1 4.43Å; F493-I694 HydrophobicContact CE2-CD1 3.57Å; F493-I694 HydrophobicContact CE2-CG2 4.35Å; F493-I694 HydrophobicContact CZ-CD1 3.8Å
494	P	93.8	Very high	79.9	Confident	48 Å²	48	57.9 Å²	57.9	31%	0.312	32%	0.318	S	S	.	.			trans	-69.3	153.2	171.4	33.4	-36.1	0	0	0	109.9	V492 R545	V492-P494 WeakPolarHBondContact O-CD 3.48Å; P494-R545 VanDerWaalsContact CG-CZ 3.45Å; P494-R545 VanDerWaalsContact CG-NH1 3.27Å; P494-R545 PolarHBondContact O-NH2 3.45Å; P494-R545 VanDerWaalsContact O-NH2 3.17Å
495	A	91.3	Very high	77.2	Confident	75 Å²	75	62.6 Å²	62.6	62%	0.62	35%	0.351	S	S	*	.			trans	-64.2	146.2	178.7	0	0	0	0	0	111.2	G684	A495-G684 WeakPolarHBondContact CA-O 3.37Å
496	C	88.3	Confident	74.6	Confident	24 Å²	24	71.7 Å²	71.7	16%	0.162	39%	0.393	C	S	.	.			trans	-111	166.1	171.5	71.5	0	0	0	0	111.6	C498 H543 G684	C496-C498 VanDerWaalsContact C-N 3.32Å; C496-H543 VanDerWaalsContact CB-NE2 3.31Å; C496-H543 WeakPolarHBondContact CB-NE2 3.28Å; C496-G684 PolarHBondContact N-O 3.28Å; C496-G684 PolarHBondContact SG-O 3.47Å
497	T	85.4	Confident	71.9	Confident	53 Å²	53	76.7 Å²	76.7	33%	0.325	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-0.1	179.4	51.6	0	0	0	0	113.7	T499 A525 E526 L528	T497-T499 PolarHBondContact O-N 3.49Å; T497-T499 PolarHBondContact O-OG1 3.14Å; T497-A525 HydrophobicContact CG2-CB 4.43Å; T497-E526 WeakPolarHBondContact CG2-O 3.46Å; T497-L528 WeakPolarHBondContact OG1-CD1 3.49Å
498	C	83.4	Confident	69	Low	30 Å²	30	80.9 Å²	80.9	20%	0.203	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-27.9	-173.8	-60.8	0	0	0	0	114	C496 R538 C540	C496-C498 VanDerWaalsContact C-N 3.32Å; C498-R538 PolarHBondContact O-N 3.43Å; C498-R538 VanDerWaalsContact O-O 3.08Å; C498-C540 HydrophobicContact CB-CB 4.37Å
499	T	66.4	Low	65.9	Low	75 Å²	75	84.6 Å²	84.6	46%	0.46	48%	0.481	S	S	.	.			trans	36.8	112.1	178.5	-21.9	0	0	0	0	116.6	T497 R537	T497-T499 PolarHBondContact O-N 3.49Å; T497-T499 PolarHBondContact O-OG1 3.14Å; T499-R537 WeakPolarHBondContact O-CA 3Å; T499-R537 WeakPolarHBondContact O-CB 3.3Å; T499-R537 VanDerWaalsContact O-CD 3.28Å; T499-R537 WeakPolarHBondContact O-CD 3.45Å; T499-R537 WeakPolarHBondContact O-CG 3.22Å
500	C	52.6	Low	63	Low	42 Å²	42	89.2 Å²	89.2	28%	0.284	52%	0.519	S	S	.	.			trans	-88.5	154.7	-155.3	-49.7	0	0	0	0	118.6	D685	C500-D685 WeakPolarHBondContact SG-CB 3.31Å
501	T	41.5	Very low	60	Low	103 Å²	103	91 Å²	91	63%	0.632	54%	0.537	S	S	*	.			trans	-119.6	115.5	133.1	36.6	0	0	0	0	105.9
502	R	46.3	Very low	57.1	Low	141 Å²	141	90.2 Å²	90.2	53%	0.532	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-71.7	136.8	169.6	-79.2	-177.4	178.6	168.4	1.3	107.5	E690	R502-E690 IonicContact CZ-OE1 3.22Å; R502-E690 IonicContact NH1-OE1 3.67Å; R502-E690 PolarHBondContact NH1-OE1 2.94Å; R502-E690 IonicContact NH2-OE1 2.82Å; R502-E690 PolarHBondContact NH2-OE1 2.7Å; R502-E690 IonicContact NH2-OE2 3.16Å; R502-E690 PolarHBondContact NH2-OE2 3.23Å
503	P	38.5	Very low	53.9	Low	103 Å²	103	93.2 Å²	93.2	67%	0.669	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-62.6	137.4	164	23.4	-24.8	0	0	0	108	S505	P503-S505 PolarHBondContact O-N 3.31Å
504	P	34.9	Very low	50.8	Low	127 Å²	127	103 Å²	103	83%	0.825	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-59.7	125.3	178.6	23	-30.2	0	0	0	109	E506	P504-E506 PolarHBondContact O-N 3.37Å
505	S	36	Very low	47.7	Very low	106 Å²	106	111.9 Å²	111.9	74%	0.741	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-60.9	125.5	167.1	45.4	0	0	0	0	108.6	P503 Q507	P503-S505 PolarHBondContact O-N 3.31Å; S505-Q507 PolarHBondContact O-N 3.47Å
506	E	39.4	Very low	44.8	Very low	191 Å²	191	114.1 Å²	114.1	89%	0.893	67%	0.671	S	S	*	*	S	Bend	trans	-65.6	82.2	169.6	-69.9	-179.1	157.4	0	0	109.6	P504	P504-E506 PolarHBondContact O-N 3.37Å
507	Q	39.2	Very low	42.1	Very low	176 Å²	176	119.1 Å²	119.1	82%	0.822	70%	0.701	S	S	*	*			trans	177.4	92.3	156.5	-100.5	163.6	33.6	0	0	108.2	S505	S505-Q507 PolarHBondContact O-N 3.47Å
508	E	35.2	Very low	39.4	Very low	198 Å²	198	121.3 Å²	121.3	93%	0.925	72%	0.716	S	S	*	*			trans	171.2	133.8	131.6	-93.5	177.1	-179.4	0	0	109.7
509	G	32	Very low	36.6	Very low	78 Å²	78	129.7 Å²	129.7	80%	0.804	75%	0.749	S	S	*	*			trans	-64	149.6	-173.2	0	0	0	0	0	113.8
510	A	34.8	Very low	34.7	Very low	98 Å²	98	135.5 Å²	135.5	81%	0.81	76%	0.764	S	S	*	*			trans	-32.6	126.7	173.4	0	0	0	0	0	116.3
511	V	33.7	Very low	33.5	Very low	143 Å²	143	138.6 Å²	138.6	87%	0.867	78%	0.783	S	S	*	*				-144.7	119.9	129.7	-177.2	0	0	0	0	108.3
512	G	35.1	Very low	33	Very low	81 Å²	81	139.6 Å²	139.6	84%	0.835	79%	0.792	S	S	*	*			trans	-68	138.1	176.5	0	0	0	0	0	112.5
513	G	28.5	Very low	32.3	Very low	65 Å²	65	141.7 Å²	141.7	67%	0.67	81%	0.807	S	S	*	*			trans	-177.2	105.6	170.3	0	0	0	0	0	109.9	R515	G513-R515 PolarHBondContact O-N 2.66Å; G513-R515 VanDerWaalsContact O-N 3.12Å
514	E	30.5	Very low	32	Very low	205 Å²	205	146.2 Å²	146.2	96%	0.958	82%	0.819	S	S	*	*			trans	-54.5	113.7	170.6	-69.3	178.5	144.4	0	0	109.4
515	R	28.9	Very low	32.3	Very low	236 Å²	236	142.7 Å²	142.7	89%	0.891	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-94.3	134.1	168.9	-74.8	-173.9	179.8	-178.1	1.6	109.5	G513	G513-R515 PolarHBondContact O-N 2.66Å; G513-R515 VanDerWaalsContact O-N 3.12Å
516	P	30.4	Very low	32.7	Very low	121 Å²	121	145.5 Å²	145.5	79%	0.786	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-69.9	136	-178.3	27.7	-31.9	0	0	0	110.9	P518	P516-P518 WeakPolarHBondContact O-CD 3.32Å
517	V	30.6	Very low	33.5	Very low	129 Å²	129	144.2 Å²	144.2	78%	0.782	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-61.7	122.1	174.7	-178.9	0	0	0	0	109.3	K519	V517-K519 PolarHBondContact O-N 2.82Å
518	P	28.4	Very low	34.5	Very low	99 Å²	99	139.3 Å²	139.3	64%	0.643	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-72	116.4	173.7	27.3	-30.1	0	0	0	109.7	P516 Y520	P516-P518 WeakPolarHBondContact O-CD 3.32Å; P518-Y520 HydrophobicContact CB-CD2 3.91Å; P518-Y520 HydrophobicContact CB-CE2 3.92Å; P518-Y520 PolarHBondContact O-N 3.5Å
519	K	26.5	Very low	35.7	Very low	207 Å²	207	133.7 Å²	133.7	90%	0.9	76%	0.758	S	S	*	*			trans	-75.8	90.7	167.1	-73.2	-179.3	178.4	177.6	0	108.7	V517	V517-K519 PolarHBondContact O-N 2.82Å
520	Y	26.2	Very low	37.1	Very low	197 Å²	197	135 Å²	135	77%	0.773	74%	0.743	S	S	*	*			trans	-102.5	140.6	160.1	-75.8	-80.8	0	0	0	109.5	P518	P518-Y520 HydrophobicContact CB-CD2 3.91Å; P518-Y520 HydrophobicContact CB-CE2 3.92Å; P518-Y520 PolarHBondContact O-N 3.5Å
521	P	26	Very low	38.4	Very low	106 Å²	106	135.1 Å²	135.1	69%	0.688	73%	0.727	S	S	*	*			trans	-64.2	142.8	173.1	28.1	-31.6	0	0	0	109.2	Q523	P521-Q523 PolarHBondContact O-N 2.62Å
522	P	32.7	Very low	39.7	Very low	125 Å²	125	133.9 Å²	133.9	81%	0.812	73%	0.732	S	S	*	*			trans	-65	112.4	178	25.4	-30.2	0	0	0	109	E524	P522-E524 PolarHBondContact O-N 3.24Å
523	Q	30.2	Very low	41.3	Very low	185 Å²	185	133.2 Å²	133.2	86%	0.864	72%	0.719	S	S	*	*			trans	-66.8	115.6	162.5	-77.9	178.7	-19.5	0	0	107.5	P521 A525	P521-Q523 PolarHBondContact O-N 2.62Å; Q523-A525 PolarHBondContact O-N 3.26Å
524	E	33.2	Very low	43.2	Very low	197 Å²	197	135.8 Å²	135.8	92%	0.921	72%	0.723	S	S	*	*			trans	6.6	75.3	166.5	-64.3	175.8	173.2	0	0	115.8	P522	P522-E524 PolarHBondContact O-N 3.24Å
525	A	39.8	Very low	45	Very low	53 Å²	53	128 Å²	128	44%	0.438	70%	0.698	S	S	.	*			trans	-83.9	120.1	159.9	0	0	0	0	0	107.2	T497 Q523 Q527	T497-A525 HydrophobicContact CG2-CB 4.43Å; Q523-A525 PolarHBondContact O-N 3.26Å; A525-Q527 PolarHBondContact O-N 3.13Å
526	E	46.2	Very low	47.3	Very low	166 Å²	166	122.1 Å²	122.1	78%	0.776	69%	0.691	S	S	*	*			trans	-53.6	112.5	171.1	-76.2	-177.8	159.9	0	0	108.4	T497	T497-E526 WeakPolarHBondContact CG2-O 3.46Å
527	Q	56	Low	49.7	Very low	164 Å²	164	124.6 Å²	124.6	77%	0.766	68%	0.684	S	S	*	*			trans	-59.5	138.6	171.8	-82.1	177.6	-22.1	0	0	108.9	A525 S529	A525-Q527 PolarHBondContact O-N 3.13Å; Q527-S529 PolarHBondContact O-N 3.25Å; Q527-S529 VanDerWaalsContact O-N 3.16Å
528	L	59.8	Low	52.2	Low	72 Å²	72	126.9 Å²	126.9	38%	0.377	68%	0.679	S	S	.	*			trans	-59.1	121.6	175.1	-76.4	165.5	0	0	0	109	T497 H530 Q531	T497-L528 WeakPolarHBondContact OG1-CD1 3.49Å; L528-H530 PolarHBondContact O-N 3.11Å; L528-Q531 HydrophobicContact CB-CB 4.21Å; L528-Q531 HydrophobicContact CB-CG 4.06Å; L528-Q531 HydrophobicContact CD1-CG 4.3Å; L528-Q531 PolarHBondContact O-N 2.87Å
529	S	60.5	Low	54.9	Low	81 Å²	81	125.5 Å²	125.5	57%	0.566	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	-20.3	-176.9	46.6	0	0	0	0	114.6	Q527 Q615	Q527-S529 PolarHBondContact O-N 3.25Å; Q527-S529 VanDerWaalsContact O-N 3.16Å; S529-Q615 PolarHBondContact OG-NE2 3.04Å; S529-Q615 VanDerWaalsContact OG-NE2 3.15Å
530	H	61.3	Low	57.9	Low	106 Å²	106	116.4 Å²	116.4	49%	0.491	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.8	1	179.3	-62.4	-67.4	0	0	0	114.9	L528 V611 Q615	L528-H530 PolarHBondContact O-N 3.11Å; H530-V611 WeakPolarHBondContact NE2-CG1 3.34Å; H530-Q615 PolarHBondContact NE2-NE2 3.21Å
531	Q	62.4	Low	60.8	Low	100 Å²	100	114.9 Å²	114.9	47%	0.467	63%	0.633	S	S	.	*			trans	-107.3	120.7	179.3	-70.4	-172.1	0.7	0	0	111.2	L528 A533	L528-Q531 HydrophobicContact CB-CB 4.21Å; L528-Q531 HydrophobicContact CB-CG 4.06Å; L528-Q531 HydrophobicContact CD1-CG 4.3Å; L528-Q531 PolarHBondContact O-N 2.87Å; Q531-A533 VanDerWaalsContact C-N 3.29Å; Q531-A533 PolarHBondContact O-N 3.05Å
532	A	61.5	Low	63.9	Low	117 Å²	117	111 Å²	111	97%	0.967	61%	0.612	S	S	*	*	S	Bend	trans	-73.8	-18.6	176.8	0	0	0	0	0	113.6
533	A	68.6	Low	66.7	Low	67 Å²	67	106.3 Å²	106.3	55%	0.554	58%	0.579	S	S	*	*	S	Bend	trans	-151.4	156.9	177.6	0	0	0	0	0	110.7	Q531 G535	Q531-A533 VanDerWaalsContact C-N 3.29Å; Q531-A533 PolarHBondContact O-N 3.05Å; A533-G535 PolarHBondContact O-N 3.28Å; A533-G535 VanDerWaalsContact O-N 3.09Å
534	P	68.7	Low	69.7	Low	119 Å²	119	99 Å²	99	77%	0.773	55%	0.545	S	S	*	.			trans	-59.9	113.8	173.8	-18.8	30.7	0	0	0	110.5
535	G	67.1	Low	72.5	Confident	42 Å²	42	91.7 Å²	91.7	43%	0.433	51%	0.509	S	S	.	.			trans	-70.2	178.7	177.6	0	0	0	0	0	113.8	A533	A533-G535 PolarHBondContact O-N 3.28Å; A533-G535 VanDerWaalsContact O-N 3.09Å
536	P	77.4	Confident	75.1	Confident	112 Å²	112	90.3 Å²	90.3	73%	0.727	50%	0.497	S	S	*	.			trans	-61.1	143.2	175.8	24.4	-32.1	0	0	0	111.6	R538	P536-R538 WeakPolarHBondContact O-CG 3.41Å
537	R	81	Confident	77.5	Confident	172 Å²	172	82.8 Å²	82.8	65%	0.649	46%	0.463	S	S	*	.			trans	-56.6	134.7	175.8	-75.1	-163.4	-177.7	170	3.2	111.6	T499	T499-R537 WeakPolarHBondContact O-CA 3Å; T499-R537 WeakPolarHBondContact O-CB 3.3Å; T499-R537 VanDerWaalsContact O-CD 3.28Å; T499-R537 WeakPolarHBondContact O-CD 3.45Å; T499-R537 WeakPolarHBondContact O-CG 3.22Å
538	R	82.6	Confident	79.3	Confident	177 Å²	177	76.5 Å²	76.5	67%	0.668	44%	0.436	S	S	*	.			trans	-131.7	149.6	-175	-64.3	-101	-85.3	-99.9	0.1	110	C498 P536	C498-R538 PolarHBondContact O-N 3.43Å; C498-R538 VanDerWaalsContact O-O 3.08Å; P536-R538 WeakPolarHBondContact O-CG 3.41Å
539	V	86.3	Confident	80.9	Confident	70 Å²	70	73.3 Å²	73.3	42%	0.424	42%	0.419	S	S	.	.			trans	-69.2	130.8	167.1	-179.6	0	0	0	0	108.2	M541	V539-M541 HydrophobicContact CB-CE 4.37Å; V539-M541 PolarHBondContact O-N 3.45Å
540	C	88.8	Confident	82.4	Confident	16 Å²	16	75 Å²	75	11%	0.108	42%	0.418	C	S	.	.			trans	-68.9	125.6	177.8	-174.8	0	0	0	0	109.4	C498 G542 G684 D685	C498-C540 HydrophobicContact CB-CB 4.37Å; C540-G542 VanDerWaalsContact C-N 3.32Å; C540-G542 PolarHBondContact SG-N 3.09Å; C540-G684 PolarHBondContact SG-N 3.01Å; C540-G684 VanDerWaalsContact SG-N 3.43Å; C540-D685 HydrophobicContact CB-CB 3.99Å
541	M	87.8	Confident	84	Confident	166 Å²	166	75.1 Å²	75.1	82%	0.818	42%	0.422	S	S	*	.			trans	-95.8	12.3	176.6	-61.4	-62.6	173.6	0	0	112.4	V539	V539-M541 HydrophobicContact CB-CE 4.37Å; V539-M541 PolarHBondContact O-N 3.45Å
542	G	90.2	Very high	85.5	Confident	25 Å²	25	70.4 Å²	70.4	26%	0.258	40%	0.4	S	S	.	.			trans	83.1	155	-170.3	0	0	0	0	0	112.7	C540	C540-G542 VanDerWaalsContact C-N 3.32Å; C540-G542 PolarHBondContact SG-N 3.09Å
543	H	91.8	Very high	87.1	Confident	25 Å²	25	65.5 Å²	65.5	12%	0.116	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	142.1	-179.5	-68.1	-85.3	0	0	0	110.5	C496 R545 D637 R681 S682	C496-H543 VanDerWaalsContact CB-NE2 3.31Å; C496-H543 WeakPolarHBondContact CB-NE2 3.28Å; H543-R545 HydrophobicContact CB-CG 4.46Å; H543-D637 WeakPolarHBondContact CA-OD1 2.99Å; H543-D637 VanDerWaalsContact CB-OD1 3.26Å; H543-D637 WeakPolarHBondContact CB-OD1 3.09Å; H543-D637 IonicContact CE1-OD2 3.05Å; H543-D637 IonicContact CG-OD1 3Å; H543-D637 IonicContact CG-OD2 2.92Å; H543-D637 IonicContact ND1-OD1 3.89Å; H543-D637 PolarHBondContact ND1-OD1 3.12Å; H543-D637 IonicContact ND1-OD2 3.77Å; H543-D637 PolarHBondContact ND1-OD2 3.39Å; H543-R681 VanDerWaalsContact O-CA 3.29Å; H543-R681 WeakPolarHBondContact O-CA 3.13Å; H543-S682 PolarHBondContact N-O 3.45Å; H543-S682 PolarHBondContact O-N 2.78Å
544	E	92.6	Very high	88.1	Confident	33 Å²	33	67.5 Å²	67.5	15%	0.154	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	133.1	170.5	-70.5	-168.2	-160.1	0	0	110.5	L581 V633 V636 D637 H679 L680 R681	E544-L581 HydrophobicContact CG-CD1 4.48Å; E544-V633 HydrophobicContact CB-CG1 4.03Å; E544-V636 HydrophobicContact CB-CG1 4.17Å; E544-V636 HydrophobicContact CG-CG1 4.45Å; E544-V636 VanDerWaalsContact OE2-CG1 3.22Å; E544-V636 WeakPolarHBondContact OE2-CG1 3.39Å; E544-D637 PolarHBondContact N-OD1 3.11Å; E544-H679 IonicContact OE2-CE1 3.79Å; E544-H679 PolarHBondContact OE2-CE1 3.43Å; E544-H679 IonicContact OE2-NE2 2.69Å; E544-H679 PolarHBondContact OE2-NE2 3.32Å; E544-L680 CarbonylContact C-O 3.44Å; E544-L680 WeakPolarHBondContact CA-O 3.4Å; E544-R681 IonicContact OE1-CZ 3.45Å; E544-R681 IonicContact OE1-NE 2.9Å; E544-R681 IonicContact OE1-NH2 3.87Å; E544-R681 PolarHBondContact OE1-NH2 3.36Å
545	R	92.9	Very high	89.1	Confident	43 Å²	43	63.7 Å²	63.7	16%	0.162	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	145.1	-172.3	-53.5	-173.6	-169.8	-84.6	13.1	111.3	P494 H543 L680 S682	P494-R545 VanDerWaalsContact CG-CZ 3.45Å; P494-R545 VanDerWaalsContact CG-NH1 3.27Å; P494-R545 PolarHBondContact O-NH2 3.45Å; P494-R545 VanDerWaalsContact O-NH2 3.17Å; H543-R545 HydrophobicContact CB-CG 4.46Å; R545-L680 PolarHBondContact N-O 3.27Å; R545-L680 PolarHBondContact O-N 2.97Å; R545-S682 WeakPolarHBondContact CD-OG 2.75Å; R545-S682 PolarHBondContact NE-OG 3.35Å
546	A	94	Very high	90.3	Very high	23 Å²	23	62.2 Å²	62.2	19%	0.19	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	126.8	170.3	0	0	0	0	0	109.5	P548 T586 V633 A677	A546-P548 WeakPolarHBondContact O-CD 3.49Å; A546-T586 HydrophobicContact CB-CG2 3.73Å; A546-V633 HydrophobicContact CB-CB 3.96Å; A546-V633 HydrophobicContact CB-CG1 4.42Å; A546-V633 HydrophobicContact CB-CG2 3.95Å; A546-A677 HydrophobicContact CB-CB 4.09Å
547	L	95.4	Very high	90.9	Very high	9 Å²	9	57.9 Å²	57.9	5%	0.047	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	96.9	170.1	-174.7	68.7	0	0	0	109.1	L488 R491 V492 I549 T552 I563 L567 A677 F678 L680	L488-L547 HydrophobicContact CD1-CD2 3.8Å; R491-L547 HydrophobicContact CB-CD1 3.97Å; V492-L547 HydrophobicContact CG2-CD2 4.39Å; L547-I549 PolarHBondContact O-N 3.39Å; L547-T552 HydrophobicContact CD1-CG2 4.05Å; L547-T552 WeakPolarHBondContact CD1-OG1 3.43Å; L547-T552 HydrophobicContact CD2-CG2 4.33Å; L547-T552 HydrophobicContact CG-CG2 4.24Å; L547-I563 HydrophobicContact CD2-CG2 4.12Å; L547-L567 HydrophobicContact CD2-CD1 4.37Å; L547-A677 CarbonylContact O-C 3.34Å; L547-A677 VanDerWaalsContact O-CA 3.25Å; L547-A677 WeakPolarHBondContact O-CA 3.43Å; L547-A677 WeakPolarHBondContact O-CB 3.5Å; L547-F678 HydrophobicContact CB-CB 4.3Å; L547-F678 HydrophobicContact CD2-CD2 4.36Å; L547-F678 PolarHBondContact N-O 2.87Å; L547-F678 PolarHBondContact O-N 2.81Å; L547-L680 HydrophobicContact CB-CD1 3.99Å; L547-L680 HydrophobicContact CD2-CD1 4.28Å
548	P	94.9	Very high	91.4	Very high	32 Å²	32	49.8 Å²	49.8	21%	0.208	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	122	-176.4	-21.2	32	0	0	0	111.1	A546 L551 T552	A546-P548 WeakPolarHBondContact O-CD 3.49Å; P548-L551 HydrophobicContact CB-CB 4.13Å; P548-T552 WeakPolarHBondContact O-CB 3.48Å; P548-T552 PolarHBondContact O-N 3.04Å; P548-T552 PolarHBondContact O-OG1 3.34Å
549	I	93.1	Very high	91.7	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-58.8	-168.2	-64.4	179.9	0	0	0	110.6	L547 L551 T552 V553 E560 T583 L676 F678	L547-I549 PolarHBondContact O-N 3.39Å; I549-L551 VanDerWaalsContact C-N 3.33Å; I549-L551 PolarHBondContact O-N 3.39Å; I549-T552 PolarHBondContact O-N 3.15Å; I549-V553 HydrophobicContact CG2-CG2 4.31Å; I549-V553 VanDerWaalsContact O-CG2 3.31Å; I549-V553 WeakPolarHBondContact O-CG2 3.32Å; I549-V553 PolarHBondContact O-N 3.14Å; I549-E560 HydrophobicContact CG2-CB 4.05Å; I549-E560 HydrophobicContact CG2-CG 3.64Å; I549-T583 HydrophobicContact CD1-CG2 3.73Å; I549-L676 WeakPolarHBondContact CB-O 3.44Å; I549-L676 HydrophobicContact CD1-CD2 3.93Å; I549-L676 HydrophobicContact CD1-CG 3.88Å; I549-L676 WeakPolarHBondContact CG1-O 3.43Å; I549-L676 PolarHBondContact N-O 2.88Å; I549-F678 HydrophobicContact CD1-CD2 4.37Å; I549-F678 HydrophobicContact CD1-CE1 4.24Å; I549-F678 HydrophobicContact CD1-CE2 4.09Å; I549-F678 HydrophobicContact CD1-CZ 4.01Å; I549-F678 HydrophobicContact CG1-CD2 3.8Å; I549-F678 HydrophobicContact CG1-CE2 3.69Å; I549-F678 HydrophobicContact CG1-CG 4.34Å; I549-F678 HydrophobicContact CG1-CZ 4.14Å
550	Q	92.8	Very high	92	Very high	117 Å²	117	44.5 Å²	44.5	55%	0.547	24%	0.239	S	C	.	.	H	α-helix	trans	-63.6	-38.9	-172.5	-172	60.2	32.6	0	0	112.6	Q554	Q550-Q554 WeakPolarHBondContact O-CG 3.46Å; Q550-Q554 PolarHBondContact O-N 3.15Å
551	L	93.5	Very high	91.9	Very high	107 Å²	107	50.5 Å²	50.5	56%	0.56	27%	0.266	S	S	*	.	H	α-helix	trans	-68	-40.3	177.9	-169.4	117.3	0	0	0	111.1	P548 I549 A555	P548-L551 HydrophobicContact CB-CB 4.13Å; I549-L551 VanDerWaalsContact C-N 3.33Å; I549-L551 PolarHBondContact O-N 3.39Å; L551-A555 VanDerWaalsContact O-CB 3.22Å; L551-A555 WeakPolarHBondContact O-CB 3.45Å; L551-A555 PolarHBondContact O-N 3.11Å
552	T	95.1	Very high	92	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.012	23%	0.232	C	C	.	.	H	α-helix	trans	-69.3	-42.1	178.6	-56.1	0	0	0	0	111.5	L488 L547 P548 I549 Q554 A555 L556 I563	L488-T552 HydrophobicContact CD1-CG2 4.39Å; L547-T552 HydrophobicContact CD1-CG2 4.05Å; L547-T552 WeakPolarHBondContact CD1-OG1 3.43Å; L547-T552 HydrophobicContact CD2-CG2 4.33Å; L547-T552 HydrophobicContact CG-CG2 4.24Å; P548-T552 WeakPolarHBondContact O-CB 3.48Å; P548-T552 PolarHBondContact O-N 3.04Å; P548-T552 PolarHBondContact O-OG1 3.34Å; I549-T552 PolarHBondContact O-N 3.15Å; T552-Q554 VanDerWaalsContact C-N 3.3Å; T552-Q554 PolarHBondContact O-N 3.4Å; T552-A555 PolarHBondContact O-N 3.28Å; T552-L556 HydrophobicContact CG2-CD1 3.49Å; T552-L556 VanDerWaalsContact CG2-CD1 3.49Å; T552-L556 HydrophobicContact CG2-CG 3.96Å; T552-L556 VanDerWaalsContact O-CB 3.3Å; T552-L556 WeakPolarHBondContact O-CB 3.35Å; T552-L556 WeakPolarHBondContact O-CG 3.42Å; T552-L556 PolarHBondContact O-N 3.01Å; T552-I563 HydrophobicContact CG2-CD1 3.77Å
553	V	93.8	Very high	92.2	Very high	14 Å²	14	42 Å²	42	9%	0.085	22%	0.219	C	C	.	.	H	α-helix	trans	-54.5	-47.2	174.8	163.2	0	0	0	0	111.2	I549 D557 M558 E560 I563 P813	I549-V553 HydrophobicContact CG2-CG2 4.31Å; I549-V553 VanDerWaalsContact O-CG2 3.31Å; I549-V553 WeakPolarHBondContact O-CG2 3.32Å; I549-V553 PolarHBondContact O-N 3.14Å; V553-D557 WeakPolarHBondContact O-CA 3.31Å; V553-D557 PolarHBondContact O-N 2.95Å; V553-D557 VanDerWaalsContact O-N 3.07Å; V553-M558 WeakPolarHBondContact CA-O 3.47Å; V553-M558 WeakPolarHBondContact CG1-O 3.42Å; V553-M558 PolarHBondContact O-N 3.47Å; V553-E560 HydrophobicContact CG2-CB 4.15Å; V553-I563 HydrophobicContact CG2-CD1 3.71Å; V553-P813 HydrophobicContact CG1-CB 3.97Å; V553-P813 HydrophobicContact CG1-CG 3.98Å
554	Q	90.3	Very high	92.1	Very high	109 Å²	109	42.1 Å²	42.1	51%	0.509	22%	0.22	S	C	.	.	H	α-helix	trans	-70.5	-42.8	178.1	-69.6	174.8	-6.8	0	0	112.1	Q550 T552 L556 C814	Q550-Q554 WeakPolarHBondContact O-CG 3.46Å; Q550-Q554 PolarHBondContact O-N 3.15Å; T552-Q554 VanDerWaalsContact C-N 3.3Å; T552-Q554 PolarHBondContact O-N 3.4Å; Q554-L556 VanDerWaalsContact C-N 3.3Å; Q554-L556 PolarHBondContact O-N 3.1Å; Q554-C814 PolarHBondContact O-SG 3Å
555	A	90.8	Very high	92	Very high	39 Å²	39	41 Å²	41	32%	0.322	22%	0.215	S	C	.	.	H	α-helix	trans	-69.3	-27.1	-177.2	0	0	0	0	0	113.8	L551 T552	L551-A555 VanDerWaalsContact O-CB 3.22Å; L551-A555 WeakPolarHBondContact O-CB 3.45Å; L551-A555 PolarHBondContact O-N 3.11Å; T552-A555 PolarHBondContact O-N 3.28Å
556	L	91.4	Very high	92	Very high	10 Å²	10	39 Å²	39	5%	0.052	21%	0.208	C	C	.	.	H	α-helix	trans	-105.7	-5.7	-176.5	-60.7	-171.5	0	0	0	113.9	A484 R487 L488 T552 Q554 M558	A484-L556 WeakPolarHBondContact CB-O 3.45Å; R487-L556 HydrophobicContact CB-CD2 3.38Å; R487-L556 HydrophobicContact CG-CD2 4.42Å; L488-L556 HydrophobicContact CB-CD1 3.78Å; L488-L556 HydrophobicContact CD1-CD1 3.93Å; L488-L556 HydrophobicContact CG-CD1 4.41Å; T552-L556 HydrophobicContact CG2-CD1 3.49Å; T552-L556 VanDerWaalsContact CG2-CD1 3.49Å; T552-L556 HydrophobicContact CG2-CG 3.96Å; T552-L556 VanDerWaalsContact O-CB 3.3Å; T552-L556 WeakPolarHBondContact O-CB 3.35Å; T552-L556 WeakPolarHBondContact O-CG 3.42Å; T552-L556 PolarHBondContact O-N 3.01Å; Q554-L556 VanDerWaalsContact C-N 3.3Å; Q554-L556 PolarHBondContact O-N 3.1Å; L556-M558 HydrophobicContact CB-CG 3.72Å; L556-M558 HydrophobicContact CB-SD 3.87Å; L556-M558 HydrophobicContact CD1-CG 4.5Å; L556-M558 HydrophobicContact CD1-SD 3.75Å; L556-M558 HydrophobicContact CG-SD 4.49Å; L556-M558 PolarHBondContact O-N 3.32Å
557	D	90.1	Very high	91.9	Very high	21 Å²	21	38 Å²	38	11%	0.112	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	42.4	-174.4	-164.3	37.2	0	0	0	113.7	V553 R805 S812 P813 C814	V553-D557 WeakPolarHBondContact O-CA 3.31Å; V553-D557 PolarHBondContact O-N 2.95Å; V553-D557 VanDerWaalsContact O-N 3.07Å; D557-R805 IonicContact OD2-NH1 2.99Å; D557-S812 WeakPolarHBondContact OD1-CB 3.42Å; D557-S812 PolarHBondContact OD1-OG 3.32Å; D557-S812 VanDerWaalsContact OD2-CB 3.24Å; D557-S812 WeakPolarHBondContact OD2-CB 3.43Å; D557-S812 PolarHBondContact OD2-OG 2.98Å; D557-P813 VanDerWaalsContact OD1-CD 3.22Å; D557-P813 WeakPolarHBondContact OD1-CD 3.4Å; D557-C814 HydrophobicContact CB-CB 4.22Å; D557-C814 VanDerWaalsContact OD1-CB 3.29Å; D557-C814 WeakPolarHBondContact OD1-CB 3.43Å; D557-C814 PolarHBondContact OD1-N 2.98Å
558	M	90.6	Very high	91.6	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	20%	0.197	C	C	.	.			trans	-134.6	143.3	-179.6	68.4	-176.9	-58.1	0	0	110.9	T480 A484 V553 L556 A562 I563 L566	T480-M558 HydrophobicContact CG2-CE 3.8Å; T480-M558 HydrophobicContact CG2-SD 4.41Å; A484-M558 HydrophobicContact CB-SD 4.46Å; V553-M558 WeakPolarHBondContact CA-O 3.47Å; V553-M558 WeakPolarHBondContact CG1-O 3.42Å; V553-M558 PolarHBondContact O-N 3.47Å; L556-M558 HydrophobicContact CB-CG 3.72Å; L556-M558 HydrophobicContact CB-SD 3.87Å; L556-M558 HydrophobicContact CD1-CG 4.5Å; L556-M558 HydrophobicContact CD1-SD 3.75Å; L556-M558 HydrophobicContact CG-SD 4.49Å; L556-M558 PolarHBondContact O-N 3.32Å; M558-A562 HydrophobicContact CE-CB 3.62Å; M558-I563 HydrophobicContact CE-CB 4.42Å; M558-I563 HydrophobicContact CE-CG1 3.68Å; M558-I563 HydrophobicContact CG-CD1 3.97Å; M558-I563 HydrophobicContact CG-CG1 3.6Å; M558-I563 HydrophobicContact SD-CD1 4.35Å; M558-I563 HydrophobicContact SD-CG1 3.55Å; M558-I563 VanDerWaalsContact SD-CG1 3.55Å; M558-L566 HydrophobicContact CE-CD1 3.82Å
559	P	90.6	Very high	91.3	Very high	49 Å²	49	36.8 Å²	36.8	32%	0.318	19%	0.19	S	C	.	.			trans	-68.5	157.2	-179.4	28.8	-34	0	0	0	111.8	E561 A562 I563	P559-E561 PolarHBondContact O-N 2.92Å; P559-A562 HydrophobicContact CG-CB 3.74Å; P559-A562 WeakPolarHBondContact O-CB 3.25Å; P559-A562 PolarHBondContact O-N 3.47Å; P559-I563 PolarHBondContact O-N 3.47Å
560	E	90.9	Very high	91.3	Very high	88 Å²	88	36.6 Å²	36.6	41%	0.411	19%	0.189	S	C	.	.	H	α-helix	trans	-52.9	-42.6	176.6	176	177.7	169.3	0	0	111.8	I549 V553 A562 I563 E564 F678	I549-E560 HydrophobicContact CG2-CB 4.05Å; I549-E560 HydrophobicContact CG2-CG 3.64Å; V553-E560 HydrophobicContact CG2-CB 4.15Å; E560-A562 VanDerWaalsContact C-N 3.29Å; E560-A562 PolarHBondContact O-N 3.09Å; E560-I563 WeakPolarHBondContact O-CB 3.34Å; E560-I563 PolarHBondContact O-N 3.36Å; E560-I563 VanDerWaalsContact O-N 3.11Å; E560-E564 PolarHBondContact O-N 3.41Å; E560-F678 HydrophobicContact CG-CZ 4.08Å
561	E	86.9	Confident	91.1	Very high	142 Å²	142	31.9 Å²	31.9	66%	0.664	17%	0.167	S	C	*	.	H	α-helix	trans	-61.2	-36.1	179.4	-63.1	156	173.4	0	0	112.2	P559 T565	P559-E561 PolarHBondContact O-N 2.92Å; E561-T565 WeakPolarHBondContact O-CB 3.4Å; E561-T565 PolarHBondContact O-N 2.82Å; E561-T565 PolarHBondContact O-OG1 2.96Å
562	A	90.4	Very high	90.5	Very high	12 Å²	12	31 Å²	31	10%	0.099	16%	0.163	C	C	.	.	H	α-helix	trans	-71.4	-39.1	175.9	0	0	0	0	0	111	M558 P559 E560 T565 L566	M558-A562 HydrophobicContact CE-CB 3.62Å; P559-A562 HydrophobicContact CG-CB 3.74Å; P559-A562 WeakPolarHBondContact O-CB 3.25Å; P559-A562 PolarHBondContact O-N 3.47Å; E560-A562 VanDerWaalsContact C-N 3.29Å; E560-A562 PolarHBondContact O-N 3.09Å; A562-T565 WeakPolarHBondContact O-CB 3.34Å; A562-T565 PolarHBondContact O-N 3.13Å; A562-L566 WeakPolarHBondContact O-CG 3.35Å; A562-L566 PolarHBondContact O-N 3.48Å
563	I	93.4	Very high	90.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.5	-50.4	175.6	-61.3	168.5	0	0	0	109.4	L488 L547 T552 V553 M558 P559 E560 T565 L566 L567 F678	L488-I563 HydrophobicContact CD1-CG2 4.15Å; L547-I563 HydrophobicContact CD2-CG2 4.12Å; T552-I563 HydrophobicContact CG2-CD1 3.77Å; V553-I563 HydrophobicContact CG2-CD1 3.71Å; M558-I563 HydrophobicContact CE-CB 4.42Å; M558-I563 HydrophobicContact CE-CG1 3.68Å; M558-I563 HydrophobicContact CG-CD1 3.97Å; M558-I563 HydrophobicContact CG-CG1 3.6Å; M558-I563 HydrophobicContact SD-CD1 4.35Å; M558-I563 HydrophobicContact SD-CG1 3.55Å; M558-I563 VanDerWaalsContact SD-CG1 3.55Å; P559-I563 PolarHBondContact O-N 3.47Å; E560-I563 WeakPolarHBondContact O-CB 3.34Å; E560-I563 PolarHBondContact O-N 3.36Å; E560-I563 VanDerWaalsContact O-N 3.11Å; I563-T565 VanDerWaalsContact C-N 3.28Å; I563-T565 PolarHBondContact O-N 3.35Å; I563-L566 PolarHBondContact O-N 2.98Å; I563-L567 HydrophobicContact CG2-CD1 3.92Å; I563-L567 HydrophobicContact CG2-CG 4.33Å; I563-L567 VanDerWaalsContact O-CG 3.32Å; I563-L567 WeakPolarHBondContact O-CG 3.29Å; I563-L567 PolarHBondContact O-N 3.42Å; I563-F678 HydrophobicContact CB-CE2 4.19Å; I563-F678 HydrophobicContact CG2-CD2 4.05Å; I563-F678 HydrophobicContact CG2-CE2 3.67Å
