A0A087XJT0_POEFO Loading...

Uridine-cytidine kinase

May contribute to UTP accumulation needed for blast transformation and proliferation.

AlphaFold DB , UniProt , Accession A0A087XJT0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 536 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.4	Very low	27.7	Very low	236 Å²	236	134.7 Å²	134.7	100%	1.163	79%	0.786	S	S	*	*				0	91.3	0	-63.7	166.7	-174.6	0	0	105.8
2	S	27.7	Very low	27.5	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	79%	0.785	S	S	*	*				73.3	95.6	84.6	60.6	0	0	0	0	110.9
3	A	26.7	Very low	27.4	Very low	94 Å²	94	138.9 Å²	138.9	78%	0.777	78%	0.78	S	S	*	*			cis	85.2	159.5	34.5	0	0	0	0	0	114.9
4	V	26.9	Very low	27.3	Very low	127 Å²	127	138.4 Å²	138.4	77%	0.77	77%	0.774	S	S	*	*			trans	80	116.8	-172.2	-172.6	0	0	0	0	111.5
5	S	25.8	Very low	27.3	Very low	111 Å²	111	139.6 Å²	139.6	78%	0.776	78%	0.779	S	S	*	*			cis	74.5	149.9	49.2	-51.7	0	0	0	0	112.1
6	V	27.2	Very low	27.1	Very low	121 Å²	121	140.9 Å²	140.9	73%	0.733	78%	0.777	S	S	*	*			cis	-155.1	134.6	44.9	168.7	0	0	0	0	106.6
7	E	27.6	Very low	27.2	Very low	144 Å²	144	143.1 Å²	143.1	67%	0.673	78%	0.78	S	S	*	*				82.4	141.3	64.4	-138.7	-157	155.6	0	0	116.5	R9	E7-R9 IonicContact OE1-CZ 2.72Å; E7-R9 IonicContact OE1-NE 2.61Å; E7-R9 PolarHBondContact OE1-NE 3.29Å; E7-R9 IonicContact OE1-NH2 2.7Å; E7-R9 PolarHBondContact OE1-NH2 3.28Å
8	G	25	Very low	27.1	Very low	67 Å²	67	145.1 Å²	145.1	69%	0.691	78%	0.78	S	S	*	*			trans	137.7	97.6	179	0	0	0	0	0	111.3
9	R	27.4	Very low	27	Very low	199 Å²	199	144.4 Å²	144.4	75%	0.751	78%	0.781	S	S	*	*				66.6	136.1	57.5	-59.2	-170.2	-174	-149	6.8	113.1	E7	E7-R9 IonicContact OE1-CZ 2.72Å; E7-R9 IonicContact OE1-NE 2.61Å; E7-R9 PolarHBondContact OE1-NE 3.29Å; E7-R9 IonicContact OE1-NH2 2.7Å; E7-R9 PolarHBondContact OE1-NH2 3.28Å
10	L	26.6	Very low	26.8	Very low	144 Å²	144	143.4 Å²	143.4	75%	0.754	78%	0.784	S	S	*	*			cis	-136.7	-155.4	-4.2	-138.7	65.9	0	0	0	107
11	T	26.3	Very low	26.7	Very low	130 Å²	130	141.1 Å²	141.1	80%	0.798	78%	0.779	S	S	*	*			cis	-141.3	-154.5	12.8	-38.7	0	0	0	0	109.5
12	K	25.4	Very low	26.1	Very low	179 Å²	179	136.8 Å²	136.8	78%	0.778	77%	0.766	S	S	*	*			trans	-162.8	173.4	-176.3	-153	-173.4	-178.6	-170.7	0	109.7
13	M	26	Very low	26	Very low	145 Å²	145	137.2 Å²	137.2	71%	0.714	77%	0.768	S	S	*	*			trans	75.7	149.3	160.7	-61.9	163.9	100.7	0	0	116
14	D	25.5	Very low	25.9	Very low	131 Å²	131	140.7 Å²	140.7	70%	0.701	77%	0.774	S	S	*	*			cis	-158.4	-177	-11.8	-107.4	-11.5	0	0	0	112.1
15	N	27.4	Very low	25.9	Very low	157 Å²	157	140.5 Å²	140.5	84%	0.84	78%	0.778	S	S	*	*			trans	-60.2	159	177	-61.4	-31.9	0	0	0	115
16	E	24.7	Very low	25.8	Very low	160 Å²	160	139.3 Å²	139.3	75%	0.748	78%	0.783	S	S	*	*				-156.3	146.7	127.9	-132.7	-177.3	-149.1	0	0	113	K18	E16-K18 IonicContact OE2-NZ 3.25Å; E16-K18 PolarHBondContact OE2-NZ 3.4Å
17	E	28	Very low	25.7	Very low	179 Å²	179	137.2 Å²	137.2	84%	0.836	79%	0.787	S	S	*	*			trans	-89	161.6	168.1	-62.2	177.2	110.7	0	0	110.7
18	K	25.4	Very low	25.6	Very low	179 Å²	179	138.4 Å²	138.4	78%	0.778	80%	0.796	S	S	*	*			trans	-154.5	120.2	157.4	-114.8	132.6	-166.9	159.1	0	114.2	E16	E16-K18 IonicContact OE2-NZ 3.25Å; E16-K18 PolarHBondContact OE2-NZ 3.4Å
19	T	24.9	Very low	25.7	Very low	131 Å²	131	144.5 Å²	144.5	80%	0.804	81%	0.806	S	S	*	*			trans	-104.8	136.2	173.4	52.4	0	0	0	0	111.4
20	C	23.4	Very low	25.7	Very low	124 Å²	124	138.7 Å²	138.7	84%	0.838	81%	0.808	S	S	*	*			trans	-154.9	158.3	163.1	-88.6	0	0	0	0	110
21	S	24.3	Very low	25.8	Very low	97 Å²	97	137.6 Å²	137.6	68%	0.678	81%	0.813	S	S	*	*				-175.7	126.8	-52.9	44.9	0	0	0	0	110.4
22	V	26.1	Very low	25.9	Very low	145 Å²	145	139.3 Å²	139.3	88%	0.879	82%	0.816	S	S	*	*			trans	53.6	121.9	146.7	-178	0	0	0	0	120.1