564	E	91	Very high	89.5	Confident	27 Å²	27	36.5 Å²	36.5	13%	0.126	20%	0.196	C	C	.	.	H	α-helix	trans	-58.4	-41.1	177.5	-171.2	177.8	-152.7	0	0	111.4	P262 R266 E560 L566 L567 C568 F678	P262-E564 HydrophobicContact CB-CG 4.34Å; R266-E564 IonicContact NH1-OE1 2.76Å; E560-E564 PolarHBondContact O-N 3.41Å; E564-L566 PolarHBondContact O-N 2.83Å; E564-L567 PolarHBondContact O-N 2.88Å; E564-C568 WeakPolarHBondContact O-CB 3.32Å; E564-C568 PolarHBondContact O-N 3.48Å; E564-C568 PolarHBondContact O-SG 2.89Å; E564-F678 HydrophobicContact CB-CE1 4.18Å; E564-F678 HydrophobicContact CB-CZ 3.99Å; E564-F678 HydrophobicContact CG-CE1 4.26Å
565	T	89.6	Confident	89.2	Confident	10 Å²	10	37.7 Å²	37.7	6%	0.061	20%	0.202	C	C	.	.	H	α-helix	trans	-55.7	-51.4	175.1	-56.9	0	0	0	0	111.7	F260 P262 E561 A562 I563 C568 Y569	F260-T565 HydrophobicContact CE1-CG2 4.22Å; P262-T565 HydrophobicContact CG-CG2 4.14Å; P262-T565 WeakPolarHBondContact CG-OG1 3.28Å; E561-T565 WeakPolarHBondContact O-CB 3.4Å; E561-T565 PolarHBondContact O-N 2.82Å; E561-T565 PolarHBondContact O-OG1 2.96Å; A562-T565 WeakPolarHBondContact O-CB 3.34Å; A562-T565 PolarHBondContact O-N 3.13Å; I563-T565 VanDerWaalsContact C-N 3.28Å; I563-T565 PolarHBondContact O-N 3.35Å; T565-C568 PolarHBondContact O-N 3.32Å; T565-Y569 HydrophobicContact CG2-CD2 4.2Å; T565-Y569 HydrophobicContact CG2-CE1 4.31Å; T565-Y569 HydrophobicContact CG2-CE2 3.64Å; T565-Y569 PolarHBondContact O-N 3.46Å
566	L	93.1	Very high	88.7	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-66.6	-38.9	-177.4	-64.1	-178.8	0	0	0	111.6	T480 V485 L488 M558 A562 I563 E564 Y569 L570 L698 V702	T480-L566 HydrophobicContact CG2-CD1 4.5Å; V485-L566 HydrophobicContact CG2-CD1 4.01Å; L488-L566 HydrophobicContact CD2-CB 3.88Å; L488-L566 HydrophobicContact CD2-CD1 3.64Å; L488-L566 HydrophobicContact CD2-CG 4.4Å; M558-L566 HydrophobicContact CE-CD1 3.82Å; A562-L566 WeakPolarHBondContact O-CG 3.35Å; A562-L566 PolarHBondContact O-N 3.48Å; I563-L566 PolarHBondContact O-N 2.98Å; E564-L566 PolarHBondContact O-N 2.83Å; L566-Y569 HydrophobicContact CD2-CD2 4.31Å; L566-Y569 PolarHBondContact O-N 3.29Å; L566-L570 WeakPolarHBondContact O-CG 3.42Å; L566-L570 PolarHBondContact O-N 3.01Å; L566-L570 VanDerWaalsContact O-N 3.13Å; L566-L698 HydrophobicContact CB-CD1 4.45Å; L566-L698 HydrophobicContact CB-CD2 4.38Å; L566-L698 HydrophobicContact CD2-CB 4.33Å; L566-L698 HydrophobicContact CD2-CD2 4.17Å; L566-V702 HydrophobicContact CD2-CG2 3.86Å
567	L	93.1	Very high	88.3	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.9	-41.2	175.3	-65.9	174	0	0	0	111.8	V492 L547 I563 E564 Y569 L570 E571 L578 L580 F678 L680	V492-L567 HydrophobicContact CG2-CD2 3.81Å; L547-L567 HydrophobicContact CD2-CD1 4.37Å; I563-L567 HydrophobicContact CG2-CD1 3.92Å; I563-L567 HydrophobicContact CG2-CG 4.33Å; I563-L567 VanDerWaalsContact O-CG 3.32Å; I563-L567 WeakPolarHBondContact O-CG 3.29Å; I563-L567 PolarHBondContact O-N 3.42Å; E564-L567 PolarHBondContact O-N 2.88Å; L567-Y569 VanDerWaalsContact C-N 3.33Å; L567-Y569 PolarHBondContact O-N 2.94Å; L567-L570 PolarHBondContact O-N 3Å; L567-E571 PolarHBondContact O-N 2.87Å; L567-L578 HydrophobicContact CD2-CD1 4.04Å; L567-L580 HydrophobicContact CB-CD2 4.2Å; L567-L580 HydrophobicContact CD1-CD1 4.31Å; L567-F678 HydrophobicContact CD1-CB 4.06Å; L567-F678 HydrophobicContact CD1-CD1 4.27Å; L567-F678 HydrophobicContact CD1-CD2 3.8Å; L567-F678 HydrophobicContact CD1-CE2 4.29Å; L567-F678 HydrophobicContact CD1-CG 3.79Å; L567-L680 HydrophobicContact CD1-CD2 4.08Å; L567-L680 HydrophobicContact CD2-CD1 4.04Å; L567-L680 HydrophobicContact CD2-CD2 4.24Å
568	C	88.3	Confident	88.4	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.007	22%	0.218	C	C	.	.	H	α-helix	trans	-64.3	-37.1	175.2	-65.8	0	0	0	0	112	P262 L265 E564 T565 L570 E571 L572	P262-C568 HydrophobicContact CB-CB 4.45Å; L265-C568 HydrophobicContact CD1-CB 4.09Å; E564-C568 WeakPolarHBondContact O-CB 3.32Å; E564-C568 PolarHBondContact O-N 3.48Å; E564-C568 PolarHBondContact O-SG 2.89Å; T565-C568 PolarHBondContact O-N 3.32Å; C568-L570 VanDerWaalsContact C-N 3.33Å; C568-L570 PolarHBondContact O-N 3.31Å; C568-E571 PolarHBondContact O-N 3.35Å; C568-L572 WeakPolarHBondContact O-CB 3.38Å; C568-L572 WeakPolarHBondContact O-CG 3.39Å; C568-L572 PolarHBondContact O-N 3.43Å
569	Y	89.1	Confident	88.4	Confident	15 Å²	15	47.1 Å²	47.1	6%	0.059	24%	0.236	C	C	.	.	H	α-helix	trans	-65.1	-35.4	175	-69.7	-22.9	0	0	0	113.1	F260 T565 L566 L567 H573 L698 R701	F260-Y569 HydrophobicContact CE1-CE1 4.39Å; F260-Y569 HydrophobicContact CZ-CE1 4.29Å; T565-Y569 HydrophobicContact CG2-CD2 4.2Å; T565-Y569 HydrophobicContact CG2-CE1 4.31Å; T565-Y569 HydrophobicContact CG2-CE2 3.64Å; T565-Y569 PolarHBondContact O-N 3.46Å; L566-Y569 HydrophobicContact CD2-CD2 4.31Å; L566-Y569 PolarHBondContact O-N 3.29Å; L567-Y569 VanDerWaalsContact C-N 3.33Å; L567-Y569 PolarHBondContact O-N 2.94Å; Y569-H573 PolarHBondContact O-N 3.3Å; Y569-L698 HydrophobicContact CD2-CD2 4.47Å; Y569-R701 HydrophobicContact CD2-CB 4.01Å; Y569-R701 HydrophobicContact CD2-CG 4.4Å; Y569-R701 HydrophobicContact CE2-CB 3.82Å
570	L	92.1	Very high	88.3	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-67.7	-40.6	174.2	-64.6	174.8	0	0	0	111.9	V492 F493 L566 L567 C568 H573 W577 L578 I694 L698	V492-L570 HydrophobicContact CG1-CD1 4.43Å; F493-L570 HydrophobicContact CE2-CD1 3.96Å; F493-L570 HydrophobicContact CZ-CD1 4.18Å; L566-L570 WeakPolarHBondContact O-CG 3.42Å; L566-L570 PolarHBondContact O-N 3.01Å; L566-L570 VanDerWaalsContact O-N 3.13Å; L567-L570 PolarHBondContact O-N 3Å; C568-L570 VanDerWaalsContact C-N 3.33Å; C568-L570 PolarHBondContact O-N 3.31Å; L570-H573 WeakPolarHBondContact O-CB 3.33Å; L570-H573 PolarHBondContact O-N 3.23Å; L570-W577 HydrophobicContact CD2-CE3 3.63Å; L570-W577 HydrophobicContact CD2-CZ3 4.17Å; L570-L578 HydrophobicContact CB-CB 4.01Å; L570-L578 HydrophobicContact CD1-CD1 4.38Å; L570-I694 HydrophobicContact CD2-CG2 3.38Å; L570-L698 HydrophobicContact CD1-CD1 4.34Å; L570-L698 HydrophobicContact CD2-CD1 3.93Å; L570-L698 HydrophobicContact CD2-CD2 3.87Å; L570-L698 HydrophobicContact CD2-CG 3.97Å; L570-L698 HydrophobicContact CG-CD1 4.23Å; L570-L698 HydrophobicContact CG-CD2 4.04Å; L570-L698 HydrophobicContact CG-CG 4.5Å
571	E	88.2	Confident	88.1	Confident	18 Å²	18	42.8 Å²	42.8	8%	0.084	21%	0.213	C	C	.	.	H	α-helix	trans	-66.8	-38.6	178.4	-179.6	172	-136.4	0	0	112.3	K269 L567 C568 H573 L578 L580	K269-E571 IonicContact NZ-OE1 2.66Å; K269-E571 PolarHBondContact NZ-OE1 3.23Å; L567-E571 PolarHBondContact O-N 2.87Å; C568-E571 PolarHBondContact O-N 3.35Å; E571-H573 VanDerWaalsContact C-N 3.27Å; E571-H573 PolarHBondContact O-N 3.08Å; E571-L578 WeakPolarHBondContact CA-O 3.32Å; E571-L578 HydrophobicContact CB-CD2 4.47Å; E571-L580 PolarHBondContact OE1-N 3.43Å; E571-L580 VanDerWaalsContact OE1-N 3.1Å; E571-L580 WeakPolarHBondContact OE2-CB 3.4Å
572	L	82.4	Confident	87.7	Confident	89 Å²	89	37.2 Å²	37.2	47%	0.466	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-4.5	177.5	-67.5	178.7	0	0	0	114.1	L265 C568	L265-L572 HydrophobicContact CB-CD1 4.16Å; L265-L572 HydrophobicContact CD1-CD1 3.51Å; L265-L572 HydrophobicContact CD2-CD1 3.84Å; L265-L572 HydrophobicContact CG-CD1 4.03Å; C568-L572 WeakPolarHBondContact O-CB 3.38Å; C568-L572 WeakPolarHBondContact O-CG 3.39Å; C568-L572 PolarHBondContact O-N 3.43Å
573	H	86.6	Confident	87.4	Confident	28 Å²	28	37.2 Å²	37.2	13%	0.13	19%	0.19	C	C	.	.	S	Bend	trans	-65.2	140	177.9	-163.5	-96.6	0	0	0	109.8	Y569 L570 E571 H575 H576 F697	Y569-H573 PolarHBondContact O-N 3.3Å; L570-H573 WeakPolarHBondContact O-CB 3.33Å; L570-H573 PolarHBondContact O-N 3.23Å; E571-H573 VanDerWaalsContact C-N 3.27Å; E571-H573 PolarHBondContact O-N 3.08Å; H573-H575 AromaticContact CE1-CD2 3.26Å; H573-H575 PolarHBondContact CE1-CD2 3.21Å; H573-H575 AromaticContact CE1-CG 3.89Å; H573-H575 AromaticContact ND1-CD2 3.55Å; H573-H575 AromaticContact ND1-CG 3.75Å; H573-H575 PolarHBondContact ND1-N 3.34Å; H573-H575 PolarHBondContact O-N 3.24Å; H573-H576 WeakPolarHBondContact O-CA 3.36Å; H573-H576 PolarHBondContact O-N 3.08Å; H573-F697 AromaticContact CD2-CD2 3.88Å; H573-F697 AromaticContact CD2-CE1 3.83Å; H573-F697 AromaticContact CD2-CE2 3.56Å; H573-F697 AromaticContact CD2-CZ 3.54Å
574	P	79.9	Confident	87.1	Confident	104 Å²	104	38.2 Å²	38.2	68%	0.675	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.8	179.7	-28	34.9	0	0	0	114.5	H576	P574-H576 PolarHBondContact O-CE1 2.95Å; P574-H576 PolarHBondContact O-N 3.15Å; P574-H576 PolarHBondContact O-ND1 3.02Å
575	H	83.8	Confident	87.1	Confident	134 Å²	134	42.1 Å²	42.1	62%	0.62	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-1.7	175.1	-60.7	-43.5	0	0	0	114.4	H573 W577	H573-H575 AromaticContact CE1-CD2 3.26Å; H573-H575 PolarHBondContact CE1-CD2 3.21Å; H573-H575 AromaticContact CE1-CG 3.89Å; H573-H575 AromaticContact ND1-CD2 3.55Å; H573-H575 AromaticContact ND1-CG 3.75Å; H573-H575 PolarHBondContact ND1-N 3.34Å; H573-H575 PolarHBondContact O-N 3.24Å; H575-W577 VanDerWaalsContact C-N 3.32Å; H575-W577 HydrophobicContact CB-CG 4.4Å; H575-W577 VanDerWaalsContact CB-NE1 3.33Å; H575-W577 AromaticContact CD2-NE1 3.91Å; H575-W577 AromaticContact CG-NE1 3.96Å; H575-W577 PolarHBondContact O-N 3.02Å
576	H	80.8	Confident	87.1	Confident	142 Å²	142	41.7 Å²	41.7	66%	0.657	21%	0.208	S	C	*	.			trans	45.6	53.9	179	-62.1	84	0	0	0	112.5	H573 P574 L578	H573-H576 WeakPolarHBondContact O-CA 3.36Å; H573-H576 PolarHBondContact O-N 3.08Å; P574-H576 PolarHBondContact O-CE1 2.95Å; P574-H576 PolarHBondContact O-N 3.15Å; P574-H576 PolarHBondContact O-ND1 3.02Å; H576-L578 PolarHBondContact O-N 3.33Å; H576-L578 VanDerWaalsContact O-N 3.1Å
577	W	84.4	Confident	87	Confident	38 Å²	38	43.1 Å²	43.1	14%	0.144	21%	0.214	C	C	.	.			trans	-62.7	-21.5	-174.2	-71	-21.7	0	0	0	113.3	F493 L570 H575 P683 I694 F697	F493-W577 HydrophobicContact CE1-CB 4.49Å; F493-W577 VanDerWaalsContact CE1-O 3.3Å; F493-W577 WeakPolarHBondContact CE1-O 3.29Å; F493-W577 HydrophobicContact CZ-CB 4.13Å; L570-W577 HydrophobicContact CD2-CE3 3.63Å; L570-W577 HydrophobicContact CD2-CZ3 4.17Å; H575-W577 VanDerWaalsContact C-N 3.32Å; H575-W577 HydrophobicContact CB-CG 4.4Å; H575-W577 VanDerWaalsContact CB-NE1 3.33Å; H575-W577 AromaticContact CD2-NE1 3.91Å; H575-W577 AromaticContact CG-NE1 3.96Å; H575-W577 PolarHBondContact O-N 3.02Å; W577-P683 VanDerWaalsContact O-CD 3.3Å; W577-P683 WeakPolarHBondContact O-CD 3.01Å; W577-I694 HydrophobicContact CD2-CD1 3.75Å; W577-I694 HydrophobicContact CD2-CG1 3.93Å; W577-I694 HydrophobicContact CE3-CB 4.1Å; W577-I694 HydrophobicContact CE3-CD1 3.62Å; W577-I694 HydrophobicContact CE3-CG1 3.54Å; W577-I694 HydrophobicContact CE3-CG2 3.86Å; W577-I694 HydrophobicContact CG-CD1 4.23Å; W577-I694 HydrophobicContact CH2-CB 4.1Å; W577-I694 HydrophobicContact CH2-CD1 4.5Å; W577-I694 HydrophobicContact CH2-CG1 3.61Å; W577-I694 HydrophobicContact CZ2-CG1 3.98Å; W577-I694 VanDerWaalsContact CZ3-CA 3.48Å; W577-I694 HydrophobicContact CZ3-CB 3.66Å; W577-I694 HydrophobicContact CZ3-CD1 4.04Å; W577-I694 HydrophobicContact CZ3-CG1 3.4Å; W577-I694 HydrophobicContact CZ3-CG2 3.69Å; W577-F697 HydrophobicContact CH2-CB 4.46Å; W577-F697 HydrophobicContact CZ3-CB 4.34Å; W577-F697 HydrophobicContact CZ3-CD1 4.01Å; W577-F697 HydrophobicContact CZ3-CG 4.38Å
578	L	92.3	Very high	87	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	21%	0.214	C	C	.	.			trans	-148.5	144.9	-175	-179.2	142.6	0	0	0	111.4	V492 F493 L567 L570 E571 H576 L580 L680	V492-L578 HydrophobicContact CG1-CD1 3.24Å; F493-L578 HydrophobicContact CZ-CB 4.48Å; L567-L578 HydrophobicContact CD2-CD1 4.04Å; L570-L578 HydrophobicContact CB-CB 4.01Å; L570-L578 HydrophobicContact CD1-CD1 4.38Å; E571-L578 WeakPolarHBondContact CA-O 3.32Å; E571-L578 HydrophobicContact CB-CD2 4.47Å; H576-L578 PolarHBondContact O-N 3.33Å; H576-L578 VanDerWaalsContact O-N 3.1Å; L578-L580 HydrophobicContact CD2-CB 3.89Å; L578-L680 HydrophobicContact CD1-CB 4.29Å; L578-L680 HydrophobicContact CD1-CD1 4.21Å; L578-L680 HydrophobicContact CD1-CD2 4.2Å; L578-L680 HydrophobicContact CD1-CG 4.46Å; L578-L680 HydrophobicContact CD2-CD2 4.01Å
579	E	89.6	Confident	87.2	Confident	85 Å²	85	47.5 Å²	47.5	40%	0.397	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	124.8	164.6	-59	174.1	179	0	0	109.7	L581 L680 R681	E579-L581 PolarHBondContact O-N 2.7Å; E579-L680 CarbonylContact O-C 3.49Å; E579-L680 WeakPolarHBondContact O-CA 3.41Å; E579-R681 HydrophobicContact CB-CB 4.19Å; E579-R681 PolarHBondContact N-O 3.46Å; E579-R681 PolarHBondContact O-N 3.04Å; E579-R681 IonicContact OE2-NH1 3.39Å
580	L	88.3	Confident	87.3	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	95.6	-179.9	178.9	58.1	0	0	0	110	R266 L567 E571 L578 F678 L680	R266-L580 HydrophobicContact CG-CD2 4.45Å; R266-L580 PolarHBondContact NH2-O 3.28Å; R266-L580 VanDerWaalsContact NH2-O 3.09Å; L567-L580 HydrophobicContact CB-CD2 4.2Å; L567-L580 HydrophobicContact CD1-CD1 4.31Å; E571-L580 PolarHBondContact OE1-N 3.43Å; E571-L580 VanDerWaalsContact OE1-N 3.1Å; E571-L580 WeakPolarHBondContact OE2-CB 3.4Å; L578-L580 HydrophobicContact CD2-CB 3.89Å; L580-F678 HydrophobicContact CD1-CB 4.26Å; L580-F678 HydrophobicContact CD1-CD1 4.23Å; L580-L680 HydrophobicContact CB-CD2 4.47Å; L580-L680 HydrophobicContact CD1-CD2 3.22Å; L580-L680 HydrophobicContact CG-CD2 4.39Å
581	L	86.4	Confident	87.2	Confident	40 Å²	40	49.3 Å²	49.3	21%	0.209	24%	0.242	C	C	.	.			trans	-72.7	-179.4	177.7	-53	176	0	0	0	111.3	R266 E544 E579 T583 H679	R266-L581 PolarHBondContact NH2-O 3.35Å; E544-L581 HydrophobicContact CG-CD1 4.48Å; E579-L581 PolarHBondContact O-N 2.7Å; L581-T583 PolarHBondContact O-N 3.12Å; L581-H679 CarbonylContact C-O 3.49Å; L581-H679 WeakPolarHBondContact CA-O 3.29Å; L581-H679 HydrophobicContact CB-CB 3.98Å; L581-H679 VanDerWaalsContact CB-O 3.29Å; L581-H679 WeakPolarHBondContact CB-O 3.48Å; L581-H679 VanDerWaalsContact CD1-CE1 3.44Å; L581-H679 WeakPolarHBondContact CD1-CE1 3.41Å; L581-H679 WeakPolarHBondContact CD1-NE2 3.36Å; L581-H679 PolarHBondContact N-O 3.47Å
582	A	78.4	Confident	87.2	Confident	25 Å²	25	48.5 Å²	48.5	21%	0.207	24%	0.238	C	C	.	.			trans	-68	128.8	-175	0	0	0	0	0	110.9	T584 H679	A582-T584 PolarHBondContact O-N 2.9Å; A582-H679 WeakPolarHBondContact O-CB 3.39Å
583	T	85.1	Confident	87.3	Confident	11 Å²	11	49 Å²	49	7%	0.067	25%	0.247	C	C	.	.			trans	-56.2	128.9	171.7	-51	0	0	0	0	108.9	A230 I549 L581 L676 A677 F678	A230-T583 WeakPolarHBondContact CA-O 3.03Å; A230-T583 WeakPolarHBondContact CB-O 3.37Å; A230-T583 PolarHBondContact N-O 2.77Å; I549-T583 HydrophobicContact CD1-CG2 3.73Å; L581-T583 PolarHBondContact O-N 3.12Å; T583-L676 HydrophobicContact CG2-CD1 3.85Å; T583-L676 HydrophobicContact CG2-CD2 4.24Å; T583-L676 HydrophobicContact CG2-CG 3.84Å; T583-A677 WeakPolarHBondContact CA-O 3.3Å; T583-A677 WeakPolarHBondContact CG2-O 3.3Å; T583-F678 HydrophobicContact CG2-CD1 4.46Å
584	T	87.2	Confident	87	Confident	22 Å²	22	50 Å²	50	14%	0.135	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	166.5	-171.7	-161.7	0	0	0	0	111.7	A582 T586 L643 R647 A677 H679	A582-T584 PolarHBondContact O-N 2.9Å; T584-T586 HydrophobicContact CG2-CG2 3.89Å; T584-T586 PolarHBondContact O-N 3.34Å; T584-L643 HydrophobicContact CG2-CD2 3.49Å; T584-L643 VanDerWaalsContact CG2-CD2 3.49Å; T584-R647 PolarHBondContact OG1-NH2 3.15Å; T584-A677 PolarHBondContact N-O 3.08Å; T584-A677 PolarHBondContact O-N 3.39Å; T584-H679 HydrophobicContact CG2-CB 4.35Å
585	Y	89.7	Confident	87.3	Confident	108 Å²	108	45.6 Å²	45.6	42%	0.424	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	116.6	173.2	-66.5	-76.4	0	0	0	109.2	R647 F673 L676	Y585-R647 PolarHBondContact O-NH2 3.29Å; Y585-F673 HydrophobicContact CG-CB 4.42Å; Y585-L676 HydrophobicContact CD1-CB 4.34Å; Y585-L676 HydrophobicContact CD1-CD1 4.46Å; Y585-L676 HydrophobicContact CE1-CB 4.13Å; Y585-L676 HydrophobicContact CE1-CD1 4.35Å
586	T	90.5	Very high	87.2	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-15.8	-172.3	54.6	0	0	0	0	112.9	A546 T584 M632 V633 E675 A677	A546-T586 HydrophobicContact CB-CG2 3.73Å; T584-T586 HydrophobicContact CG2-CG2 3.89Å; T584-T586 PolarHBondContact O-N 3.34Å; T586-M632 VanDerWaalsContact O-CB 3.24Å; T586-M632 WeakPolarHBondContact O-CB 3.43Å; T586-M632 WeakPolarHBondContact O-CG 3.47Å; T586-M632 PolarHBondContact O-N 2.96Å; T586-V633 HydrophobicContact CG2-CG2 3.45Å; T586-V633 VanDerWaalsContact CG2-CG2 3.45Å; T586-E675 PolarHBondContact N-O 3.14Å; T586-A677 HydrophobicContact CG2-CB 3.75Å; T586-A677 WeakPolarHBondContact OG1-CB 3.4Å
587	H	91.6	Very high	87.3	Confident	33 Å²	33	39.4 Å²	39.4	15%	0.153	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	136.5	178.8	-147.7	100.4	0	0	0	111	F630 F673 S674 E675	H587-F630 PolarHBondContact NE2-N 3.34Å; H587-F673 VanDerWaalsContact O-CA 3.31Å; H587-F673 WeakPolarHBondContact O-CA 3.29Å; H587-S674 WeakPolarHBondContact CB-O 3.38Å; H587-S674 PolarHBondContact N-O 2.9Å; H587-S674 PolarHBondContact O-N 3.47Å; H587-E675 HydrophobicContact CB-CB 3.91Å; H587-E675 HydrophobicContact CB-CG 3.93Å; H587-E675 IonicContact CG-OE2 3.5Å; H587-E675 IonicContact ND1-OE2 2.65Å; H587-E675 PolarHBondContact ND1-OE2 2.84Å
588	C	93	Very high	87.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128.9	175	-178.2	0	0	0	0	110.3	E629 F630 M632 L650 F673	C588-E629 WeakPolarHBondContact O-CA 3.42Å; C588-F630 HydrophobicContact CB-CD2 4.42Å; C588-F630 HydrophobicContact CB-CE2 3.96Å; C588-F630 HydrophobicContact CB-CZ 4.23Å; C588-F630 PolarHBondContact N-O 3.36Å; C588-F630 PolarHBondContact O-N 2.77Å; C588-F630 VanDerWaalsContact O-N 3.14Å; C588-M632 HydrophobicContact CB-CG 3.75Å; C588-M632 HydrophobicContact CB-SD 3.82Å; C588-L650 HydrophobicContact CB-CD1 4.1Å; C588-F673 HydrophobicContact CB-CD1 4.12Å; C588-F673 HydrophobicContact CB-CE1 4.16Å
589	R	91.8	Very high	87	Confident	92 Å²	92	39.9 Å²	39.9	35%	0.347	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.4	168.8	-179.4	176.6	-169.9	159.3	10.2	109.7	E629 E672	R589-E629 HydrophobicContact CB-CG 3.83Å; R589-E629 WeakPolarHBondContact CD-OE1 3.48Å; R589-E629 HydrophobicContact CG-CG 3.64Å; R589-E629 IonicContact CZ-OE1 3.45Å; R589-E629 IonicContact NE-OE1 3.24Å; R589-E629 PolarHBondContact NE-OE1 3.3Å; R589-E629 IonicContact NH1-OE1 2.62Å; R589-E629 PolarHBondContact NH1-OE1 3.47Å; R589-E629 IonicContact NH2-OE1 3.5Å; R589-E672 HydrophobicContact CB-CB 4.39Å; R589-E672 PolarHBondContact N-O 3.43Å; R589-E672 PolarHBondContact O-N 2.78Å
590	L	90.6	Very high	86.8	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125.8	171.9	-59.9	177.4	0	0	0	108.7	L599 L609 S627 V628 F630 L650 L653 L670 V671	L590-L599 HydrophobicContact CB-CD1 4.46Å; L590-L599 HydrophobicContact CD1-CD1 4.34Å; L590-L609 HydrophobicContact CD1-CD1 3.76Å; L590-L609 HydrophobicContact CD1-CD2 4.45Å; L590-S627 CarbonylContact O-C 3.52Å; L590-S627 WeakPolarHBondContact O-CA 3.23Å; L590-S627 VanDerWaalsContact O-CB 3.31Å; L590-S627 WeakPolarHBondContact O-CB 3.27Å; L590-V628 PolarHBondContact N-O 3.01Å; L590-V628 PolarHBondContact O-N 3.18Å; L590-F630 HydrophobicContact CD1-CE1 3.94Å; L590-F630 HydrophobicContact CD1-CZ 4.09Å; L590-F630 HydrophobicContact CG-CE1 4.37Å; L590-L650 HydrophobicContact CD1-CD2 4.31Å; L590-L653 HydrophobicContact CD1-CD1 3.87Å; L590-L653 HydrophobicContact CD2-CD1 4.11Å; L590-L670 WeakPolarHBondContact CA-O 3.38Å; L590-V671 HydrophobicContact CD2-CB 4.11Å; L590-V671 HydrophobicContact CD2-CG1 3.85Å; L590-V671 HydrophobicContact CD2-CG2 3.69Å
591	N	90	Very high	86.6	Confident	55 Å²	55	43.7 Å²	43.7	29%	0.294	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.5	174.1	-168.2	1.9	0	0	0	109.6	S626 V669 L670	N591-S626 PolarHBondContact OD1-O 3.18Å; N591-V669 WeakPolarHBondContact O-CA 3.31Å; N591-L670 HydrophobicContact CB-CB 4.26Å; N591-L670 PolarHBondContact N-O 3.27Å; N591-L670 PolarHBondContact O-N 3.38Å
592	C	88	Confident	86.5	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.007	25%	0.253	C	S	.	.			trans	-110	112.4	-175.1	-70.3	0	0	0	0	110.4	G594 G595 Q598 L599 S626	C592-G594 PolarHBondContact O-N 3.4Å; C592-G595 PolarHBondContact O-N 3.43Å; C592-Q598 HydrophobicContact CB-CB 4.41Å; C592-Q598 HydrophobicContact CB-CG 4.49Å; C592-L599 WeakPolarHBondContact SG-CD1 3.24Å; C592-S626 PolarHBondContact N-O 3.38Å
593	P	85.1	Confident	86.8	Confident	100 Å²	100	41.3 Å²	41.3	65%	0.649	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-31.5	176.7	-23.5	33	0	0	0	113.6	G595 G668	P593-G595 PolarHBondContact O-N 3.05Å; P593-G668 WeakPolarHBondContact CD-O 3.29Å; P593-G668 VanDerWaalsContact CG-O 3.3Å; P593-G668 WeakPolarHBondContact CG-O 3.32Å
594	G	80.2	Confident	86.6	Confident	47 Å²	47	49 Å²	49	49%	0.485	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	11.3	176.1	0	0	0	0	0	114.4	C592	C592-G594 PolarHBondContact O-N 3.4Å
595	G	85.9	Confident	86.4	Confident	13 Å²	13	53.2 Å²	53.2	13%	0.134	29%	0.294	C	S	.	.	H	α-helix	trans	67.5	-158.6	175.5	0	0	0	0	0	114.1	C592 P593 A597 Q598 L599	C592-G595 PolarHBondContact O-N 3.43Å; P593-G595 PolarHBondContact O-N 3.05Å; G595-A597 VanDerWaalsContact C-N 3.3Å; G595-A597 PolarHBondContact O-N 3.02Å; G595-Q598 PolarHBondContact O-N 2.99Å; G595-L599 PolarHBondContact O-N 3.19Å
596	P	82.9	Confident	86.3	Confident	70 Å²	70	48 Å²	48	46%	0.455	27%	0.274	S	S	.	.	H	α-helix	trans	-65.4	-30.1	-174.2	25.6	-34.9	0	0	0	113.3	Q598 L599 Q600	P596-Q598 PolarHBondContact O-N 3.47Å; P596-L599 PolarHBondContact O-N 3.35Å; P596-Q600 PolarHBondContact O-N 2.94Å
597	A	83.4	Confident	86.3	Confident	76 Å²	76	51.1 Å²	51.1	63%	0.628	29%	0.294	S	S	*	.	H	α-helix	trans	-63.6	-41	177.6	0	0	0	0	0	112.1	G595 L599 A601	G595-A597 VanDerWaalsContact C-N 3.3Å; G595-A597 PolarHBondContact O-N 3.02Å; A597-L599 VanDerWaalsContact C-N 3.35Å; A597-A601 PolarHBondContact O-N 3.34Å; A597-A601 VanDerWaalsContact O-N 3.12Å
598	Q	85.9	Confident	86.2	Confident	44 Å²	44	49.6 Å²	49.6	21%	0.206	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-41.5	174.2	-177.1	179.4	31.2	0	0	111.2	C592 G595 P596 A601 L602 T667	C592-Q598 HydrophobicContact CB-CB 4.41Å; C592-Q598 HydrophobicContact CB-CG 4.49Å; G595-Q598 PolarHBondContact O-N 2.99Å; P596-Q598 PolarHBondContact O-N 3.47Å; Q598-A601 PolarHBondContact O-N 2.88Å; Q598-L602 HydrophobicContact CG-CD1 4.19Å; Q598-L602 WeakPolarHBondContact O-CG 3.39Å; Q598-L602 PolarHBondContact O-N 3.11Å; Q598-L602 VanDerWaalsContact O-N 3.11Å; Q598-T667 PolarHBondContact NE2-O 3Å
599	L	84.2	Confident	86	Confident	7 Å²	7	49.6 Å²	49.6	4%	0.037	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-41.9	-179.5	-167.5	70.3	0	0	0	111.8	L590 C592 G595 P596 A597 L602 A603 L609 L613 V628	L590-L599 HydrophobicContact CB-CD1 4.46Å; L590-L599 HydrophobicContact CD1-CD1 4.34Å; C592-L599 WeakPolarHBondContact SG-CD1 3.24Å; G595-L599 PolarHBondContact O-N 3.19Å; P596-L599 PolarHBondContact O-N 3.35Å; A597-L599 VanDerWaalsContact C-N 3.35Å; L599-L602 PolarHBondContact O-N 3.18Å; L599-A603 PolarHBondContact O-N 3.05Å; L599-A603 VanDerWaalsContact O-N 3.15Å; L599-L609 HydrophobicContact CD1-CD1 3.94Å; L599-L609 HydrophobicContact CD1-CD2 4.01Å; L599-L609 HydrophobicContact CG-CD1 4.27Å; L599-L613 HydrophobicContact CD2-CD2 3.67Å; L599-L613 HydrophobicContact CG-CD1 4.34Å; L599-L613 HydrophobicContact CG-CD2 4.15Å; L599-V628 HydrophobicContact CD2-CB 3.91Å; L599-V628 HydrophobicContact CD2-CG2 3.32Å
600	Q	83.9	Confident	85.8	Confident	109 Å²	109	47.1 Å²	47.1	51%	0.509	29%	0.286	S	S	.	.	H	α-helix	trans	-63.6	-41.4	175	-173.2	63.4	26.3	0	0	112	P596 L602 A603	P596-Q600 PolarHBondContact O-N 2.94Å; Q600-L602 VanDerWaalsContact C-N 3.26Å; Q600-L602 PolarHBondContact O-N 3.34Å; Q600-A603 WeakPolarHBondContact O-CB 3.48Å; Q600-A603 PolarHBondContact O-N 3.26Å
601	A	84.8	Confident	85.6	Confident	63 Å²	63	48.8 Å²	48.8	52%	0.521	30%	0.296	S	S	.	.	H	α-helix	trans	-61.7	-36.4	177	0	0	0	0	0	112.1	A597 Q598 A603	A597-A601 PolarHBondContact O-N 3.34Å; A597-A601 VanDerWaalsContact O-N 3.12Å; Q598-A601 PolarHBondContact O-N 2.88Å; A601-A603 VanDerWaalsContact C-N 3.34Å
602	L	84.6	Confident	85.4	Confident	8 Å²	8	46.3 Å²	46.3	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-75.1	-21.4	178.2	-70.1	173.3	0	0	0	113.7	Q598 L599 Q600 H604 R605 C606 L609 L653 T667 V669	Q598-L602 HydrophobicContact CG-CD1 4.19Å; Q598-L602 WeakPolarHBondContact O-CG 3.39Å; Q598-L602 PolarHBondContact O-N 3.11Å; Q598-L602 VanDerWaalsContact O-N 3.11Å; L599-L602 PolarHBondContact O-N 3.18Å; Q600-L602 VanDerWaalsContact C-N 3.26Å; Q600-L602 PolarHBondContact O-N 3.34Å; L602-H604 VanDerWaalsContact C-N 3.26Å; L602-H604 PolarHBondContact O-N 3.15Å; L602-R605 PolarHBondContact O-N 3.37Å; L602-C606 PolarHBondContact O-N 3.35Å; L602-L609 HydrophobicContact CB-CD2 3.96Å; L602-L653 HydrophobicContact CB-CD2 3.97Å; L602-L653 HydrophobicContact CD2-CD2 4.32Å; L602-T667 HydrophobicContact CD2-CG2 4.13Å; L602-V669 HydrophobicContact CD1-CG2 3.46Å; L602-V669 VanDerWaalsContact CD1-CG2 3.46Å
603	A	85.1	Confident	85.3	Confident	8 Å²	8	48 Å²	48	7%	0.066	29%	0.292	C	S	.	.	H	α-helix	trans	-58.3	-37.9	178.5	0	0	0	0	0	112.3	L599 Q600 A601 R605 C606 L609 A610 L613	L599-A603 PolarHBondContact O-N 3.05Å; L599-A603 VanDerWaalsContact O-N 3.15Å; Q600-A603 WeakPolarHBondContact O-CB 3.48Å; Q600-A603 PolarHBondContact O-N 3.26Å; A601-A603 VanDerWaalsContact C-N 3.34Å; A603-R605 PolarHBondContact O-N 3.01Å; A603-R605 VanDerWaalsContact O-N 3.12Å; A603-C606 CarbonylContact O-C 3.5Å; A603-C606 PolarHBondContact O-N 3.07Å; A603-L609 HydrophobicContact CB-CG 4.4Å; A603-A610 HydrophobicContact CB-CB 4.34Å; A603-L613 HydrophobicContact CB-CD1 3.66Å
604	H	81.4	Confident	85.2	Confident	173 Å²	173	46.3 Å²	46.3	80%	0.801	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.6	176	-77.7	-74.8	0	0	0	113.7	L602	L602-H604 VanDerWaalsContact C-N 3.26Å; L602-H604 PolarHBondContact O-N 3.15Å
605	R	81.3	Confident	85	Confident	109 Å²	109	47.8 Å²	47.8	41%	0.411	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-11.3	-176.9	-62	179.9	62.5	-142.5	-11.2	113.1	L602 A603 W655 D656	L602-R605 PolarHBondContact O-N 3.37Å; A603-R605 PolarHBondContact O-N 3.01Å; A603-R605 VanDerWaalsContact O-N 3.12Å; R605-W655 PolarHBondContact NH1-O 2.88Å; R605-W655 PolarHBondContact NH2-O 3.39Å; R605-D656 IonicContact CZ-OD1 3.2Å; R605-D656 VanDerWaalsContact CZ-OD1 3.3Å; R605-D656 IonicContact NE-OD1 3.68Å; R605-D656 IonicContact NH1-OD1 3.1Å; R605-D656 PolarHBondContact NH1-OD1 2.95Å; R605-D656 IonicContact NH1-OD2 3.02Å; R605-D656 IonicContact NH2-OD1 3.85Å
606	C	88.4	Confident	84.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.295	C	S	.	.			trans	-136.9	97.6	-173.9	-175	0	0	0	0	109.8	L602 A603 P608 L609 A610 L653	L602-C606 PolarHBondContact O-N 3.35Å; A603-C606 CarbonylContact O-C 3.5Å; A603-C606 PolarHBondContact O-N 3.07Å; C606-P608 VanDerWaalsContact C-CD 3.49Å; C606-P608 VanDerWaalsContact C-N 3.33Å; C606-L609 HydrophobicContact CB-CB 3.89Å; C606-L609 WeakPolarHBondContact O-CA 3.45Å; C606-L609 WeakPolarHBondContact O-CB 3.42Å; C606-L609 PolarHBondContact O-N 2.65Å; C606-A610 PolarHBondContact O-N 3.4Å; C606-L653 HydrophobicContact CB-CD1 4.42Å; C606-L653 HydrophobicContact CB-CD2 3.57Å; C606-L653 HydrophobicContact CB-CG 4.21Å
607	P	90.3	Very high	83	Confident	66 Å²	66	55.4 Å²	55.4	43%	0.429	31%	0.311	S	S	.	.	H	α-helix	trans	-53.3	-40.8	179.5	-24.1	32.1	0	0	0	114.2	L609 A610 V611 W641	P607-L609 VanDerWaalsContact C-N 3.31Å; P607-L609 PolarHBondContact O-N 2.72Å; P607-A610 PolarHBondContact O-N 3.46Å; P607-V611 WeakPolarHBondContact O-CG2 3.47Å; P607-V611 PolarHBondContact O-N 2.91Å; P607-V611 VanDerWaalsContact O-N 3.09Å; P607-W641 HydrophobicContact CB-CH2 4.48Å; P607-W641 HydrophobicContact CB-CZ2 4.36Å; P607-W641 HydrophobicContact CG-CH2 4.21Å; P607-W641 HydrophobicContact CG-CZ2 4.36Å
608	P	90.6	Very high	81.5	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-56.4	-42.5	172.5	-26.3	34.1	0	0	0	113.7	C606 V611 C612 L635 M639 V646 A649 L650	C606-P608 VanDerWaalsContact C-CD 3.49Å; C606-P608 VanDerWaalsContact C-N 3.33Å; P608-V611 PolarHBondContact O-N 2.63Å; P608-C612 PolarHBondContact O-N 3.5Å; P608-C612 VanDerWaalsContact O-N 3.11Å; P608-C612 PolarHBondContact O-SG 2.77Å; P608-L635 HydrophobicContact CB-CD1 4.18Å; P608-M639 HydrophobicContact CB-CE 4.22Å; P608-M639 HydrophobicContact CG-CE 4.02Å; P608-M639 HydrophobicContact CG-SD 4.35Å; P608-V646 HydrophobicContact CB-CG1 4.07Å; P608-V646 HydrophobicContact CG-CG1 4.11Å; P608-V646 HydrophobicContact CG-CG2 4.41Å; P608-A649 HydrophobicContact CG-CB 4.26Å; P608-L650 HydrophobicContact CB-CD2 4.42Å
609	L	88.5	Confident	79.7	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-67.3	-41.2	178.1	178.1	58.6	0	0	0	111.6	L590 L599 L602 A603 C606 P607 V611 C612 L613 L653	L590-L609 HydrophobicContact CD1-CD1 3.76Å; L590-L609 HydrophobicContact CD1-CD2 4.45Å; L599-L609 HydrophobicContact CD1-CD1 3.94Å; L599-L609 HydrophobicContact CD1-CD2 4.01Å; L599-L609 HydrophobicContact CG-CD1 4.27Å; L602-L609 HydrophobicContact CB-CD2 3.96Å; A603-L609 HydrophobicContact CB-CG 4.4Å; C606-L609 HydrophobicContact CB-CB 3.89Å; C606-L609 WeakPolarHBondContact O-CA 3.45Å; C606-L609 WeakPolarHBondContact O-CB 3.42Å; C606-L609 PolarHBondContact O-N 2.65Å; P607-L609 VanDerWaalsContact C-N 3.31Å; P607-L609 PolarHBondContact O-N 2.72Å; L609-V611 VanDerWaalsContact C-N 3.32Å; L609-V611 PolarHBondContact O-N 3.2Å; L609-C612 WeakPolarHBondContact O-CB 3.4Å; L609-C612 PolarHBondContact O-N 2.87Å; L609-L613 HydrophobicContact CD1-CD1 4.14Å; L609-L613 HydrophobicContact CD1-CD2 4.36Å; L609-L613 HydrophobicContact CD1-CG 3.99Å; L609-L613 HydrophobicContact CG-CD1 4.09Å; L609-L613 HydrophobicContact CG-CG 4.36Å; L609-L613 WeakPolarHBondContact O-CG 3.19Å; L609-L613 PolarHBondContact O-N 2.81Å; L609-L653 HydrophobicContact CD2-CD1 3.94Å; L609-L653 HydrophobicContact CD2-CD2 4.41Å
610	A	87.7	Confident	77.9	Confident	41 Å²	41	68.9 Å²	68.9	34%	0.339	37%	0.373	S	S	.	.	H	α-helix	trans	-59.1	-43.6	177.4	0	0	0	0	0	112.1	A603 C606 P607 L613 A614	A603-A610 HydrophobicContact CB-CB 4.34Å; C606-A610 PolarHBondContact O-N 3.4Å; P607-A610 PolarHBondContact O-N 3.46Å; A610-L613 PolarHBondContact O-N 3.5Å; A610-A614 WeakPolarHBondContact O-CB 3.31Å; A610-A614 PolarHBondContact O-N 3.46Å; A610-A614 VanDerWaalsContact O-N 3.07Å
611	V	86.6	Confident	76.1	Confident	35 Å²	35	69.8 Å²	69.8	21%	0.212	39%	0.388	C	S	.	.	H	α-helix	trans	-62.9	-45.3	176.2	171.9	0	0	0	0	111.2	H530 P607 P608 L609 L613 A614 Q615 L635 M639	H530-V611 WeakPolarHBondContact NE2-CG1 3.34Å; P607-V611 WeakPolarHBondContact O-CG2 3.47Å; P607-V611 PolarHBondContact O-N 2.91Å; P607-V611 VanDerWaalsContact O-N 3.09Å; P608-V611 PolarHBondContact O-N 2.63Å; L609-V611 VanDerWaalsContact C-N 3.32Å; L609-V611 PolarHBondContact O-N 3.2Å; V611-L613 PolarHBondContact O-N 2.91Å; V611-A614 PolarHBondContact O-N 3.01Å; V611-Q615 WeakPolarHBondContact O-CG 3.47Å; V611-Q615 PolarHBondContact O-N 3.08Å; V611-Q615 VanDerWaalsContact O-N 3.16Å; V611-L635 HydrophobicContact CB-CD2 4.47Å; V611-L635 HydrophobicContact CG1-CD2 3.92Å; V611-M639 HydrophobicContact CG2-CE 4.42Å
612	C	85.8	Confident	74.3	Confident	3 Å²	3	70.4 Å²	70.4	2%	0.02	40%	0.4	C	S	.	.	H	α-helix	trans	-57.8	-48.5	176.5	-70.4	0	0	0	0	113	P608 L609 A614 Q615 Q616 F630 L635	P608-C612 PolarHBondContact O-N 3.5Å; P608-C612 VanDerWaalsContact O-N 3.11Å; P608-C612 PolarHBondContact O-SG 2.77Å; L609-C612 WeakPolarHBondContact O-CB 3.4Å; L609-C612 PolarHBondContact O-N 2.87Å; C612-A614 VanDerWaalsContact C-N 3.27Å; C612-A614 PolarHBondContact O-N 2.89Å; C612-Q615 PolarHBondContact O-N 3.46Å; C612-Q615 VanDerWaalsContact O-N 3.15Å; C612-Q616 PolarHBondContact O-N 3.06Å; C612-Q616 VanDerWaalsContact O-N 3.09Å; C612-F630 HydrophobicContact CB-CD1 4.11Å; C612-F630 HydrophobicContact CB-CE1 4.31Å; C612-F630 HydrophobicContact CB-CG 4.48Å; C612-F630 VanDerWaalsContact SG-CD1 3.57Å; C612-F630 VanDerWaalsContact SG-CD2 3.59Å; C612-F630 WeakPolarHBondContact SG-CG 3.38Å; C612-L635 WeakPolarHBondContact SG-CD1 3.32Å
613	L	84.5	Confident	72.4	Confident	35 Å²	35	78.2 Å²	78.2	18%	0.183	44%	0.437	C	S	.	.	H	α-helix	trans	-65.5	-33.4	-178.5	-65.9	177.3	0	0	0	111.8	L599 A603 L609 A610 V611 Q615 V628	L599-L613 HydrophobicContact CD2-CD2 3.67Å; L599-L613 HydrophobicContact CG-CD1 4.34Å; L599-L613 HydrophobicContact CG-CD2 4.15Å; A603-L613 HydrophobicContact CB-CD1 3.66Å; L609-L613 HydrophobicContact CD1-CD1 4.14Å; L609-L613 HydrophobicContact CD1-CD2 4.36Å; L609-L613 HydrophobicContact CD1-CG 3.99Å; L609-L613 HydrophobicContact CG-CD1 4.09Å; L609-L613 HydrophobicContact CG-CG 4.36Å; L609-L613 WeakPolarHBondContact O-CG 3.19Å; L609-L613 PolarHBondContact O-N 2.81Å; A610-L613 PolarHBondContact O-N 3.5Å; V611-L613 PolarHBondContact O-N 2.91Å; L613-Q615 VanDerWaalsContact C-N 3.31Å; L613-Q615 PolarHBondContact O-N 3.22Å; L613-V628 HydrophobicContact CD2-CG2 4.43Å
614	A	82.8	Confident	71.1	Confident	66 Å²	66	80.1 Å²	80.1	55%	0.545	46%	0.457	S	S	.	.	H	α-helix	trans	-67.9	-29.8	175	0	0	0	0	0	113	A610 V611 C612	A610-A614 WeakPolarHBondContact O-CB 3.31Å; A610-A614 PolarHBondContact O-N 3.46Å; A610-A614 VanDerWaalsContact O-N 3.07Å; V611-A614 PolarHBondContact O-N 3.01Å; C612-A614 VanDerWaalsContact C-N 3.27Å; C612-A614 PolarHBondContact O-N 2.89Å
615	Q	77.2	Confident	70.3	Confident	78 Å²	78	75.1 Å²	75.1	36%	0.364	44%	0.442	S	S	.	.	H	α-helix	trans	-82	-29	178.4	-68	176.7	1.3	0	0	113	S529 H530 V611 C612 L613 L617	S529-Q615 PolarHBondContact OG-NE2 3.04Å; S529-Q615 VanDerWaalsContact OG-NE2 3.15Å; H530-Q615 PolarHBondContact NE2-NE2 3.21Å; V611-Q615 WeakPolarHBondContact O-CG 3.47Å; V611-Q615 PolarHBondContact O-N 3.08Å; V611-Q615 VanDerWaalsContact O-N 3.16Å; C612-Q615 PolarHBondContact O-N 3.46Å; C612-Q615 VanDerWaalsContact O-N 3.15Å; L613-Q615 VanDerWaalsContact C-N 3.31Å; L613-Q615 PolarHBondContact O-N 3.22Å; Q615-L617 PolarHBondContact O-N 3.06Å
616	Q	70.4	Confident	70.2	Confident	92 Å²	92	72.7 Å²	72.7	43%	0.43	44%	0.441	S	S	.	.			trans	-88	73.5	177.2	-65.9	-174.7	-5.8	0	0	110	C612 P618 E629	C612-Q616 PolarHBondContact O-N 3.06Å; C612-Q616 VanDerWaalsContact O-N 3.09Å; Q616-P618 WeakPolarHBondContact O-CD 3.47Å; Q616-E629 PolarHBondContact NE2-O 3.06Å
617	L	56.7	Low	70	Confident	150 Å²	150	73.7 Å²	73.7	79%	0.785	45%	0.449	S	S	*	.			trans	-63.1	124.1	168.8	-84.3	155.6	0	0	0	108.9	Q615 E619	Q615-L617 PolarHBondContact O-N 3.06Å; L617-E619 PolarHBondContact O-N 3.17Å
618	P	52	Low	69.9	Low	97 Å²	97	71.2 Å²	71.2	63%	0.63	43%	0.432	S	S	*	.			trans	-69.5	120.2	178.5	25.4	-30.1	0	0	0	109.7	Q616 D620	Q616-P618 WeakPolarHBondContact O-CD 3.47Å; P618-D620 PolarHBondContact O-N 3.37Å
619	E	47.2	Very low	69.8	Low	201 Å²	201	75.3 Å²	75.3	94%	0.939	45%	0.451	S	S	*	.	S	Bend	trans	-67.2	-14.2	168	-70.1	-164.3	154	0	0	112	L617	L617-E619 PolarHBondContact O-N 3.17Å
620	D	45.3	Very low	69.8	Low	113 Å²	113	76.1 Å²	76.1	60%	0.604	46%	0.455	S	S	*	.			trans	-144.2	115.4	177	-123.9	-27.5	0	0	0	111.7	P618 G622	P618-D620 PolarHBondContact O-N 3.37Å; D620-G622 PolarHBondContact O-N 3.3Å; D620-G622 VanDerWaalsContact O-N 3.14Å
621	P	46.6	Very low	70	Confident	127 Å²	127	75.9 Å²	75.9	83%	0.825	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-3.7	-175.2	26.2	-32.3	0	0	0	114.6
622	G	46.5	Very low	70.2	Confident	76 Å²	76	74.2 Å²	74.2	78%	0.784	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-7.6	-175.4	0	0	0	0	0	116.2	D620	D620-G622 PolarHBondContact O-N 3.3Å; D620-G622 VanDerWaalsContact O-N 3.14Å
623	Q	46.4	Very low	70.5	Confident	172 Å²	172	74.1 Å²	74.1	80%	0.804	44%	0.437	S	S	*	.			trans	-132.5	53.9	-171.6	-131.9	171.7	26.1	0	0	111.9	S625	Q623-S625 PolarHBondContact O-N 3.11Å; Q623-S625 VanDerWaalsContact O-N 3.07Å
624	G	56.2	Low	70.6	Confident	48 Å²	48	78.8 Å²	78.8	50%	0.495	46%	0.456	S	S	.	.			trans	-61.7	111.3	173.9	0	0	0	0	0	111.1	S626	G624-S626 PolarHBondContact O-N 2.96Å
625	S	64.8	Low	70.9	Confident	69 Å²	69	75.8 Å²	75.8	48%	0.483	43%	0.431	S	S	.	.			trans	-60	133.7	174.7	174.2	0	0	0	0	110.3	Q623 S627	Q623-S625 PolarHBondContact O-N 3.11Å; Q623-S625 VanDerWaalsContact O-N 3.07Å; S625-S627 WeakPolarHBondContact CB-O 3.5Å; S625-S627 PolarHBondContact O-N 2.96Å; S625-S627 PolarHBondContact OG-N 3.15Å; S625-S627 PolarHBondContact OG-O 2.93Å
626	S	78.8	Confident	71.5	Confident	57 Å²	57	72.3 Å²	72.3	40%	0.399	42%	0.415	S	S	.	.	S	Bend	trans	-71.9	-3.4	173.1	61.7	0	0	0	0	113.1	N591 C592 G624	N591-S626 PolarHBondContact OD1-O 3.18Å; C592-S626 PolarHBondContact N-O 3.38Å; G624-S626 PolarHBondContact O-N 2.96Å
627	S	84.4	Confident	72.4	Confident	22 Å²	22	70.8 Å²	70.8	15%	0.154	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	141.9	175.1	61.4	0	0	0	0	112.7	L590 S625	L590-S627 CarbonylContact O-C 3.52Å; L590-S627 WeakPolarHBondContact O-CA 3.23Å; L590-S627 VanDerWaalsContact O-CB 3.31Å; L590-S627 WeakPolarHBondContact O-CB 3.27Å; S625-S627 WeakPolarHBondContact CB-O 3.5Å; S625-S627 PolarHBondContact O-N 2.96Å; S625-S627 PolarHBondContact OG-N 3.15Å; S625-S627 PolarHBondContact OG-O 2.93Å
628	V	88.4	Confident	73.8	Confident	13 Å²	13	66.2 Å²	66.2	8%	0.079	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	137.4	176.5	165.7	0	0	0	0	109.4	L590 L599 L613 F630	L590-V628 PolarHBondContact N-O 3.01Å; L590-V628 PolarHBondContact O-N 3.18Å; L599-V628 HydrophobicContact CD2-CB 3.91Å; L599-V628 HydrophobicContact CD2-CG2 3.32Å; L613-V628 HydrophobicContact CD2-CG2 4.43Å; V628-F630 HydrophobicContact CG1-CD1 3.75Å; V628-F630 HydrophobicContact CG1-CE1 4.04Å
629	E	89	Confident	75.5	Confident	86 Å²	86	63.6 Å²	63.6	40%	0.402	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	135.8	-176.7	-70.9	-179.1	-166	0	0	109.1	C588 R589 Q616	C588-E629 WeakPolarHBondContact O-CA 3.42Å; R589-E629 HydrophobicContact CB-CG 3.83Å; R589-E629 WeakPolarHBondContact CD-OE1 3.48Å; R589-E629 HydrophobicContact CG-CG 3.64Å; R589-E629 IonicContact CZ-OE1 3.45Å; R589-E629 IonicContact NE-OE1 3.24Å; R589-E629 PolarHBondContact NE-OE1 3.3Å; R589-E629 IonicContact NH1-OE1 2.62Å; R589-E629 PolarHBondContact NH1-OE1 3.47Å; R589-E629 IonicContact NH2-OE1 3.5Å; Q616-E629 PolarHBondContact NE2-O 3.06Å
630	F	89	Confident	77.4	Confident	18 Å²	18	57.3 Å²	57.3	8%	0.079	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	158.9	179.3	51.6	-94.5	0	0	0	112.8	H587 C588 L590 C612 V628 M632 L635 L650	H587-F630 PolarHBondContact NE2-N 3.34Å; C588-F630 HydrophobicContact CB-CD2 4.42Å; C588-F630 HydrophobicContact CB-CE2 3.96Å; C588-F630 HydrophobicContact CB-CZ 4.23Å; C588-F630 PolarHBondContact N-O 3.36Å; C588-F630 PolarHBondContact O-N 2.77Å; C588-F630 VanDerWaalsContact O-N 3.14Å; L590-F630 HydrophobicContact CD1-CE1 3.94Å; L590-F630 HydrophobicContact CD1-CZ 4.09Å; L590-F630 HydrophobicContact CG-CE1 4.37Å; C612-F630 HydrophobicContact CB-CD1 4.11Å; C612-F630 HydrophobicContact CB-CE1 4.31Å; C612-F630 HydrophobicContact CB-CG 4.48Å; C612-F630 VanDerWaalsContact SG-CD1 3.57Å; C612-F630 VanDerWaalsContact SG-CD2 3.59Å; C612-F630 WeakPolarHBondContact SG-CG 3.38Å; V628-F630 HydrophobicContact CG1-CD1 3.75Å; V628-F630 HydrophobicContact CG1-CE1 4.04Å; F630-M632 HydrophobicContact CE2-CG 4.44Å; F630-L635 HydrophobicContact CD2-CD1 3.55Å; F630-L635 HydrophobicContact CD2-CG 4.45Å; F630-L635 HydrophobicContact CE2-CD1 3.56Å; F630-L650 HydrophobicContact CE2-CD1 3.91Å; F630-L650 HydrophobicContact CE2-CD2 4.25Å; F630-L650 HydrophobicContact CZ-CD1 4.15Å; F630-L650 HydrophobicContact CZ-CD2 3.74Å
631	D	90.8	Very high	79.5	Confident	36 Å²	36	56.9 Å²	56.9	19%	0.193	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	115.6	173.4	-175.5	-12.3	0	0	0	110.6	V633 K634 L635	D631-V633 VanDerWaalsContact C-N 3.3Å; D631-V633 PolarHBondContact O-N 3.13Å; D631-V633 PolarHBondContact OD1-N 3.43Å; D631-K634 HydrophobicContact CB-CB 4.25Å; D631-K634 HydrophobicContact CB-CD 4.1Å; D631-K634 HydrophobicContact CB-CG 4.05Å; D631-L635 PolarHBondContact O-N 3.22Å
632	M	92.2	Very high	81.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-67.2	-29.4	179.8	-61.7	172.1	57.8	0	0	112.8	T586 C588 F630 L635 V636 L643 V646 R647 L650 F673	T586-M632 VanDerWaalsContact O-CB 3.24Å; T586-M632 WeakPolarHBondContact O-CB 3.43Å; T586-M632 WeakPolarHBondContact O-CG 3.47Å; T586-M632 PolarHBondContact O-N 2.96Å; C588-M632 HydrophobicContact CB-CG 3.75Å; C588-M632 HydrophobicContact CB-SD 3.82Å; F630-M632 HydrophobicContact CE2-CG 4.44Å; M632-L635 WeakPolarHBondContact O-CB 3.29Å; M632-L635 PolarHBondContact O-N 3.34Å; M632-V636 WeakPolarHBondContact O-CG2 3.16Å; M632-V636 PolarHBondContact O-N 3.23Å; M632-L643 HydrophobicContact CB-CD1 3.88Å; M632-L643 HydrophobicContact CE-CD1 3.91Å; M632-V646 HydrophobicContact CB-CG1 4.42Å; M632-V646 HydrophobicContact CE-CB 4.45Å; M632-V646 HydrophobicContact CE-CG1 4.04Å; M632-R647 HydrophobicContact CE-CB 3.71Å; M632-R647 HydrophobicContact CE-CG 4.16Å; M632-L650 HydrophobicContact CE-CD1 4.05Å; M632-L650 HydrophobicContact CG-CD1 4.11Å; M632-L650 HydrophobicContact SD-CD1 4.2Å; M632-F673 HydrophobicContact CE-CE1 4.08Å; M632-F673 HydrophobicContact SD-CD1 3.67Å; M632-F673 HydrophobicContact SD-CE1 3.6Å
633	V	90.9	Very high	83.5	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-76.4	-33.8	-177	-179.1	0	0	0	0	110.7	E544 A546 T586 D631 L635 V636 D637 L643	E544-V633 HydrophobicContact CB-CG1 4.03Å; A546-V633 HydrophobicContact CB-CB 3.96Å; A546-V633 HydrophobicContact CB-CG1 4.42Å; A546-V633 HydrophobicContact CB-CG2 3.95Å; T586-V633 HydrophobicContact CG2-CG2 3.45Å; T586-V633 VanDerWaalsContact CG2-CG2 3.45Å; D631-V633 VanDerWaalsContact C-N 3.3Å; D631-V633 PolarHBondContact O-N 3.13Å; D631-V633 PolarHBondContact OD1-N 3.43Å; V633-L635 VanDerWaalsContact C-N 3.27Å; V633-L635 PolarHBondContact O-N 2.93Å; V633-V636 WeakPolarHBondContact O-CB 3.44Å; V633-V636 PolarHBondContact O-N 3.13Å; V633-D637 PolarHBondContact O-N 3.11Å; V633-L643 HydrophobicContact CG2-CD1 4.14Å; V633-L643 HydrophobicContact CG2-CD2 4.43Å
634	K	87.9	Confident	85.4	Confident	132 Å²	132	48.8 Å²	48.8	57%	0.574	29%	0.289	S	S	*	.	H	α-helix	trans	-60	-38.8	168.4	-70.8	-173.9	-177.9	-165.8	0	111.9	D631 S638	D631-K634 HydrophobicContact CB-CB 4.25Å; D631-K634 HydrophobicContact CB-CD 4.1Å; D631-K634 HydrophobicContact CB-CG 4.05Å; K634-S638 WeakPolarHBondContact O-CB 3.46Å; K634-S638 PolarHBondContact O-N 3.35Å; K634-S638 PolarHBondContact O-OG 3.12Å; K634-S638 VanDerWaalsContact O-OG 3.04Å
635	L	88.9	Confident	87	Confident	4 Å²	4	48 Å²	48	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-64.8	-48.7	174.1	-67	175.8	0	0	0	111.4	P608 V611 C612 F630 D631 M632 V633 D637 S638 M639	P608-L635 HydrophobicContact CB-CD1 4.18Å; V611-L635 HydrophobicContact CB-CD2 4.47Å; V611-L635 HydrophobicContact CG1-CD2 3.92Å; C612-L635 WeakPolarHBondContact SG-CD1 3.32Å; F630-L635 HydrophobicContact CD2-CD1 3.55Å; F630-L635 HydrophobicContact CD2-CG 4.45Å; F630-L635 HydrophobicContact CE2-CD1 3.56Å; D631-L635 PolarHBondContact O-N 3.22Å; M632-L635 WeakPolarHBondContact O-CB 3.29Å; M632-L635 PolarHBondContact O-N 3.34Å; V633-L635 VanDerWaalsContact C-N 3.27Å; V633-L635 PolarHBondContact O-N 2.93Å; L635-D637 VanDerWaalsContact C-N 3.29Å; L635-D637 PolarHBondContact O-N 3.3Å; L635-S638 PolarHBondContact O-N 3.42Å; L635-S638 PolarHBondContact O-OG 2.98Å; L635-M639 HydrophobicContact CB-SD 4.19Å; L635-M639 WeakPolarHBondContact O-CB 3.22Å; L635-M639 WeakPolarHBondContact O-CG 3.49Å; L635-M639 PolarHBondContact O-N 3.06Å
636	V	89	Confident	88.2	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.024	25%	0.254	C	S	.	.	H	α-helix	trans	-49.9	-50.5	176	157.6	0	0	0	0	111.3	E544 M632 V633 G640 W641 L643 V646	E544-V636 HydrophobicContact CB-CG1 4.17Å; E544-V636 HydrophobicContact CG-CG1 4.45Å; E544-V636 VanDerWaalsContact OE2-CG1 3.22Å; E544-V636 WeakPolarHBondContact OE2-CG1 3.39Å; M632-V636 WeakPolarHBondContact O-CG2 3.16Å; M632-V636 PolarHBondContact O-N 3.23Å; V633-V636 WeakPolarHBondContact O-CB 3.44Å; V633-V636 PolarHBondContact O-N 3.13Å; V636-G640 WeakPolarHBondContact O-CA 3.44Å; V636-G640 PolarHBondContact O-N 2.94Å; V636-W641 WeakPolarHBondContact CG1-O 3.33Å; V636-W641 WeakPolarHBondContact CG2-O 3.34Å; V636-W641 PolarHBondContact O-N 2.88Å; V636-L643 HydrophobicContact CG2-CB 3.96Å; V636-L643 HydrophobicContact CG2-CD1 3.88Å; V636-V646 HydrophobicContact CG2-CB 4.41Å; V636-V646 HydrophobicContact CG2-CG2 3.78Å
637	D	89.1	Confident	88.8	Confident	61 Å²	61	44.6 Å²	44.6	33%	0.326	24%	0.244	S	C	.	.	H	α-helix	trans	-64.1	-45	-179.7	-166.5	70.5	0	0	0	112.5	H543 E544 V633 L635	H543-D637 WeakPolarHBondContact CA-OD1 2.99Å; H543-D637 VanDerWaalsContact CB-OD1 3.26Å; H543-D637 WeakPolarHBondContact CB-OD1 3.09Å; H543-D637 IonicContact CE1-OD2 3.05Å; H543-D637 IonicContact CG-OD1 3Å; H543-D637 IonicContact CG-OD2 2.92Å; H543-D637 IonicContact ND1-OD1 3.89Å; H543-D637 PolarHBondContact ND1-OD1 3.12Å; H543-D637 IonicContact ND1-OD2 3.77Å; H543-D637 PolarHBondContact ND1-OD2 3.39Å; E544-D637 PolarHBondContact N-OD1 3.11Å; V633-D637 PolarHBondContact O-N 3.11Å; L635-D637 VanDerWaalsContact C-N 3.29Å; L635-D637 PolarHBondContact O-N 3.3Å
638	S	86.9	Confident	89	Confident	53 Å²	53	50.5 Å²	50.5	37%	0.371	26%	0.263	S	S	.	.	H	α-helix	trans	-71.9	-32.2	-178.3	62.9	0	0	0	0	114.1	K634 L635	K634-S638 WeakPolarHBondContact O-CB 3.46Å; K634-S638 PolarHBondContact O-N 3.35Å; K634-S638 PolarHBondContact O-OG 3.12Å; K634-S638 VanDerWaalsContact O-OG 3.04Å; L635-S638 PolarHBondContact O-N 3.42Å; L635-S638 PolarHBondContact O-OG 2.98Å
639	M	87.3	Confident	89.1	Confident	42 Å²	42	51 Å²	51	21%	0.207	27%	0.268	C	S	.	.	H	α-helix	trans	-100.9	-11.3	-174.3	82.1	-167.7	-25.2	0	0	113.6	P608 V611 L635 W641 V646	P608-M639 HydrophobicContact CB-CE 4.22Å; P608-M639 HydrophobicContact CG-CE 4.02Å; P608-M639 HydrophobicContact CG-SD 4.35Å; V611-M639 HydrophobicContact CG2-CE 4.42Å; L635-M639 HydrophobicContact CB-SD 4.19Å; L635-M639 WeakPolarHBondContact O-CB 3.22Å; L635-M639 WeakPolarHBondContact O-CG 3.49Å; L635-M639 PolarHBondContact O-N 3.06Å; M639-W641 VanDerWaalsContact C-N 3.31Å; M639-W641 HydrophobicContact CE-CG 4.49Å; M639-W641 HydrophobicContact CG-CB 3.51Å; M639-W641 HydrophobicContact CG-CD2 4.48Å; M639-W641 HydrophobicContact CG-CG 3.54Å; M639-W641 PolarHBondContact O-N 3.48Å; M639-W641 HydrophobicContact SD-CB 3.71Å; M639-W641 HydrophobicContact SD-CD2 4.12Å; M639-W641 HydrophobicContact SD-CG 3.69Å; M639-V646 HydrophobicContact SD-CG2 3.74Å
640	G	86.8	Confident	89.2	Confident	70 Å²	70	46.9 Å²	46.9	72%	0.722	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.7	26.7	-176.7	0	0	0	0	0	113.9	V636	V636-G640 WeakPolarHBondContact O-CA 3.44Å; V636-G640 PolarHBondContact O-N 2.94Å
641	W	90.4	Very high	89.2	Confident	103 Å²	103	47.7 Å²	47.7	39%	0.39	26%	0.257	S	S	.	.			trans	-97.8	153.2	178.5	-79.7	37	0	0	0	111.6	P607 V636 M639 V646	P607-W641 HydrophobicContact CB-CH2 4.48Å; P607-W641 HydrophobicContact CB-CZ2 4.36Å; P607-W641 HydrophobicContact CG-CH2 4.21Å; P607-W641 HydrophobicContact CG-CZ2 4.36Å; V636-W641 WeakPolarHBondContact CG1-O 3.33Å; V636-W641 WeakPolarHBondContact CG2-O 3.34Å; V636-W641 PolarHBondContact O-N 2.88Å; M639-W641 VanDerWaalsContact C-N 3.31Å; M639-W641 HydrophobicContact CE-CG 4.49Å; M639-W641 HydrophobicContact CG-CB 3.51Å; M639-W641 HydrophobicContact CG-CD2 4.48Å; M639-W641 HydrophobicContact CG-CG 3.54Å; M639-W641 PolarHBondContact O-N 3.48Å; M639-W641 HydrophobicContact SD-CB 3.71Å; M639-W641 HydrophobicContact SD-CD2 4.12Å; M639-W641 HydrophobicContact SD-CG 3.69Å; W641-V646 HydrophobicContact CB-CG2 3.9Å; W641-V646 HydrophobicContact CE3-CG2 4.29Å
642	E	87.9	Confident	89.1	Confident	134 Å²	134	49.9 Å²	49.9	63%	0.626	27%	0.266	S	S	*	.			trans	-70.7	141.4	168.8	-63.3	-178.5	172.1	0	0	112.3	A644 S645 V646	E642-A644 PolarHBondContact O-N 3.26Å; E642-A644 VanDerWaalsContact O-N 3.16Å; E642-S645 WeakPolarHBondContact O-CA 3.38Å; E642-S645 WeakPolarHBondContact O-CB 3.43Å; E642-S645 PolarHBondContact O-N 2.99Å; E642-V646 PolarHBondContact O-N 3.42Å; E642-V646 VanDerWaalsContact O-N 3.08Å
643	L	88.3	Confident	88.9	Confident	19 Å²	19	50.1 Å²	50.1	10%	0.099	27%	0.267	C	S	.	.	H	α-helix	trans	-55.5	-35.9	178.1	-174.9	63.8	0	0	0	113.4	T584 M632 V633 V636 S645 V646 R647	T584-L643 HydrophobicContact CG2-CD2 3.49Å; T584-L643 VanDerWaalsContact CG2-CD2 3.49Å; M632-L643 HydrophobicContact CB-CD1 3.88Å; M632-L643 HydrophobicContact CE-CD1 3.91Å; V633-L643 HydrophobicContact CG2-CD1 4.14Å; V633-L643 HydrophobicContact CG2-CD2 4.43Å; V636-L643 HydrophobicContact CG2-CB 3.96Å; V636-L643 HydrophobicContact CG2-CD1 3.88Å; L643-S645 VanDerWaalsContact C-N 3.32Å; L643-S645 PolarHBondContact O-N 3.08Å; L643-V646 PolarHBondContact O-N 3.48Å; L643-R647 WeakPolarHBondContact O-CB 3.31Å; L643-R647 PolarHBondContact O-N 2.96Å
644	A	86.6	Confident	88.8	Confident	52 Å²	52	53.1 Å²	53.1	43%	0.43	28%	0.281	S	S	.	.	H	α-helix	trans	-64.4	-37	176.2	0	0	0	0	0	112.2	E642 R648	E642-A644 PolarHBondContact O-N 3.26Å; E642-A644 VanDerWaalsContact O-N 3.16Å; A644-R648 WeakPolarHBondContact O-CB 3.44Å; A644-R648 VanDerWaalsContact O-CG 3.32Å; A644-R648 WeakPolarHBondContact O-CG 3.32Å; A644-R648 PolarHBondContact O-N 2.97Å; A644-R648 PolarHBondContact O-NE 2.88Å
645	S	89.8	Confident	88.7	Confident	32 Å²	32	51.2 Å²	51.2	22%	0.224	27%	0.27	C	S	.	.	H	α-helix	trans	-70.9	-42.4	177.8	-64.6	0	0	0	0	111.5	E642 L643 R648 A649	E642-S645 WeakPolarHBondContact O-CA 3.38Å; E642-S645 WeakPolarHBondContact O-CB 3.43Å; E642-S645 PolarHBondContact O-N 2.99Å; L643-S645 VanDerWaalsContact C-N 3.32Å; L643-S645 PolarHBondContact O-N 3.08Å; S645-R648 PolarHBondContact O-N 2.92Å; S645-R648 PolarHBondContact OG-NH2 3.41Å; S645-A649 WeakPolarHBondContact O-CB 3.49Å; S645-A649 PolarHBondContact O-N 3.16Å
646	V	90.8	Very high	88.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-48.1	172.5	179.2	0	0	0	0	110.7	P608 M632 V636 M639 W641 E642 L643 R648 A649 L650	P608-V646 HydrophobicContact CB-CG1 4.07Å; P608-V646 HydrophobicContact CG-CG1 4.11Å; P608-V646 HydrophobicContact CG-CG2 4.41Å; M632-V646 HydrophobicContact CB-CG1 4.42Å; M632-V646 HydrophobicContact CE-CB 4.45Å; M632-V646 HydrophobicContact CE-CG1 4.04Å; V636-V646 HydrophobicContact CG2-CB 4.41Å; V636-V646 HydrophobicContact CG2-CG2 3.78Å; M639-V646 HydrophobicContact SD-CG2 3.74Å; W641-V646 HydrophobicContact CB-CG2 3.9Å; W641-V646 HydrophobicContact CE3-CG2 4.29Å; E642-V646 PolarHBondContact O-N 3.42Å; E642-V646 VanDerWaalsContact O-N 3.08Å; L643-V646 PolarHBondContact O-N 3.48Å; V646-R648 PolarHBondContact O-N 3.05Å; V646-A649 PolarHBondContact O-N 2.88Å; V646-L650 HydrophobicContact CG1-CD1 3.87Å; V646-L650 HydrophobicContact CG1-CG 4.44Å; V646-L650 VanDerWaalsContact O-CG 3.31Å; V646-L650 WeakPolarHBondContact O-CG 3.38Å; V646-L650 PolarHBondContact O-N 2.93Å
647	R	89.8	Confident	87.8	Confident	55 Å²	55	58.4 Å²	58.4	21%	0.208	31%	0.306	C	S	.	.	H	α-helix	trans	-58.7	-45	177.7	-166.8	-175.4	-70.9	-82.6	2.3	112.1	T584 Y585 M632 L643 L650 C651 F673	T584-R647 PolarHBondContact OG1-NH2 3.15Å; Y585-R647 PolarHBondContact O-NH2 3.29Å; M632-R647 HydrophobicContact CE-CB 3.71Å; M632-R647 HydrophobicContact CE-CG 4.16Å; L643-R647 WeakPolarHBondContact O-CB 3.31Å; L643-R647 PolarHBondContact O-N 2.96Å; R647-L650 PolarHBondContact O-N 2.76Å; R647-C651 PolarHBondContact O-N 2.72Å; R647-C651 PolarHBondContact O-SG 3.12Å; R647-C651 VanDerWaalsContact O-SG 3.36Å; R647-F673 HydrophobicContact CG-CE1 4.05Å; R647-F673 HydrophobicContact CG-CE2 3.86Å; R647-F673 HydrophobicContact CG-CZ 3.49Å; R647-F673 VanDerWaalsContact CG-CZ 3.49Å
648	R	89.1	Confident	87.2	Confident	146 Å²	146	58.8 Å²	58.8	55%	0.551	31%	0.305	S	S	*	.	H	α-helix	trans	-61.1	-49.5	177.3	-79.1	-177.6	-66.1	-145.1	0	111.2	A644 S645 V646 L650 C651 Q652	A644-R648 WeakPolarHBondContact O-CB 3.44Å; A644-R648 VanDerWaalsContact O-CG 3.32Å; A644-R648 WeakPolarHBondContact O-CG 3.32Å; A644-R648 PolarHBondContact O-N 2.97Å; A644-R648 PolarHBondContact O-NE 2.88Å; S645-R648 PolarHBondContact O-N 2.92Å; S645-R648 PolarHBondContact OG-NH2 3.41Å; V646-R648 PolarHBondContact O-N 3.05Å; R648-L650 VanDerWaalsContact C-N 3.32Å; R648-L650 PolarHBondContact O-N 2.99Å; R648-C651 PolarHBondContact O-N 2.78Å; R648-Q652 WeakPolarHBondContact O-CG 3.46Å; R648-Q652 PolarHBondContact O-N 2.97Å
649	A	90.4	Very high	86.6	Confident	22 Å²	22	62.8 Å²	62.8	18%	0.182	33%	0.33	C	S	.	.	H	α-helix	trans	-58.4	-43.3	179.9	0	0	0	0	0	112	P608 S645 V646 Q652	P608-A649 HydrophobicContact CG-CB 4.26Å; S645-A649 WeakPolarHBondContact O-CB 3.49Å; S645-A649 PolarHBondContact O-N 3.16Å; V646-A649 PolarHBondContact O-N 2.88Å; A649-Q652 PolarHBondContact O-N 2.69Å
650	L	90.9	Very high	85.9	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-65.3	-42.9	176.9	-67.1	170.9	0	0	0	112.3	C588 L590 P608 F630 M632 V646 R647 R648 Q652 L653 V671	C588-L650 HydrophobicContact CB-CD1 4.1Å; L590-L650 HydrophobicContact CD1-CD2 4.31Å; P608-L650 HydrophobicContact CB-CD2 4.42Å; F630-L650 HydrophobicContact CE2-CD1 3.91Å; F630-L650 HydrophobicContact CE2-CD2 4.25Å; F630-L650 HydrophobicContact CZ-CD1 4.15Å; F630-L650 HydrophobicContact CZ-CD2 3.74Å; M632-L650 HydrophobicContact CE-CD1 4.05Å; M632-L650 HydrophobicContact CG-CD1 4.11Å; M632-L650 HydrophobicContact SD-CD1 4.2Å; V646-L650 HydrophobicContact CG1-CD1 3.87Å; V646-L650 HydrophobicContact CG1-CG 4.44Å; V646-L650 VanDerWaalsContact O-CG 3.31Å; V646-L650 WeakPolarHBondContact O-CG 3.38Å; V646-L650 PolarHBondContact O-N 2.93Å; R647-L650 PolarHBondContact O-N 2.76Å; R648-L650 VanDerWaalsContact C-N 3.32Å; R648-L650 PolarHBondContact O-N 2.99Å; L650-Q652 VanDerWaalsContact C-N 3.27Å; L650-Q652 PolarHBondContact O-N 2.83Å; L650-L653 HydrophobicContact CD2-CD1 4.22Å; L650-L653 VanDerWaalsContact O-CB 3.22Å; L650-L653 WeakPolarHBondContact O-CB 3.31Å; L650-L653 WeakPolarHBondContact O-CG 3.48Å; L650-L653 PolarHBondContact O-N 2.93Å; L650-V671 HydrophobicContact CB-CG1 4.45Å; L650-V671 WeakPolarHBondContact O-CG2 3.46Å