23	S	25.3	Very low	26	Very low	117 Å²	117	138.9 Å²	138.9	82%	0.818	82%	0.822	S	S	*	*				-160.4	151.9	126.1	61.3	0	0	0	0	112.5
24	N	24.6	Very low	26.3	Very low	167 Å²	167	143 Å²	143	89%	0.893	83%	0.83	S	S	*	*			trans	-104.1	145	-179.1	-98.1	-8.9	0	0	0	111.3
25	S	26.6	Very low	26.6	Very low	124 Å²	124	144.7 Å²	144.7	87%	0.867	84%	0.838	S	S	*	*			trans	-152	146.6	143.5	58.1	0	0	0	0	109.2
26	G	24.4	Very low	26.6	Very low	85 Å²	85	145.3 Å²	145.3	88%	0.876	84%	0.84	S	S	*	*			trans	-127.6	166.5	-176	0	0	0	0	0	112.5
27	G	23.9	Very low	26.9	Very low	78 Å²	78	143.6 Å²	143.6	80%	0.804	84%	0.843	S	S	*	*			trans	-177.6	133	177.1	0	0	0	0	0	110.6
28	I	26.7	Very low	26.8	Very low	169 Å²	169	140.6 Å²	140.6	87%	0.867	84%	0.842	S	S	*	*			trans	-88.8	135.5	179.6	-58.8	163.1	0	0	0	108.6
29	E	27.2	Very low	26.9	Very low	194 Å²	194	138.9 Å²	138.9	91%	0.907	85%	0.846	S	S	*	*			trans	167.4	166.2	134.8	-95.7	-179.8	-170.1	0	0	112.3
30	G	26.8	Very low	27	Very low	77 Å²	77	137.7 Å²	137.7	79%	0.794	84%	0.843	S	S	*	*			trans	102.1	81.2	161.4	0	0	0	0	0	117.4
31	S	29.7	Very low	27.5	Very low	121 Å²	121	140.7 Å²	140.7	85%	0.846	85%	0.85	S	S	*	*			trans	-72.6	126.8	169.9	150.8	0	0	0	0	112.4
32	L	28.3	Very low	27.6	Very low	167 Å²	167	139 Å²	139	87%	0.874	85%	0.848	S	S	*	*			trans	-156.6	26.8	156.8	-118.6	167.5	0	0	0	116.5	R34	L32-R34 PolarHBondContact O-N 3.43Å; L32-R34 VanDerWaalsContact O-N 3.13Å
33	D	26.4	Very low	27.8	Very low	169 Å²	169	140.5 Å²	140.5	90%	0.904	85%	0.85	S	S	*	*			trans	-76.7	97.6	176.6	-92.1	-39	0	0	0	113.3
34	R	33.1	Very low	27.9	Very low	233 Å²	233	140.1 Å²	140.1	88%	0.879	85%	0.848	S	S	*	*			trans	-144.5	154.9	155.1	-84.6	-169.2	170.9	178.8	-3	109.6	L32	L32-R34 PolarHBondContact O-N 3.43Å; L32-R34 VanDerWaalsContact O-N 3.13Å
35	L	31.2	Very low	28.3	Very low	166 Å²	166	137.9 Å²	137.9	87%	0.869	84%	0.842	S	S	*	*			trans	85.3	50.5	176.2	-51	178.1	0	0	0	118.1
36	L	28.4	Very low	28.5	Very low	170 Å²	170	143.9 Å²	143.9	89%	0.89	85%	0.846	S	S	*	*			trans	-136.5	123.7	146.9	-75.6	-179.2	0	0	0	110.7
37	P	29.6	Very low	28.6	Very low	123 Å²	123	149.1 Å²	149.1	80%	0.799	84%	0.844	S	S	*	*			trans	-70.4	158.3	169.2	-19.2	33.4	0	0	0	112.8
38	S	26.8	Very low	28.9	Very low	117 Å²	117	153.3 Å²	153.3	82%	0.818	84%	0.836	S	S	*	*			trans	-70.2	135.3	-179.3	43.7	0	0	0	0	113.2	S40	S38-S40 PolarHBondContact O-N 3.49Å
39	V	27.8	Very low	28.9	Very low	143 Å²	143	151.8 Å²	151.8	87%	0.867	84%	0.835	S	S	*	*			trans	-75.4	112.2	173.9	-178.9	0	0	0	0	109.5
40	S	26.9	Very low	28.9	Very low	105 Å²	105	147.8 Å²	147.8	73%	0.734	82%	0.824	S	S	*	*			trans	-83.9	138.9	170.3	51.2	0	0	0	0	110.8	S38 G42	S38-S40 PolarHBondContact O-N 3.49Å; S40-G42 PolarHBondContact O-N 2.88Å
41	L	33.4	Very low	29	Very low	187 Å²	187	148.8 Å²	148.8	98%	0.979	82%	0.819	S	S	*	*			trans	-78.4	62.1	177.5	-79.4	165.7	0	0	0	111.6
42	G	27.1	Very low	29.1	Very low	63 Å²	63	152.2 Å²	152.2	65%	0.649	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-88	116.4	170.4	0	0	0	0	0	111.3	S40 S44	S40-G42 PolarHBondContact O-N 2.88Å; G42-S44 PolarHBondContact O-N 3.15Å
43	L	30.5	Very low	29.1	Very low	175 Å²	175	147.2 Å²	147.2	92%	0.916	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64	117.1	166.8	-80.2	166.1	0	0	0	109	P45	L43-P45 WeakPolarHBondContact O-CD 3.48Å
44	S	27.5	Very low	29.2	Very low	110 Å²	110	148.4 Å²	148.4	77%	0.769	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-63.2	125.4	179.7	47	0	0	0	0	110.7	G42 R46	G42-S44 PolarHBondContact O-N 3.15Å; S44-R46 PolarHBondContact O-N 3.14Å
45	P	31.8	Very low	29.3	Very low	119 Å²	119	143.2 Å²	143.2	77%	0.773	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-59.6	139.8	175.4	-24.8	34.8	0	0	0	110.9	L43 K47	L43-P45 WeakPolarHBondContact O-CD 3.48Å; P45-K47 PolarHBondContact O-N 3.43Å
46	R	30.4	Very low	29.4	Very low	251 Å²	251	141 Å²	141	95%	0.947	78%	0.781	S	S	*	*			trans	-59.4	110.9	167.9	-84.1	-177.6	169.8	167	-2.7	108.3	S44 R48	S44-R46 PolarHBondContact O-N 3.14Å; R46-R48 PolarHBondContact O-N 2.96Å; R46-R48 VanDerWaalsContact O-N 3.12Å
47	K	27.4	Very low	29.7	Very low	194 Å²	194	137 Å²	137	84%	0.843	77%	0.765	S	S	*	*			trans	-52.4	120.2	173.2	-70.1	-170	175.1	-170.5	0	109.2	P45 T49	P45-K47 PolarHBondContact O-N 3.43Å; K47-T49 PolarHBondContact O-N 3.3Å
48	R	29.4	Very low	30.7	Very low	167 Å²	167	133 Å²	133	63%	0.63	74%	0.74	S	S	*	*			trans	-60.4	118.4	164	-174.6	-176.8	-77.9	-170.8	-5.4	105.7	R46 T50	R46-R48 PolarHBondContact O-N 2.96Å; R46-R48 VanDerWaalsContact O-N 3.12Å; R48-T50 HydrophobicContact CG-CG2 4.35Å; R48-T50 PolarHBondContact O-N 3.3Å
49	T	26.6	Very low	31.7	Very low	137 Å²	137	128.6 Å²	128.6	84%	0.84	71%	0.707	S	S	*	*			trans	-77.6	75.6	-177.6	48.5	0	0	0	0	110.1	K47 S51	K47-T49 PolarHBondContact O-N 3.3Å; T49-S51 PolarHBondContact O-N 3.48Å
50	T	28.5	Very low	32.4	Very low	110 Å²	110	125.9 Å²	125.9	68%	0.675	69%	0.687	S	S	*	*			trans	-74.2	96	167.1	46.2	0	0	0	0	108.7	R48 Q52	R48-T50 HydrophobicContact CG-CG2 4.35Å; R48-T50 PolarHBondContact O-N 3.3Å; T50-Q52 PolarHBondContact O-N 3.16Å
51	S	28.1	Very low	33.3	Very low	98 Å²	98	128.7 Å²	128.7	69%	0.685	68%	0.682	S	S	*	*			trans	-69.2	93.7	168.2	48.8	0	0	0	0	109.5	T49 C53	T49-S51 PolarHBondContact O-N 3.48Å; S51-C53 PolarHBondContact O-N 3.32Å
52	Q	31.4	Very low	33.8	Very low	193 Å²	193	123.5 Å²	123.5	90%	0.902	66%	0.657	S	S	*	*			trans	-69.5	62.1	160.1	-76.1	-175.7	-23.8	0	0	109.5	T50	T50-Q52 PolarHBondContact O-N 3.16Å
53	C	28.8	Very low	34.2	Very low	62 Å²	62	126.5 Å²	126.5	42%	0.419	67%	0.669	S	S	.	*			trans	-85.8	115.9	175.8	-72.3	0	0	0	0	108.9	S51 S55 E56	S51-C53 PolarHBondContact O-N 3.32Å; C53-S55 PolarHBondContact O-N 3.44Å; C53-E56 HydrophobicContact CB-CG 4.06Å; C53-E56 PolarHBondContact SG-OE1 3.46Å
54	K	29.2	Very low	34.3	Very low	193 Å²	193	127.2 Å²	127.2	84%	0.839	66%	0.664	S	S	*	*	S	Bend	trans	-50.7	126.7	157.7	-60.4	172.1	-179.5	178.6	0	107.2	E56	K54-E56 PolarHBondContact O-N 2.93Å
55	S	34.4	Very low	34.7	Very low	125 Å²	125	131.1 Å²	131.1	87%	0.874	66%	0.662	S	S	*	*			trans	-16.3	85.2	-175	60	0	0	0	0	114.9	C53	C53-S55 PolarHBondContact O-N 3.44Å
56	E	33.7	Very low	35.4	Very low	118 Å²	118	128.7 Å²	128.7	55%	0.551	65%	0.645	S	S	*	*			trans	-71	144.8	167.9	-79.3	179.9	-171.1	0	0	108.2	C53 K54	C53-E56 HydrophobicContact CB-CG 4.06Å; C53-E56 PolarHBondContact SG-OE1 3.46Å; K54-E56 PolarHBondContact O-N 2.93Å
57	P	34.8	Very low	36	Very low	86 Å²	86	120.9 Å²	120.9	56%	0.558	62%	0.621	S	S	*	*			trans	-59.4	151	177.1	26.9	-35.1	0	0	0	110	L59	P57-L59 PolarHBondContact O-N 3.44Å
58	P	50.3	Low	37.2	Very low	40 Å²	40	116.7 Å²	116.7	26%	0.26	60%	0.601	S	S	.	*	S	Bend	trans	-65.7	15.3	-173.7	27.1	-37.1	0	0	0	115.8	Y68 T69 A70 D111	P58-Y68 CarbonylContact O-C 3.53Å; P58-Y68 VanDerWaalsContact O-CA 3.3Å; P58-Y68 WeakPolarHBondContact O-CA 3.31Å; P58-T69 VanDerWaalsContact CA-OG1 3.27Å; P58-T69 WeakPolarHBondContact CA-OG1 3.33Å; P58-T69 PolarHBondContact O-N 3.01Å; P58-T69 PolarHBondContact O-OG1 3.49Å; P58-A70 HydrophobicContact CB-CB 4.13Å; P58-D111 VanDerWaalsContact CD-OD2 3.27Å; P58-D111 WeakPolarHBondContact CD-OD2 3.37Å; P58-D111 WeakPolarHBondContact CG-OD2 3.3Å