651	C	89.2	Confident	85.4	Confident	35 Å²	35	72.9 Å²	72.9	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-62.8	-32.9	174.5	-72.1	0	0	0	0	112.8	R647 R648 L653 Q654 W655 F673	R647-C651 PolarHBondContact O-N 2.72Å; R647-C651 PolarHBondContact O-SG 3.12Å; R647-C651 VanDerWaalsContact O-SG 3.36Å; R648-C651 PolarHBondContact O-N 2.78Å; C651-L653 PolarHBondContact O-N 3.17Å; C651-L653 VanDerWaalsContact O-N 3.16Å; C651-Q654 WeakPolarHBondContact O-CB 3.37Å; C651-Q654 WeakPolarHBondContact O-CG 3.31Å; C651-Q654 PolarHBondContact O-N 2.93Å; C651-W655 VanDerWaalsContact O-CZ3 3.29Å; C651-W655 WeakPolarHBondContact O-CZ3 3.48Å; C651-F673 VanDerWaalsContact SG-CE2 3.58Å
652	Q	88.6	Confident	84.6	Confident	82 Å²	82	70.1 Å²	70.1	38%	0.383	36%	0.356	S	S	.	.	H	α-helix	trans	-63	-19.4	178.2	-69.7	-60	-32.1	0	0	113.1	R648 A649 L650 Q654 W655 R664	R648-Q652 WeakPolarHBondContact O-CG 3.46Å; R648-Q652 PolarHBondContact O-N 2.97Å; A649-Q652 PolarHBondContact O-N 2.69Å; L650-Q652 VanDerWaalsContact C-N 3.27Å; L650-Q652 PolarHBondContact O-N 2.83Å; Q652-Q654 PolarHBondContact O-N 3.43Å; Q652-Q654 VanDerWaalsContact O-N 3.13Å; Q652-W655 PolarHBondContact O-N 3.31Å; Q652-W655 VanDerWaalsContact O-O 3.11Å; Q652-R664 VanDerWaalsContact OE1-NH2 3.1Å
653	L	89	Confident	84.2	Confident	5 Å²	5	68 Å²	68	3%	0.026	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.3	175.7	-64.9	178	0	0	0	113.7	L590 L602 C606 L609 L650 C651 W655 T667	L590-L653 HydrophobicContact CD1-CD1 3.87Å; L590-L653 HydrophobicContact CD2-CD1 4.11Å; L602-L653 HydrophobicContact CB-CD2 3.97Å; L602-L653 HydrophobicContact CD2-CD2 4.32Å; C606-L653 HydrophobicContact CB-CD1 4.42Å; C606-L653 HydrophobicContact CB-CD2 3.57Å; C606-L653 HydrophobicContact CB-CG 4.21Å; L609-L653 HydrophobicContact CD2-CD1 3.94Å; L609-L653 HydrophobicContact CD2-CD2 4.41Å; L650-L653 HydrophobicContact CD2-CD1 4.22Å; L650-L653 VanDerWaalsContact O-CB 3.22Å; L650-L653 WeakPolarHBondContact O-CB 3.31Å; L650-L653 WeakPolarHBondContact O-CG 3.48Å; L650-L653 PolarHBondContact O-N 2.93Å; C651-L653 PolarHBondContact O-N 3.17Å; C651-L653 VanDerWaalsContact O-N 3.16Å; L653-W655 PolarHBondContact O-N 3.27Å; L653-T667 WeakPolarHBondContact O-CB 3.31Å; L653-T667 VanDerWaalsContact O-CG2 3.26Å; L653-T667 WeakPolarHBondContact O-CG2 3.26Å; L653-T667 PolarHBondContact O-OG1 2.85Å
654	Q	87.9	Confident	83.8	Confident	64 Å²	64	73.7 Å²	73.7	30%	0.299	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-16.7	175.8	-62.2	-178.2	-4.9	0	0	112.7	C651 Q652 G666 T667 V671	C651-Q654 WeakPolarHBondContact O-CB 3.37Å; C651-Q654 WeakPolarHBondContact O-CG 3.31Å; C651-Q654 PolarHBondContact O-N 2.93Å; Q652-Q654 PolarHBondContact O-N 3.43Å; Q652-Q654 VanDerWaalsContact O-N 3.13Å; Q654-G666 WeakPolarHBondContact O-CA 3.39Å; Q654-T667 WeakPolarHBondContact CA-OG1 3.35Å; Q654-T667 PolarHBondContact O-N 2.98Å; Q654-T667 PolarHBondContact O-OG1 2.87Å; Q654-V671 HydrophobicContact CG-CB 4.48Å; Q654-V671 HydrophobicContact CG-CG2 3.73Å
655	W	85.4	Confident	83.6	Confident	92 Å²	92	78.9 Å²	78.9	35%	0.348	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	141.1	-175.9	-53.7	-70.3	0	0	0	112.1	R605 C651 Q652 L653 R665	R605-W655 PolarHBondContact NH1-O 2.88Å; R605-W655 PolarHBondContact NH2-O 3.39Å; C651-W655 VanDerWaalsContact O-CZ3 3.29Å; C651-W655 WeakPolarHBondContact O-CZ3 3.48Å; Q652-W655 PolarHBondContact O-N 3.31Å; Q652-W655 VanDerWaalsContact O-O 3.11Å; L653-W655 PolarHBondContact O-N 3.27Å; W655-R665 CarbonylContact C-O 3.59Å; W655-R665 WeakPolarHBondContact CA-O 2.93Å
656	D	82.3	Confident	83.4	Confident	65 Å²	65	80 Å²	80	35%	0.348	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	159.9	170.8	-147.2	-8.9	0	0	0	110.4	R605 R664 R665 T667	R605-D656 IonicContact CZ-OD1 3.2Å; R605-D656 VanDerWaalsContact CZ-OD1 3.3Å; R605-D656 IonicContact NE-OD1 3.68Å; R605-D656 IonicContact NH1-OD1 3.1Å; R605-D656 PolarHBondContact NH1-OD1 2.95Å; R605-D656 IonicContact NH1-OD2 3.02Å; R605-D656 IonicContact NH2-OD1 3.85Å; D656-R664 CarbonylContact O-C 3.58Å; D656-R664 VanDerWaalsContact O-CA 3.29Å; D656-R664 WeakPolarHBondContact O-CA 3.04Å; D656-R665 PolarHBondContact N-O 3.39Å; D656-R665 PolarHBondContact O-N 3.36Å; D656-T667 HydrophobicContact CB-CG2 3.75Å
657	H	78.1	Confident	83	Confident	95 Å²	95	81.1 Å²	81.1	44%	0.44	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	127.7	171	-74.7	-86.7	0	0	0	109	P659 G662	H657-P659 WeakPolarHBondContact O-CD 3.38Å; H657-G662 PolarHBondContact ND1-O 3.04Å
658	E	76.4	Confident	82.8	Confident	69 Å²	69	80.6 Å²	80.6	32%	0.322	42%	0.416	S	S	.	.			trans	-67.2	123.6	176.4	-172.3	164.3	-119.9	0	0	109.4	R660 T661 G662 V663 R665	E658-R660 PolarHBondContact O-N 3.36Å; E658-T661 WeakPolarHBondContact CB-OG1 3.4Å; E658-T661 PolarHBondContact O-N 3.33Å; E658-T661 PolarHBondContact OE2-OG1 3.45Å; E658-G662 WeakPolarHBondContact O-CA 3.39Å; E658-G662 PolarHBondContact O-N 2.75Å; E658-V663 PolarHBondContact N-O 3.09Å; E658-R665 IonicContact OE1-NH1 3.35Å; E658-R665 PolarHBondContact OE1-NH1 3.27Å
659	P	73.9	Confident	82.8	Confident	136 Å²	136	73.9 Å²	73.9	88%	0.883	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-23.2	-167.5	-27	32.9	0	0	0	115.4	H657	H657-P659 WeakPolarHBondContact O-CD 3.38Å
660	R	72.4	Confident	82.8	Confident	242 Å²	242	77.2 Å²	77.2	91%	0.913	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-27.7	-175.1	-66	-174.9	178	-173.7	-1.1	114	E658	E658-R660 PolarHBondContact O-N 3.36Å
661	T	75.4	Confident	82.8	Confident	83 Å²	83	78 Å²	78	51%	0.509	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-14.2	-169.8	59.2	0	0	0	0	112.4	E658 V663	E658-T661 WeakPolarHBondContact CB-OG1 3.4Å; E658-T661 PolarHBondContact O-N 3.33Å; E658-T661 PolarHBondContact OE2-OG1 3.45Å; T661-V663 PolarHBondContact O-N 2.91Å; T661-V663 VanDerWaalsContact O-N 3.11Å; T661-V663 WeakPolarHBondContact OG1-CG2 3.28Å; T661-V663 PolarHBondContact OG1-N 3.49Å
662	G	74.3	Confident	82.9	Confident	44 Å²	44	81.3 Å²	81.3	45%	0.454	42%	0.422	S	S	.	.			trans	68	0.4	-172.9	0	0	0	0	0	113.9	H657 E658 R664	H657-G662 PolarHBondContact ND1-O 3.04Å; E658-G662 WeakPolarHBondContact O-CA 3.39Å; E658-G662 PolarHBondContact O-N 2.75Å; G662-R664 PolarHBondContact O-N 3.39Å
663	V	80.3	Confident	83.1	Confident	89 Å²	89	80 Å²	80	54%	0.539	42%	0.415	S	S	.	.			trans	-67	133.7	-177	175.9	0	0	0	0	109.5	E658 T661 R665	E658-V663 PolarHBondContact N-O 3.09Å; T661-V663 PolarHBondContact O-N 2.91Å; T661-V663 VanDerWaalsContact O-N 3.11Å; T661-V663 WeakPolarHBondContact OG1-CG2 3.28Å; T661-V663 PolarHBondContact OG1-N 3.49Å; V663-R665 PolarHBondContact O-N 2.87Å
664	R	79.3	Confident	83.2	Confident	139 Å²	139	82 Å²	82	53%	0.525	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	120.5	175.1	-94.5	-174.6	172.1	177.8	-5.9	110.7	Q652 D656 G662	Q652-R664 VanDerWaalsContact OE1-NH2 3.1Å; D656-R664 CarbonylContact O-C 3.58Å; D656-R664 VanDerWaalsContact O-CA 3.29Å; D656-R664 WeakPolarHBondContact O-CA 3.04Å; G662-R664 PolarHBondContact O-N 3.39Å
665	R	83.1	Confident	83.3	Confident	162 Å²	162	83.4 Å²	83.4	61%	0.611	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	142.7	174.4	-162.8	171.5	-170.9	168	-1.4	110	W655 D656 E658 V663	W655-R665 CarbonylContact C-O 3.59Å; W655-R665 WeakPolarHBondContact CA-O 2.93Å; D656-R665 PolarHBondContact N-O 3.39Å; D656-R665 PolarHBondContact O-N 3.36Å; E658-R665 IonicContact OE1-NH1 3.35Å; E658-R665 PolarHBondContact OE1-NH1 3.27Å; V663-R665 PolarHBondContact O-N 2.87Å
666	G	83.9	Confident	83.5	Confident	56 Å²	56	81.9 Å²	81.9	58%	0.577	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	131.3	175.4	0	0	0	0	0	111.2	Q654 G668	Q654-G666 WeakPolarHBondContact O-CA 3.39Å; G666-G668 PolarHBondContact O-N 3.21Å
667	T	83.9	Confident	84	Confident	23 Å²	23	78.8 Å²	78.8	14%	0.141	42%	0.418	C	S	.	.			trans	-72.2	-19.1	173.5	57	0	0	0	0	112.4	Q598 L602 L653 Q654 D656 V669	Q598-T667 PolarHBondContact NE2-O 3Å; L602-T667 HydrophobicContact CD2-CG2 4.13Å; L653-T667 WeakPolarHBondContact O-CB 3.31Å; L653-T667 VanDerWaalsContact O-CG2 3.26Å; L653-T667 WeakPolarHBondContact O-CG2 3.26Å; L653-T667 PolarHBondContact O-OG1 2.85Å; Q654-T667 WeakPolarHBondContact CA-OG1 3.35Å; Q654-T667 PolarHBondContact O-N 2.98Å; Q654-T667 PolarHBondContact O-OG1 2.87Å; D656-T667 HydrophobicContact CB-CG2 3.75Å; T667-V669 PolarHBondContact O-N 3Å; T667-V669 PolarHBondContact OG1-N 3.02Å
668	G	85.4	Confident	84.7	Confident	43 Å²	43	74.3 Å²	74.3	44%	0.443	40%	0.398	S	S	.	.			trans	79.5	0.5	-172	0	0	0	0	0	114	P593 G666	P593-G668 WeakPolarHBondContact CD-O 3.29Å; P593-G668 VanDerWaalsContact CG-O 3.3Å; P593-G668 WeakPolarHBondContact CG-O 3.32Å; G666-G668 PolarHBondContact O-N 3.21Å
669	V	88.6	Confident	85.5	Confident	5 Å²	5	71.7 Å²	71.7	3%	0.03	39%	0.385	C	S	.	.			trans	-69.1	132.8	175.5	176.8	0	0	0	0	110.2	N591 L602 T667 V671	N591-V669 WeakPolarHBondContact O-CA 3.31Å; L602-V669 HydrophobicContact CD1-CG2 3.46Å; L602-V669 VanDerWaalsContact CD1-CG2 3.46Å; T667-V669 PolarHBondContact O-N 3Å; T667-V669 PolarHBondContact OG1-N 3.02Å; V669-V671 HydrophobicContact CG1-CG2 4.29Å
670	L	89.8	Confident	86.4	Confident	92 Å²	92	65.3 Å²	65.3	48%	0.482	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	126.2	173	-57	175.4	0	0	0	108.8	L590 N591	L590-L670 WeakPolarHBondContact CA-O 3.38Å; N591-L670 HydrophobicContact CB-CB 4.26Å; N591-L670 PolarHBondContact N-O 3.27Å; N591-L670 PolarHBondContact O-N 3.38Å
671	V	92.5	Very high	87.4	Confident	17 Å²	17	58.3 Å²	58.3	10%	0.103	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	112.9	177.1	-174.1	0	0	0	0	107.2	L590 L650 Q654 V669 F673	L590-V671 HydrophobicContact CD2-CB 4.11Å; L590-V671 HydrophobicContact CD2-CG1 3.85Å; L590-V671 HydrophobicContact CD2-CG2 3.69Å; L650-V671 HydrophobicContact CB-CG1 4.45Å; L650-V671 WeakPolarHBondContact O-CG2 3.46Å; Q654-V671 HydrophobicContact CG-CB 4.48Å; Q654-V671 HydrophobicContact CG-CG2 3.73Å; V669-V671 HydrophobicContact CG1-CG2 4.29Å; V671-F673 HydrophobicContact CG1-CE1 4.19Å; V671-F673 HydrophobicContact CG1-CE2 4.4Å; V671-F673 HydrophobicContact CG1-CZ 3.89Å
672	E	91.5	Very high	88.3	Confident	104 Å²	104	54.4 Å²	54.4	49%	0.486	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.8	-178.8	-65.2	-179.4	-177.1	0	0	109.5	R589	R589-E672 HydrophobicContact CB-CB 4.39Å; R589-E672 PolarHBondContact N-O 3.43Å; R589-E672 PolarHBondContact O-N 2.78Å
673	F	91.8	Very high	89.2	Confident	54 Å²	54	53.9 Å²	53.9	24%	0.237	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.5	172.7	-57.3	-65.2	0	0	0	109.6	Y585 H587 C588 M632 R647 C651 V671	Y585-F673 HydrophobicContact CG-CB 4.42Å; H587-F673 VanDerWaalsContact O-CA 3.31Å; H587-F673 WeakPolarHBondContact O-CA 3.29Å; C588-F673 HydrophobicContact CB-CD1 4.12Å; C588-F673 HydrophobicContact CB-CE1 4.16Å; M632-F673 HydrophobicContact CE-CE1 4.08Å; M632-F673 HydrophobicContact SD-CD1 3.67Å; M632-F673 HydrophobicContact SD-CE1 3.6Å; R647-F673 HydrophobicContact CG-CE1 4.05Å; R647-F673 HydrophobicContact CG-CE2 3.86Å; R647-F673 HydrophobicContact CG-CZ 3.49Å; R647-F673 VanDerWaalsContact CG-CZ 3.49Å; C651-F673 VanDerWaalsContact SG-CE2 3.58Å; V671-F673 HydrophobicContact CG1-CE1 4.19Å; V671-F673 HydrophobicContact CG1-CE2 4.4Å; V671-F673 HydrophobicContact CG1-CZ 3.89Å
674	S	90.9	Very high	89.8	Confident	48 Å²	48	49.9 Å²	49.9	34%	0.336	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	178.9	-178.1	56.4	0	0	0	0	110.5	H587	H587-S674 WeakPolarHBondContact CB-O 3.38Å; H587-S674 PolarHBondContact N-O 2.9Å; H587-S674 PolarHBondContact O-N 3.47Å
675	E	89.4	Confident	90.3	Very high	93 Å²	93	45 Å²	45	44%	0.435	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	54.5	92.2	179.4	-53.8	-171.4	148.3	0	0	114.1	T586 H587 A677	T586-E675 PolarHBondContact N-O 3.14Å; H587-E675 HydrophobicContact CB-CB 3.91Å; H587-E675 HydrophobicContact CB-CG 3.93Å; H587-E675 IonicContact CG-OE2 3.5Å; H587-E675 IonicContact ND1-OE2 2.65Å; H587-E675 PolarHBondContact ND1-OE2 2.84Å; E675-A677 PolarHBondContact O-N 3.25Å
676	L	90.9	Very high	90.7	Very high	60 Å²	60	38.4 Å²	38.4	31%	0.314	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	124.9	170.6	-169.7	68.3	0	0	0	109.2	A230 I549 T583 Y585	A230-L676 HydrophobicContact CB-CD1 3.82Å; I549-L676 WeakPolarHBondContact CB-O 3.44Å; I549-L676 HydrophobicContact CD1-CD2 3.93Å; I549-L676 HydrophobicContact CD1-CG 3.88Å; I549-L676 WeakPolarHBondContact CG1-O 3.43Å; I549-L676 PolarHBondContact N-O 2.88Å; T583-L676 HydrophobicContact CG2-CD1 3.85Å; T583-L676 HydrophobicContact CG2-CD2 4.24Å; T583-L676 HydrophobicContact CG2-CG 3.84Å; Y585-L676 HydrophobicContact CD1-CB 4.34Å; Y585-L676 HydrophobicContact CD1-CD1 4.46Å; Y585-L676 HydrophobicContact CE1-CB 4.13Å; Y585-L676 HydrophobicContact CE1-CD1 4.35Å
677	A	93.1	Very high	91.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	150.3	-177.5	0	0	0	0	0	111.4	A546 L547 T583 T584 T586 E675 H679	A546-A677 HydrophobicContact CB-CB 4.09Å; L547-A677 CarbonylContact O-C 3.34Å; L547-A677 VanDerWaalsContact O-CA 3.25Å; L547-A677 WeakPolarHBondContact O-CA 3.43Å; L547-A677 WeakPolarHBondContact O-CB 3.5Å; T583-A677 WeakPolarHBondContact CA-O 3.3Å; T583-A677 WeakPolarHBondContact CG2-O 3.3Å; T584-A677 PolarHBondContact N-O 3.08Å; T584-A677 PolarHBondContact O-N 3.39Å; T586-A677 HydrophobicContact CG2-CB 3.75Å; T586-A677 WeakPolarHBondContact OG1-CB 3.4Å; E675-A677 PolarHBondContact O-N 3.25Å; A677-H679 PolarHBondContact O-N 3.07Å
678	F	92.4	Very high	91.5	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.009	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	122.2	161.2	-61.8	-70.4	0	0	0	108	L547 I549 E560 I563 E564 L567 L580 T583 L680	L547-F678 HydrophobicContact CB-CB 4.3Å; L547-F678 HydrophobicContact CD2-CD2 4.36Å; L547-F678 PolarHBondContact N-O 2.87Å; L547-F678 PolarHBondContact O-N 2.81Å; I549-F678 HydrophobicContact CD1-CD2 4.37Å; I549-F678 HydrophobicContact CD1-CE1 4.24Å; I549-F678 HydrophobicContact CD1-CE2 4.09Å; I549-F678 HydrophobicContact CD1-CZ 4.01Å; I549-F678 HydrophobicContact CG1-CD2 3.8Å; I549-F678 HydrophobicContact CG1-CE2 3.69Å; I549-F678 HydrophobicContact CG1-CG 4.34Å; I549-F678 HydrophobicContact CG1-CZ 4.14Å; E560-F678 HydrophobicContact CG-CZ 4.08Å; I563-F678 HydrophobicContact CB-CE2 4.19Å; I563-F678 HydrophobicContact CG2-CD2 4.05Å; I563-F678 HydrophobicContact CG2-CE2 3.67Å; E564-F678 HydrophobicContact CB-CE1 4.18Å; E564-F678 HydrophobicContact CB-CZ 3.99Å; E564-F678 HydrophobicContact CG-CE1 4.26Å; L567-F678 HydrophobicContact CD1-CB 4.06Å; L567-F678 HydrophobicContact CD1-CD1 4.27Å; L567-F678 HydrophobicContact CD1-CD2 3.8Å; L567-F678 HydrophobicContact CD1-CE2 4.29Å; L567-F678 HydrophobicContact CD1-CG 3.79Å; L580-F678 HydrophobicContact CD1-CB 4.26Å; L580-F678 HydrophobicContact CD1-CD1 4.23Å; T583-F678 HydrophobicContact CG2-CD1 4.46Å; F678-L680 HydrophobicContact CB-CD2 4.04Å; F678-L680 HydrophobicContact CB-CG 4.29Å
679	H	92.4	Very high	92	Very high	14 Å²	14	46 Å²	46	7%	0.065	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	121.5	173.4	-175.5	-164.6	0	0	0	107.5	E544 L581 A582 T584 A677	E544-H679 IonicContact OE2-CE1 3.79Å; E544-H679 PolarHBondContact OE2-CE1 3.43Å; E544-H679 IonicContact OE2-NE2 2.69Å; E544-H679 PolarHBondContact OE2-NE2 3.32Å; L581-H679 CarbonylContact C-O 3.49Å; L581-H679 WeakPolarHBondContact CA-O 3.29Å; L581-H679 HydrophobicContact CB-CB 3.98Å; L581-H679 VanDerWaalsContact CB-O 3.29Å; L581-H679 WeakPolarHBondContact CB-O 3.48Å; L581-H679 VanDerWaalsContact CD1-CE1 3.44Å; L581-H679 WeakPolarHBondContact CD1-CE1 3.41Å; L581-H679 WeakPolarHBondContact CD1-NE2 3.36Å; L581-H679 PolarHBondContact N-O 3.47Å; A582-H679 WeakPolarHBondContact O-CB 3.39Å; T584-H679 HydrophobicContact CG2-CB 4.35Å; A677-H679 PolarHBondContact O-N 3.07Å
680	L	93.4	Very high	92.2	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	150.4	-171.2	-50.7	171.7	0	0	0	109.1	V492 E544 R545 L547 L567 L578 E579 L580 F678	V492-L680 HydrophobicContact CG2-CD1 4.3Å; E544-L680 CarbonylContact C-O 3.44Å; E544-L680 WeakPolarHBondContact CA-O 3.4Å; R545-L680 PolarHBondContact N-O 3.27Å; R545-L680 PolarHBondContact O-N 2.97Å; L547-L680 HydrophobicContact CB-CD1 3.99Å; L547-L680 HydrophobicContact CD2-CD1 4.28Å; L567-L680 HydrophobicContact CD1-CD2 4.08Å; L567-L680 HydrophobicContact CD2-CD1 4.04Å; L567-L680 HydrophobicContact CD2-CD2 4.24Å; L578-L680 HydrophobicContact CD1-CB 4.29Å; L578-L680 HydrophobicContact CD1-CD1 4.21Å; L578-L680 HydrophobicContact CD1-CD2 4.2Å; L578-L680 HydrophobicContact CD1-CG 4.46Å; L578-L680 HydrophobicContact CD2-CD2 4.01Å; E579-L680 CarbonylContact O-C 3.49Å; E579-L680 WeakPolarHBondContact O-CA 3.41Å; L580-L680 HydrophobicContact CB-CD2 4.47Å; L580-L680 HydrophobicContact CD1-CD2 3.22Å; L580-L680 HydrophobicContact CG-CD2 4.39Å; F678-L680 HydrophobicContact CB-CD2 4.04Å; F678-L680 HydrophobicContact CB-CG 4.29Å
681	R	93.4	Very high	92.4	Very high	95 Å²	95	45.4 Å²	45.4	36%	0.358	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.3	159.8	-177.2	178.1	-73.1	168	-6.5	108.9	H543 E544 E579	H543-R681 VanDerWaalsContact O-CA 3.29Å; H543-R681 WeakPolarHBondContact O-CA 3.13Å; E544-R681 IonicContact OE1-CZ 3.45Å; E544-R681 IonicContact OE1-NE 2.9Å; E544-R681 IonicContact OE1-NH2 3.87Å; E544-R681 PolarHBondContact OE1-NH2 3.36Å; E579-R681 HydrophobicContact CB-CB 4.19Å; E579-R681 PolarHBondContact N-O 3.46Å; E579-R681 PolarHBondContact O-N 3.04Å; E579-R681 IonicContact OE2-NH1 3.39Å
682	S	94.6	Very high	92.6	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.007	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	148.2	-179	64.7	0	0	0	0	112.5	V492 H543 R545	V492-S682 PolarHBondContact O-OG 2.93Å; H543-S682 PolarHBondContact N-O 3.45Å; H543-S682 PolarHBondContact O-N 2.78Å; R545-S682 WeakPolarHBondContact CD-OG 2.75Å; R545-S682 PolarHBondContact NE-OG 3.35Å
683	P	93.4	Very high	92.7	Very high	33 Å²	33	47.4 Å²	47.4	21%	0.214	25%	0.248	C	C	.	.			trans	-62.7	147.2	171.8	26	-34.2	0	0	0	111.6	F493 W577 D685 L686	F493-P683 HydrophobicContact CD1-CG 4.26Å; F493-P683 HydrophobicContact CE1-CG 4.23Å; W577-P683 VanDerWaalsContact O-CD 3.3Å; W577-P683 WeakPolarHBondContact O-CD 3.01Å; P683-D685 WeakPolarHBondContact CB-OD1 3.23Å; P683-L686 HydrophobicContact CB-CG 4.41Å; P683-L686 HydrophobicContact CG-CD1 4.15Å; P683-L686 HydrophobicContact CG-CD2 4.08Å; P683-L686 HydrophobicContact CG-CG 3.96Å
684	G	91.4	Very high	93	Very high	4 Å²	4	44.9 Å²	44.9	4%	0.041	24%	0.237	C	C	.	.	S	Bend	trans	-107.2	4.2	175.8	0	0	0	0	0	114	A495 C496 C540	A495-G684 WeakPolarHBondContact CA-O 3.37Å; C496-G684 PolarHBondContact N-O 3.28Å; C496-G684 PolarHBondContact SG-O 3.47Å; C540-G684 PolarHBondContact SG-N 3.01Å; C540-G684 VanDerWaalsContact SG-N 3.43Å
685	D	90.9	Very high	93.2	Very high	36 Å²	36	42.7 Å²	42.7	19%	0.193	22%	0.222	C	C	.	.			trans	-109.9	11.9	-174	68.4	-39.9	0	0	0	114.1	C500 C540 P683 T687	C500-D685 WeakPolarHBondContact SG-CB 3.31Å; C540-D685 HydrophobicContact CB-CB 3.99Å; P683-D685 WeakPolarHBondContact CB-OD1 3.23Å; D685-T687 PolarHBondContact O-N 3.32Å
686	L	91.5	Very high	93.5	Very high	25 Å²	25	43.3 Å²	43.3	13%	0.131	23%	0.228	C	C	.	.			trans	-65.5	131.8	175.8	-62.1	-175.5	0	0	0	111.5	F493 P683 E690 K691 I694	F493-L686 HydrophobicContact CB-CD1 4.1Å; F493-L686 HydrophobicContact CD1-CD1 3.41Å; F493-L686 VanDerWaalsContact CD1-CD1 3.41Å; F493-L686 HydrophobicContact CD1-CG 4.42Å; F493-L686 HydrophobicContact CD2-CD1 4.38Å; F493-L686 HydrophobicContact CE1-CD1 3.82Å; F493-L686 HydrophobicContact CG-CD1 3.72Å; F493-L686 HydrophobicContact CZ-CD1 4.47Å; P683-L686 HydrophobicContact CB-CG 4.41Å; P683-L686 HydrophobicContact CG-CD1 4.15Å; P683-L686 HydrophobicContact CG-CD2 4.08Å; P683-L686 HydrophobicContact CG-CG 3.96Å; L686-E690 WeakPolarHBondContact CA-OE2 3.36Å; L686-E690 HydrophobicContact CB-CB 4.47Å; L686-E690 HydrophobicContact CD2-CB 4.46Å; L686-K691 HydrophobicContact CB-CG 4.18Å; L686-K691 VanDerWaalsContact O-CE 3.31Å; L686-K691 WeakPolarHBondContact O-CE 3.08Å; L686-I694 HydrophobicContact CD1-CD1 3.77Å
687	T	92.1	Very high	93.7	Very high	68 Å²	68	42.5 Å²	42.5	42%	0.417	22%	0.222	S	C	.	.			trans	-68.7	165.4	172.8	63.4	0	0	0	0	111.5	D685 E689 E690 K691	D685-T687 PolarHBondContact O-N 3.32Å; T687-E689 VanDerWaalsContact C-N 3.29Å; T687-E689 PolarHBondContact O-N 3.31Å; T687-E690 WeakPolarHBondContact CB-OE2 3.24Å; T687-E690 PolarHBondContact N-OE2 2.9Å; T687-E690 WeakPolarHBondContact OG1-CB 3.4Å; T687-E690 VanDerWaalsContact OG1-CG 3.31Å; T687-E690 WeakPolarHBondContact OG1-CG 3.23Å; T687-E690 PolarHBondContact OG1-N 3.32Å; T687-E690 VanDerWaalsContact OG1-N 3.17Å; T687-E690 PolarHBondContact OG1-OE2 3.47Å; T687-K691 WeakPolarHBondContact O-CG 3.36Å; T687-K691 PolarHBondContact O-N 2.9Å; T687-K691 VanDerWaalsContact O-N 3.11Å
688	A	93.1	Very high	93.8	Very high	74 Å²	74	42.5 Å²	42.5	61%	0.612	22%	0.222	S	C	*	.	H	α-helix	trans	-62	-38.9	174.5	0	0	0	0	0	111.9	K691 D692	A688-K691 PolarHBondContact O-N 3.04Å; A688-D692 PolarHBondContact O-N 2.91Å
689	E	94.2	Very high	93.9	Very high	139 Å²	139	45.2 Å²	45.2	65%	0.65	23%	0.233	S	C	*	.	H	α-helix	trans	-64.1	-47.3	178	-175.5	179.5	175.7	0	0	111.8	T687 K691 D692 Q693	T687-E689 VanDerWaalsContact C-N 3.29Å; T687-E689 PolarHBondContact O-N 3.31Å; E689-K691 VanDerWaalsContact C-N 3.3Å; E689-K691 PolarHBondContact O-N 3.38Å; E689-D692 PolarHBondContact O-N 3.1Å; E689-D692 VanDerWaalsContact O-N 3.15Å; E689-Q693 WeakPolarHBondContact O-CG 3.31Å; E689-Q693 PolarHBondContact O-N 3.29Å
690	E	93.6	Very high	94	Very high	40 Å²	40	46 Å²	46	19%	0.187	24%	0.244	C	C	.	.	H	α-helix	trans	-57.9	-44.6	174.7	-74	161.7	146.2	0	0	110.3	R502 L686 T687 D692 Q693 I694	R502-E690 IonicContact CZ-OE1 3.22Å; R502-E690 IonicContact NH1-OE1 3.67Å; R502-E690 PolarHBondContact NH1-OE1 2.94Å; R502-E690 IonicContact NH2-OE1 2.82Å; R502-E690 PolarHBondContact NH2-OE1 2.7Å; R502-E690 IonicContact NH2-OE2 3.16Å; R502-E690 PolarHBondContact NH2-OE2 3.23Å; L686-E690 WeakPolarHBondContact CA-OE2 3.36Å; L686-E690 HydrophobicContact CB-CB 4.47Å; L686-E690 HydrophobicContact CD2-CB 4.46Å; T687-E690 WeakPolarHBondContact CB-OE2 3.24Å; T687-E690 PolarHBondContact N-OE2 2.9Å; T687-E690 WeakPolarHBondContact OG1-CB 3.4Å; T687-E690 VanDerWaalsContact OG1-CG 3.31Å; T687-E690 WeakPolarHBondContact OG1-CG 3.23Å; T687-E690 PolarHBondContact OG1-N 3.32Å; T687-E690 VanDerWaalsContact OG1-N 3.17Å; T687-E690 PolarHBondContact OG1-OE2 3.47Å; E690-D692 VanDerWaalsContact C-N 3.33Å; E690-D692 PolarHBondContact O-N 3.29Å; E690-Q693 WeakPolarHBondContact O-CB 3.38Å; E690-Q693 PolarHBondContact O-N 3.33Å; E690-I694 VanDerWaalsContact O-CG1 3.24Å; E690-I694 WeakPolarHBondContact O-CG1 3.42Å; E690-I694 PolarHBondContact O-N 3.03Å
691	K	94.9	Very high	93.8	Very high	44 Å²	44	50.2 Å²	50.2	19%	0.191	26%	0.26	C	S	.	.	H	α-helix	trans	-62.1	-36.4	177.1	-69.9	177.8	-164.1	-174	0	113.1	V489 F493 L686 T687 A688 E689 I694 C695	V489-K691 HydrophobicContact CG1-CB 4.15Å; V489-K691 HydrophobicContact CG1-CG 4.35Å; F493-K691 VanDerWaalsContact O-CE 3.26Å; F493-K691 WeakPolarHBondContact O-CE 3.44Å; F493-K691 PolarHBondContact O-NZ 3.1Å; L686-K691 HydrophobicContact CB-CG 4.18Å; L686-K691 VanDerWaalsContact O-CE 3.31Å; L686-K691 WeakPolarHBondContact O-CE 3.08Å; T687-K691 WeakPolarHBondContact O-CG 3.36Å; T687-K691 PolarHBondContact O-N 2.9Å; T687-K691 VanDerWaalsContact O-N 3.11Å; A688-K691 PolarHBondContact O-N 3.04Å; E689-K691 VanDerWaalsContact C-N 3.3Å; E689-K691 PolarHBondContact O-N 3.38Å; K691-I694 WeakPolarHBondContact O-CB 3.4Å; K691-I694 PolarHBondContact O-N 2.65Å; K691-C695 PolarHBondContact O-N 3.36Å; K691-C695 PolarHBondContact O-SG 3.49Å
692	D	95.3	Very high	93.7	Very high	67 Å²	67	46.5 Å²	46.5	36%	0.358	25%	0.248	S	C	.	.	H	α-helix	trans	-68.7	-40.1	175.4	-75	-30.9	0	0	0	110.7	K486 A688 E689 E690 I694 C695 D696	K486-D692 IonicContact NZ-OD1 3.81Å; K486-D692 PolarHBondContact NZ-OD1 3.25Å; A688-D692 PolarHBondContact O-N 2.91Å; E689-D692 PolarHBondContact O-N 3.1Å; E689-D692 VanDerWaalsContact O-N 3.15Å; E690-D692 VanDerWaalsContact C-N 3.33Å; E690-D692 PolarHBondContact O-N 3.29Å; D692-I694 VanDerWaalsContact C-N 3.29Å; D692-I694 PolarHBondContact O-N 2.82Å; D692-C695 WeakPolarHBondContact O-CA 3.36Å; D692-C695 WeakPolarHBondContact O-CB 3.43Å; D692-C695 PolarHBondContact O-N 3.36Å; D692-D696 PolarHBondContact O-N 3.27Å
693	Q	95.1	Very high	93.5	Very high	97 Å²	97	50.2 Å²	50.2	45%	0.453	27%	0.265	S	S	.	.	H	α-helix	trans	-59.2	-38.5	171.2	-65.1	170.3	1.7	0	0	112.2	E689 E690 C695 D696 F697	E689-Q693 WeakPolarHBondContact O-CG 3.31Å; E689-Q693 PolarHBondContact O-N 3.29Å; E690-Q693 WeakPolarHBondContact O-CB 3.38Å; E690-Q693 PolarHBondContact O-N 3.33Å; Q693-C695 VanDerWaalsContact C-N 3.34Å; Q693-D696 PolarHBondContact O-N 3.41Å; Q693-F697 WeakPolarHBondContact O-CB 3.24Å; Q693-F697 PolarHBondContact O-N 2.95Å
694	I	96.3	Very high	93.2	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-45.3	172.4	-54.8	-160.2	0	0	0	110.9	V489 F493 L570 W577 L686 E690 K691 D692 D696 F697 L698	V489-I694 HydrophobicContact CG1-CB 4.24Å; V489-I694 HydrophobicContact CG1-CG2 4.2Å; V489-I694 HydrophobicContact CG2-CB 4.46Å; V489-I694 HydrophobicContact CG2-CG2 3.78Å; F493-I694 HydrophobicContact CD2-CD1 4.02Å; F493-I694 HydrophobicContact CE1-CD1 4.43Å; F493-I694 HydrophobicContact CE2-CD1 3.57Å; F493-I694 HydrophobicContact CE2-CG2 4.35Å; F493-I694 HydrophobicContact CZ-CD1 3.8Å; L570-I694 HydrophobicContact CD2-CG2 3.38Å; W577-I694 HydrophobicContact CD2-CD1 3.75Å; W577-I694 HydrophobicContact CD2-CG1 3.93Å; W577-I694 HydrophobicContact CE3-CB 4.1Å; W577-I694 HydrophobicContact CE3-CD1 3.62Å; W577-I694 HydrophobicContact CE3-CG1 3.54Å; W577-I694 HydrophobicContact CE3-CG2 3.86Å; W577-I694 HydrophobicContact CG-CD1 4.23Å; W577-I694 HydrophobicContact CH2-CB 4.1Å; W577-I694 HydrophobicContact CH2-CD1 4.5Å; W577-I694 HydrophobicContact CH2-CG1 3.61Å; W577-I694 HydrophobicContact CZ2-CG1 3.98Å; W577-I694 VanDerWaalsContact CZ3-CA 3.48Å; W577-I694 HydrophobicContact CZ3-CB 3.66Å; W577-I694 HydrophobicContact CZ3-CD1 4.04Å; W577-I694 HydrophobicContact CZ3-CG1 3.4Å; W577-I694 HydrophobicContact CZ3-CG2 3.69Å; L686-I694 HydrophobicContact CD1-CD1 3.77Å; E690-I694 VanDerWaalsContact O-CG1 3.24Å; E690-I694 WeakPolarHBondContact O-CG1 3.42Å; E690-I694 PolarHBondContact O-N 3.03Å; K691-I694 WeakPolarHBondContact O-CB 3.4Å; K691-I694 PolarHBondContact O-N 2.65Å; D692-I694 VanDerWaalsContact C-N 3.29Å; D692-I694 PolarHBondContact O-N 2.82Å; I694-D696 VanDerWaalsContact C-N 3.34Å; I694-D696 PolarHBondContact O-N 2.77Å; I694-F697 PolarHBondContact O-N 3.21Å; I694-L698 HydrophobicContact CG2-CD1 4.12Å; I694-L698 HydrophobicContact CG2-CG 4.35Å; I694-L698 WeakPolarHBondContact O-CB 3.33Å; I694-L698 WeakPolarHBondContact O-CG 3.03Å; I694-L698 PolarHBondContact O-N 3.29Å