59	L	47.3	Very low	38.2	Very low	24 Å²	24	112.1 Å²	112.1	13%	0.126	59%	0.592	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-123	97.9	-176.4	-53.5	-173.9	0	0	0	112.8	P57 R61 T66 I67 Y68 D111	P57-L59 PolarHBondContact O-N 3.44Å; L59-R61 HydrophobicContact CB-CG 4.26Å; L59-R61 PolarHBondContact O-N 3.18Å; L59-R61 VanDerWaalsContact O-N 3.08Å; L59-T66 HydrophobicContact CB-CG2 4.15Å; L59-T66 HydrophobicContact CD1-CG2 4.36Å; L59-T66 HydrophobicContact CD2-CG2 3.79Å; L59-T66 HydrophobicContact CG-CG2 4.33Å; L59-I67 CarbonylContact C-O 3.51Å; L59-I67 WeakPolarHBondContact CA-O 3.21Å; L59-Y68 HydrophobicContact CD2-CD1 3.29Å; L59-Y68 HydrophobicContact CD2-CE1 3.33Å; L59-Y68 HydrophobicContact CD2-CG 4.21Å; L59-D111 WeakPolarHBondContact CD1-OD1 3.36Å; L59-D111 WeakPolarHBondContact CG-OD1 3.27Å
60	L	43.5	Very low	39.7	Very low	87 Å²	87	107.3 Å²	107.3	46%	0.455	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.9	97.5	163.1	-73.7	173.4	0	0	0	109.4	I67 T69	L60-I67 HydrophobicContact CB-CB 4.1Å; L60-I67 PolarHBondContact N-O 3.17Å; L60-I67 WeakPolarHBondContact O-CB 3.45Å; L60-I67 PolarHBondContact O-N 3.16Å; L60-T69 HydrophobicContact CD1-CG2 3.98Å; L60-T69 HydrophobicContact CG-CG2 4.1Å
61	R	44.5	Very low	41.1	Very low	164 Å²	164	102.1 Å²	102.1	62%	0.619	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	116.8	-179.5	-65.9	-174	-178.5	-163.1	-0	111.6	L59	L59-R61 HydrophobicContact CB-CG 4.26Å; L59-R61 PolarHBondContact O-N 3.18Å; L59-R61 VanDerWaalsContact O-N 3.08Å
62	T	43.8	Very low	43.1	Very low	77 Å²	77	98 Å²	98	47%	0.472	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	158.6	163.8	69.8	0	0	0	0	110	K64 R65 I67	T62-K64 PolarHBondContact O-N 2.65Å; T62-R65 PolarHBondContact N-O 2.79Å; T62-R65 PolarHBondContact O-N 2.8Å; T62-R65 PolarHBondContact OG1-N 3.13Å; T62-R65 VanDerWaalsContact OG1-N 3.11Å; T62-R65 PolarHBondContact OG1-O 3.43Å; T62-I67 HydrophobicContact CG2-CD1 4.43Å
63	S	35.4	Very low	44.8	Very low	127 Å²	127	90.9 Å²	90.9	89%	0.888	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-2.3	-178	58.4	0	0	0	0	115.9
64	K	34.2	Very low	46.7	Very low	189 Å²	189	89.2 Å²	89.2	82%	0.822	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.3	-7.6	175.7	-63.7	-176.1	179.4	178.4	0	114.7	T62	T62-K64 PolarHBondContact O-N 2.65Å
65	R	36	Very low	48.7	Very low	193 Å²	193	80.7 Å²	80.7	73%	0.728	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-155	133.5	-176.3	-63.4	-174.7	179.3	168.2	0	111.9	T62	T62-R65 PolarHBondContact N-O 2.79Å; T62-R65 PolarHBondContact O-N 2.8Å; T62-R65 PolarHBondContact OG1-N 3.13Å; T62-R65 VanDerWaalsContact OG1-N 3.11Å; T62-R65 PolarHBondContact OG1-O 3.43Å
66	T	45.4	Very low	50.4	Low	68 Å²	68	74.8 Å²	74.8	42%	0.417	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	132.6	158.6	-51.7	0	0	0	0	108.6	L59 Y68	L59-T66 HydrophobicContact CB-CG2 4.15Å; L59-T66 HydrophobicContact CD1-CG2 4.36Å; L59-T66 HydrophobicContact CD2-CG2 3.79Å; L59-T66 HydrophobicContact CG-CG2 4.33Å; T66-Y68 HydrophobicContact CG2-CE2 4.26Å
67	I	44.4	Very low	52.2	Low	86 Å²	86	71.1 Å²	71.1	44%	0.441	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	116.1	172.6	-59.3	170.3	0	0	0	106.7	L59 L60 T62	L59-I67 CarbonylContact C-O 3.51Å; L59-I67 WeakPolarHBondContact CA-O 3.21Å; L60-I67 HydrophobicContact CB-CB 4.1Å; L60-I67 PolarHBondContact N-O 3.17Å; L60-I67 WeakPolarHBondContact O-CB 3.45Å; L60-I67 PolarHBondContact O-N 3.16Å; T62-I67 HydrophobicContact CG2-CD1 4.43Å
68	Y	50.9	Low	53.8	Low	107 Å²	107	70.3 Å²	70.3	42%	0.42	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	134.3	172.9	-59.9	-90.5	0	0	0	109.2	P58 L59 T66 P113	P58-Y68 CarbonylContact O-C 3.53Å; P58-Y68 VanDerWaalsContact O-CA 3.3Å; P58-Y68 WeakPolarHBondContact O-CA 3.31Å; L59-Y68 HydrophobicContact CD2-CD1 3.29Å; L59-Y68 HydrophobicContact CD2-CE1 3.33Å; L59-Y68 HydrophobicContact CD2-CG 4.21Å; T66-Y68 HydrophobicContact CG2-CE2 4.26Å; Y68-P113 HydrophobicContact CD1-CB 3.63Å; Y68-P113 HydrophobicContact CD1-CG 3.68Å; Y68-P113 HydrophobicContact CD2-CB 4.42Å; Y68-P113 HydrophobicContact CE1-CB 4.08Å; Y68-P113 HydrophobicContact CE1-CG 4.42Å; Y68-P113 HydrophobicContact CG-CB 3.83Å; Y68-P113 HydrophobicContact CG-CG 4.05Å