695	C	96.4	Very high	93	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.014	29%	0.287	C	S	.	.	H	α-helix	trans	-61.5	-44.4	179.4	-65.5	0	0	0	0	111.3	F482 K691 D692 Q693 L698 Y699	F482-C695 HydrophobicContact CE2-CB 4.03Å; F482-C695 HydrophobicContact CZ-CB 4.29Å; K691-C695 PolarHBondContact O-N 3.36Å; K691-C695 PolarHBondContact O-SG 3.49Å; D692-C695 WeakPolarHBondContact O-CA 3.36Å; D692-C695 WeakPolarHBondContact O-CB 3.43Å; D692-C695 PolarHBondContact O-N 3.36Å; Q693-C695 VanDerWaalsContact C-N 3.34Å; C695-L698 PolarHBondContact O-N 3.23Å; C695-Y699 VanDerWaalsContact O-CB 3.23Å; C695-Y699 WeakPolarHBondContact O-CB 3.26Å; C695-Y699 PolarHBondContact O-N 3.02Å
696	D	95.3	Very high	92.9	Very high	106 Å²	106	54.6 Å²	54.6	57%	0.567	28%	0.283	S	S	*	.	H	α-helix	trans	-65	-43.4	180	-68.6	-19.8	0	0	0	111.7	D692 Q693 I694 G700	D692-D696 PolarHBondContact O-N 3.27Å; Q693-D696 PolarHBondContact O-N 3.41Å; I694-D696 VanDerWaalsContact C-N 3.34Å; I694-D696 PolarHBondContact O-N 2.77Å; D696-G700 PolarHBondContact O-N 3.48Å
697	F	94.9	Very high	92.8	Very high	43 Å²	43	61 Å²	61	19%	0.189	31%	0.305	C	S	.	.	H	α-helix	trans	-57.9	-53.3	173.9	165.7	-104.5	0	0	0	111.7	H573 W577 Q693 I694 G700 R701	H573-F697 AromaticContact CD2-CD2 3.88Å; H573-F697 AromaticContact CD2-CE1 3.83Å; H573-F697 AromaticContact CD2-CE2 3.56Å; H573-F697 AromaticContact CD2-CZ 3.54Å; W577-F697 HydrophobicContact CH2-CB 4.46Å; W577-F697 HydrophobicContact CZ3-CB 4.34Å; W577-F697 HydrophobicContact CZ3-CD1 4.01Å; W577-F697 HydrophobicContact CZ3-CG 4.38Å; Q693-F697 WeakPolarHBondContact O-CB 3.24Å; Q693-F697 PolarHBondContact O-N 2.95Å; I694-F697 PolarHBondContact O-N 3.21Å; F697-G700 PolarHBondContact O-N 2.95Å; F697-R701 HydrophobicContact CE2-CG 4.07Å; F697-R701 HydrophobicContact CZ-CG 4.18Å; F697-R701 WeakPolarHBondContact O-CG 3.25Å; F697-R701 PolarHBondContact O-N 3.35Å; F697-R701 VanDerWaalsContact O-N 3.09Å
698	L	94.9	Very high	92.5	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.7	-45.4	-177.6	-73.6	-177.3	0	0	0	111.7	V485 V489 L566 Y569 L570 I694 C695 R701 V702	V485-L698 HydrophobicContact CG1-CB 3.71Å; V485-L698 HydrophobicContact CG1-CD1 3.95Å; V489-L698 HydrophobicContact CG2-CD1 3.9Å; L566-L698 HydrophobicContact CB-CD1 4.45Å; L566-L698 HydrophobicContact CB-CD2 4.38Å; L566-L698 HydrophobicContact CD2-CB 4.33Å; L566-L698 HydrophobicContact CD2-CD2 4.17Å; Y569-L698 HydrophobicContact CD2-CD2 4.47Å; L570-L698 HydrophobicContact CD1-CD1 4.34Å; L570-L698 HydrophobicContact CD2-CD1 3.93Å; L570-L698 HydrophobicContact CD2-CD2 3.87Å; L570-L698 HydrophobicContact CD2-CG 3.97Å; L570-L698 HydrophobicContact CG-CD1 4.23Å; L570-L698 HydrophobicContact CG-CD2 4.04Å; L570-L698 HydrophobicContact CG-CG 4.5Å; I694-L698 HydrophobicContact CG2-CD1 4.12Å; I694-L698 HydrophobicContact CG2-CG 4.35Å; I694-L698 WeakPolarHBondContact O-CB 3.33Å; I694-L698 WeakPolarHBondContact O-CG 3.03Å; I694-L698 PolarHBondContact O-N 3.29Å; C695-L698 PolarHBondContact O-N 3.23Å; L698-R701 WeakPolarHBondContact O-CB 3.13Å; L698-R701 PolarHBondContact O-N 3.4Å; L698-V702 WeakPolarHBondContact O-CG2 3.38Å; L698-V702 PolarHBondContact O-N 3.4Å
699	Y	94.8	Very high	92.2	Very high	59 Å²	59	57.4 Å²	57.4	23%	0.231	27%	0.274	C	S	.	.	H	α-helix	trans	-69.8	-37.1	-178.9	-168.2	-115.4	0	0	0	111.9	F482 V485 C695 R701 V702 Q703	F482-Y699 HydrophobicContact CB-CD1 4.46Å; F482-Y699 HydrophobicContact CB-CD2 3.97Å; F482-Y699 HydrophobicContact CB-CE1 4.24Å; F482-Y699 HydrophobicContact CB-CE2 3.76Å; F482-Y699 HydrophobicContact CB-CG 4.33Å; F482-Y699 AromaticContact CD2-CD1 3.8Å; F482-Y699 HydrophobicContact CD2-CD1 3.8Å; F482-Y699 HydrophobicContact CD2-CD2 4.07Å; F482-Y699 HydrophobicContact CD2-CE1 4.32Å; F482-Y699 AromaticContact CD2-CG 3.65Å; F482-Y699 HydrophobicContact CD2-CG 3.65Å; F482-Y699 HydrophobicContact CG-CG 4.48Å; V485-Y699 HydrophobicContact CG2-CD2 4.39Å; C695-Y699 VanDerWaalsContact O-CB 3.23Å; C695-Y699 WeakPolarHBondContact O-CB 3.26Å; C695-Y699 PolarHBondContact O-N 3.02Å; Y699-R701 VanDerWaalsContact C-N 3.29Å; Y699-R701 PolarHBondContact O-N 3.46Å; Y699-V702 WeakPolarHBondContact O-CB 3.45Å; Y699-V702 PolarHBondContact O-N 2.73Å; Y699-V702 VanDerWaalsContact O-N 3.11Å; Y699-Q703 HydrophobicContact CD1-CG 4.14Å; Y699-Q703 VanDerWaalsContact CE1-CD 3.43Å; Y699-Q703 HydrophobicContact CE1-CG 3.87Å; Y699-Q703 WeakPolarHBondContact O-CG 3.39Å; Y699-Q703 PolarHBondContact O-N 3.47Å
700	G	93.9	Very high	92	Very high	29 Å²	29	52.4 Å²	52.4	30%	0.299	25%	0.251	S	S	.	.	H	α-helix	trans	-57.2	-40.9	171.3	0	0	0	0	0	112.4	D696 F697 Q703 A704	D696-G700 PolarHBondContact O-N 3.48Å; F697-G700 PolarHBondContact O-N 2.95Å; G700-Q703 PolarHBondContact O-N 3.36Å; G700-A704 WeakPolarHBondContact O-CB 3.21Å; G700-A704 PolarHBondContact O-N 3.35Å
701	R	91.1	Very high	91.7	Very high	92 Å²	92	53.2 Å²	53.2	35%	0.347	27%	0.265	S	S	.	.	H	α-helix	trans	-65.5	-41	173.3	-68.9	-69.7	-176.3	144.9	2	112.8	Y569 F697 L698 Y699 R705	Y569-R701 HydrophobicContact CD2-CB 4.01Å; Y569-R701 HydrophobicContact CD2-CG 4.4Å; Y569-R701 HydrophobicContact CE2-CB 3.82Å; F697-R701 HydrophobicContact CE2-CG 4.07Å; F697-R701 HydrophobicContact CZ-CG 4.18Å; F697-R701 WeakPolarHBondContact O-CG 3.25Å; F697-R701 PolarHBondContact O-N 3.35Å; F697-R701 VanDerWaalsContact O-N 3.09Å; L698-R701 WeakPolarHBondContact O-CB 3.13Å; L698-R701 PolarHBondContact O-N 3.4Å; Y699-R701 VanDerWaalsContact C-N 3.29Å; Y699-R701 PolarHBondContact O-N 3.46Å; R701-R705 WeakPolarHBondContact O-CB 3.42Å; R701-R705 PolarHBondContact O-N 2.92Å
702	V	91.3	Very high	91.4	Very high	16 Å²	16	53.4 Å²	53.4	10%	0.097	26%	0.264	C	S	.	.	H	α-helix	trans	-61	-47.1	175.2	172.4	0	0	0	0	110.7	L566 L698 Y699 R705 E706	L566-V702 HydrophobicContact CD2-CG2 3.86Å; L698-V702 WeakPolarHBondContact O-CG2 3.38Å; L698-V702 PolarHBondContact O-N 3.4Å; Y699-V702 WeakPolarHBondContact O-CB 3.45Å; Y699-V702 PolarHBondContact O-N 2.73Å; Y699-V702 VanDerWaalsContact O-N 3.11Å; V702-R705 PolarHBondContact O-N 2.86Å; V702-E706 PolarHBondContact O-N 2.99Å
703	Q	89.5	Confident	91.2	Very high	79 Å²	79	50.5 Å²	50.5	37%	0.369	25%	0.249	S	C	.	.	H	α-helix	trans	-66.5	-40.9	179.2	-70.9	-177.1	-49.4	0	0	112.7	Y699 G700 R705 E706 R707	Y699-Q703 HydrophobicContact CD1-CG 4.14Å; Y699-Q703 VanDerWaalsContact CE1-CD 3.43Å; Y699-Q703 HydrophobicContact CE1-CG 3.87Å; Y699-Q703 WeakPolarHBondContact O-CG 3.39Å; Y699-Q703 PolarHBondContact O-N 3.47Å; G700-Q703 PolarHBondContact O-N 3.36Å; Q703-R705 VanDerWaalsContact C-N 3.32Å; Q703-R705 PolarHBondContact O-N 3.26Å; Q703-E706 PolarHBondContact O-N 3.2Å; Q703-R707 WeakPolarHBondContact O-CB 3.39Å; Q703-R707 WeakPolarHBondContact O-CG 3.32Å; Q703-R707 PolarHBondContact O-N 2.85Å
704	A	87.7	Confident	90.9	Very high	40 Å²	40	50 Å²	50	33%	0.331	24%	0.242	S	C	.	.	H	α-helix	trans	-60.4	-43.3	175.2	0	0	0	0	0	111.3	G700 R707 Q708	G700-A704 WeakPolarHBondContact O-CB 3.21Å; G700-A704 PolarHBondContact O-N 3.35Å; A704-R707 PolarHBondContact O-N 2.9Å; A704-Q708 WeakPolarHBondContact O-CB 3.39Å; A704-Q708 PolarHBondContact O-N 3.31Å
705	R	87.2	Confident	90.7	Very high	105 Å²	105	54 Å²	54	40%	0.396	26%	0.257	S	S	.	.	H	α-helix	trans	-64.8	-42.9	177	-172.7	177.5	177.7	-170.6	-0.4	112.4	R701 V702 Q703 Q708 A709	R701-R705 WeakPolarHBondContact O-CB 3.42Å; R701-R705 PolarHBondContact O-N 2.92Å; V702-R705 PolarHBondContact O-N 2.86Å; Q703-R705 VanDerWaalsContact C-N 3.32Å; Q703-R705 PolarHBondContact O-N 3.26Å; R705-Q708 PolarHBondContact O-N 3.21Å; R705-A709 WeakPolarHBondContact O-CB 3.37Å; R705-A709 PolarHBondContact O-N 2.97Å
706	E	88.5	Confident	90.5	Very high	20 Å²	20	53.9 Å²	53.9	9%	0.093	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-49.5	175.6	-173.6	171.9	-161.5	0	0	110.7	V475 H476 V702 Q703 Q708 A709 L710 R801 H836	V475-E706 HydrophobicContact CG1-CG 4.05Å; H476-E706 IonicContact CE1-OE1 3.22Å; H476-E706 IonicContact CG-OE1 3.7Å; H476-E706 IonicContact ND1-OE1 3.06Å; H476-E706 PolarHBondContact ND1-OE1 3.33Å; V702-E706 PolarHBondContact O-N 2.99Å; Q703-E706 PolarHBondContact O-N 3.2Å; E706-Q708 PolarHBondContact O-N 3.48Å; E706-A709 PolarHBondContact O-N 2.92Å; E706-L710 HydrophobicContact CG-CD1 4.23Å; E706-L710 WeakPolarHBondContact O-CG 3.41Å; E706-L710 PolarHBondContact O-N 2.9Å; E706-R801 IonicContact OE1-NH2 3.96Å; E706-R801 PolarHBondContact OE1-NH2 3.43Å; E706-R801 VanDerWaalsContact OE1-NH2 3.13Å; E706-H836 IonicContact OE1-CE1 3.87Å
707	R	88.1	Confident	90.4	Very high	159 Å²	159	49.8 Å²	49.8	60%	0.6	23%	0.234	S	C	*	.	H	α-helix	trans	-58.3	-46.8	177.1	-75.2	-173.9	-70.5	172.5	-2.2	112.3	Q703 A704 A709 L710 A711	Q703-R707 WeakPolarHBondContact O-CB 3.39Å; Q703-R707 WeakPolarHBondContact O-CG 3.32Å; Q703-R707 PolarHBondContact O-N 2.85Å; A704-R707 PolarHBondContact O-N 2.9Å; R707-A709 PolarHBondContact O-N 3.05Å; R707-L710 PolarHBondContact O-N 3.17Å; R707-A711 WeakPolarHBondContact O-CB 3.3Å; R707-A711 PolarHBondContact O-N 2.96Å
708	Q	86.1	Confident	90.2	Very high	52 Å²	52	52.6 Å²	52.6	24%	0.243	25%	0.248	C	C	.	.	H	α-helix	trans	-62.4	-42.7	178.7	-168.6	-164.9	-1.1	0	0	111.8	W256 A704 R705 E706 A711 R712	W256-Q708 PolarHBondContact O-NE2 2.96Å; A704-Q708 WeakPolarHBondContact O-CB 3.39Å; A704-Q708 PolarHBondContact O-N 3.31Å; R705-Q708 PolarHBondContact O-N 3.21Å; E706-Q708 PolarHBondContact O-N 3.48Å; Q708-A711 PolarHBondContact O-N 3.33Å; Q708-R712 VanDerWaalsContact O-CB 3.31Å; Q708-R712 WeakPolarHBondContact O-CB 3.29Å; Q708-R712 PolarHBondContact O-N 2.93Å
709	A	87.4	Confident	90.2	Very high	15 Å²	15	53.1 Å²	53.1	12%	0.124	25%	0.252	C	S	.	.	H	α-helix	trans	-63.5	-41.9	178	0	0	0	0	0	112	V475 R705 E706 R707 R712 L713	V475-A709 HydrophobicContact CG1-CB 3.72Å; V475-A709 HydrophobicContact CG2-CB 3.95Å; R705-A709 WeakPolarHBondContact O-CB 3.37Å; R705-A709 PolarHBondContact O-N 2.97Å; E706-A709 PolarHBondContact O-N 2.92Å; R707-A709 PolarHBondContact O-N 3.05Å; A709-R712 PolarHBondContact O-N 3.24Å; A709-L713 WeakPolarHBondContact O-CG 3.38Å; A709-L713 PolarHBondContact O-N 3.23Å
710	L	89.2	Confident	90.2	Very high	35 Å²	35	50.3 Å²	50.3	18%	0.183	24%	0.241	C	C	.	.	H	α-helix	trans	-66.7	-43.6	175.8	-67	173.3	0	0	0	112.3	R472 V475 E706 R707 R712 L713 R714	R472-L710 HydrophobicContact CB-CD2 4.2Å; R472-L710 HydrophobicContact CG-CD2 3.94Å; V475-L710 HydrophobicContact CB-CD2 4.16Å; V475-L710 HydrophobicContact CG1-CD2 3.98Å; V475-L710 HydrophobicContact CG1-CG 4Å; E706-L710 HydrophobicContact CG-CD1 4.23Å; E706-L710 WeakPolarHBondContact O-CG 3.41Å; E706-L710 PolarHBondContact O-N 2.9Å; R707-L710 PolarHBondContact O-N 3.17Å; L710-R712 VanDerWaalsContact C-N 3.33Å; L710-R712 PolarHBondContact O-N 2.68Å; L710-L713 PolarHBondContact O-N 3.38Å; L710-R714 PolarHBondContact O-N 3.34Å
711	A	88	Confident	90.2	Very high	57 Å²	57	53.1 Å²	53.1	47%	0.471	25%	0.246	S	C	.	.	H	α-helix	trans	-60.8	-43.3	176.2	0	0	0	0	0	111.4	R707 Q708 L713 R714 R715	R707-A711 WeakPolarHBondContact O-CB 3.3Å; R707-A711 PolarHBondContact O-N 2.96Å; Q708-A711 PolarHBondContact O-N 3.33Å; A711-L713 PolarHBondContact O-N 2.89Å; A711-R714 PolarHBondContact O-N 3.17Å; A711-R715 WeakPolarHBondContact O-CB 3.14Å; A711-R715 PolarHBondContact O-N 3.33Å
712	R	89.3	Confident	90.4	Very high	48 Å²	48	51 Å²	51	18%	0.181	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-45	175	-175.9	169.7	63.2	-142.5	-3.2	111.9	Q708 A709 L710 R714 R715 T716	Q708-R712 VanDerWaalsContact O-CB 3.31Å; Q708-R712 WeakPolarHBondContact O-CB 3.29Å; Q708-R712 PolarHBondContact O-N 2.93Å; A709-R712 PolarHBondContact O-N 3.24Å; L710-R712 VanDerWaalsContact C-N 3.33Å; L710-R712 PolarHBondContact O-N 2.68Å; R712-R714 PolarHBondContact O-N 3.01Å; R712-R715 PolarHBondContact O-N 3Å; R712-T716 VanDerWaalsContact O-CB 3.28Å; R712-T716 WeakPolarHBondContact O-CB 3.47Å; R712-T716 PolarHBondContact O-N 3.25Å; R712-T716 PolarHBondContact O-OG1 3.07Å
713	L	90.8	Very high	90.7	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-43.2	175.7	-74.9	176.7	0	0	0	112.1	P436 L468 L471 R472 V475 A709 L710 A711 T716 F717	P436-L713 WeakPolarHBondContact O-CD2 3.4Å; L468-L713 HydrophobicContact CD1-CB 3.99Å; L471-L713 HydrophobicContact CB-CD1 3.86Å; L471-L713 HydrophobicContact CB-CD2 3.8Å; L471-L713 HydrophobicContact CD1-CD2 3.85Å; L471-L713 HydrophobicContact CG-CD2 4.37Å; R472-L713 HydrophobicContact CG-CD1 3.98Å; V475-L713 HydrophobicContact CG2-CD1 3.77Å; A709-L713 WeakPolarHBondContact O-CG 3.38Å; A709-L713 PolarHBondContact O-N 3.23Å; L710-L713 PolarHBondContact O-N 3.38Å; A711-L713 PolarHBondContact O-N 2.89Å; L713-T716 PolarHBondContact O-N 2.78Å; L713-F717 WeakPolarHBondContact O-CB 3.22Å; L713-F717 PolarHBondContact O-N 3.17Å
714	R	89.4	Confident	90.9	Very high	86 Å²	86	47.6 Å²	47.6	33%	0.325	23%	0.232	S	C	.	.	H	α-helix	trans	-61.5	-50	177.1	-179.1	177.4	175.2	174.7	-1.8	111.4	L710 A711 R712 T716 F717 Q718	L710-R714 PolarHBondContact O-N 3.34Å; A711-R714 PolarHBondContact O-N 3.17Å; R712-R714 PolarHBondContact O-N 3.01Å; R714-T716 VanDerWaalsContact C-N 3.32Å; R714-T716 PolarHBondContact O-N 2.79Å; R714-F717 PolarHBondContact O-N 3.19Å; R714-Q718 WeakPolarHBondContact O-CB 3.24Å; R714-Q718 VanDerWaalsContact O-CG 3.32Å; R714-Q718 WeakPolarHBondContact O-CG 3.12Å; R714-Q718 PolarHBondContact O-N 3.16Å
715	R	90.9	Very high	91.3	Very high	85 Å²	85	46.7 Å²	46.7	32%	0.321	22%	0.221	S	C	.	.	H	α-helix	trans	-59.7	-43	178.1	-169.2	175.5	-179.9	174.6	-2.7	111.4	F438 A711 R712 Q718 A719 E753 E755	F438-R715 HydrophobicContact CE2-CG 4.13Å; A711-R715 WeakPolarHBondContact O-CB 3.14Å; A711-R715 PolarHBondContact O-N 3.33Å; R712-R715 PolarHBondContact O-N 3Å; R715-Q718 PolarHBondContact O-N 3.07Å; R715-A719 PolarHBondContact O-N 2.92Å; R715-A719 VanDerWaalsContact O-N 3.09Å; R715-E753 IonicContact CZ-OE2 3.4Å; R715-E753 VanDerWaalsContact CZ-OE2 3.28Å; R715-E753 IonicContact NH1-OE2 3.62Å; R715-E753 PolarHBondContact NH1-OE2 2.93Å; R715-E753 IonicContact NH2-OE1 3.76Å; R715-E753 IonicContact NH2-OE2 3.42Å; R715-E753 PolarHBondContact NH2-OE2 2.61Å; R715-E755 IonicContact NH1-OE1 3.86Å; R715-E755 PolarHBondContact NH1-OE1 3.37Å
716	T	92.3	Very high	91.7	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-50.2	177.9	-56.4	0	0	0	0	111.5	L434 F438 R712 L713 R714 A719 F720	L434-T716 HydrophobicContact CD1-CG2 4.19Å; F438-T716 HydrophobicContact CD1-CG2 4.11Å; F438-T716 HydrophobicContact CE1-CG2 4.06Å; R712-T716 VanDerWaalsContact O-CB 3.28Å; R712-T716 WeakPolarHBondContact O-CB 3.47Å; R712-T716 PolarHBondContact O-N 3.25Å; R712-T716 PolarHBondContact O-OG1 3.07Å; L713-T716 PolarHBondContact O-N 2.78Å; R714-T716 VanDerWaalsContact C-N 3.32Å; R714-T716 PolarHBondContact O-N 2.79Å; T716-A719 PolarHBondContact O-N 2.77Å; T716-F720 HydrophobicContact CG2-CD2 3.83Å; T716-F720 HydrophobicContact CG2-CE2 3.44Å; T716-F720 VanDerWaalsContact CG2-CE2 3.44Å; T716-F720 WeakPolarHBondContact O-CD2 3.16Å; T716-F720 PolarHBondContact O-N 3.1Å
717	F	92.8	Very high	92	Very high	19 Å²	19	48.3 Å²	48.3	8%	0.083	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-47.2	177.4	178	-99.8	0	0	0	112.2	L434 L468 L713 R714 A719 F720 H721 P770	L434-F717 HydrophobicContact CD1-CB 4.35Å; L434-F717 HydrophobicContact CD1-CD2 4.37Å; L434-F717 HydrophobicContact CD2-CB 3.93Å; L434-F717 HydrophobicContact CD2-CD2 4.08Å; L434-F717 HydrophobicContact CD2-CG 4.49Å; L468-F717 HydrophobicContact CB-CD2 4.35Å; L468-F717 HydrophobicContact CD1-CB 4.29Å; L468-F717 HydrophobicContact CD2-CB 4.18Å; L468-F717 HydrophobicContact CD2-CD1 4.06Å; L468-F717 HydrophobicContact CD2-CD2 4.21Å; L468-F717 HydrophobicContact CD2-CG 3.88Å; L713-F717 WeakPolarHBondContact O-CB 3.22Å; L713-F717 PolarHBondContact O-N 3.17Å; R714-F717 PolarHBondContact O-N 3.19Å; F717-A719 VanDerWaalsContact C-N 3.34Å; F717-A719 PolarHBondContact O-N 3.05Å; F717-F720 PolarHBondContact O-N 2.91Å; F717-H721 HydrophobicContact CE1-CB 4.22Å; F717-H721 HydrophobicContact CZ-CB 4.34Å; F717-H721 AromaticContact CZ-CD2 3.81Å; F717-H721 WeakPolarHBondContact O-CB 3.16Å; F717-H721 PolarHBondContact O-N 3.28Å; F717-P770 HydrophobicContact CE1-CB 4.42Å; F717-P770 HydrophobicContact CE1-CG 4.46Å
718	Q	91.8	Very high	92.3	Very high	102 Å²	102	41 Å²	41	48%	0.477	22%	0.221	S	C	.	.	H	α-helix	trans	-59.5	-42.6	-179	-75.7	177	-17.6	0	0	112.3	R714 R715 S722	R714-Q718 WeakPolarHBondContact O-CB 3.24Å; R714-Q718 VanDerWaalsContact O-CG 3.32Å; R714-Q718 WeakPolarHBondContact O-CG 3.12Å; R714-Q718 PolarHBondContact O-N 3.16Å; R715-Q718 PolarHBondContact O-N 3.07Å; Q718-S722 VanDerWaalsContact O-CB 3.28Å; Q718-S722 WeakPolarHBondContact O-CB 3.44Å; Q718-S722 PolarHBondContact O-N 3.29Å
719	A	93.6	Very high	92.6	Very high	11 Å²	11	40.1 Å²	40.1	9%	0.091	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-50.9	178.3	0	0	0	0	0	111.9	F438 R715 T716 F717 S722 L746	F438-A719 HydrophobicContact CE1-CB 3.69Å; F438-A719 HydrophobicContact CZ-CB 3.47Å; F438-A719 VanDerWaalsContact CZ-CB 3.47Å; R715-A719 PolarHBondContact O-N 2.92Å; R715-A719 VanDerWaalsContact O-N 3.09Å; T716-A719 PolarHBondContact O-N 2.77Å; F717-A719 VanDerWaalsContact C-N 3.34Å; F717-A719 PolarHBondContact O-N 3.05Å; A719-S722 PolarHBondContact O-N 3.06Å; A719-S722 PolarHBondContact O-OG 2.95Å; A719-L746 HydrophobicContact CB-CD1 4.34Å
720	F	95.9	Very high	92.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.1	-41.5	179.6	-67.9	-55.2	0	0	0	112.5	V321 L434 P435 F438 Y441 L459 L461 T716 F717 S722 V723 A724 L743	V321-F720 HydrophobicContact CG1-CB 4.36Å; V321-F720 HydrophobicContact CG2-CD1 4.19Å; L434-F720 HydrophobicContact CD1-CD2 3.72Å; L434-F720 HydrophobicContact CD1-CE2 4.36Å; P435-F720 HydrophobicContact CG-CE2 4.09Å; P435-F720 HydrophobicContact CG-CZ 4.34Å; F438-F720 HydrophobicContact CD1-CE2 4.31Å; F438-F720 HydrophobicContact CD1-CZ 4.23Å; F438-F720 HydrophobicContact CE1-CE2 4.27Å; F438-F720 HydrophobicContact CE1-CZ 4.38Å; Y441-F720 AromaticContact CD1-CE1 3.94Å; Y441-F720 HydrophobicContact CD1-CE1 3.94Å; Y441-F720 AromaticContact CD1-CZ 3.71Å; Y441-F720 HydrophobicContact CD1-CZ 3.71Å; Y441-F720 HydrophobicContact CD2-CE1 4.35Å; Y441-F720 AromaticContact CD2-CZ 3.95Å; Y441-F720 HydrophobicContact CD2-CZ 3.95Å; Y441-F720 AromaticContact CE1-CE1 3.81Å; Y441-F720 HydrophobicContact CE1-CE1 3.81Å; Y441-F720 HydrophobicContact CE1-CZ 4.07Å; Y441-F720 HydrophobicContact CE2-CE1 4.21Å; Y441-F720 HydrophobicContact CE2-CZ 4.27Å; Y441-F720 HydrophobicContact CG-CE1 4.2Å; Y441-F720 AromaticContact CG-CZ 3.63Å; Y441-F720 HydrophobicContact CG-CZ 3.63Å; Y441-F720 AromaticContact CZ-CE1 3.93Å; L459-F720 HydrophobicContact CD2-CB 3.84Å; L459-F720 HydrophobicContact CD2-CD1 3.57Å; L459-F720 HydrophobicContact CD2-CD2 3.72Å; L459-F720 HydrophobicContact CD2-CE1 3.99Å; L459-F720 HydrophobicContact CD2-CE2 4.11Å; L459-F720 HydrophobicContact CD2-CG 3.44Å; L459-F720 VanDerWaalsContact CD2-CG 3.44Å; L459-F720 HydrophobicContact CD2-CZ 4.25Å; L461-F720 HydrophobicContact CD1-CB 4.1Å; L461-F720 HydrophobicContact CD2-CB 4.47Å; T716-F720 HydrophobicContact CG2-CD2 3.83Å; T716-F720 HydrophobicContact CG2-CE2 3.44Å; T716-F720 VanDerWaalsContact CG2-CE2 3.44Å; T716-F720 WeakPolarHBondContact O-CD2 3.16Å; T716-F720 PolarHBondContact O-N 3.1Å; F717-F720 PolarHBondContact O-N 2.91Å; F720-S722 VanDerWaalsContact C-N 3.3Å; F720-S722 PolarHBondContact O-N 3.41Å; F720-V723 VanDerWaalsContact O-CG2 3.29Å; F720-V723 WeakPolarHBondContact O-CG2 3.36Å; F720-V723 PolarHBondContact O-N 3.33Å; F720-A724 PolarHBondContact O-N 3.37Å; F720-L743 HydrophobicContact CD1-CD1 3.95Å; F720-L743 HydrophobicContact CD1-CD2 4.11Å; F720-L743 HydrophobicContact CE1-CD1 4.07Å; F720-L743 HydrophobicContact CE1-CD2 4.15Å
721	H	94.4	Very high	92.9	Very high	88 Å²	88	41.5 Å²	41.5	41%	0.407	24%	0.236	S	C	.	.	H	α-helix	trans	-62.3	-37.9	176.6	-175.9	-79.3	0	0	0	111.7	M323 L461 F717 V723 A724	M323-H721 VanDerWaalsContact SD-CD2 3.57Å; L461-H721 HydrophobicContact CD1-CB 4.47Å; F717-H721 HydrophobicContact CE1-CB 4.22Å; F717-H721 HydrophobicContact CZ-CB 4.34Å; F717-H721 AromaticContact CZ-CD2 3.81Å; F717-H721 WeakPolarHBondContact O-CB 3.16Å; F717-H721 PolarHBondContact O-N 3.28Å; H721-V723 PolarHBondContact O-N 2.97Å; H721-V723 VanDerWaalsContact O-N 3.09Å; H721-A724 WeakPolarHBondContact O-CB 3.38Å; H721-A724 PolarHBondContact O-N 3.04Å; H721-A724 VanDerWaalsContact O-N 3.12Å
722	S	94.9	Very high	93	Very high	49 Å²	49	40.6 Å²	40.6	34%	0.343	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.9	-178.7	79.8	0	0	0	0	114.8	Q718 A719 F720	Q718-S722 VanDerWaalsContact O-CB 3.28Å; Q718-S722 WeakPolarHBondContact O-CB 3.44Å; Q718-S722 PolarHBondContact O-N 3.29Å; A719-S722 PolarHBondContact O-N 3.06Å; A719-S722 PolarHBondContact O-OG 2.95Å; F720-S722 VanDerWaalsContact C-N 3.3Å; F720-S722 PolarHBondContact O-N 3.41Å
723	V	96.1	Very high	92.7	Very high	6 Å²	6	44.2 Å²	44.2	4%	0.036	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	2.7	178.1	-61.9	0	0	0	0	112.7	V321 F720 H721 R739 R742 L743	V321-V723 HydrophobicContact CB-CG2 4.41Å; V321-V723 HydrophobicContact CG2-CG2 3.91Å; F720-V723 VanDerWaalsContact O-CG2 3.29Å; F720-V723 WeakPolarHBondContact O-CG2 3.36Å; F720-V723 PolarHBondContact O-N 3.33Å; H721-V723 PolarHBondContact O-N 2.97Å; H721-V723 VanDerWaalsContact O-N 3.09Å; V723-R739 PolarHBondContact O-NH1 3.24Å; V723-R742 HydrophobicContact CG1-CG 4.28Å; V723-L743 HydrophobicContact CG1-CB 4.47Å; V723-L743 HydrophobicContact CG2-CB 4.27Å; V723-L743 HydrophobicContact CG2-CD1 4.21Å; V723-L743 HydrophobicContact CG2-CD2 4.17Å; V723-L743 HydrophobicContact CG2-CG 4.45Å
724	A	95.6	Very high	92.3	Very high	17 Å²	17	51.4 Å²	51.4	14%	0.14	28%	0.276	C	S	.	.			trans	-73.1	145	-174.8	0	0	0	0	0	112.9	V321 M323 L461 F720 H721 R739	V321-A724 HydrophobicContact CB-CB 4.23Å; V321-A724 HydrophobicContact CG1-CB 3.82Å; V321-A724 WeakPolarHBondContact O-CA 3.44Å; M323-A724 HydrophobicContact CG-CB 4.15Å; M323-A724 HydrophobicContact SD-CB 4.26Å; L461-A724 HydrophobicContact CD1-CB 4.34Å; F720-A724 PolarHBondContact O-N 3.37Å; H721-A724 WeakPolarHBondContact O-CB 3.38Å; H721-A724 PolarHBondContact O-N 3.04Å; H721-A724 VanDerWaalsContact O-N 3.12Å; A724-R739 VanDerWaalsContact C-NH1 3.28Å; A724-R739 PolarHBondContact O-NH1 2.96Å
725	F	96	Very high	91.8	Very high	20 Å²	20	48.9 Å²	48.9	9%	0.088	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-91	154.8	165.6	-69.4	-77.3	0	0	0	111	V321 S322 M323 S727 P730 D736 R739	V321-F725 PolarHBondContact O-N 3.05Å; S322-F725 CarbonylContact C-O 3.59Å; S322-F725 WeakPolarHBondContact CA-O 3.45Å; M323-F725 PolarHBondContact N-O 3.05Å; F725-S727 WeakPolarHBondContact CB-O 3.39Å; F725-S727 PolarHBondContact O-N 3.09Å; F725-P730 HydrophobicContact CB-CG 4.5Å; F725-P730 HydrophobicContact CD1-CB 3.8Å; F725-P730 HydrophobicContact CD1-CG 3.84Å; F725-P730 HydrophobicContact CE1-CB 3.78Å; F725-P730 HydrophobicContact CE1-CG 4.28Å; F725-P730 HydrophobicContact CG-CB 4.26Å; F725-P730 HydrophobicContact CG-CG 4.26Å; F725-P730 HydrophobicContact CZ-CB 4.22Å; F725-D736 HydrophobicContact CE2-CB 4.26Å; F725-D736 HydrophobicContact CZ-CB 3.85Å; F725-R739 VanDerWaalsContact CZ-NE 3.28Å
726	P	94.6	Very high	91.8	Very high	110 Å²	110	47.2 Å²	47.2	71%	0.714	27%	0.265	S	S	*	.	S	Bend	trans	-62.3	-25.2	172.2	-22.6	34	0	0	0	113.7	M323	M323-P726 CarbonylContact C-O 3.53Å
727	S	95.6	Very high	91.8	Very high	50 Å²	50	51.3 Å²	51.3	35%	0.35	28%	0.284	S	S	.	.	S	Bend	trans	-150.7	167.2	174.3	66.9	0	0	0	0	110.1	S322 D324 F725 G729 P730	S322-S727 VanDerWaalsContact CB-C 3.41Å; D324-S727 VanDerWaalsContact OD1-CA 3.27Å; D324-S727 WeakPolarHBondContact OD1-CA 3.41Å; D324-S727 WeakPolarHBondContact OD1-CB 3.34Å; F725-S727 WeakPolarHBondContact CB-O 3.39Å; F725-S727 PolarHBondContact O-N 3.09Å; S727-G729 PolarHBondContact O-N 3.38Å; S727-G729 PolarHBondContact OG-N 3.07Å; S727-P730 VanDerWaalsContact O-CD 3.28Å; S727-P730 WeakPolarHBondContact O-CD 3.29Å
728	C	93.7	Very high	91.9	Very high	4 Å²	4	58.2 Å²	58.2	3%	0.027	32%	0.317	C	S	.	.	S	Bend	trans	-71.7	-10.9	175.7	61.8	0	0	0	0	113.6	D324 L334 F460 C731 L732	D324-C728 PolarHBondContact OD1-N 3.1Å; D324-C728 PolarHBondContact OD1-SG 3.17Å; D324-C728 VanDerWaalsContact OD1-SG 3.33Å; D324-C728 PolarHBondContact OD2-N 3.23Å; L334-C728 HydrophobicContact CD1-CB 4.32Å; F460-C728 HydrophobicContact CE1-CB 4.18Å; C728-C731 PolarHBondContact O-N 2.99Å; C728-C731 PolarHBondContact O-SG 2.79Å; C728-L732 PolarHBondContact O-N 2.65Å
729	G	92.6	Very high	92	Very high	35 Å²	35	57.2 Å²	57.2	36%	0.361	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-46.3	-53.1	-178	0	0	0	0	0	115.1	S727 C731 L732	S727-G729 PolarHBondContact O-N 3.38Å; S727-G729 PolarHBondContact OG-N 3.07Å; G729-C731 PolarHBondContact O-N 2.7Å; G729-L732 WeakPolarHBondContact O-CG 3.5Å; G729-L732 PolarHBondContact O-N 2.8Å
730	P	92.1	Very high	92.2	Very high	79 Å²	79	56.7 Å²	56.7	51%	0.513	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-59.7	-16.7	179.4	-26.1	36.7	0	0	0	115.1	F725 S727	F725-P730 HydrophobicContact CB-CG 4.5Å; F725-P730 HydrophobicContact CD1-CB 3.8Å; F725-P730 HydrophobicContact CD1-CG 3.84Å; F725-P730 HydrophobicContact CE1-CB 3.78Å; F725-P730 HydrophobicContact CE1-CG 4.28Å; F725-P730 HydrophobicContact CG-CB 4.26Å; F725-P730 HydrophobicContact CG-CG 4.26Å; F725-P730 HydrophobicContact CZ-CB 4.22Å; S727-P730 VanDerWaalsContact O-CD 3.28Å; S727-P730 WeakPolarHBondContact O-CD 3.29Å
731	C	90.8	Very high	92.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-116.8	19.1	-178	70.6	0	0	0	0	114.4	S320 R339 C728 G729 Q734	S320-C731 PolarHBondContact OG-SG 3.32Å; R339-C731 WeakPolarHBondContact CD-O 3.42Å; C728-C731 PolarHBondContact O-N 2.99Å; C728-C731 PolarHBondContact O-SG 2.79Å; G729-C731 PolarHBondContact O-N 2.7Å; C731-Q734 WeakPolarHBondContact CA-O 3.44Å
732	L	90.6	Very high	92.1	Very high	38 Å²	38	61.6 Å²	61.6	20%	0.199	33%	0.326	C	S	.	.	S	Bend	trans	-73.8	-34.6	178.3	-71.3	177.2	0	0	0	113.9	T333 L334 K338 R339 C728 G729	T333-L732 HydrophobicContact CG2-CD1 4Å; T333-L732 HydrophobicContact CG2-CD2 4.16Å; L334-L732 HydrophobicContact CB-CD2 4.42Å; L334-L732 HydrophobicContact CD1-CD2 3.9Å; K338-L732 PolarHBondContact N-O 2.99Å; R339-L732 VanDerWaalsContact CB-O 3.3Å; R339-L732 WeakPolarHBondContact CB-O 3.27Å; R339-L732 PolarHBondContact N-O 3.45Å; C728-L732 PolarHBondContact O-N 2.65Å; G729-L732 WeakPolarHBondContact O-CG 3.5Å; G729-L732 PolarHBondContact O-N 2.8Å
733	E	83.1	Confident	92.1	Very high	124 Å²	124	59.4 Å²	59.4	58%	0.579	31%	0.31	S	S	*	.	S	Bend	trans	-95.1	-53	-179.2	-65.2	-157.9	142.2	0	0	112.2	K338	K338-E733 HydrophobicContact CD-CG 4.27Å; K338-E733 WeakPolarHBondContact CE-OE1 3.42Å; K338-E733 IonicContact NZ-OE1 2.65Å; K338-E733 PolarHBondContact NZ-OE1 3.07Å
734	Q	81.1	Confident	92	Very high	156 Å²	156	60.7 Å²	60.7	73%	0.729	32%	0.315	S	S	*	.	S	Bend	trans	-137.8	154.4	178.4	-60.6	-169.4	-8.1	0	0	109.5	C731	C731-Q734 WeakPolarHBondContact CA-O 3.44Å
735	Q	79.9	Confident	91.9	Very high	32 Å²	32	63.9 Å²	63.9	15%	0.15	33%	0.33	C	S	.	.			trans	-79	155.7	172.5	62.8	-106.8	-20.6	0	0	111.4	H318 R339 H456 E737	H318-Q735 HydrophobicContact CB-CG 3.81Å; H318-Q735 VanDerWaalsContact CD2-CD 3.48Å; H318-Q735 PolarHBondContact CD2-NE2 3.35Å; H318-Q735 PolarHBondContact NE2-NE2 2.8Å; R339-Q735 VanDerWaalsContact NH2-OE1 3.08Å; H456-Q735 PolarHBondContact CE1-OE1 3.32Å; H456-Q735 PolarHBondContact ND1-OE1 3.01Å; Q735-E737 VanDerWaalsContact CG-OE1 3.24Å; Q735-E737 WeakPolarHBondContact CG-OE1 3.48Å; Q735-E737 PolarHBondContact NE2-OE1 3.46Å; Q735-E737 PolarHBondContact O-N 3.43Å
736	D	91.1	Very high	91.7	Very high	51 Å²	51	65 Å²	65	27%	0.273	34%	0.337	S	S	.	.			trans	-80.6	103.4	166.9	-177.2	-34.9	0	0	0	108.4	F725 E738 R739 S740	F725-D736 HydrophobicContact CE2-CB 4.26Å; F725-D736 HydrophobicContact CZ-CB 3.85Å; D736-E738 VanDerWaalsContact C-N 3.28Å; D736-E738 PolarHBondContact O-N 2.94Å; D736-E738 WeakPolarHBondContact OD1-CB 3.24Å; D736-E738 PolarHBondContact OD1-N 3.45Å; D736-E738 VanDerWaalsContact OD1-N 3.16Å; D736-R739 HydrophobicContact CB-CB 4.13Å; D736-R739 HydrophobicContact CB-CG 4.28Å; D736-R739 PolarHBondContact O-N 3.32Å; D736-R739 PolarHBondContact OD1-N 3.25Å; D736-R739 VanDerWaalsContact OD2-CD 3.28Å; D736-R739 WeakPolarHBondContact OD2-CD 3.47Å; D736-R739 WeakPolarHBondContact OD2-CG 3.15Å; D736-R739 IonicContact OD2-NE 3.34Å; D736-R739 PolarHBondContact OD2-NE 3.03Å; D736-S740 WeakPolarHBondContact O-CB 3.28Å; D736-S740 PolarHBondContact O-N 3.37Å
737	E	92.1	Very high	91.6	Very high	86 Å²	86	59.8 Å²	59.8	40%	0.402	30%	0.303	S	S	.	.	H	α-helix	trans	-63.2	-32.6	-177.9	-72.1	-58.5	151.3	0	0	112.6	H318 Q735 S740 T741	H318-E737 IonicContact CD2-OE1 3.13Å; H318-E737 PolarHBondContact CD2-OE1 3.05Å; H318-E737 VanDerWaalsContact CD2-OE1 3.28Å; H318-E737 IonicContact CD2-OE2 2.82Å; H318-E737 IonicContact NE2-OE1 2.69Å; Q735-E737 VanDerWaalsContact CG-OE1 3.24Å; Q735-E737 WeakPolarHBondContact CG-OE1 3.48Å; Q735-E737 PolarHBondContact NE2-OE1 3.46Å; Q735-E737 PolarHBondContact O-N 3.43Å; E737-S740 PolarHBondContact O-N 3.38Å; E737-T741 VanDerWaalsContact O-CB 3.24Å; E737-T741 WeakPolarHBondContact O-CB 3.5Å; E737-T741 PolarHBondContact O-N 2.92Å; E737-T741 PolarHBondContact O-OG1 3.16Å
738	E	94.1	Very high	91.2	Very high	165 Å²	165	58 Å²	58	77%	0.771	29%	0.293	S	S	*	.	H	α-helix	trans	-66.5	-48.3	178	-63.9	-176.2	176.9	0	0	110.4	D736 T741 R742	D736-E738 VanDerWaalsContact C-N 3.28Å; D736-E738 PolarHBondContact O-N 2.94Å; D736-E738 WeakPolarHBondContact OD1-CB 3.24Å; D736-E738 PolarHBondContact OD1-N 3.45Å; D736-E738 VanDerWaalsContact OD1-N 3.16Å; E738-T741 PolarHBondContact O-N 2.83Å; E738-R742 VanDerWaalsContact O-CB 3.27Å; E738-R742 WeakPolarHBondContact O-CB 3.27Å; E738-R742 PolarHBondContact O-N 3.18Å
739	R	95.3	Very high	91	Very high	81 Å²	81	64.6 Å²	64.6	31%	0.306	32%	0.317	S	S	.	.	H	α-helix	trans	-64.8	-41	175.9	-71.3	-179.1	-175.8	-130.6	1.3	112.2	V723 A724 F725 D736 T741 L743	V723-R739 PolarHBondContact O-NH1 3.24Å; A724-R739 VanDerWaalsContact C-NH1 3.28Å; A724-R739 PolarHBondContact O-NH1 2.96Å; F725-R739 VanDerWaalsContact CZ-NE 3.28Å; D736-R739 HydrophobicContact CB-CB 4.13Å; D736-R739 HydrophobicContact CB-CG 4.28Å; D736-R739 PolarHBondContact O-N 3.32Å; D736-R739 PolarHBondContact OD1-N 3.25Å; D736-R739 VanDerWaalsContact OD2-CD 3.28Å; D736-R739 WeakPolarHBondContact OD2-CD 3.47Å; D736-R739 WeakPolarHBondContact OD2-CG 3.15Å; D736-R739 IonicContact OD2-NE 3.34Å; D736-R739 PolarHBondContact OD2-NE 3.03Å; R739-T741 VanDerWaalsContact C-N 3.34Å; R739-L743 WeakPolarHBondContact O-CB 3.27Å; R739-L743 PolarHBondContact O-N 3.06Å
740	S	95.8	Very high	90.7	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.4	-43.7	177.3	-176.3	0	0	0	0	111.1	L319 D736 E737 K744	L319-S740 PolarHBondContact N-OG 3.05Å; L319-S740 WeakPolarHBondContact O-CB 3.33Å; D736-S740 WeakPolarHBondContact O-CB 3.28Å; D736-S740 PolarHBondContact O-N 3.37Å; E737-S740 PolarHBondContact O-N 3.38Å; S740-K744 WeakPolarHBondContact O-CE 3.42Å; S740-K744 WeakPolarHBondContact O-CG 3.36Å; S740-K744 PolarHBondContact O-N 3.36Å
741	T	94.6	Very high	90.5	Very high	60 Å²	60	61.2 Å²	61.2	37%	0.368	28%	0.283	S	S	.	.	H	α-helix	trans	-68	-46.5	179.7	-58.5	0	0	0	0	110.6	E737 E738 R739 L743 K744 D745	E737-T741 VanDerWaalsContact O-CB 3.24Å; E737-T741 WeakPolarHBondContact O-CB 3.5Å; E737-T741 PolarHBondContact O-N 2.92Å; E737-T741 PolarHBondContact O-OG1 3.16Å; E738-T741 PolarHBondContact O-N 2.83Å; R739-T741 VanDerWaalsContact C-N 3.34Å; T741-L743 VanDerWaalsContact C-N 3.28Å; T741-L743 PolarHBondContact O-N 3.5Å; T741-K744 CarbonylContact O-C 3.51Å; T741-K744 WeakPolarHBondContact O-CA 3.5Å; T741-K744 WeakPolarHBondContact O-CB 3.37Å; T741-K744 PolarHBondContact O-N 3.24Å; T741-D745 VanDerWaalsContact O-CG 3.24Å; T741-D745 PolarHBondContact O-N 3Å
742	R	95.3	Very high	90.1	Very high	131 Å²	131	66.6 Å²	66.6	49%	0.494	31%	0.308	S	S	.	.	H	α-helix	trans	-56.5	-40	175.6	179	175.5	160.1	-176.8	-7.2	113	V723 E738 L746	V723-R742 HydrophobicContact CG1-CG 4.28Å; E738-R742 VanDerWaalsContact O-CB 3.27Å; E738-R742 WeakPolarHBondContact O-CB 3.27Å; E738-R742 PolarHBondContact O-N 3.18Å; R742-L746 WeakPolarHBondContact O-CG 3.47Å; R742-L746 PolarHBondContact O-N 3.24Å; R742-L746 VanDerWaalsContact O-N 3.07Å
743	L	95.3	Very high	89.4	Confident	2 Å²	2	68.3 Å²	68.3	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-68.4	-41.9	175.3	-177.8	58.5	0	0	0	111.7	L319 V321 F720 V723 R739 T741 D745 L746 L747	L319-L743 HydrophobicContact CB-CD2 3.91Å; L319-L743 HydrophobicContact CD1-CB 4.42Å; L319-L743 HydrophobicContact CD1-CD2 3.84Å; L319-L743 HydrophobicContact CD1-CG 3.98Å; V321-L743 HydrophobicContact CG2-CD2 4.09Å; F720-L743 HydrophobicContact CD1-CD1 3.95Å; F720-L743 HydrophobicContact CD1-CD2 4.11Å; F720-L743 HydrophobicContact CE1-CD1 4.07Å; F720-L743 HydrophobicContact CE1-CD2 4.15Å; V723-L743 HydrophobicContact CG1-CB 4.47Å; V723-L743 HydrophobicContact CG2-CB 4.27Å; V723-L743 HydrophobicContact CG2-CD1 4.21Å; V723-L743 HydrophobicContact CG2-CD2 4.17Å; V723-L743 HydrophobicContact CG2-CG 4.45Å; R739-L743 WeakPolarHBondContact O-CB 3.27Å; R739-L743 PolarHBondContact O-N 3.06Å; T741-L743 VanDerWaalsContact C-N 3.28Å; T741-L743 PolarHBondContact O-N 3.5Å; L743-D745 VanDerWaalsContact C-N 3.3Å; L743-D745 PolarHBondContact O-N 2.92Å; L743-L746 PolarHBondContact O-N 3.13Å; L743-L747 HydrophobicContact CG-CD1 4.34Å; L743-L747 WeakPolarHBondContact O-CG 3.29Å; L743-L747 PolarHBondContact O-N 3.37Å
744	K	93.8	Very high	88.5	Confident	34 Å²	34	69 Å²	69	15%	0.148	32%	0.319	C	S	.	.	H	α-helix	trans	-58.7	-42.1	174.3	-74.1	-178	-69.4	-164.1	0	111.3	V313 L317 L319 S740 T741 L747 G748	V313-K744 HydrophobicContact CB-CG 4.36Å; V313-K744 HydrophobicContact CG1-CD 4.13Å; V313-K744 HydrophobicContact CG1-CG 3.97Å; L317-K744 PolarHBondContact O-NZ 3.2Å; L319-K744 HydrophobicContact CD1-CG 3.77Å; L319-K744 HydrophobicContact CG-CG 4.33Å; S740-K744 WeakPolarHBondContact O-CE 3.42Å; S740-K744 WeakPolarHBondContact O-CG 3.36Å; S740-K744 PolarHBondContact O-N 3.36Å; T741-K744 CarbonylContact O-C 3.51Å; T741-K744 WeakPolarHBondContact O-CA 3.5Å; T741-K744 WeakPolarHBondContact O-CB 3.37Å; T741-K744 PolarHBondContact O-N 3.24Å; K744-L747 PolarHBondContact O-N 2.98Å; K744-G748 PolarHBondContact O-N 2.96Å
745	D	91.7	Very high	87.3	Confident	84 Å²	84	65 Å²	65	45%	0.449	30%	0.3	S	S	.	.	H	α-helix	trans	-68.6	-35.4	178.7	-61.3	-19.1	0	0	0	112.9	T741 L743 R749	T741-D745 VanDerWaalsContact O-CG 3.24Å; T741-D745 PolarHBondContact O-N 3Å; L743-D745 VanDerWaalsContact C-N 3.3Å; L743-D745 PolarHBondContact O-N 2.92Å; D745-R749 WeakPolarHBondContact O-CB 3.39Å; D745-R749 WeakPolarHBondContact O-CG 3.46Å; D745-R749 PolarHBondContact O-N 3.44Å; D745-R749 PolarHBondContact O-NE 3.09Å; D745-R749 VanDerWaalsContact O-NE 3.12Å
746	L	92.4	Very high	85.5	Confident	44 Å²	44	67.3 Å²	67.3	23%	0.23	33%	0.333	C	S	.	.	H	α-helix	trans	-64.5	-41.8	173.1	-77.9	170.5	0	0	0	111.3	A719 R742 L743 Y750	A719-L746 HydrophobicContact CB-CD1 4.34Å; R742-L746 WeakPolarHBondContact O-CG 3.47Å; R742-L746 PolarHBondContact O-N 3.24Å; R742-L746 VanDerWaalsContact O-N 3.07Å; L743-L746 PolarHBondContact O-N 3.13Å; L746-Y750 PolarHBondContact O-N 3Å
747	L	91.9	Very high	82.9	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-67.1	-46.4	176	-65.5	170.8	0	0	0	110.9	V313 L319 F438 Y441 V442 L743 K744 R749 Y750 F751	V313-L747 HydrophobicContact CG2-CB 4.28Å; V313-L747 HydrophobicContact CG2-CD1 3.94Å; L319-L747 HydrophobicContact CD1-CD1 4.18Å; F438-L747 HydrophobicContact CB-CD2 3.93Å; F438-L747 HydrophobicContact CD1-CD2 3.37Å; F438-L747 HydrophobicContact CE1-CD2 3.98Å; F438-L747 HydrophobicContact CG-CD2 3.75Å; Y441-L747 HydrophobicContact CD1-CD1 4.14Å; Y441-L747 HydrophobicContact CE1-CD1 4.02Å; V442-L747 HydrophobicContact CG2-CD1 4.17Å; V442-L747 HydrophobicContact CG2-CD2 4.29Å; L743-L747 HydrophobicContact CG-CD1 4.34Å; L743-L747 WeakPolarHBondContact O-CG 3.29Å; L743-L747 PolarHBondContact O-N 3.37Å; K744-L747 PolarHBondContact O-N 2.98Å; L747-R749 PolarHBondContact O-N 2.82Å; L747-Y750 WeakPolarHBondContact O-CB 3.44Å; L747-Y750 PolarHBondContact O-N 3.2Å; L747-F751 WeakPolarHBondContact O-CD2 3.5Å; L747-F751 PolarHBondContact O-N 2.9Å
748	G	88.4	Confident	80.4	Confident	13 Å²	13	76.1 Å²	76.1	13%	0.134	37%	0.372	C	S	.	.	H	α-helix	trans	-54.9	-53.1	177.8	0	0	0	0	0	112.1	K744 Y750 F751 E752	K744-G748 PolarHBondContact O-N 2.96Å; G748-Y750 VanDerWaalsContact C-N 3.29Å; G748-Y750 PolarHBondContact O-N 2.83Å; G748-F751 PolarHBondContact O-N 3.41Å; G748-F751 VanDerWaalsContact O-N 3.09Å; G748-E752 WeakPolarHBondContact O-CG 3.22Å; G748-E752 PolarHBondContact O-N 3.09Å; G748-E752 VanDerWaalsContact O-N 3.09Å
749	R	88.3	Confident	77.7	Confident	142 Å²	142	72.6 Å²	72.6	54%	0.536	36%	0.364	S	S	.	.	H	α-helix	trans	-56.3	-41.1	176.9	-76.1	-179.3	-77.5	161	-12.6	112.9	D745 L747 F751 E752 E753	D745-R749 WeakPolarHBondContact O-CB 3.39Å; D745-R749 WeakPolarHBondContact O-CG 3.46Å; D745-R749 PolarHBondContact O-N 3.44Å; D745-R749 PolarHBondContact O-NE 3.09Å; D745-R749 VanDerWaalsContact O-NE 3.12Å; L747-R749 PolarHBondContact O-N 2.82Å; R749-F751 VanDerWaalsContact C-N 3.32Å; R749-F751 PolarHBondContact O-N 3.01Å; R749-E752 PolarHBondContact O-N 3.1Å; R749-E753 WeakPolarHBondContact O-CB 3.29Å; R749-E753 PolarHBondContact O-N 3.16Å
750	Y	88.3	Confident	74.7	Confident	27 Å²	27	72.6 Å²	72.6	11%	0.106	39%	0.389	C	S	.	.	H	α-helix	trans	-60.5	-37.6	178	169	-99.9	0	0	0	113.5	T288 F438 E439 L746 L747 G748	T288-Y750 HydrophobicContact CG2-CD1 4.26Å; T288-Y750 HydrophobicContact CG2-CE1 3.61Å; T288-Y750 HydrophobicContact CG2-CE2 4.38Å; F438-Y750 HydrophobicContact CB-CD1 3.84Å; F438-Y750 HydrophobicContact CB-CE1 3.79Å; F438-Y750 AromaticContact CD2-CD1 3.61Å; F438-Y750 HydrophobicContact CD2-CD1 3.61Å; F438-Y750 AromaticContact CD2-CD2 3.7Å; F438-Y750 HydrophobicContact CD2-CD2 3.7Å; F438-Y750 AromaticContact CD2-CE1 3.84Å; F438-Y750 HydrophobicContact CD2-CE1 3.84Å; F438-Y750 AromaticContact CD2-CE2 3.94Å; F438-Y750 HydrophobicContact CD2-CE2 3.94Å; F438-Y750 AromaticContact CD2-CG 3.52Å; F438-Y750 HydrophobicContact CD2-CG 3.52Å; F438-Y750 HydrophobicContact CE2-CD2 4.05Å; F438-Y750 HydrophobicContact CE2-CE2 4.49Å; F438-Y750 HydrophobicContact CE2-CG 4.09Å; F438-Y750 HydrophobicContact CG-CD1 4.16Å; F438-Y750 HydrophobicContact CG-CE1 4.33Å; F438-Y750 HydrophobicContact CG-CG 4.44Å; E439-Y750 HydrophobicContact CG-CE1 4.4Å; E439-Y750 PolarHBondContact OE1-OH 3.04Å; L746-Y750 PolarHBondContact O-N 3Å; L747-Y750 WeakPolarHBondContact O-CB 3.44Å; L747-Y750 PolarHBondContact O-N 3.2Å; G748-Y750 VanDerWaalsContact C-N 3.29Å; G748-Y750 PolarHBondContact O-N 2.83Å
751	F	86.1	Confident	71.6	Confident	15 Å²	15	76 Å²	76	7%	0.066	42%	0.423	C	S	.	.	H	α-helix	trans	-79.7	-26.8	178	-73.5	-78.2	0	0	0	112.9	T288 R289 P312 E439 V442 L747 G748 R749	T288-F751 HydrophobicContact CG2-CD1 4.17Å; R289-F751 PolarHBondContact N-O 3.16Å; P312-F751 HydrophobicContact CB-CD2 3.67Å; P312-F751 HydrophobicContact CB-CE2 4.11Å; P312-F751 HydrophobicContact CB-CG 4.18Å; P312-F751 HydrophobicContact CG-CB 3.62Å; P312-F751 HydrophobicContact CG-CD2 3.5Å; P312-F751 VanDerWaalsContact CG-CD2 3.5Å; P312-F751 HydrophobicContact CG-CE2 4.41Å; P312-F751 HydrophobicContact CG-CG 3.71Å; E439-F751 HydrophobicContact CB-CZ 4.49Å; E439-F751 HydrophobicContact CG-CE1 3.83Å; E439-F751 HydrophobicContact CG-CZ 4.01Å; V442-F751 HydrophobicContact CB-CE2 4.32Å; V442-F751 HydrophobicContact CB-CZ 4.31Å; V442-F751 HydrophobicContact CG2-CE2 3.79Å; V442-F751 HydrophobicContact CG2-CZ 4.21Å; L747-F751 WeakPolarHBondContact O-CD2 3.5Å; L747-F751 PolarHBondContact O-N 2.9Å; G748-F751 PolarHBondContact O-N 3.41Å; G748-F751 VanDerWaalsContact O-N 3.09Å; R749-F751 VanDerWaalsContact C-N 3.32Å; R749-F751 PolarHBondContact O-N 3.01Å
752	E	82.5	Confident	68.7	Low	113 Å²	113	79.4 Å²	79.4	53%	0.528	44%	0.437	S	S	.	.	H	α-helix	trans	-82.5	-16.3	178	-70.6	171.3	-177.4	0	0	113.8	R289 G748 R749 E754	R289-E752 VanDerWaalsContact CD-O 3.22Å; R289-E752 WeakPolarHBondContact CD-O 3.36Å; R289-E752 PolarHBondContact NE-O 2.85Å; G748-E752 WeakPolarHBondContact O-CG 3.22Å; G748-E752 PolarHBondContact O-N 3.09Å; G748-E752 VanDerWaalsContact O-N 3.09Å; R749-E752 PolarHBondContact O-N 3.1Å; E752-E754 PolarHBondContact O-N 3.3Å
753	E	75.9	Confident	65.9	Low	75 Å²	75	81 Å²	81	35%	0.35	45%	0.45	S	S	.	.			trans	-69.8	123.2	-175.7	-147.9	168.1	-154.3	0	0	112.2	R715 R749 E755	R715-E753 IonicContact CZ-OE2 3.4Å; R715-E753 VanDerWaalsContact CZ-OE2 3.28Å; R715-E753 IonicContact NH1-OE2 3.62Å; R715-E753 PolarHBondContact NH1-OE2 2.93Å; R715-E753 IonicContact NH2-OE1 3.76Å; R715-E753 IonicContact NH2-OE2 3.42Å; R715-E753 PolarHBondContact NH2-OE2 2.61Å; R749-E753 WeakPolarHBondContact O-CB 3.29Å; R749-E753 PolarHBondContact O-N 3.16Å; E753-E755 HydrophobicContact CG-CG 4.04Å
754	E	64.1	Low	62.9	Low	137 Å²	137	87.1 Å²	87.1	64%	0.64	48%	0.482	S	S	*	.			trans	-97	91.7	164.2	-62.2	-178.3	-172.9	0	0	107.7	R289 E752 G756	R289-E754 HydrophobicContact CB-CG 3.88Å; R289-E754 VanDerWaalsContact CD-CG 3.44Å; R289-E754 VanDerWaalsContact CD-OE1 3.27Å; R289-E754 WeakPolarHBondContact CD-OE1 3.5Å; R289-E754 HydrophobicContact CG-CG 4.34Å; R289-E754 IonicContact CZ-OE1 3.88Å; R289-E754 IonicContact NE-OE1 3.15Å; R289-E754 IonicContact NH1-OE1 2.96Å; R289-E754 PolarHBondContact NH1-OE1 2.52Å; E752-E754 PolarHBondContact O-N 3.3Å; E754-G756 PolarHBondContact O-N 3.44Å
755	E	56.8	Low	60	Low	73 Å²	73	88.2 Å²	88.2	34%	0.341	50%	0.498	S	S	.	.			trans	-75	98	-179.2	-83	-174.8	175.6	0	0	111.6	R715 E753	R715-E755 IonicContact NH1-OE1 3.86Å; R715-E755 PolarHBondContact NH1-OE1 3.37Å; E753-E755 HydrophobicContact CG-CG 4.04Å
756	G	42.4	Very low	57.4	Low	81 Å²	81	92.2 Å²	92.2	84%	0.835	51%	0.514	S	S	*	.	S	Bend	trans	-100.4	1.5	142.3	0	0	0	0	0	112.6	E754	E754-G756 PolarHBondContact O-N 3.44Å
757	Q	36	Very low	55	Low	164 Å²	164	92.4 Å²	92.4	77%	0.766	53%	0.527	S	S	*	.			trans	-111.3	86.2	165.5	-75.4	173.7	-12	0	0	106.8
758	E	38.7	Very low	53	Low	158 Å²	158	97 Å²	97	74%	0.738	56%	0.557	S	S	*	*			trans	-48.9	136.3	141.2	-66.3	-169.9	164	0	0	105.4	G760	E758-G760 PolarHBondContact O-N 3.07Å
759	P	37.6	Very low	51.5	Low	91 Å²	91	99.4 Å²	99.4	59%	0.591	57%	0.565	S	S	*	*			trans	-56.9	94.8	164.7	21.9	-28.9	0	0	0	106.5	G761 M762	P759-G761 PolarHBondContact O-N 3.19Å; P759-M762 PolarHBondContact O-N 3.01Å
760	G	33.8	Very low	49.9	Very low	81 Å²	81	96.3 Å²	96.3	84%	0.835	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.7	115.9	172.7	0	0	0	0	0	106	E758	E758-G760 PolarHBondContact O-N 3.07Å
761	G	30.6	Very low	48.4	Very low	70 Å²	70	97.7 Å²	97.7	72%	0.722	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	92	37	177.5	0	0	0	0	0	116.7	P759	P759-G761 PolarHBondContact O-N 3.19Å
762	M	32.3	Very low	47.5	Very low	132 Å²	132	99.8 Å²	99.8	65%	0.65	60%	0.595	S	S	*	*			trans	-115.3	27.1	146.6	-76.7	-150.5	-158.5	0	0	113.1	P759	P759-M762 PolarHBondContact O-N 3.01Å
763	E	37.3	Very low	47	Very low	166 Å²	166	96.3 Å²	96.3	78%	0.776	59%	0.586	S	S	*	*	S	Bend	trans	-66.2	128.3	140.6	-67.3	-172	149.4	0	0	106.3
764	D	32.9	Very low	46.8	Very low	129 Å²	129	100.8 Å²	100.8	69%	0.69	60%	0.599	S	S	*	*			trans	73.6	34.7	172.9	-61.1	-37.1	0	0	0	120.6	Q766	D764-Q766 HydrophobicContact CB-CG 4.33Å; D764-Q766 PolarHBondContact O-N 3.11Å
765	A	32.2	Very low	47.4	Very low	57 Å²	57	96.8 Å²	96.8	47%	0.471	58%	0.582	S	S	.	*			trans	-76.3	76.6	150.5	0	0	0	0	0	109.7	G767	A765-G767 PolarHBondContact O-N 3.07Å
766	Q	36.8	Very low	48.3	Very low	168 Å²	168	100.8 Å²	100.8	79%	0.785	60%	0.601	S	S	*	*			trans	-66.7	57.8	179.3	-66.4	172.6	-0.4	0	0	113	D764	D764-Q766 HydrophobicContact CB-CG 4.33Å; D764-Q766 PolarHBondContact O-N 3.11Å
767	G	42.2	Very low	50.2	Low	49 Å²	49	102.5 Å²	102.5	51%	0.505	59%	0.591	S	S	.	*	S	Bend	trans	-91.7	146	159	0	0	0	0	0	109.7	A765 E769	A765-G767 PolarHBondContact O-N 3.07Å; G767-E769 PolarHBondContact O-N 3.06Å; G767-E769 VanDerWaalsContact O-N 3.14Å
768	P	49.3	Very low	52.7	Low	97 Å²	97	99.3 Å²	99.3	63%	0.63	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-55.5	124.4	168.7	23.6	-30.9	0	0	0	108.4
769	E	58.6	Low	55.1	Low	63 Å²	63	94.7 Å²	94.7	29%	0.294	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-57.8	145.6	180	-63.4	-159.6	114.2	0	0	110.1	R472 G767 G771 Q772	R472-E769 IonicContact CZ-OE1 2.85Å; R472-E769 IonicContact CZ-OE2 3.29Å; R472-E769 VanDerWaalsContact CZ-OE2 3.22Å; R472-E769 IonicContact NH1-OE1 3.28Å; R472-E769 IonicContact NH1-OE2 2.72Å; R472-E769 PolarHBondContact NH1-OE2 2.92Å; R472-E769 IonicContact NH2-OE1 2.78Å; R472-E769 PolarHBondContact NH2-OE1 2.87Å; R472-E769 IonicContact NH2-OE2 3.23Å; R472-E769 PolarHBondContact NH2-OE2 3.49Å; G767-E769 PolarHBondContact O-N 3.06Å; G767-E769 VanDerWaalsContact O-N 3.14Å; E769-G771 PolarHBondContact O-N 2.91Å; E769-Q772 HydrophobicContact CB-CG 4.43Å; E769-Q772 PolarHBondContact O-N 3.35Å; E769-Q772 PolarHBondContact OE2-NE2 2.84Å; E769-Q772 VanDerWaalsContact OE2-NE2 3.12Å
770	P	54.3	Low	57.6	Low	77 Å²	77	97 Å²	97	50%	0.5	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-50.9	119	-175.6	-24.9	31.9	0	0	0	111.8	F717	F717-P770 HydrophobicContact CE1-CB 4.42Å; F717-P770 HydrophobicContact CE1-CG 4.46Å
771	G	56	Low	60.4	Low	56 Å²	56	97.6 Å²	97.6	58%	0.577	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	7.6	177.8	0	0	0	0	0	116.7	E769	E769-G771 PolarHBondContact O-N 2.91Å
772	Q	67.2	Low	63.4	Low	59 Å²	59	94.3 Å²	94.3	28%	0.276	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-95.9	134.4	171.6	-74.9	179.4	1.1	0	0	112.2	E769 H832	E769-Q772 HydrophobicContact CB-CG 4.43Å; E769-Q772 PolarHBondContact O-N 3.35Å; E769-Q772 PolarHBondContact OE2-NE2 2.84Å; E769-Q772 VanDerWaalsContact OE2-NE2 3.12Å; Q772-H832 WeakPolarHBondContact CA-O 3.47Å
773	A	71.5	Confident	66.3	Low	40 Å²	40	89.6 Å²	89.6	33%	0.331	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-81.3	160	171.1	0	0	0	0	0	111.1	H832 L833	A773-H832 PolarHBondContact N-O 3.44Å; A773-L833 HydrophobicContact CB-CD2 4.16Å
774	R	73.4	Confident	69	Low	168 Å²	168	85 Å²	85	63%	0.634	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-72.2	133.4	175	-63.9	-179.8	-179	-177.4	0.1	109.6	Q776 D777	R774-Q776 VanDerWaalsContact C-N 3.26Å; R774-Q776 PolarHBondContact O-N 2.96Å; R774-D777 PolarHBondContact O-N 3.48Å
775	L	75.4	Confident	72	Confident	53 Å²	53	79.1 Å²	79.1	28%	0.277	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-60.9	-37.1	-179.3	-174.4	67.3	0	0	0	112.4	D777 W778 E779 L833 A837 L841	L775-D777 PolarHBondContact O-N 3.41Å; L775-D777 VanDerWaalsContact O-N 3.12Å; L775-W778 PolarHBondContact O-N 3.17Å; L775-E779 PolarHBondContact O-N 2.81Å; L775-L833 HydrophobicContact CD1-CD1 4.38Å; L775-A837 HydrophobicContact CD1-CB 3.74Å; L775-A837 HydrophobicContact CD2-CB 3.71Å; L775-A837 HydrophobicContact CG-CB 4.21Å; L775-L841 HydrophobicContact CD1-CD1 3.88Å; L775-L841 HydrophobicContact CD2-CD1 4.44Å; L775-L841 HydrophobicContact CG-CD1 4.41Å
776	Q	76.8	Confident	74.9	Confident	157 Å²	157	76.5 Å²	76.5	73%	0.734	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-54.1	-33.1	-177.2	-69.4	166.8	-5.3	0	0	112.5	R774 W778	R774-Q776 VanDerWaalsContact C-N 3.26Å; R774-Q776 PolarHBondContact O-N 2.96Å; Q776-W778 VanDerWaalsContact C-N 3.25Å; Q776-W778 PolarHBondContact O-N 3.45Å
777	D	82.4	Confident	77.6	Confident	117 Å²	117	74.2 Å²	74.2	63%	0.626	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-75.6	-14.4	-178.3	-55.2	-33.8	0	0	0	112.9	R774 L775	R774-D777 PolarHBondContact O-N 3.48Å; L775-D777 PolarHBondContact O-N 3.41Å; L775-D777 VanDerWaalsContact O-N 3.12Å
778	W	87.4	Confident	80.1	Confident	98 Å²	98	75.9 Å²	75.9	37%	0.371	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	-6.5	-170.7	-69.4	88.3	0	0	0	114.2	L775 Q776 D780 Q781 V782 Y830 H832 L833	L775-W778 PolarHBondContact O-N 3.17Å; Q776-W778 VanDerWaalsContact C-N 3.25Å; Q776-W778 PolarHBondContact O-N 3.45Å; W778-D780 PolarHBondContact O-N 2.93Å; W778-Q781 PolarHBondContact O-N 3.26Å; W778-V782 HydrophobicContact CB-CG2 4.23Å; W778-V782 VanDerWaalsContact O-CG2 3.24Å; W778-V782 WeakPolarHBondContact O-CG2 3.31Å; W778-V782 PolarHBondContact O-N 2.88Å; W778-Y830 HydrophobicContact CE3-CD1 4.41Å; W778-Y830 AromaticContact CE3-CE1 3.83Å; W778-Y830 HydrophobicContact CE3-CE1 3.83Å; W778-Y830 HydrophobicContact CZ3-CE1 4.27Å; W778-H832 AromaticContact CD2-NE2 3.71Å; W778-H832 AromaticContact CE2-NE2 3.41Å; W778-H832 AromaticContact CZ2-NE2 3.68Å; W778-H832 AromaticContact NE1-NE2 3.72Å; W778-L833 HydrophobicContact CB-CD1 3.82Å; W778-L833 HydrophobicContact CB-CD2 4.22Å; W778-L833 HydrophobicContact CG-CD1 4.24Å; W778-L833 HydrophobicContact CG-CD2 4.09Å
779	E	89.3	Confident	82.2	Confident	61 Å²	61	71.3 Å²	71.3	29%	0.285	36%	0.361	S	S	.	.	H	α-helix	trans	-56.5	-52.3	-168	-173.5	171.4	166.4	0	0	113.2	L775 Q781 V782 R783 L841	L775-E779 PolarHBondContact O-N 2.81Å; E779-Q781 VanDerWaalsContact C-N 3.32Å; E779-Q781 PolarHBondContact O-N 3.06Å; E779-V782 PolarHBondContact O-N 3.21Å; E779-R783 WeakPolarHBondContact O-CG 3.38Å; E779-R783 PolarHBondContact O-N 2.67Å; E779-R783 IonicContact OE1-CZ 3.98Å; E779-R783 IonicContact OE1-NE 2.8Å; E779-R783 PolarHBondContact OE1-NE 3.48Å; E779-R783 IonicContact OE1-NH2 3.34Å; E779-R783 PolarHBondContact OE1-NH2 3Å; E779-L841 HydrophobicContact CG-CD1 4.16Å; E779-L841 HydrophobicContact CG-CD2 3.78Å
780	D	90.6	Very high	83.8	Confident	139 Å²	139	69.4 Å²	69.4	74%	0.743	35%	0.352	S	S	*	.	H	α-helix	trans	-61	-41.9	-179.1	-71.1	-31.8	0	0	0	112.3	W778 R783 C784	W778-D780 PolarHBondContact O-N 2.93Å; D780-R783 PolarHBondContact O-N 3.01Å; D780-C784 WeakPolarHBondContact O-CB 3.49Å; D780-C784 PolarHBondContact O-N 3.45Å
781	Q	92.8	Very high	85.6	Confident	94 Å²	94	69.9 Å²	69.9	44%	0.439	36%	0.357	S	S	.	.	H	α-helix	trans	-65.8	-44.5	179.1	-174.2	58.2	66.1	0	0	110.6	W778 E779 C784 D785	W778-Q781 PolarHBondContact O-N 3.26Å; E779-Q781 VanDerWaalsContact C-N 3.32Å; E779-Q781 PolarHBondContact O-N 3.06Å; Q781-C784 PolarHBondContact O-N 3.41Å; Q781-D785 PolarHBondContact NE2-OD2 3.39Å; Q781-D785 WeakPolarHBondContact O-CB 3.44Å; Q781-D785 PolarHBondContact O-N 3.03Å
782	V	92.4	Very high	87.3	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-59.8	-48.2	176.7	170.4	0	0	0	0	110.8	W778 E779 C784 D785 I786 Y830 L833 L838 L841	W778-V782 HydrophobicContact CB-CG2 4.23Å; W778-V782 VanDerWaalsContact O-CG2 3.24Å; W778-V782 WeakPolarHBondContact O-CG2 3.31Å; W778-V782 PolarHBondContact O-N 2.88Å; E779-V782 PolarHBondContact O-N 3.21Å; V782-C784 PolarHBondContact O-N 3.46Å; V782-D785 PolarHBondContact O-N 3.04Å; V782-I786 HydrophobicContact CG1-CD1 3.66Å; V782-I786 HydrophobicContact CG1-CG1 4.33Å; V782-I786 VanDerWaalsContact O-CG1 3.28Å; V782-I786 WeakPolarHBondContact O-CG1 3.22Å; V782-I786 PolarHBondContact O-N 3.11Å; V782-Y830 WeakPolarHBondContact CA-OH 3.34Å; V782-Y830 HydrophobicContact CB-CE2 4.34Å; V782-Y830 HydrophobicContact CG1-CE2 4.5Å; V782-Y830 HydrophobicContact CG2-CD1 4Å; V782-Y830 HydrophobicContact CG2-CD2 4.09Å; V782-Y830 HydrophobicContact CG2-CE1 3.64Å; V782-Y830 HydrophobicContact CG2-CE2 3.76Å; V782-Y830 HydrophobicContact CG2-CG 4.21Å; V782-Y830 VanDerWaalsContact CG2-CZ 3.5Å; V782-L833 HydrophobicContact CG2-CD1 3.71Å; V782-L838 HydrophobicContact CB-CD2 4.49Å; V782-L838 HydrophobicContact CG1-CD2 3.54Å; V782-L838 HydrophobicContact CG2-CD2 4.06Å; V782-L841 HydrophobicContact CB-CD1 4.02Å; V782-L841 HydrophobicContact CG1-CB 4.38Å; V782-L841 HydrophobicContact CG1-CD1 3.62Å
783	R	94.1	Very high	88.4	Confident	33 Å²	33	70.3 Å²	70.3	13%	0.125	35%	0.345	C	S	.	.	H	α-helix	trans	-59.6	-45.8	178.5	-71.1	178.5	-176.8	-83.7	2.3	111.7	E779 D780 D785 I786 R787 L841 E844 E845	E779-R783 WeakPolarHBondContact O-CG 3.38Å; E779-R783 PolarHBondContact O-N 2.67Å; E779-R783 IonicContact OE1-CZ 3.98Å; E779-R783 IonicContact OE1-NE 2.8Å; E779-R783 PolarHBondContact OE1-NE 3.48Å; E779-R783 IonicContact OE1-NH2 3.34Å; E779-R783 PolarHBondContact OE1-NH2 3Å; D780-R783 PolarHBondContact O-N 3.01Å; R783-D785 VanDerWaalsContact C-N 3.34Å; R783-D785 PolarHBondContact O-N 3.33Å; R783-I786 PolarHBondContact O-N 2.88Å; R783-R787 WeakPolarHBondContact O-CG 3.4Å; R783-R787 PolarHBondContact O-N 3.23Å; R783-L841 HydrophobicContact CG-CD2 4.35Å; R783-L841 VanDerWaalsContact CZ-CD2 3.49Å; R783-L841 VanDerWaalsContact NH2-CD2 3.27Å; R783-E844 IonicContact CZ-OE2 3.59Å; R783-E844 IonicContact NH1-OE2 2.65Å; R783-E844 PolarHBondContact NH1-OE2 3.39Å; R783-E844 IonicContact NH2-OE2 3.17Å; R783-E844 PolarHBondContact NH2-OE2 2.88Å; R783-E845 HydrophobicContact CB-CG 4.46Å; R783-E845 WeakPolarHBondContact CD-OE1 3.31Å; R783-E845 HydrophobicContact CG-CG 4.34Å; R783-E845 WeakPolarHBondContact CG-OE1 3.32Å; R783-E845 IonicContact CZ-OE1 3.78Å; R783-E845 IonicContact NH1-OE1 2.91Å; R783-E845 PolarHBondContact NH1-OE1 3.22Å