69	T	51.5	Low	54.6	Low	71 Å²	71	73.1 Å²	73.1	44%	0.436	37%	0.366	S	S	.	.			trans	-95.6	-39.1	177.3	55.9	0	0	0	0	112	P58 L60 H424	P58-T69 VanDerWaalsContact CA-OG1 3.27Å; P58-T69 WeakPolarHBondContact CA-OG1 3.33Å; P58-T69 PolarHBondContact O-N 3.01Å; P58-T69 PolarHBondContact O-OG1 3.49Å; L60-T69 HydrophobicContact CD1-CG2 3.98Å; L60-T69 HydrophobicContact CG-CG2 4.1Å; T69-H424 PolarHBondContact O-CE1 2.9Å; T69-H424 PolarHBondContact O-ND1 3.23Å
70	A	58.5	Low	55.3	Low	35 Å²	35	72.1 Å²	72.1	29%	0.289	36%	0.362	S	S	.	.	S	Bend	trans	-70.4	146.1	170.3	0	0	0	0	0	112.1	P58	P58-A70 HydrophobicContact CB-CB 4.13Å
71	G	56.6	Low	56.4	Low	2 Å²	2	70.3 Å²	70.3	2%	0.021	36%	0.359	C	S	.	.			trans	-99	-160.4	176.6	0	0	0	0	0	112.8	W114 E422 L423 H424	G71-W114 PolarHBondContact O-NE1 2.88Å; G71-E422 WeakPolarHBondContact CA-OE2 3.33Å; G71-E422 PolarHBondContact N-OE2 3.5Å; G71-L423 CarbonylContact C-O 3.55Å; G71-L423 VanDerWaalsContact CA-O 3.23Å; G71-L423 WeakPolarHBondContact CA-O 3.33Å; G71-H424 PolarHBondContact N-CE1 2.76Å; G71-H424 VanDerWaalsContact N-CE1 3.28Å; G71-H424 PolarHBondContact N-ND1 3.38Å
72	R	70.3	Confident	57.5	Low	10 Å²	10	64.8 Å²	64.8	4%	0.038	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-98	112.8	179.7	-159.5	175.3	179.1	-143.7	-3.6	111.6	W75 W114 G187 E422 L423 M452	R72-W75 HydrophobicContact CB-CZ3 4.23Å; R72-W75 HydrophobicContact CG-CE3 3.91Å; R72-W75 HydrophobicContact CG-CZ3 3.99Å; R72-W114 VanDerWaalsContact CA-CE2 3.47Å; R72-W114 HydrophobicContact CB-CD2 3.75Å; R72-W114 HydrophobicContact CB-CE3 4.11Å; R72-W114 HydrophobicContact CB-CG 4.43Å; R72-W114 HydrophobicContact CB-CH2 3.9Å; R72-W114 HydrophobicContact CB-CZ2 3.52Å; R72-W114 HydrophobicContact CB-CZ3 4.16Å; R72-W114 HydrophobicContact CG-CD2 3.54Å; R72-W114 HydrophobicContact CG-CE3 3.96Å; R72-W114 HydrophobicContact CG-CG 3.83Å; R72-W114 HydrophobicContact CG-CZ2 4.29Å; R72-W114 HydrophobicContact CG-CZ3 4.47Å; R72-W114 VanDerWaalsContact N-CZ2 3.28Å; R72-G187 PolarHBondContact NE-O 2.66Å; R72-G187 PolarHBondContact NH2-O 3.2Å; R72-E422 VanDerWaalsContact O-CA 3.31Å; R72-E422 WeakPolarHBondContact O-CA 3.41Å; R72-L423 HydrophobicContact CB-CB 3.96Å; R72-L423 PolarHBondContact N-O 3.33Å; R72-L423 PolarHBondContact O-N 2.85Å; R72-M452 WeakPolarHBondContact O-CE 3.37Å
73	P	68.3	Low	58.1	Low	45 Å²	45	63 Å²	63	29%	0.292	33%	0.331	S	S	.	.			trans	-64.6	166.4	171.3	28.9	-35.6	0	0	0	111.2	W75	P73-W75 PolarHBondContact O-N 2.89Å
74	P	66.9	Low	59.7	Low	26 Å²	26	61.6 Å²	61.6	17%	0.169	31%	0.309	C	S	.	.			trans	-57.5	124.6	-176.8	-25.6	35.7	0	0	0	114.1	Y76 V295 P421 M452	P74-Y76 HydrophobicContact CB-CD1 4.18Å; P74-Y76 HydrophobicContact CB-CE1 3.82Å; P74-V295 HydrophobicContact CB-CG2 3.97Å; P74-V295 HydrophobicContact CG-CG2 4.38Å; P74-P421 HydrophobicContact CG-CG 3.97Å; P74-M452 HydrophobicContact CG-CE 4.17Å
75	W	72.6	Confident	61.6	Low	14 Å²	14	57.1 Å²	57.1	5%	0.053	29%	0.291	C	S	.	.			trans	-100.7	21.2	171.4	63.3	101.9	0	0	0	112.4	R72 P73 Q82 S83 L423 M452 R455 V456 D459	R72-W75 HydrophobicContact CB-CZ3 4.23Å; R72-W75 HydrophobicContact CG-CE3 3.91Å; R72-W75 HydrophobicContact CG-CZ3 3.99Å; P73-W75 PolarHBondContact O-N 2.89Å; W75-Q82 WeakPolarHBondContact O-CA 3.12Å; W75-S83 PolarHBondContact O-N 3.13Å; W75-S83 PolarHBondContact O-OG 2.79Å; W75-L423 HydrophobicContact CH2-CD2 4.2Å; W75-M452 HydrophobicContact CE3-CE 4.44Å; W75-M452 HydrophobicContact CH2-CG 4.09Å; W75-M452 HydrophobicContact CZ3-CE 3.85Å; W75-M452 HydrophobicContact CZ3-CG 4.2Å; W75-M452 HydrophobicContact CZ3-SD 4.31Å; W75-R455 HydrophobicContact CZ2-CB 4.4Å; W75-R455 HydrophobicContact CZ2-CG 3.83Å; W75-V456 HydrophobicContact CH2-CG2 3.58Å; W75-V456 HydrophobicContact CZ2-CG2 3.83Å; W75-D459 VanDerWaalsContact CE2-OD2 3.31Å; W75-D459 WeakPolarHBondContact CZ2-OD2 3.47Å; W75-D459 PolarHBondContact NE1-OD2 3.2Å