784	C	93.6	Very high	89.1	Confident	69 Å²	69	73.8 Å²	73.8	47%	0.466	36%	0.364	S	S	.	.	H	α-helix	trans	-58.1	-46.6	176.5	-174.1	0	0	0	0	111.7	D780 Q781 V782 I786 R787 Q788	D780-C784 WeakPolarHBondContact O-CB 3.49Å; D780-C784 PolarHBondContact O-N 3.45Å; Q781-C784 PolarHBondContact O-N 3.41Å; V782-C784 PolarHBondContact O-N 3.46Å; C784-I786 PolarHBondContact O-N 2.92Å; C784-R787 PolarHBondContact O-N 2.95Å; C784-Q788 WeakPolarHBondContact O-CB 3.19Å; C784-Q788 PolarHBondContact O-N 3.32Å
785	D	94.9	Very high	89.7	Confident	6 Å²	6	74.9 Å²	74.9	3%	0.032	38%	0.376	C	S	.	.	H	α-helix	trans	-66.5	-35.2	178.4	-77.1	-63.1	0	0	0	113.1	Q781 V782 R783 Q788 F789 F807 K829 Y830	Q781-D785 PolarHBondContact NE2-OD2 3.39Å; Q781-D785 WeakPolarHBondContact O-CB 3.44Å; Q781-D785 PolarHBondContact O-N 3.03Å; V782-D785 PolarHBondContact O-N 3.04Å; R783-D785 VanDerWaalsContact C-N 3.34Å; R783-D785 PolarHBondContact O-N 3.33Å; D785-Q788 PolarHBondContact O-N 2.78Å; D785-F789 VanDerWaalsContact O-CB 3.22Å; D785-F789 WeakPolarHBondContact O-CB 3.49Å; D785-F789 PolarHBondContact O-N 3.45Å; D785-F807 HydrophobicContact CB-CE1 3.93Å; D785-F807 HydrophobicContact CB-CZ 4.02Å; D785-K829 IonicContact OD1-NZ 3.7Å; D785-K829 PolarHBondContact OD1-NZ 3.15Å; D785-K829 VanDerWaalsContact OD2-CE 3.27Å; D785-K829 WeakPolarHBondContact OD2-CE 3.5Å; D785-K829 IonicContact OD2-NZ 3.51Å; D785-K829 PolarHBondContact OD2-NZ 3.4Å; D785-Y830 HydrophobicContact CB-CE2 4.46Å; D785-Y830 PolarHBondContact OD2-OH 3.28Å
786	I	94.1	Very high	90.2	Very high	2 Å²	2	76.1 Å²	76.1	1%	0.01	38%	0.381	C	S	.	.	H	α-helix	trans	-63.2	-48.4	173.6	-70.2	165.8	0	0	0	110.1	V782 R783 C784 Q788 F789 L790 V803 F807 L841 A842 E845	V782-I786 HydrophobicContact CG1-CD1 3.66Å; V782-I786 HydrophobicContact CG1-CG1 4.33Å; V782-I786 VanDerWaalsContact O-CG1 3.28Å; V782-I786 WeakPolarHBondContact O-CG1 3.22Å; V782-I786 PolarHBondContact O-N 3.11Å; R783-I786 PolarHBondContact O-N 2.88Å; C784-I786 PolarHBondContact O-N 2.92Å; I786-Q788 VanDerWaalsContact C-N 3.32Å; I786-Q788 PolarHBondContact O-N 3.36Å; I786-F789 WeakPolarHBondContact O-CB 3.45Å; I786-F789 PolarHBondContact O-N 2.81Å; I786-L790 HydrophobicContact CG2-CD1 3.96Å; I786-L790 HydrophobicContact CG2-CG 4.42Å; I786-L790 VanDerWaalsContact O-CG 3.32Å; I786-L790 WeakPolarHBondContact O-CG 3.45Å; I786-L790 PolarHBondContact O-N 2.97Å; I786-V803 HydrophobicContact CG1-CG1 4.04Å; I786-V803 HydrophobicContact CG2-CG1 4.26Å; I786-F807 HydrophobicContact CG1-CE2 3.84Å; I786-F807 HydrophobicContact CG1-CZ 4.2Å; I786-L841 HydrophobicContact CD1-CB 4.22Å; I786-A842 HydrophobicContact CD1-CB 4.17Å; I786-E845 HydrophobicContact CB-CG 4.44Å; I786-E845 HydrophobicContact CG2-CB 3.75Å; I786-E845 HydrophobicContact CG2-CG 4.08Å
787	R	93.7	Very high	90.5	Very high	121 Å²	121	77.9 Å²	77.9	46%	0.457	39%	0.386	S	S	.	.	H	α-helix	trans	-60.1	-42.5	176.6	-68.4	176.5	-170.6	148.8	12.3	111.9	R783 C784 L790 S791 E845	R783-R787 WeakPolarHBondContact O-CG 3.4Å; R783-R787 PolarHBondContact O-N 3.23Å; C784-R787 PolarHBondContact O-N 2.95Å; R787-L790 PolarHBondContact O-N 2.74Å; R787-S791 WeakPolarHBondContact O-CB 3.41Å; R787-S791 PolarHBondContact O-N 3.04Å; R787-S791 PolarHBondContact O-OG 3.27Å; R787-E845 WeakPolarHBondContact CG-OE2 3.43Å; R787-E845 IonicContact CZ-OE1 3.81Å; R787-E845 IonicContact CZ-OE2 2.81Å; R787-E845 VanDerWaalsContact CZ-OE2 3.27Å; R787-E845 IonicContact NE-OE1 3.35Å; R787-E845 IonicContact NE-OE2 3.06Å; R787-E845 PolarHBondContact NE-OE2 3.07Å; R787-E845 IonicContact NH2-OE1 3.54Å; R787-E845 PolarHBondContact NH2-OE1 3.48Å; R787-E845 IonicContact NH2-OE2 3.87Å; R787-E845 PolarHBondContact NH2-OE2 3.26Å
788	Q	94.2	Very high	90.7	Very high	84 Å²	84	73.4 Å²	73.4	39%	0.393	36%	0.361	S	S	.	.	H	α-helix	trans	-64.7	-41.3	175.9	-170.1	-177.8	12.7	0	0	111.6	C784 D785 I786 S791 L792 F826	C784-Q788 WeakPolarHBondContact O-CB 3.19Å; C784-Q788 PolarHBondContact O-N 3.32Å; D785-Q788 PolarHBondContact O-N 2.78Å; I786-Q788 VanDerWaalsContact C-N 3.32Å; I786-Q788 PolarHBondContact O-N 3.36Å; Q788-S791 PolarHBondContact O-OG 3.38Å; Q788-S791 VanDerWaalsContact O-OG 3.08Å; Q788-L792 HydrophobicContact CG-CD1 4.33Å; Q788-L792 VanDerWaalsContact O-CG 3.26Å; Q788-L792 WeakPolarHBondContact O-CG 3.35Å; Q788-L792 PolarHBondContact O-N 3.1Å; Q788-F826 HydrophobicContact CB-CE1 4.43Å; Q788-F826 HydrophobicContact CB-CZ 4.49Å; Q788-F826 HydrophobicContact CG-CZ 4.17Å
789	F	93.9	Very high	90.7	Very high	1 Å²	1	70.4 Å²	70.4	0%	0.004	36%	0.355	C	S	.	.	H	α-helix	trans	-61.4	-45.3	177.9	173.8	-98.2	0	0	0	111.8	D785 I786 R793 F798 V803 I806 F807 Y820 F826	D785-F789 VanDerWaalsContact O-CB 3.22Å; D785-F789 WeakPolarHBondContact O-CB 3.49Å; D785-F789 PolarHBondContact O-N 3.45Å; I786-F789 WeakPolarHBondContact O-CB 3.45Å; I786-F789 PolarHBondContact O-N 2.81Å; F789-R793 PolarHBondContact O-NH1 3.36Å; F789-F798 AromaticContact CE1-CD1 3.99Å; F789-F798 HydrophobicContact CE1-CD1 3.99Å; F789-F798 HydrophobicContact CE1-CD2 4.18Å; F789-F798 AromaticContact CE1-CE1 3.71Å; F789-F798 HydrophobicContact CE1-CE1 3.71Å; F789-F798 AromaticContact CE1-CE2 3.9Å; F789-F798 HydrophobicContact CE1-CE2 3.9Å; F789-F798 HydrophobicContact CE1-CG 4.21Å; F789-F798 AromaticContact CE1-CZ 3.63Å; F789-F798 HydrophobicContact CE1-CZ 3.63Å; F789-F798 HydrophobicContact CZ-CD1 4.34Å; F789-F798 AromaticContact CZ-CE1 3.66Å; F789-F798 HydrophobicContact CZ-CE1 3.66Å; F789-F798 HydrophobicContact CZ-CE2 4.31Å; F789-F798 AromaticContact CZ-CZ 3.62Å; F789-F798 HydrophobicContact CZ-CZ 3.62Å; F789-V803 HydrophobicContact CE1-CG2 4.42Å; F789-I806 HydrophobicContact CE2-CG2 3.83Å; F789-I806 HydrophobicContact CZ-CB 4.43Å; F789-I806 HydrophobicContact CZ-CG1 4.07Å; F789-I806 HydrophobicContact CZ-CG2 4.15Å; F789-F807 HydrophobicContact CB-CE2 4.33Å; F789-F807 HydrophobicContact CB-CZ 4.17Å; F789-F807 HydrophobicContact CG-CE2 4.41Å; F789-Y820 HydrophobicContact CZ-CD1 4.5Å; F789-Y820 HydrophobicContact CZ-CE1 4.39Å; F789-F826 HydrophobicContact CB-CD1 3.97Å; F789-F826 HydrophobicContact CB-CE1 3.91Å; F789-F826 HydrophobicContact CB-CG 4.33Å; F789-F826 HydrophobicContact CB-CZ 4.21Å; F789-F826 HydrophobicContact CD2-CB 4.08Å; F789-F826 HydrophobicContact CD2-CD1 4.24Å; F789-F826 AromaticContact CD2-CD2 3.7Å; F789-F826 HydrophobicContact CD2-CD2 3.7Å; F789-F826 HydrophobicContact CD2-CE2 4.17Å; F789-F826 AromaticContact CD2-CG 3.73Å; F789-F826 HydrophobicContact CD2-CG 3.73Å; F789-F826 HydrophobicContact CE2-CD2 4.47Å; F789-F826 HydrophobicContact CG-CG 4.47Å
790	L	92.3	Very high	90.8	Very high	22 Å²	22	68.9 Å²	68.9	12%	0.115	35%	0.351	C	S	.	.	H	α-helix	trans	-68.5	-42.4	179.4	-66.2	173.9	0	0	0	111.9	I786 R787 L792 R793 F798 V803 L846 V849	I786-L790 HydrophobicContact CG2-CD1 3.96Å; I786-L790 HydrophobicContact CG2-CG 4.42Å; I786-L790 VanDerWaalsContact O-CG 3.32Å; I786-L790 WeakPolarHBondContact O-CG 3.45Å; I786-L790 PolarHBondContact O-N 2.97Å; R787-L790 PolarHBondContact O-N 2.74Å; L790-L792 VanDerWaalsContact C-N 3.26Å; L790-L792 PolarHBondContact O-N 2.97Å; L790-R793 CarbonylContact O-C 3.3Å; L790-R793 VanDerWaalsContact O-C 3.3Å; L790-R793 PolarHBondContact O-N 3.14Å; L790-F798 HydrophobicContact CD2-CB 4.34Å; L790-F798 HydrophobicContact CD2-CD2 3.76Å; L790-F798 HydrophobicContact CD2-CE2 4.48Å; L790-F798 HydrophobicContact CD2-CG 4.33Å; L790-V803 HydrophobicContact CD2-CG2 4.31Å; L790-L846 HydrophobicContact CD1-CD2 3.78Å; L790-L846 HydrophobicContact CD1-CG 4.39Å; L790-L846 HydrophobicContact CD2-CD2 3.94Å; L790-V849 HydrophobicContact CD1-CG2 4.45Å
791	S	91.5	Very high	90.7	Very high	87 Å²	87	63 Å²	63	61%	0.608	32%	0.318	S	S	*	.	H	α-helix	trans	-66.4	-27.3	-179.7	66.1	0	0	0	0	113.6	R787 Q788 R793	R787-S791 WeakPolarHBondContact O-CB 3.41Å; R787-S791 PolarHBondContact O-N 3.04Å; R787-S791 PolarHBondContact O-OG 3.27Å; Q788-S791 PolarHBondContact O-OG 3.38Å; Q788-S791 VanDerWaalsContact O-OG 3.08Å; S791-R793 PolarHBondContact O-N 2.61Å
792	L	92	Very high	90.5	Very high	83 Å²	83	58.5 Å²	58.5	44%	0.435	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-12.6	173.3	-71	171.4	0	0	0	113.4	Q788 L790 F826	Q788-L792 HydrophobicContact CG-CD1 4.33Å; Q788-L792 VanDerWaalsContact O-CG 3.26Å; Q788-L792 WeakPolarHBondContact O-CG 3.35Å; Q788-L792 PolarHBondContact O-N 3.1Å; L790-L792 VanDerWaalsContact C-N 3.26Å; L790-L792 PolarHBondContact O-N 2.97Å; L792-F826 HydrophobicContact CD1-CE2 3.76Å; L792-F826 HydrophobicContact CD1-CZ 3.78Å
793	R	89.9	Confident	90.5	Very high	41 Å²	41	58.6 Å²	58.6	16%	0.155	30%	0.298	C	S	.	.			trans	-139.1	60.9	-173.4	-63	179.7	-175.7	74.8	2.4	112	F789 L790 S791 E795 E796 F798 D823	F789-R793 PolarHBondContact O-NH1 3.36Å; L790-R793 CarbonylContact O-C 3.3Å; L790-R793 VanDerWaalsContact O-C 3.3Å; L790-R793 PolarHBondContact O-N 3.14Å; S791-R793 PolarHBondContact O-N 2.61Å; R793-E795 VanDerWaalsContact C-N 3.28Å; R793-E795 PolarHBondContact O-N 3.23Å; R793-E796 HydrophobicContact CB-CB 4.32Å; R793-E796 HydrophobicContact CB-CG 4.48Å; R793-E796 WeakPolarHBondContact CD-OE2 3.4Å; R793-E796 PolarHBondContact O-N 3Å; R793-F798 HydrophobicContact CB-CE2 3.92Å; R793-F798 HydrophobicContact CB-CZ 4.26Å; R793-D823 IonicContact NH2-OD2 2.82Å; R793-D823 PolarHBondContact NH2-OD2 3.12Å
794	P	86.1	Confident	90.4	Very high	113 Å²	113	57 Å²	57	73%	0.734	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-23.8	-174.2	28.7	-35.8	0	0	0	114
795	E	85.6	Confident	90.3	Very high	191 Å²	191	54.4 Å²	54.4	89%	0.893	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-13.7	-179.3	-59.6	-169.2	-175	0	0	113.2	R793	R793-E795 VanDerWaalsContact C-N 3.28Å; R793-E795 PolarHBondContact O-N 3.23Å
796	E	86.3	Confident	90.2	Very high	80 Å²	80	54.2 Å²	54.2	37%	0.374	27%	0.272	S	S	.	.	S	Bend	trans	-95.9	133.3	-177.6	-65.2	177.8	-156.6	0	0	110.6	R793 F798 Y820	R793-E796 HydrophobicContact CB-CB 4.32Å; R793-E796 HydrophobicContact CB-CG 4.48Å; R793-E796 WeakPolarHBondContact CD-OE2 3.4Å; R793-E796 PolarHBondContact O-N 3Å; E796-F798 HydrophobicContact CB-CD2 4.33Å; E796-F798 HydrophobicContact CB-CE2 3.58Å; E796-F798 HydrophobicContact CB-CZ 3.83Å; E796-F798 WeakPolarHBondContact OE2-CZ 3.32Å; E796-Y820 VanDerWaalsContact CD-OH 3.24Å; E796-Y820 PolarHBondContact OE1-OH 3.31Å; E796-Y820 PolarHBondContact OE2-OH 3.22Å
797	K	83.4	Confident	90.1	Very high	193 Å²	193	54.2 Å²	54.2	84%	0.839	27%	0.272	S	S	*	.			trans	-91.7	125.2	174.3	-64.4	-175.5	-179.8	-178.1	0	108.9	Y815	K797-Y815 PolarHBondContact O-OH 3.31Å
798	F	87.4	Confident	90	Very high	24 Å²	24	49 Å²	49	11%	0.105	25%	0.252	C	S	.	.			trans	-114	140	177	-64.8	-82.9	0	0	0	111.6	F789 L790 R793 E796 A802 V803 Y815 Y820	F789-F798 AromaticContact CE1-CD1 3.99Å; F789-F798 HydrophobicContact CE1-CD1 3.99Å; F789-F798 HydrophobicContact CE1-CD2 4.18Å; F789-F798 AromaticContact CE1-CE1 3.71Å; F789-F798 HydrophobicContact CE1-CE1 3.71Å; F789-F798 AromaticContact CE1-CE2 3.9Å; F789-F798 HydrophobicContact CE1-CE2 3.9Å; F789-F798 HydrophobicContact CE1-CG 4.21Å; F789-F798 AromaticContact CE1-CZ 3.63Å; F789-F798 HydrophobicContact CE1-CZ 3.63Å; F789-F798 HydrophobicContact CZ-CD1 4.34Å; F789-F798 AromaticContact CZ-CE1 3.66Å; F789-F798 HydrophobicContact CZ-CE1 3.66Å; F789-F798 HydrophobicContact CZ-CE2 4.31Å; F789-F798 AromaticContact CZ-CZ 3.62Å; F789-F798 HydrophobicContact CZ-CZ 3.62Å; L790-F798 HydrophobicContact CD2-CB 4.34Å; L790-F798 HydrophobicContact CD2-CD2 3.76Å; L790-F798 HydrophobicContact CD2-CE2 4.48Å; L790-F798 HydrophobicContact CD2-CG 4.33Å; R793-F798 HydrophobicContact CB-CE2 3.92Å; R793-F798 HydrophobicContact CB-CZ 4.26Å; E796-F798 HydrophobicContact CB-CD2 4.33Å; E796-F798 HydrophobicContact CB-CE2 3.58Å; E796-F798 HydrophobicContact CB-CZ 3.83Å; E796-F798 WeakPolarHBondContact OE2-CZ 3.32Å; F798-A802 HydrophobicContact CD1-CB 4.34Å; F798-V803 HydrophobicContact CB-CG2 3.81Å; F798-V803 HydrophobicContact CG-CG2 4.34Å; F798-Y815 HydrophobicContact CD1-CD1 4.37Å; F798-Y815 AromaticContact CD1-CE1 3.76Å; F798-Y815 HydrophobicContact CD1-CE1 3.76Å; F798-Y815 HydrophobicContact CD1-CE2 4.45Å; F798-Y815 AromaticContact CD1-CZ 3.83Å; F798-Y815 AromaticContact CE1-CD1 3.83Å; F798-Y815 HydrophobicContact CE1-CD1 3.83Å; F798-Y815 AromaticContact CE1-CE1 3.5Å; F798-Y815 HydrophobicContact CE1-CE1 3.5Å; F798-Y815 HydrophobicContact CZ-CE1 4.38Å; F798-Y820 HydrophobicContact CE1-CE1 4.23Å; F798-Y820 HydrophobicContact CZ-CE1 4.3Å
799	S	87.8	Confident	89.7	Confident	34 Å²	34	45.2 Å²	45.2	24%	0.238	24%	0.236	C	C	.	.			trans	-81	158.8	160.4	73.6	0	0	0	0	110	D481 R801 A802 V803	D481-S799 PolarHBondContact OD2-OG 3.46Å; S799-R801 PolarHBondContact O-N 3.02Å; S799-A802 WeakPolarHBondContact O-CB 3.37Å; S799-A802 PolarHBondContact O-N 2.94Å; S799-A802 WeakPolarHBondContact OG-CB 3.46Å; S799-A802 PolarHBondContact OG-N 3.31Å; S799-V803 PolarHBondContact O-N 3.42Å
800	S	89.5	Confident	89.6	Confident	30 Å²	30	45.5 Å²	45.5	21%	0.21	24%	0.238	C	C	.	.	H	α-helix	trans	-59.4	-36.7	175.1	52.6	0	0	0	0	112	V803 A804 T843	S800-V803 PolarHBondContact O-N 3.21Å; S800-A804 PolarHBondContact O-N 3.47Å; S800-T843 WeakPolarHBondContact CB-OG1 3.22Å; S800-T843 PolarHBondContact OG-OG1 3.34Å
801	R	88.6	Confident	89.4	Confident	14 Å²	14	46.1 Å²	46.1	5%	0.053	25%	0.249	C	C	.	.	H	α-helix	trans	-66.7	-39	171.8	-161.4	-179.8	-169.5	95.1	9.5	112.7	H476 S479 D481 E706 S799 V803 A804 R805 F835 V839	H476-R801 PolarHBondContact O-NE 3.04Å; H476-R801 PolarHBondContact O-NH2 3.34Å; S479-R801 PolarHBondContact OG-NE 3.07Å; S479-R801 PolarHBondContact OG-NH2 3.08Å; D481-R801 WeakPolarHBondContact OD1-CB 3.22Å; D481-R801 WeakPolarHBondContact OD1-CD 3.47Å; D481-R801 WeakPolarHBondContact OD1-CG 3.47Å; E706-R801 IonicContact OE1-NH2 3.96Å; E706-R801 PolarHBondContact OE1-NH2 3.43Å; E706-R801 VanDerWaalsContact OE1-NH2 3.13Å; S799-R801 PolarHBondContact O-N 3.02Å; R801-V803 VanDerWaalsContact C-N 3.32Å; R801-V803 PolarHBondContact O-N 2.96Å; R801-A804 PolarHBondContact O-N 3.07Å; R801-R805 HydrophobicContact CG-CG 4.43Å; R801-R805 WeakPolarHBondContact O-CB 3.41Å; R801-R805 VanDerWaalsContact O-CG 3.29Å; R801-R805 WeakPolarHBondContact O-CG 3.41Å; R801-R805 PolarHBondContact O-N 3.33Å; R801-F835 HydrophobicContact CG-CE1 3.86Å; R801-F835 HydrophobicContact CG-CZ 3.61Å; R801-V839 HydrophobicContact CG-CG2 4.43Å
802	A	89.3	Confident	89.2	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-60.1	-43.5	175.6	0	0	0	0	0	111.5	F798 S799 R805 I806 Y815	F798-A802 HydrophobicContact CD1-CB 4.34Å; S799-A802 WeakPolarHBondContact O-CB 3.37Å; S799-A802 PolarHBondContact O-N 2.94Å; S799-A802 WeakPolarHBondContact OG-CB 3.46Å; S799-A802 PolarHBondContact OG-N 3.31Å; A802-R805 WeakPolarHBondContact O-CB 3.36Å; A802-R805 PolarHBondContact O-N 2.98Å; A802-I806 WeakPolarHBondContact O-CG1 3.38Å; A802-I806 PolarHBondContact O-N 2.98Å; A802-Y815 HydrophobicContact CB-CD2 3.94Å; A802-Y815 HydrophobicContact CB-CE2 3.48Å; A802-Y815 VanDerWaalsContact CB-CE2 3.48Å
803	V	92.1	Very high	89	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-59.3	-52.7	173.6	178.3	0	0	0	0	110.3	I786 F789 L790 F798 S799 S800 R801 R805 I806 F807 A842 L846	I786-V803 HydrophobicContact CG1-CG1 4.04Å; I786-V803 HydrophobicContact CG2-CG1 4.26Å; F789-V803 HydrophobicContact CE1-CG2 4.42Å; L790-V803 HydrophobicContact CD2-CG2 4.31Å; F798-V803 HydrophobicContact CB-CG2 3.81Å; F798-V803 HydrophobicContact CG-CG2 4.34Å; S799-V803 PolarHBondContact O-N 3.42Å; S800-V803 PolarHBondContact O-N 3.21Å; R801-V803 VanDerWaalsContact C-N 3.32Å; R801-V803 PolarHBondContact O-N 2.96Å; V803-R805 VanDerWaalsContact C-N 3.28Å; V803-R805 PolarHBondContact O-N 3.25Å; V803-I806 WeakPolarHBondContact O-CB 3.45Å; V803-I806 PolarHBondContact O-N 3.14Å; V803-I806 VanDerWaalsContact O-N 3.1Å; V803-F807 HydrophobicContact CG1-CD2 3.73Å; V803-F807 HydrophobicContact CG1-CE2 3.65Å; V803-F807 VanDerWaalsContact O-CD2 3.29Å; V803-F807 WeakPolarHBondContact O-CD2 3.44Å; V803-F807 PolarHBondContact O-N 3.16Å; V803-F807 VanDerWaalsContact O-N 3.09Å; V803-A842 HydrophobicContact CB-CB 3.93Å; V803-A842 HydrophobicContact CG1-CB 3.94Å; V803-L846 HydrophobicContact CG2-CD1 4.48Å
804	A	91.9	Very high	88.9	Confident	1 Å²	1	42 Å²	42	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-58.3	-38.4	178.3	0	0	0	0	0	112.8	S800 R801 F807 H808 F835 L838 V839	S800-A804 PolarHBondContact O-N 3.47Å; R801-A804 PolarHBondContact O-N 3.07Å; A804-F807 PolarHBondContact O-N 3.46Å; A804-H808 PolarHBondContact O-N 3.29Å; A804-F835 HydrophobicContact CB-CD2 4.32Å; A804-F835 HydrophobicContact CB-CE1 4.44Å; A804-F835 HydrophobicContact CB-CE2 3.78Å; A804-F835 HydrophobicContact CB-CZ 3.85Å; A804-L838 HydrophobicContact CB-CB 4.02Å; A804-V839 HydrophobicContact CB-CG2 3.54Å
805	R	91.4	Very high	89	Confident	13 Å²	13	38 Å²	38	5%	0.049	20%	0.202	C	C	.	.	H	α-helix	trans	-57.9	-49.6	173.8	-80.5	176.4	168.8	168.4	-3.4	110.8	A477 S479 D557 R801 A802 V803 F807 H808 G809 I810 F835	A477-R805 PolarHBondContact O-NH2 3.47Å; A477-R805 VanDerWaalsContact O-NH2 3.08Å; S479-R805 PolarHBondContact O-NH2 3.33Å; D557-R805 IonicContact OD2-NH1 2.99Å; R801-R805 HydrophobicContact CG-CG 4.43Å; R801-R805 WeakPolarHBondContact O-CB 3.41Å; R801-R805 VanDerWaalsContact O-CG 3.29Å; R801-R805 WeakPolarHBondContact O-CG 3.41Å; R801-R805 PolarHBondContact O-N 3.33Å; A802-R805 WeakPolarHBondContact O-CB 3.36Å; A802-R805 PolarHBondContact O-N 2.98Å; V803-R805 VanDerWaalsContact C-N 3.28Å; V803-R805 PolarHBondContact O-N 3.25Å; R805-F807 PolarHBondContact O-N 3.11Å; R805-H808 CarbonylContact O-C 3.51Å; R805-H808 PolarHBondContact O-N 3.25Å; R805-G809 PolarHBondContact O-N 2.86Å; R805-I810 CarbonylContact C-O 3.58Å; R805-I810 HydrophobicContact CB-CB 3.9Å; R805-I810 HydrophobicContact CB-CG2 4.16Å; R805-I810 HydrophobicContact CG-CB 3.98Å; R805-I810 HydrophobicContact CG-CD1 4.44Å; R805-I810 HydrophobicContact CG-CG2 3.81Å; R805-I810 PolarHBondContact O-N 3.15Å; R805-F835 HydrophobicContact CG-CE2 4.26Å; R805-F835 HydrophobicContact CG-CZ 4.16Å
806	I	92.8	Very high	89.2	Confident	3 Å²	3	31 Å²	31	2%	0.015	17%	0.173	C	C	.	.	H	α-helix	trans	-57.9	-47.9	176.8	-64.9	-52.6	0	0	0	111.4	F789 A802 V803 H808 G809 Y820 F826 W827	F789-I806 HydrophobicContact CE2-CG2 3.83Å; F789-I806 HydrophobicContact CZ-CB 4.43Å; F789-I806 HydrophobicContact CZ-CG1 4.07Å; F789-I806 HydrophobicContact CZ-CG2 4.15Å; A802-I806 WeakPolarHBondContact O-CG1 3.38Å; A802-I806 PolarHBondContact O-N 2.98Å; V803-I806 WeakPolarHBondContact O-CB 3.45Å; V803-I806 PolarHBondContact O-N 3.14Å; V803-I806 VanDerWaalsContact O-N 3.1Å; I806-H808 VanDerWaalsContact C-N 3.3Å; I806-H808 PolarHBondContact O-N 3.46Å; I806-G809 WeakPolarHBondContact O-CA 3.44Å; I806-G809 PolarHBondContact O-N 2.89Å; I806-Y820 HydrophobicContact CD1-CD1 3.7Å; I806-Y820 HydrophobicContact CD1-CD2 4.49Å; I806-Y820 HydrophobicContact CD1-CG 3.69Å; I806-Y820 HydrophobicContact CG1-CD1 4.27Å; I806-F826 HydrophobicContact CG2-CB 4.19Å; I806-W827 HydrophobicContact CD1-CE3 4.15Å; I806-W827 HydrophobicContact CD1-CZ3 3.74Å; I806-W827 HydrophobicContact CG2-CE3 4.31Å; I806-W827 WeakPolarHBondContact O-CA 3.46Å
807	F	93	Very high	89.3	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.009	17%	0.172	C	C	.	.	H	α-helix	trans	-66	-29.8	-179	-79.7	-78.6	0	0	0	113.7	D785 I786 F789 V803 A804 R805 G809 F826 R828 K829 Y830 L838	D785-F807 HydrophobicContact CB-CE1 3.93Å; D785-F807 HydrophobicContact CB-CZ 4.02Å; I786-F807 HydrophobicContact CG1-CE2 3.84Å; I786-F807 HydrophobicContact CG1-CZ 4.2Å; F789-F807 HydrophobicContact CB-CE2 4.33Å; F789-F807 HydrophobicContact CB-CZ 4.17Å; F789-F807 HydrophobicContact CG-CE2 4.41Å; V803-F807 HydrophobicContact CG1-CD2 3.73Å; V803-F807 HydrophobicContact CG1-CE2 3.65Å; V803-F807 VanDerWaalsContact O-CD2 3.29Å; V803-F807 WeakPolarHBondContact O-CD2 3.44Å; V803-F807 PolarHBondContact O-N 3.16Å; V803-F807 VanDerWaalsContact O-N 3.09Å; A804-F807 PolarHBondContact O-N 3.46Å; R805-F807 PolarHBondContact O-N 3.11Å; F807-G809 VanDerWaalsContact C-N 3.34Å; F807-F826 WeakPolarHBondContact CA-O 3.46Å; F807-F826 HydrophobicContact CD1-CB 4.44Å; F807-F826 HydrophobicContact CE1-CB 4.05Å; F807-F826 AromaticContact CE1-CD1 3.8Å; F807-F826 HydrophobicContact CE1-CD1 3.8Å; F807-F826 HydrophobicContact CE1-CG 4.42Å; F807-F826 HydrophobicContact CZ-CB 4.29Å; F807-F826 AromaticContact CZ-CD1 3.75Å; F807-F826 HydrophobicContact CZ-CD1 3.75Å; F807-F826 HydrophobicContact CZ-CG 4.41Å; F807-R828 CarbonylContact O-C 3.18Å; F807-R828 VanDerWaalsContact O-CA 3.23Å; F807-R828 WeakPolarHBondContact O-CA 3.26Å; F807-R828 PolarHBondContact O-N 3.43Å; F807-K829 HydrophobicContact CD1-CB 4.31Å; F807-K829 PolarHBondContact O-N 2.9Å; F807-K829 VanDerWaalsContact O-N 3.1Å; F807-Y830 HydrophobicContact CB-CD2 4.09Å; F807-Y830 AromaticContact CD1-CD2 3.33Å; F807-Y830 HydrophobicContact CD1-CD2 3.33Å; F807-Y830 AromaticContact CD1-CE2 3.5Å; F807-Y830 HydrophobicContact CD1-CE2 3.5Å; F807-Y830 VanDerWaalsContact CD1-CE2 3.5Å; F807-Y830 AromaticContact CE1-CD2 4Å; F807-Y830 HydrophobicContact CE1-CD2 4Å; F807-Y830 AromaticContact CE1-CE2 3.65Å; F807-Y830 HydrophobicContact CE1-CE2 3.65Å; F807-Y830 AromaticContact CG-CD2 3.96Å; F807-Y830 HydrophobicContact CG-CD2 3.96Å; F807-Y830 HydrophobicContact CG-CE2 4.42Å; F807-Y830 PolarHBondContact O-N 3.36Å; F807-L838 HydrophobicContact CB-CD1 4.36Å
808	H	90.4	Very high	89.5	Confident	10 Å²	10	27 Å²	27	5%	0.046	17%	0.165	C	C	.	.	H	α-helix	trans	-82.2	-8.5	168.2	-87.8	-102.6	0	0	0	113.8	R473 A804 R805 I806 I810 L831 L833 F835 L838	R473-H808 WeakPolarHBondContact CD-O 3.38Å; R473-H808 HydrophobicContact CG-CB 4.47Å; R473-H808 PolarHBondContact NH1-O 3.45Å; R473-H808 VanDerWaalsContact NH1-O 3.07Å; A804-H808 PolarHBondContact O-N 3.29Å; R805-H808 CarbonylContact O-C 3.51Å; R805-H808 PolarHBondContact O-N 3.25Å; I806-H808 VanDerWaalsContact C-N 3.3Å; I806-H808 PolarHBondContact O-N 3.46Å; H808-I810 HydrophobicContact CB-CD1 3.96Å; H808-I810 HydrophobicContact CB-CG1 4.08Å; H808-L831 WeakPolarHBondContact O-CD2 3.49Å; H808-L833 PolarHBondContact CE1-O 3.37Å; H808-F835 HydrophobicContact CB-CD2 4.32Å; H808-F835 AromaticContact CD2-CD2 3.62Å; H808-F835 AromaticContact CG-CD2 3.82Å; H808-F835 WeakPolarHBondContact NE2-CA 3.5Å; H808-F835 AromaticContact NE2-CD2 3.96Å; H808-L838 WeakPolarHBondContact CD2-CD1 3.46Å; H808-L838 VanDerWaalsContact NE2-CD1 3.27Å; H808-L838 WeakPolarHBondContact NE2-CD1 3.34Å
809	G	89.6	Confident	89.6	Confident	5 Å²	5	30 Å²	30	5%	0.052	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	42	-173.5	0	0	0	0	0	114	R473 R805 I806 F807 W827	R473-G809 PolarHBondContact NH1-O 2.98Å; R805-G809 PolarHBondContact O-N 2.86Å; I806-G809 WeakPolarHBondContact O-CA 3.44Å; I806-G809 PolarHBondContact O-N 2.89Å; F807-G809 VanDerWaalsContact C-N 3.34Å; G809-W827 VanDerWaalsContact C-CH2 3.45Å; G809-W827 VanDerWaalsContact CA-CD2 3.48Å; G809-W827 VanDerWaalsContact CA-CZ2 3.43Å; G809-W827 WeakPolarHBondContact O-CZ2 3.48Å
810	I	89.8	Confident	89.7	Confident	8 Å²	8	29.4 Å²	29.4	4%	0.041	18%	0.178	C	C	.	.			trans	-95.8	126.4	168	-63.1	168.5	0	0	0	107.1	R473 H476 A477 R805 H808 F835	R473-I810 HydrophobicContact CG-CD1 3.68Å; R473-I810 HydrophobicContact CG-CG1 3.48Å; R473-I810 VanDerWaalsContact CG-CG1 3.48Å; R473-I810 WeakPolarHBondContact O-CD1 3.44Å; H476-I810 HydrophobicContact CB-CD1 4.19Å; A477-I810 HydrophobicContact CB-CB 4.47Å; A477-I810 HydrophobicContact CB-CD1 4.35Å; A477-I810 HydrophobicContact CB-CG1 4.34Å; A477-I810 HydrophobicContact CB-CG2 3.37Å; R805-I810 CarbonylContact C-O 3.58Å; R805-I810 HydrophobicContact CB-CB 3.9Å; R805-I810 HydrophobicContact CB-CG2 4.16Å; R805-I810 HydrophobicContact CG-CB 3.98Å; R805-I810 HydrophobicContact CG-CD1 4.44Å; R805-I810 HydrophobicContact CG-CG2 3.81Å; R805-I810 PolarHBondContact O-N 3.15Å; H808-I810 HydrophobicContact CB-CD1 3.96Å; H808-I810 HydrophobicContact CB-CG1 4.08Å; I810-F835 HydrophobicContact CD1-CD2 4.26Å; I810-F835 HydrophobicContact CD1-CE2 3.91Å
811	G	88.3	Confident	89.7	Confident	34 Å²	34	28.5 Å²	28.5	35%	0.351	17%	0.173	S	C	.	.			trans	-89.1	160.4	173.7	0	0	0	0	0	111.7	Y815	G811-Y815 WeakPolarHBondContact CA-O 3.26Å
812	S	88.6	Confident	89.7	Confident	14 Å²	14	35.1 Å²	35.1	10%	0.098	21%	0.205	C	C	.	.			trans	-138	169.7	171.7	72.2	0	0	0	0	110.6	D557 C814 Y815	D557-S812 WeakPolarHBondContact OD1-CB 3.42Å; D557-S812 PolarHBondContact OD1-OG 3.32Å; D557-S812 VanDerWaalsContact OD2-CB 3.24Å; D557-S812 WeakPolarHBondContact OD2-CB 3.43Å; D557-S812 PolarHBondContact OD2-OG 2.98Å; S812-C814 VanDerWaalsContact C-N 3.26Å; S812-C814 PolarHBondContact O-N 3.16Å; S812-Y815 PolarHBondContact N-O 3.47Å; S812-Y815 CarbonylContact O-C 3.56Å; S812-Y815 PolarHBondContact O-N 3.28Å; S812-Y815 VanDerWaalsContact O-N 3.16Å; S812-Y815 WeakPolarHBondContact OG-CD2 3.4Å; S812-Y815 PolarHBondContact OG-N 3.06Å
813	P	87.2	Confident	89.7	Confident	58 Å²	58	36.4 Å²	36.4	38%	0.377	21%	0.211	S	C	.	.	S	Bend	trans	-50.9	-40.8	176.5	-30.2	36.4	0	0	0	114.6	V553 D557	V553-P813 HydrophobicContact CG1-CB 3.97Å; V553-P813 HydrophobicContact CG1-CG 3.98Å; D557-P813 VanDerWaalsContact OD1-CD 3.22Å; D557-P813 WeakPolarHBondContact OD1-CD 3.4Å
814	C	87	Confident	89.5	Confident	54 Å²	54	45.2 Å²	45.2	37%	0.365	24%	0.244	S	C	.	.	S	Bend	trans	-80.8	-32.3	177.1	-68.5	0	0	0	0	112.8	Q554 D557 S812 P816	Q554-C814 PolarHBondContact O-SG 3Å; D557-C814 HydrophobicContact CB-CB 4.22Å; D557-C814 VanDerWaalsContact OD1-CB 3.29Å; D557-C814 WeakPolarHBondContact OD1-CB 3.43Å; D557-C814 PolarHBondContact OD1-N 2.98Å; S812-C814 VanDerWaalsContact C-N 3.26Å; S812-C814 PolarHBondContact O-N 3.16Å; C814-P816 WeakPolarHBondContact O-CD 3.49Å