76	Y	70	Confident	63.8	Low	2 Å²	2	48.1 Å²	48.1	1%	0.008	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-138.4	154.2	-175.2	62.3	-86.6	0	0	0	109.6	P74 A81 V295 A448 M451 M452 R455	P74-Y76 HydrophobicContact CB-CD1 4.18Å; P74-Y76 HydrophobicContact CB-CE1 3.82Å; Y76-A81 CarbonylContact C-O 3.52Å; Y76-A81 WeakPolarHBondContact CA-O 3.31Å; Y76-A81 WeakPolarHBondContact CB-O 3.44Å; Y76-V295 HydrophobicContact CE2-CG1 4.48Å; Y76-A448 PolarHBondContact OH-O 2.72Å; Y76-M451 HydrophobicContact CE2-CB 4.05Å; Y76-M452 HydrophobicContact CE1-CB 4Å; Y76-M452 HydrophobicContact CE1-CE 4.14Å; Y76-M452 HydrophobicContact CE1-CG 4.35Å; Y76-M452 WeakPolarHBondContact OH-CB 3.46Å; Y76-M452 PolarHBondContact OH-N 3.28Å; Y76-R455 HydrophobicContact CD1-CB 4.06Å; Y76-R455 HydrophobicContact CD1-CG 3.85Å; Y76-R455 HydrophobicContact CE1-CB 4.44Å; Y76-R455 HydrophobicContact CG-CB 4.42Å; Y76-R455 HydrophobicContact CG-CG 4.17Å
77	N	71.9	Confident	65.9	Low	41 Å²	41	45.5 Å²	45.5	22%	0.219	24%	0.241	C	C	.	.			trans	-94.1	-178.7	178.5	66.9	11.5	0	0	0	111.8	H79 G80 A81	N77-H79 PolarHBondContact O-N 2.79Å; N77-H79 WeakPolarHBondContact OD1-CA 3.5Å; N77-H79 WeakPolarHBondContact OD1-CB 3.32Å; N77-H79 PolarHBondContact OD1-N 3.49Å; N77-G80 PolarHBondContact O-N 3.4Å; N77-G80 PolarHBondContact OD1-N 3.41Å; N77-A81 PolarHBondContact N-O 3.06Å; N77-A81 PolarHBondContact OD1-N 3.06Å; N77-A81 PolarHBondContact OD1-O 3.45Å
78	E	66.8	Low	68.1	Low	69 Å²	69	41.4 Å²	41.4	32%	0.322	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-22.4	176.7	-64.5	153.7	-116.1	0	0	114.2	A298	E78-A298 HydrophobicContact CG-CB 3.86Å; E78-A298 WeakPolarHBondContact OE1-CB 3.24Å; E78-A298 WeakPolarHBondContact OE2-CB 3.43Å
79	H	68.2	Low	70.2	Confident	99 Å²	99	36.3 Å²	36.3	46%	0.458	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	12	177.7	-46	-61.9	0	0	0	113.3	N77 A81 Y484 A485	N77-H79 PolarHBondContact O-N 2.79Å; N77-H79 WeakPolarHBondContact OD1-CA 3.5Å; N77-H79 WeakPolarHBondContact OD1-CB 3.32Å; N77-H79 PolarHBondContact OD1-N 3.49Å; H79-A81 PolarHBondContact O-N 2.89Å; H79-Y484 AromaticContact CE1-CE1 3.77Å; H79-Y484 AromaticContact CE1-CZ 3.89Å; H79-Y484 PolarHBondContact CE1-OH 3.24Å; H79-Y484 VanDerWaalsContact CE1-OH 3.3Å; H79-Y484 AromaticContact ND1-CE1 3.26Å; H79-Y484 VanDerWaalsContact ND1-CE1 3.26Å; H79-Y484 WeakPolarHBondContact ND1-CE1 3.47Å; H79-Y484 AromaticContact ND1-CZ 3.55Å; H79-Y484 PolarHBondContact ND1-OH 2.97Å; H79-A485 VanDerWaalsContact O-O 3.12Å
80	G	62.8	Low	72.2	Confident	3 Å²	3	33 Å²	33	3%	0.031	18%	0.179	C	C	.	.	S	Bend	trans	69.6	-11.7	-178.2	0	0	0	0	0	115.5	N77 R455 F486	N77-G80 PolarHBondContact O-N 3.4Å; N77-G80 PolarHBondContact OD1-N 3.41Å; G80-R455 PolarHBondContact O-NH1 3.24Å; G80-F486 VanDerWaalsContact CA-CZ 3.5Å
81	A	66.3	Low	74	Confident	49 Å²	49	31.3 Å²	31.3	41%	0.405	17%	0.166	S	C	.	.	S	Bend	trans	-66.1	150.4	173.8	0	0	0	0	0	110.6	Y76 N77 H79 S83	Y76-A81 CarbonylContact C-O 3.52Å; Y76-A81 WeakPolarHBondContact CA-O 3.31Å; Y76-A81 WeakPolarHBondContact CB-O 3.44Å; N77-A81 PolarHBondContact N-O 3.06Å; N77-A81 PolarHBondContact OD1-N 3.06Å; N77-A81 PolarHBondContact OD1-O 3.45Å; H79-A81 PolarHBondContact O-N 2.89Å; A81-S83 PolarHBondContact O-N 3.12Å
82	Q	65.9	Low	75.8	Confident	47 Å²	47	31.2 Å²	31.2	22%	0.22	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-64.3	129	178.5	-177.7	178.6	-16.5	0	0	109.3	W75 K84 K161 Q162	W75-Q82 WeakPolarHBondContact O-CA 3.12Å; Q82-K84 WeakPolarHBondContact CG-O 3.43Å; Q82-K84 PolarHBondContact NE2-O 3.4Å; Q82-K161 PolarHBondContact NE2-O 2.87Å; Q82-Q162 PolarHBondContact OE1-O 3.33Å; Q82-Q162 VanDerWaalsContact OE1-O 3.05Å
83	S	58.1	Low	76.8	Confident	39 Å²	39	30.7 Å²	30.7	27%	0.273	16%	0.163	S	C	.	.	S	Bend	trans	-68.4	-44.4	-168.3	54.7	0	0	0	0	112.7	W75 A81	W75-S83 PolarHBondContact O-N 3.13Å; W75-S83 PolarHBondContact O-OG 2.79Å; A81-S83 PolarHBondContact O-N 3.12Å
84	K	67.6	Low	77.8	Confident	99 Å²	99	28.6 Å²	28.6	43%	0.43	15%	0.149	S	C	.	.	S	Bend	trans	-147.5	160.6	164.5	-61	-173.5	-167.6	166.9	0	110.1	Q82 E290 R291	Q82-K84 WeakPolarHBondContact CG-O 3.43Å; Q82-K84 PolarHBondContact NE2-O 3.4Å; K84-E290 PolarHBondContact NZ-O 3.05Å; K84-R291 HydrophobicContact CD-CG 3.88Å
85	E	75.8	Confident	78.8	Confident	94 Å²	94	27.9 Å²	27.9	44%	0.439	15%	0.145	S	C	.	.	P	Polyproline II helix	trans	-63.1	153.5	169.3	-73.7	-162.5	147.1	0	0	111.9	K161 R291	E85-K161 HydrophobicContact CB-CG 3.89Å; E85-K161 HydrophobicContact CG-CG 4.33Å; E85-K161 WeakPolarHBondContact OE2-CD 3.33Å; E85-K161 WeakPolarHBondContact OE2-CE 3.03Å; E85-R291 PolarHBondContact O-NH1 3.26Å
86	A	82.3	Confident	79.4	Confident	5 Å²	5	28.2 Å²	28.2	4%	0.041	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-65.4	140.8	178.5	0	0	0	0	0	111.3	V88 K161 A188 I191	A86-V88 PolarHBondContact O-N 2.9Å; A86-K161 PolarHBondContact N-O 3.46Å; A86-A188 WeakPolarHBondContact CB-O 3.17Å; A86-I191 HydrophobicContact CB-CD1 3.9Å; A86-I191 HydrophobicContact CB-CG1 4.26Å
87	F	87.8	Confident	80.3	Confident	13 Å²	13	28.2 Å²	28.2	6%	0.057	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	120.1	-178	-170.5	-107.5	0	0	0	111	I89 S189 V190 I191 D209 M210 V284 Q287	F87-I89 HydrophobicContact CD1-CD1 4.26Å; F87-I89 HydrophobicContact CD1-CG1 3.81Å; F87-I89 HydrophobicContact CE1-CD1 4.26Å; F87-I89 HydrophobicContact CE1-CG1 3.77Å; F87-S189 PolarHBondContact N-O 3.5Å; F87-V190 CarbonylContact O-C 3.6Å; F87-V190 WeakPolarHBondContact O-CA 3.26Å; F87-I191 PolarHBondContact O-N 2.9Å; F87-D209 HydrophobicContact CD2-CB 3.66Å; F87-D209 HydrophobicContact CE2-CB 3.51Å; F87-D209 HydrophobicContact CG-CB 4.49Å; F87-D209 HydrophobicContact CZ-CB 4.22Å; F87-M210 HydrophobicContact CE1-CB 4.11Å; F87-M210 HydrophobicContact CZ-CB 3.91Å; F87-V284 HydrophobicContact CD1-CG2 4.21Å; F87-V284 HydrophobicContact CE1-CG2 3.86Å; F87-Q287 HydrophobicContact CE2-CG 4.4Å
88	V	91.9	Very high	81	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	112.9	-172.5	-169.4	0	0	0	0	111.2	A86 L157 K161 I191 L207 L208 D209 M210	A86-V88 PolarHBondContact O-N 2.9Å; V88-L157 HydrophobicContact CG1-CD1 3.92Å; V88-L157 HydrophobicContact CG1-CD2 4.4Å; V88-K161 HydrophobicContact CG2-CB 4.36Å; V88-K161 HydrophobicContact CG2-CD 3.97Å; V88-K161 HydrophobicContact CG2-CG 4.07Å; V88-I191 CarbonylContact C-O 3.49Å; V88-I191 WeakPolarHBondContact CA-O 3.32Å; V88-I191 HydrophobicContact CG1-CB 4.37Å; V88-I191 HydrophobicContact CG1-CG2 4.41Å; V88-I191 HydrophobicContact CG2-CB 4.33Å; V88-I191 HydrophobicContact CG2-CD1 4.19Å; V88-L207 WeakPolarHBondContact CB-O 3.42Å; V88-L208 HydrophobicContact CG1-CD2 3.56Å; V88-D209 PolarHBondContact N-OD2 3.08Å; V88-D209 PolarHBondContact O-N 3.33Å; V88-M210 PolarHBondContact O-N 2.82Å; V88-M210 VanDerWaalsContact O-N 3.08Å