815	Y	89.3	Confident	89.5	Confident	29 Å²	29	51.4 Å²	51.4	11%	0.114	27%	0.267	C	S	.	.	S	Bend	trans	-119.3	71.9	-176.9	-42.3	-67.8	0	0	0	111.3	K797 F798 A802 G811 S812 Y820	K797-Y815 PolarHBondContact O-OH 3.31Å; F798-Y815 HydrophobicContact CD1-CD1 4.37Å; F798-Y815 AromaticContact CD1-CE1 3.76Å; F798-Y815 HydrophobicContact CD1-CE1 3.76Å; F798-Y815 HydrophobicContact CD1-CE2 4.45Å; F798-Y815 AromaticContact CD1-CZ 3.83Å; F798-Y815 AromaticContact CE1-CD1 3.83Å; F798-Y815 HydrophobicContact CE1-CD1 3.83Å; F798-Y815 AromaticContact CE1-CE1 3.5Å; F798-Y815 HydrophobicContact CE1-CE1 3.5Å; F798-Y815 HydrophobicContact CZ-CE1 4.38Å; A802-Y815 HydrophobicContact CB-CD2 3.94Å; A802-Y815 HydrophobicContact CB-CE2 3.48Å; A802-Y815 VanDerWaalsContact CB-CE2 3.48Å; G811-Y815 WeakPolarHBondContact CA-O 3.26Å; S812-Y815 PolarHBondContact N-O 3.47Å; S812-Y815 CarbonylContact O-C 3.56Å; S812-Y815 PolarHBondContact O-N 3.28Å; S812-Y815 VanDerWaalsContact O-N 3.16Å; S812-Y815 WeakPolarHBondContact OG-CD2 3.4Å; S812-Y815 PolarHBondContact OG-N 3.06Å; Y815-Y820 HydrophobicContact CD1-CE1 4.27Å; Y815-Y820 AromaticContact CD1-CE2 3.91Å; Y815-Y820 HydrophobicContact CD1-CE2 3.91Å; Y815-Y820 AromaticContact CD1-CZ 3.64Å; Y815-Y820 WeakPolarHBondContact CD1-OH 3.43Å; Y815-Y820 HydrophobicContact CG-CE2 4.35Å
816	P	89.2	Confident	89.6	Confident	42 Å²	42	50.8 Å²	50.8	27%	0.273	27%	0.265	S	S	.	.			trans	-68.3	138.4	-173.2	25.5	-34	0	0	0	111.8	C814 Q818 V819 Y820	C814-P816 WeakPolarHBondContact O-CD 3.49Å; P816-Q818 PolarHBondContact O-N 3.31Å; P816-Q818 VanDerWaalsContact O-N 3.1Å; P816-V819 HydrophobicContact CG-CB 4.19Å; P816-V819 HydrophobicContact CG-CG2 3.87Å; P816-V819 PolarHBondContact O-N 3.44Å; P816-Y820 PolarHBondContact O-N 3.4Å
817	A	88.1	Confident	89.5	Confident	43 Å²	43	51.9 Å²	51.9	36%	0.355	27%	0.269	S	S	.	.	H	α-helix	trans	-58.4	-26.1	179.9	0	0	0	0	0	113.3	V819 G821 W827	A817-V819 PolarHBondContact O-N 3Å; A817-G821 WeakPolarHBondContact O-CA 3.46Å; A817-G821 PolarHBondContact O-N 3.08Å; A817-W827 HydrophobicContact CB-CH2 3.59Å; A817-W827 HydrophobicContact CB-CZ2 3.55Å
818	Q	88.2	Confident	89.4	Confident	147 Å²	147	55.6 Å²	55.6	69%	0.687	28%	0.283	S	S	*	.	H	α-helix	trans	-66.5	-26	176.2	-61.1	85.1	-4.7	0	0	113	P816 Q822	P816-Q818 PolarHBondContact O-N 3.31Å; P816-Q818 VanDerWaalsContact O-N 3.1Å; Q818-Q822 WeakPolarHBondContact O-CG 3.48Å; Q818-Q822 PolarHBondContact O-NE2 3.44Å
819	V	89.8	Confident	89.5	Confident	88 Å²	88	58.7 Å²	58.7	53%	0.533	30%	0.296	S	S	.	.	H	α-helix	trans	-96.8	-59.8	179.8	179.3	0	0	0	0	109.4	P816 A817 G821 Q822	P816-V819 HydrophobicContact CG-CB 4.19Å; P816-V819 HydrophobicContact CG-CG2 3.87Å; P816-V819 PolarHBondContact O-N 3.44Å; A817-V819 PolarHBondContact O-N 3Å; V819-G821 VanDerWaalsContact C-N 3.34Å; V819-G821 PolarHBondContact O-N 3.19Å; V819-Q822 WeakPolarHBondContact O-CB 3.34Å; V819-Q822 PolarHBondContact O-N 2.97Å
820	Y	90.6	Very high	89.5	Confident	20 Å²	20	58.4 Å²	58.4	8%	0.078	29%	0.294	C	S	.	.	H	α-helix	trans	-73.2	-26.2	-175.1	-70.3	-99.4	0	0	0	113	F789 E796 F798 I806 Y815 P816 Q822 D823	F789-Y820 HydrophobicContact CZ-CD1 4.5Å; F789-Y820 HydrophobicContact CZ-CE1 4.39Å; E796-Y820 VanDerWaalsContact CD-OH 3.24Å; E796-Y820 PolarHBondContact OE1-OH 3.31Å; E796-Y820 PolarHBondContact OE2-OH 3.22Å; F798-Y820 HydrophobicContact CE1-CE1 4.23Å; F798-Y820 HydrophobicContact CZ-CE1 4.3Å; I806-Y820 HydrophobicContact CD1-CD1 3.7Å; I806-Y820 HydrophobicContact CD1-CD2 4.49Å; I806-Y820 HydrophobicContact CD1-CG 3.69Å; I806-Y820 HydrophobicContact CG1-CD1 4.27Å; Y815-Y820 HydrophobicContact CD1-CE1 4.27Å; Y815-Y820 AromaticContact CD1-CE2 3.91Å; Y815-Y820 HydrophobicContact CD1-CE2 3.91Å; Y815-Y820 AromaticContact CD1-CZ 3.64Å; Y815-Y820 WeakPolarHBondContact CD1-OH 3.43Å; Y815-Y820 HydrophobicContact CG-CE2 4.35Å; P816-Y820 PolarHBondContact O-N 3.4Å; Y820-Q822 PolarHBondContact O-N 3.2Å; Y820-Q822 VanDerWaalsContact O-N 3.16Å; Y820-D823 PolarHBondContact O-N 3.46Å; Y820-D823 VanDerWaalsContact O-N 3.11Å
821	G	87.7	Confident	89.3	Confident	11 Å²	11	59.4 Å²	59.4	11%	0.113	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-9.1	175.9	0	0	0	0	0	115.1	A817 V819 R824 W827	A817-G821 WeakPolarHBondContact O-CA 3.46Å; A817-G821 PolarHBondContact O-N 3.08Å; V819-G821 VanDerWaalsContact C-N 3.34Å; V819-G821 PolarHBondContact O-N 3.19Å; G821-R824 PolarHBondContact O-NE 2.96Å; G821-W827 VanDerWaalsContact CA-CD2 3.48Å
822	Q	89.2	Confident	89	Confident	154 Å²	154	59.9 Å²	59.9	72%	0.72	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-30.6	171.8	-58.3	-176.9	20.3	0	0	111.6	Q818 V819 Y820 R824	Q818-Q822 WeakPolarHBondContact O-CG 3.48Å; Q818-Q822 PolarHBondContact O-NE2 3.44Å; V819-Q822 WeakPolarHBondContact O-CB 3.34Å; V819-Q822 PolarHBondContact O-N 2.97Å; Y820-Q822 PolarHBondContact O-N 3.2Å; Y820-Q822 VanDerWaalsContact O-N 3.16Å; Q822-R824 PolarHBondContact O-N 3.37Å
823	D	89.9	Confident	88.9	Confident	27 Å²	27	59.3 Å²	59.3	14%	0.144	29%	0.288	C	S	.	.			trans	-85.2	80.8	179.2	-162.3	-9.9	0	0	0	110.9	R793 Y820 R825 F826 W827	R793-D823 IonicContact NH2-OD2 2.82Å; R793-D823 PolarHBondContact NH2-OD2 3.12Å; Y820-D823 PolarHBondContact O-N 3.46Å; Y820-D823 VanDerWaalsContact O-N 3.11Å; D823-R825 PolarHBondContact O-N 3.04Å; D823-R825 WeakPolarHBondContact OD1-CB 3.39Å; D823-R825 IonicContact OD1-CZ 2.67Å; D823-R825 PolarHBondContact OD1-N 3.02Å; D823-R825 IonicContact OD1-NE 3.89Å; D823-R825 PolarHBondContact OD1-NE 2.91Å; D823-R825 IonicContact OD1-NH2 3.3Å; D823-R825 PolarHBondContact OD1-NH2 3.47Å; D823-R825 IonicContact OD2-CZ 2.84Å; D823-R825 IonicContact OD2-NE 3.04Å; D823-R825 IonicContact OD2-NH2 3.27Å; D823-R825 PolarHBondContact OD2-NH2 3.01Å; D823-F826 PolarHBondContact O-N 3.22Å; D823-F826 WeakPolarHBondContact OD2-CD2 3.4Å; D823-F826 WeakPolarHBondContact OD2-CE2 3.37Å; D823-W827 WeakPolarHBondContact O-CB 3.05Å; D823-W827 PolarHBondContact O-N 3.27Å
824	R	88.2	Confident	88.8	Confident	187 Å²	187	58.2 Å²	58.2	71%	0.706	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-10	-178.8	-61.9	-63	-178.2	137.5	2.9	114.3	G821 Q822 F826	G821-R824 PolarHBondContact O-NE 2.96Å; Q822-R824 PolarHBondContact O-N 3.37Å; R824-F826 VanDerWaalsContact C-N 3.27Å
825	R	90.9	Very high	88.8	Confident	130 Å²	130	55.8 Å²	55.8	49%	0.491	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-28.6	174.9	-63.3	175.5	-66	174.3	3.7	112.3	D823 K829	D823-R825 PolarHBondContact O-N 3.04Å; D823-R825 WeakPolarHBondContact OD1-CB 3.39Å; D823-R825 IonicContact OD1-CZ 2.67Å; D823-R825 PolarHBondContact OD1-N 3.02Å; D823-R825 IonicContact OD1-NE 3.89Å; D823-R825 PolarHBondContact OD1-NE 2.91Å; D823-R825 IonicContact OD1-NH2 3.3Å; D823-R825 PolarHBondContact OD1-NH2 3.47Å; D823-R825 IonicContact OD2-CZ 2.84Å; D823-R825 IonicContact OD2-NE 3.04Å; D823-R825 IonicContact OD2-NH2 3.27Å; D823-R825 PolarHBondContact OD2-NH2 3.01Å; R825-K829 WeakPolarHBondContact O-CD 3.09Å
826	F	93.1	Very high	88.6	Confident	1 Å²	1	58.9 Å²	58.9	0%	0.004	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-37.3	-178.5	-50.5	-68.4	0	0	0	111.3	Q788 F789 L792 I806 F807 D823 R824 R828 K829	Q788-F826 HydrophobicContact CB-CE1 4.43Å; Q788-F826 HydrophobicContact CB-CZ 4.49Å; Q788-F826 HydrophobicContact CG-CZ 4.17Å; F789-F826 HydrophobicContact CB-CD1 3.97Å; F789-F826 HydrophobicContact CB-CE1 3.91Å; F789-F826 HydrophobicContact CB-CG 4.33Å; F789-F826 HydrophobicContact CB-CZ 4.21Å; F789-F826 HydrophobicContact CD2-CB 4.08Å; F789-F826 HydrophobicContact CD2-CD1 4.24Å; F789-F826 AromaticContact CD2-CD2 3.7Å; F789-F826 HydrophobicContact CD2-CD2 3.7Å; F789-F826 HydrophobicContact CD2-CE2 4.17Å; F789-F826 AromaticContact CD2-CG 3.73Å; F789-F826 HydrophobicContact CD2-CG 3.73Å; F789-F826 HydrophobicContact CE2-CD2 4.47Å; F789-F826 HydrophobicContact CG-CG 4.47Å; L792-F826 HydrophobicContact CD1-CE2 3.76Å; L792-F826 HydrophobicContact CD1-CZ 3.78Å; I806-F826 HydrophobicContact CG2-CB 4.19Å; F807-F826 WeakPolarHBondContact CA-O 3.46Å; F807-F826 HydrophobicContact CD1-CB 4.44Å; F807-F826 HydrophobicContact CE1-CB 4.05Å; F807-F826 AromaticContact CE1-CD1 3.8Å; F807-F826 HydrophobicContact CE1-CD1 3.8Å; F807-F826 HydrophobicContact CE1-CG 4.42Å; F807-F826 HydrophobicContact CZ-CB 4.29Å; F807-F826 AromaticContact CZ-CD1 3.75Å; F807-F826 HydrophobicContact CZ-CD1 3.75Å; F807-F826 HydrophobicContact CZ-CG 4.41Å; D823-F826 PolarHBondContact O-N 3.22Å; D823-F826 WeakPolarHBondContact OD2-CD2 3.4Å; D823-F826 WeakPolarHBondContact OD2-CE2 3.37Å; R824-F826 VanDerWaalsContact C-N 3.27Å; F826-R828 PolarHBondContact O-N 2.96Å; F826-K829 WeakPolarHBondContact O-CB 3.4Å; F826-K829 PolarHBondContact O-N 3.18Å
827	W	92.3	Very high	88.5	Confident	25 Å²	25	58 Å²	58	10%	0.095	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	122.5	-175.1	-171	-98.3	0	0	0	113.5	I806 G809 A817 G821 D823 K829	I806-W827 HydrophobicContact CD1-CE3 4.15Å; I806-W827 HydrophobicContact CD1-CZ3 3.74Å; I806-W827 HydrophobicContact CG2-CE3 4.31Å; I806-W827 WeakPolarHBondContact O-CA 3.46Å; G809-W827 VanDerWaalsContact C-CH2 3.45Å; G809-W827 VanDerWaalsContact CA-CD2 3.48Å; G809-W827 VanDerWaalsContact CA-CZ2 3.43Å; G809-W827 WeakPolarHBondContact O-CZ2 3.48Å; A817-W827 HydrophobicContact CB-CH2 3.59Å; A817-W827 HydrophobicContact CB-CZ2 3.55Å; G821-W827 VanDerWaalsContact CA-CD2 3.48Å; D823-W827 WeakPolarHBondContact O-CB 3.05Å; D823-W827 PolarHBondContact O-N 3.27Å; W827-K829 PolarHBondContact O-N 3.34Å
828	R	90.9	Very high	88.6	Confident	80 Å²	80	56 Å²	56	30%	0.302	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	22.7	-176.7	-59.1	179.8	94.6	169	10.1	114.3	E470 F807 F826 L831	E470-R828 IonicContact OE1-NH2 3.12Å; E470-R828 IonicContact OE2-NH2 2.77Å; E470-R828 PolarHBondContact OE2-NH2 3.15Å; F807-R828 CarbonylContact O-C 3.18Å; F807-R828 VanDerWaalsContact O-CA 3.23Å; F807-R828 WeakPolarHBondContact O-CA 3.26Å; F807-R828 PolarHBondContact O-N 3.43Å; F826-R828 PolarHBondContact O-N 2.96Å; R828-L831 HydrophobicContact CB-CD1 4.02Å; R828-L831 HydrophobicContact CB-CD2 4.24Å; R828-L831 HydrophobicContact CB-CG 4.05Å; R828-L831 HydrophobicContact CG-CD1 4.49Å; R828-L831 HydrophobicContact CG-CD2 4.34Å
829	K	91.4	Very high	88.7	Confident	75 Å²	75	50.3 Å²	50.3	33%	0.326	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-37.5	-179.5	-179.3	165.4	178.7	174.7	0	113	D785 F807 R825 F826 W827	D785-K829 IonicContact OD1-NZ 3.7Å; D785-K829 PolarHBondContact OD1-NZ 3.15Å; D785-K829 VanDerWaalsContact OD2-CE 3.27Å; D785-K829 WeakPolarHBondContact OD2-CE 3.5Å; D785-K829 IonicContact OD2-NZ 3.51Å; D785-K829 PolarHBondContact OD2-NZ 3.4Å; F807-K829 HydrophobicContact CD1-CB 4.31Å; F807-K829 PolarHBondContact O-N 2.9Å; F807-K829 VanDerWaalsContact O-N 3.1Å; R825-K829 WeakPolarHBondContact O-CD 3.09Å; F826-K829 WeakPolarHBondContact O-CB 3.4Å; F826-K829 PolarHBondContact O-N 3.18Å; W827-K829 PolarHBondContact O-N 3.34Å
830	Y	90.1	Very high	88.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	39.5	-171.2	-62.8	-60.8	0	0	0	114	W778 V782 D785 F807 H832 L833 L838	W778-Y830 HydrophobicContact CE3-CD1 4.41Å; W778-Y830 AromaticContact CE3-CE1 3.83Å; W778-Y830 HydrophobicContact CE3-CE1 3.83Å; W778-Y830 HydrophobicContact CZ3-CE1 4.27Å; V782-Y830 WeakPolarHBondContact CA-OH 3.34Å; V782-Y830 HydrophobicContact CB-CE2 4.34Å; V782-Y830 HydrophobicContact CG1-CE2 4.5Å; V782-Y830 HydrophobicContact CG2-CD1 4Å; V782-Y830 HydrophobicContact CG2-CD2 4.09Å; V782-Y830 HydrophobicContact CG2-CE1 3.64Å; V782-Y830 HydrophobicContact CG2-CE2 3.76Å; V782-Y830 HydrophobicContact CG2-CG 4.21Å; V782-Y830 VanDerWaalsContact CG2-CZ 3.5Å; D785-Y830 HydrophobicContact CB-CE2 4.46Å; D785-Y830 PolarHBondContact OD2-OH 3.28Å; F807-Y830 HydrophobicContact CB-CD2 4.09Å; F807-Y830 AromaticContact CD1-CD2 3.33Å; F807-Y830 HydrophobicContact CD1-CD2 3.33Å; F807-Y830 AromaticContact CD1-CE2 3.5Å; F807-Y830 HydrophobicContact CD1-CE2 3.5Å; F807-Y830 VanDerWaalsContact CD1-CE2 3.5Å; F807-Y830 AromaticContact CE1-CD2 4Å; F807-Y830 HydrophobicContact CE1-CD2 4Å; F807-Y830 AromaticContact CE1-CE2 3.65Å; F807-Y830 HydrophobicContact CE1-CE2 3.65Å; F807-Y830 AromaticContact CG-CD2 3.96Å; F807-Y830 HydrophobicContact CG-CD2 3.96Å; F807-Y830 HydrophobicContact CG-CE2 4.42Å; F807-Y830 PolarHBondContact O-N 3.36Å; Y830-H832 PolarHBondContact O-N 3.11Å; Y830-H832 VanDerWaalsContact O-N 3.13Å; Y830-L833 HydrophobicContact CD1-CD1 3.69Å; Y830-L833 HydrophobicContact CD1-CG 4.42Å; Y830-L833 HydrophobicContact CE1-CD1 4.42Å; Y830-L833 HydrophobicContact CG-CD1 4Å; Y830-L833 PolarHBondContact O-N 3.3Å; Y830-L833 VanDerWaalsContact O-N 3.11Å; Y830-L838 HydrophobicContact CD2-CD2 4.29Å; Y830-L838 HydrophobicContact CG-CD2 4.42Å
831	L	85.3	Confident	88.7	Confident	29 Å²	29	46.9 Å²	46.9	15%	0.152	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-30.2	179.3	-67.5	177.2	0	0	0	113.6	R469 H808 R828 L833	R469-L831 VanDerWaalsContact CD-O 3.25Å; R469-L831 WeakPolarHBondContact CD-O 3.5Å; H808-L831 WeakPolarHBondContact O-CD2 3.49Å; R828-L831 HydrophobicContact CB-CD1 4.02Å; R828-L831 HydrophobicContact CB-CD2 4.24Å; R828-L831 HydrophobicContact CB-CG 4.05Å; R828-L831 HydrophobicContact CG-CD1 4.49Å; R828-L831 HydrophobicContact CG-CD2 4.34Å; L831-L833 VanDerWaalsContact C-N 3.31Å
832	H	82.7	Confident	88.9	Confident	44 Å²	44	46.4 Å²	46.4	20%	0.204	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-6.3	-177	59.9	-87.4	0	0	0	113.7	Q772 A773 W778 Y830	Q772-H832 WeakPolarHBondContact CA-O 3.47Å; A773-H832 PolarHBondContact N-O 3.44Å; W778-H832 AromaticContact CD2-NE2 3.71Å; W778-H832 AromaticContact CE2-NE2 3.41Å; W778-H832 AromaticContact CZ2-NE2 3.68Å; W778-H832 AromaticContact NE1-NE2 3.72Å; Y830-H832 PolarHBondContact O-N 3.11Å; Y830-H832 VanDerWaalsContact O-N 3.13Å
833	L	86.2	Confident	89	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.01	20%	0.198	C	C	.	.	S	Bend	trans	-95.6	159.9	175.5	-61.5	-178.3	0	0	0	110.6	A773 L775 W778 V782 H808 Y830 L831 L838	A773-L833 HydrophobicContact CB-CD2 4.16Å; L775-L833 HydrophobicContact CD1-CD1 4.38Å; W778-L833 HydrophobicContact CB-CD1 3.82Å; W778-L833 HydrophobicContact CB-CD2 4.22Å; W778-L833 HydrophobicContact CG-CD1 4.24Å; W778-L833 HydrophobicContact CG-CD2 4.09Å; V782-L833 HydrophobicContact CG2-CD1 3.71Å; H808-L833 PolarHBondContact CE1-O 3.37Å; Y830-L833 HydrophobicContact CD1-CD1 3.69Å; Y830-L833 HydrophobicContact CD1-CG 4.42Å; Y830-L833 HydrophobicContact CE1-CD1 4.42Å; Y830-L833 HydrophobicContact CG-CD1 4Å; Y830-L833 PolarHBondContact O-N 3.3Å; Y830-L833 VanDerWaalsContact O-N 3.11Å; L831-L833 VanDerWaalsContact C-N 3.31Å; L833-L838 HydrophobicContact CB-CD1 4.47Å; L833-L838 HydrophobicContact CB-CG 4.41Å; L833-L838 HydrophobicContact CD1-CD2 4.15Å
834	S	85.1	Confident	89.1	Confident	34 Å²	34	44.5 Å²	44.5	24%	0.238	21%	0.211	C	C	.	.			trans	-66.5	132.5	173.2	168.5	0	0	0	0	110.5	H836 A837 L838	S834-H836 VanDerWaalsContact C-N 3.31Å; S834-H836 PolarHBondContact O-N 2.89Å; S834-H836 PolarHBondContact OG-N 3.12Å; S834-A837 WeakPolarHBondContact O-CB 3.48Å; S834-A837 PolarHBondContact O-N 3.48Å; S834-A837 PolarHBondContact OG-N 2.94Å; S834-L838 PolarHBondContact O-N 2.67Å; S834-L838 VanDerWaalsContact O-N 3.13Å
835	F	87.3	Confident	89.3	Confident	3 Å²	3	35.6 Å²	35.6	1%	0.013	18%	0.177	C	C	.	.	H	α-helix	trans	-59.3	-43.9	176.8	-177	-90.7	0	0	0	111.3	H476 R801 A804 R805 H808 I810 A837 L838 V839	H476-F835 HydrophobicContact CB-CD1 4.04Å; H476-F835 HydrophobicContact CB-CD2 4.12Å; H476-F835 HydrophobicContact CB-CE1 4.28Å; H476-F835 HydrophobicContact CB-CE2 4.34Å; H476-F835 HydrophobicContact CB-CG 3.97Å; H476-F835 HydrophobicContact CB-CZ 4.42Å; H476-F835 AromaticContact CD2-CG 3.93Å; H476-F835 AromaticContact CG-CD1 3.92Å; H476-F835 AromaticContact CG-CG 3.8Å; H476-F835 AromaticContact ND1-CD1 4Å; R801-F835 HydrophobicContact CG-CE1 3.86Å; R801-F835 HydrophobicContact CG-CZ 3.61Å; A804-F835 HydrophobicContact CB-CD2 4.32Å; A804-F835 HydrophobicContact CB-CE1 4.44Å; A804-F835 HydrophobicContact CB-CE2 3.78Å; A804-F835 HydrophobicContact CB-CZ 3.85Å; R805-F835 HydrophobicContact CG-CE2 4.26Å; R805-F835 HydrophobicContact CG-CZ 4.16Å; H808-F835 HydrophobicContact CB-CD2 4.32Å; H808-F835 AromaticContact CD2-CD2 3.62Å; H808-F835 AromaticContact CG-CD2 3.82Å; H808-F835 WeakPolarHBondContact NE2-CA 3.5Å; H808-F835 AromaticContact NE2-CD2 3.96Å; I810-F835 HydrophobicContact CD1-CD2 4.26Å; I810-F835 HydrophobicContact CD1-CE2 3.91Å; F835-A837 VanDerWaalsContact C-N 3.32Å; F835-A837 PolarHBondContact O-N 2.95Å; F835-L838 PolarHBondContact O-N 3.33Å; F835-V839 HydrophobicContact CD1-CG2 3.93Å; F835-V839 HydrophobicContact CE1-CG2 3.49Å; F835-V839 VanDerWaalsContact CE1-CG2 3.49Å; F835-V839 HydrophobicContact CZ-CG2 4.05Å; F835-V839 WeakPolarHBondContact O-CG2 3.38Å; F835-V839 PolarHBondContact O-N 3.22Å
836	H	85.2	Confident	89.3	Confident	95 Å²	95	31.2 Å²	31.2	44%	0.44	16%	0.163	S	C	.	.	H	α-helix	trans	-65.9	-34.7	178.8	-66.5	-68.4	0	0	0	112.6	H476 E706 S834 V839 G840	H476-H836 AromaticContact CE1-NE2 3.75Å; E706-H836 IonicContact OE1-CE1 3.87Å; S834-H836 VanDerWaalsContact C-N 3.31Å; S834-H836 PolarHBondContact O-N 2.89Å; S834-H836 PolarHBondContact OG-N 3.12Å; H836-V839 PolarHBondContact O-N 3.43Å; H836-G840 PolarHBondContact O-N 2.9Å
837	A	87.4	Confident	89	Confident	23 Å²	23	36.1 Å²	36.1	19%	0.19	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-43	174.2	0	0	0	0	0	111.7	L775 S834 F835 G840 L841	L775-A837 HydrophobicContact CD1-CB 3.74Å; L775-A837 HydrophobicContact CD2-CB 3.71Å; L775-A837 HydrophobicContact CG-CB 4.21Å; S834-A837 WeakPolarHBondContact O-CB 3.48Å; S834-A837 PolarHBondContact O-N 3.48Å; S834-A837 PolarHBondContact OG-N 2.94Å; F835-A837 VanDerWaalsContact C-N 3.32Å; F835-A837 PolarHBondContact O-N 2.95Å; A837-G840 PolarHBondContact O-N 3.15Å; A837-L841 PolarHBondContact O-N 3.19Å
838	L	90.2	Very high	88.7	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-65.3	-37.4	174.7	-69.5	176.2	0	0	0	112.6	V782 A804 F807 H808 Y830 L833 S834 F835 G840 A842	V782-L838 HydrophobicContact CB-CD2 4.49Å; V782-L838 HydrophobicContact CG1-CD2 3.54Å; V782-L838 HydrophobicContact CG2-CD2 4.06Å; A804-L838 HydrophobicContact CB-CB 4.02Å; F807-L838 HydrophobicContact CB-CD1 4.36Å; H808-L838 WeakPolarHBondContact CD2-CD1 3.46Å; H808-L838 VanDerWaalsContact NE2-CD1 3.27Å; H808-L838 WeakPolarHBondContact NE2-CD1 3.34Å; Y830-L838 HydrophobicContact CD2-CD2 4.29Å; Y830-L838 HydrophobicContact CG-CD2 4.42Å; L833-L838 HydrophobicContact CB-CD1 4.47Å; L833-L838 HydrophobicContact CB-CG 4.41Å; L833-L838 HydrophobicContact CD1-CD2 4.15Å; S834-L838 PolarHBondContact O-N 2.67Å; S834-L838 VanDerWaalsContact O-N 3.13Å; F835-L838 PolarHBondContact O-N 3.33Å; L838-G840 VanDerWaalsContact C-N 3.32Å; L838-A842 VanDerWaalsContact O-CB 3.23Å; L838-A842 WeakPolarHBondContact O-CB 3.3Å; L838-A842 PolarHBondContact O-N 3.35Å
839	V	89.1	Confident	88	Confident	27 Å²	27	40.1 Å²	40.1	16%	0.164	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-42.1	172.7	174.4	0	0	0	0	110.8	R801 A804 F835 H836 A842 T843	R801-V839 HydrophobicContact CG-CG2 4.43Å; A804-V839 HydrophobicContact CB-CG2 3.54Å; F835-V839 HydrophobicContact CD1-CG2 3.93Å; F835-V839 HydrophobicContact CE1-CG2 3.49Å; F835-V839 VanDerWaalsContact CE1-CG2 3.49Å; F835-V839 HydrophobicContact CZ-CG2 4.05Å; F835-V839 WeakPolarHBondContact O-CG2 3.38Å; F835-V839 PolarHBondContact O-N 3.22Å; H836-V839 PolarHBondContact O-N 3.43Å; V839-A842 PolarHBondContact O-N 3.02Å; V839-T843 WeakPolarHBondContact O-CB 3.22Å; V839-T843 PolarHBondContact O-N 3.48Å; V839-T843 PolarHBondContact O-OG1 3Å
840	G	89.1	Confident	86.7	Confident	30 Å²	30	40.8 Å²	40.8	31%	0.309	24%	0.238	S	C	.	.	H	α-helix	trans	-58	-55.7	175.8	0	0	0	0	0	111.9	H836 A837 L838 A842 T843 E844	H836-G840 PolarHBondContact O-N 2.9Å; A837-G840 PolarHBondContact O-N 3.15Å; L838-G840 VanDerWaalsContact C-N 3.32Å; G840-A842 VanDerWaalsContact C-N 3.35Å; G840-A842 PolarHBondContact O-N 3.4Å; G840-T843 WeakPolarHBondContact O-CB 3.49Å; G840-T843 PolarHBondContact O-N 3.38Å; G840-T843 VanDerWaalsContact O-N 3.07Å; G840-E844 PolarHBondContact O-N 3.09Å; G840-E844 VanDerWaalsContact O-N 3.1Å
841	L	92.1	Very high	84.9	Confident	6 Å²	6	53.5 Å²	53.5	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-59.6	-43.1	178.2	-65.8	178	0	0	0	112.3	L775 E779 V782 R783 I786 A837 T843 E844 E845	L775-L841 HydrophobicContact CD1-CD1 3.88Å; L775-L841 HydrophobicContact CD2-CD1 4.44Å; L775-L841 HydrophobicContact CG-CD1 4.41Å; E779-L841 HydrophobicContact CG-CD1 4.16Å; E779-L841 HydrophobicContact CG-CD2 3.78Å; V782-L841 HydrophobicContact CB-CD1 4.02Å; V782-L841 HydrophobicContact CG1-CB 4.38Å; V782-L841 HydrophobicContact CG1-CD1 3.62Å; R783-L841 HydrophobicContact CG-CD2 4.35Å; R783-L841 VanDerWaalsContact CZ-CD2 3.49Å; R783-L841 VanDerWaalsContact NH2-CD2 3.27Å; I786-L841 HydrophobicContact CD1-CB 4.22Å; A837-L841 PolarHBondContact O-N 3.19Å; L841-T843 VanDerWaalsContact C-N 3.28Å; L841-T843 PolarHBondContact O-N 2.88Å; L841-E844 PolarHBondContact O-N 2.95Å; L841-E845 WeakPolarHBondContact O-CG 3.19Å; L841-E845 PolarHBondContact O-N 3.17Å
842	A	92.1	Very high	84.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64	-33.8	176.5	0	0	0	0	0	112.8	I786 V803 L838 V839 G840 L846	I786-A842 HydrophobicContact CD1-CB 4.17Å; V803-A842 HydrophobicContact CB-CB 3.93Å; V803-A842 HydrophobicContact CG1-CB 3.94Å; L838-A842 VanDerWaalsContact O-CB 3.23Å; L838-A842 WeakPolarHBondContact O-CB 3.3Å; L838-A842 PolarHBondContact O-N 3.35Å; V839-A842 PolarHBondContact O-N 3.02Å; G840-A842 VanDerWaalsContact C-N 3.35Å; G840-A842 PolarHBondContact O-N 3.4Å; A842-L846 WeakPolarHBondContact O-CB 3.31Å; A842-L846 WeakPolarHBondContact O-CD1 3.46Å; A842-L846 VanDerWaalsContact O-CG 3.24Å; A842-L846 WeakPolarHBondContact O-CG 3.1Å; A842-L846 PolarHBondContact O-N 3.24Å
843	T	91.1	Very high	85	Confident	53 Å²	53	55.3 Å²	55.3	33%	0.325	30%	0.297	S	S	.	.	H	α-helix	trans	-65.1	-47	176.2	-58.5	0	0	0	0	110.5	S800 V839 G840 L841 L846 L847	S800-T843 WeakPolarHBondContact CB-OG1 3.22Å; S800-T843 PolarHBondContact OG-OG1 3.34Å; V839-T843 WeakPolarHBondContact O-CB 3.22Å; V839-T843 PolarHBondContact O-N 3.48Å; V839-T843 PolarHBondContact O-OG1 3Å; G840-T843 WeakPolarHBondContact O-CB 3.49Å; G840-T843 PolarHBondContact O-N 3.38Å; G840-T843 VanDerWaalsContact O-N 3.07Å; L841-T843 VanDerWaalsContact C-N 3.28Å; L841-T843 PolarHBondContact O-N 2.88Å; T843-L846 PolarHBondContact O-N 3.48Å; T843-L847 HydrophobicContact CG2-CD1 4.11Å; T843-L847 WeakPolarHBondContact O-CB 3.28Å; T843-L847 VanDerWaalsContact O-CG 3.27Å; T843-L847 WeakPolarHBondContact O-CG 3.44Å; T843-L847 PolarHBondContact O-N 3.29Å
844	E	91.9	Very high	84.9	Confident	88 Å²	88	58.2 Å²	58.2	41%	0.411	31%	0.313	S	S	.	.	H	α-helix	trans	-61.9	-45	178.4	-67.1	175.4	-161.3	0	0	112.2	R783 G840 L841 L847 Q848	R783-E844 IonicContact CZ-OE2 3.59Å; R783-E844 IonicContact NH1-OE2 2.65Å; R783-E844 PolarHBondContact NH1-OE2 3.39Å; R783-E844 IonicContact NH2-OE2 3.17Å; R783-E844 PolarHBondContact NH2-OE2 2.88Å; G840-E844 PolarHBondContact O-N 3.09Å; G840-E844 VanDerWaalsContact O-N 3.1Å; L841-E844 PolarHBondContact O-N 2.95Å; E844-L847 PolarHBondContact O-N 3.33Å; E844-Q848 WeakPolarHBondContact O-CG 3.49Å; E844-Q848 PolarHBondContact O-N 2.96Å
845	E	92.9	Very high	84.9	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.6	-40.1	179.3	-66.4	-57.4	144	0	0	112.2	R783 I786 R787 L841 L847 Q848 V849	R783-E845 HydrophobicContact CB-CG 4.46Å; R783-E845 WeakPolarHBondContact CD-OE1 3.31Å; R783-E845 HydrophobicContact CG-CG 4.34Å; R783-E845 WeakPolarHBondContact CG-OE1 3.32Å; R783-E845 IonicContact CZ-OE1 3.78Å; R783-E845 IonicContact NH1-OE1 2.91Å; R783-E845 PolarHBondContact NH1-OE1 3.22Å; I786-E845 HydrophobicContact CB-CG 4.44Å; I786-E845 HydrophobicContact CG2-CB 3.75Å; I786-E845 HydrophobicContact CG2-CG 4.08Å; R787-E845 WeakPolarHBondContact CG-OE2 3.43Å; R787-E845 IonicContact CZ-OE1 3.81Å; R787-E845 IonicContact CZ-OE2 2.81Å; R787-E845 VanDerWaalsContact CZ-OE2 3.27Å; R787-E845 IonicContact NE-OE1 3.35Å; R787-E845 IonicContact NE-OE2 3.06Å; R787-E845 PolarHBondContact NE-OE2 3.07Å; R787-E845 IonicContact NH2-OE1 3.54Å; R787-E845 PolarHBondContact NH2-OE1 3.48Å; R787-E845 IonicContact NH2-OE2 3.87Å; R787-E845 PolarHBondContact NH2-OE2 3.26Å; L841-E845 WeakPolarHBondContact O-CG 3.19Å; L841-E845 PolarHBondContact O-N 3.17Å; E845-L847 VanDerWaalsContact C-N 3.33Å; E845-L847 PolarHBondContact O-N 3.2Å; E845-Q848 PolarHBondContact O-N 3.41Å; E845-V849 WeakPolarHBondContact O-CG2 3.45Å; E845-V849 PolarHBondContact O-N 3.27Å
846	L	89.1	Confident	84.8	Confident	39 Å²	39	63.2 Å²	63.2	20%	0.204	34%	0.336	C	S	.	.	H	α-helix	trans	-65.2	-37	175.8	-76.5	168.7	0	0	0	112.2	L790 V803 A842 T843 Q848 V849 A850	L790-L846 HydrophobicContact CD1-CD2 3.78Å; L790-L846 HydrophobicContact CD1-CG 4.39Å; L790-L846 HydrophobicContact CD2-CD2 3.94Å; V803-L846 HydrophobicContact CG2-CD1 4.48Å; A842-L846 WeakPolarHBondContact O-CB 3.31Å; A842-L846 WeakPolarHBondContact O-CD1 3.46Å; A842-L846 VanDerWaalsContact O-CG 3.24Å; A842-L846 WeakPolarHBondContact O-CG 3.1Å; A842-L846 PolarHBondContact O-N 3.24Å; T843-L846 PolarHBondContact O-N 3.48Å; L846-Q848 VanDerWaalsContact C-N 3.3Å; L846-V849 PolarHBondContact O-N 3.14Å; L846-A850 WeakPolarHBondContact O-CB 3.47Å; L846-A850 PolarHBondContact O-N 3.31Å
847	L	88.1	Confident	84.7	Confident	104 Å²	104	61.1 Å²	61.1	55%	0.545	33%	0.329	S	S	.	.	H	α-helix	trans	-67.9	-30.3	175	-71.9	172.8	0	0	0	112.4	T843 E844 E845 R851	T843-L847 HydrophobicContact CG2-CD1 4.11Å; T843-L847 WeakPolarHBondContact O-CB 3.28Å; T843-L847 VanDerWaalsContact O-CG 3.27Å; T843-L847 WeakPolarHBondContact O-CG 3.44Å; T843-L847 PolarHBondContact O-N 3.29Å; E844-L847 PolarHBondContact O-N 3.33Å; E845-L847 VanDerWaalsContact C-N 3.33Å; E845-L847 PolarHBondContact O-N 3.2Å; L847-R851 WeakPolarHBondContact O-CG 3.46Å
848	Q	85.9	Confident	84.6	Confident	97 Å²	97	63.8 Å²	63.8	45%	0.453	34%	0.339	S	S	.	.	H	α-helix	trans	-73.8	-36.7	174.5	-72.1	176	23.3	0	0	112.4	E844 E845 L846 A850	E844-Q848 WeakPolarHBondContact O-CG 3.49Å; E844-Q848 PolarHBondContact O-N 2.96Å; E845-Q848 PolarHBondContact O-N 3.41Å; L846-Q848 VanDerWaalsContact C-N 3.3Å; Q848-A850 VanDerWaalsContact C-N 3.35Å
849	V	75.8	Confident	84.1	Confident	92 Å²	92	68.5 Å²	68.5	56%	0.558	37%	0.365	S	S	*	.	H	α-helix	trans	-75	-25.1	177.8	175	0	0	0	0	112.4	L790 E845 L846	L790-V849 HydrophobicContact CD1-CG2 4.45Å; E845-V849 WeakPolarHBondContact O-CG2 3.45Å; E845-V849 PolarHBondContact O-N 3.27Å; L846-V849 PolarHBondContact O-N 3.14Å
850	A	64.3	Low	83.7	Confident	89 Å²	89	72 Å²	72	74%	0.736	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-13	177	0	0	0	0	0	114.1	L846 Q848	L846-A850 WeakPolarHBondContact O-CB 3.47Å; L846-A850 PolarHBondContact O-N 3.31Å; Q848-A850 VanDerWaalsContact C-N 3.35Å
851	R	52.1	Low	83.2	Confident	266 Å²	266	75.8 Å²	75.8	100%	1.004	39%	0.388	S	S	*	.			trans	-90.4	0	171	-72.5	176	-179	-173	1.4	109.5	L847	L847-R851 WeakPolarHBondContact O-CG 3.46Å

Retrieved 851 of 851 residues in 2095.5 ms (Link to these results)

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