89	I	93.8	Very high	82.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	105.9	176.1	-51.6	173.5	0	0	0	108.2	F87 L91 V190 I191 I192 F193 M210 I212 V284	F87-I89 HydrophobicContact CD1-CD1 4.26Å; F87-I89 HydrophobicContact CD1-CG1 3.81Å; F87-I89 HydrophobicContact CE1-CD1 4.26Å; F87-I89 HydrophobicContact CE1-CG1 3.77Å; I89-L91 HydrophobicContact CG2-CD2 4Å; I89-V190 HydrophobicContact CD1-CG1 3.77Å; I89-V190 HydrophobicContact CG1-CG1 4.27Å; I89-I191 PolarHBondContact N-O 2.92Å; I89-I192 HydrophobicContact CB-CG1 4.39Å; I89-I192 HydrophobicContact CD1-CG1 4.28Å; I89-I192 CarbonylContact O-C 3.56Å; I89-I192 WeakPolarHBondContact O-CA 3.36Å; I89-F193 PolarHBondContact O-N 3Å; I89-M210 CarbonylContact C-O 3.54Å; I89-M210 WeakPolarHBondContact CA-O 3.22Å; I89-I212 HydrophobicContact CG2-CD1 3.59Å; I89-I212 HydrophobicContact CG2-CG1 4.12Å; I89-V284 HydrophobicContact CD1-CG2 3.61Å
90	G	95	Very high	83.1	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	121.6	174	0	0	0	0	0	111.9	F193 F199 M210 I212	G90-F193 CarbonylContact C-O 3.43Å; G90-F193 WeakPolarHBondContact CA-O 3.35Å; G90-F199 WeakPolarHBondContact O-CZ 3.32Å; G90-M210 PolarHBondContact N-O 2.94Å; G90-I212 PolarHBondContact O-N 3.26Å
91	L	94.8	Very high	84.4	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	117.9	173.2	-52.5	-176.5	0	0	0	110	I89 A103 I192 F193 E194 G195 S198 I212	I89-L91 HydrophobicContact CG2-CD2 4Å; L91-A103 HydrophobicContact CD1-CB 3.63Å; L91-I192 HydrophobicContact CD1-CG2 3.63Å; L91-I192 HydrophobicContact CG-CG2 3.96Å; L91-F193 PolarHBondContact N-O 3.08Å; L91-E194 HydrophobicContact CB-CB 4.18Å; L91-E194 HydrophobicContact CD1-CB 4.43Å; L91-G195 PolarHBondContact O-N 3.04Å; L91-G195 VanDerWaalsContact O-N 3.15Å; L91-S198 PolarHBondContact O-OG 3.4Å; L91-I212 WeakPolarHBondContact CA-O 3.28Å; L91-I212 HydrophobicContact CD2-CB 3.79Å; L91-I212 HydrophobicContact CD2-CD1 3.96Å; L91-I212 HydrophobicContact CD2-CG1 4.2Å; L91-I212 HydrophobicContact CD2-CG2 4.36Å
92	C	94.5	Very high	85.5	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	177.6	174.5	-158.1	0	0	0	0	111.3	F199 I212 F213 V214	C92-F199 HydrophobicContact CB-CB 4.48Å; C92-F199 HydrophobicContact CB-CD1 3.91Å; C92-F199 HydrophobicContact CB-CD2 3.35Å; C92-F199 HydrophobicContact CB-CE1 3.79Å; C92-F199 HydrophobicContact CB-CE2 3.25Å; C92-F199 HydrophobicContact CB-CG 3.66Å; C92-F199 HydrophobicContact CB-CZ 3.45Å; C92-F199 VanDerWaalsContact CB-CZ 3.45Å; C92-I212 PolarHBondContact N-O 3.42Å; C92-F213 HydrophobicContact CB-CD2 4.08Å; C92-V214 PolarHBondContact O-N 3.48Å
93	G	92	Very high	86.6	Confident	0 Å²	0	21 Å²	21	0%	0	12%	0.119	C	C	.	.			trans	126.4	165.1	-177.6	0	0	0	0	0	112.5	K99	G93-K99 PolarHBondContact O-NZ 2.91Å
94	G	89.1	Confident	88	Confident	1 Å²	1	26 Å²	26	1%	0.01	13%	0.132	C	C	.	.			trans	-64.9	168.8	-171	0	0	0	0	0	115.7	A96 S97 K99	G94-A96 PolarHBondContact O-N 3.33Å; G94-S97 PolarHBondContact O-N 3.01Å; G94-S97 PolarHBondContact O-OG 3.4Å; G94-K99 PolarHBondContact O-NZ 3.31Å
95	S	88.1	Confident	88.9	Confident	11 Å²	11	24.2 Å²	24.2	8%	0.077	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	135.2	169.2	179.5	0	0	0	0	110.3	S97 R221 R225	S95-S97 VanDerWaalsContact C-N 3.27Å; S95-S97 PolarHBondContact O-N 3.07Å; S95-R221 PolarHBondContact O-NE 2.96Å; S95-R225 PolarHBondContact OG-NH1 2.82Å
96	A	85.8	Confident	89.4	Confident	21 Å²	21	19.8 Å²	19.8	17%	0.174	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	15	-179.3	0	0	0	0	0	117.8	G94 G98 R221 R224 R225	G94-A96 PolarHBondContact O-N 3.33Å; A96-G98 PolarHBondContact O-N 3.08Å; A96-R221 WeakPolarHBondContact CB-O 3.49Å; A96-R224 HydrophobicContact CB-CB 3.87Å; A96-R224 WeakPolarHBondContact O-CD 3.33Å; A96-R225 HydrophobicContact CB-CB 4.01Å
97	S	87.9	Confident	89.6	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.007	11%	0.111	C	C	.	.	S	Bend	trans	-66.3	-21.6	173.6	69.5	0	0	0	0	114	G94 S95 V214 T216 R224	G94-S97 PolarHBondContact O-N 3.01Å; G94-S97 PolarHBondContact O-OG 3.4Å; S95-S97 VanDerWaalsContact C-N 3.27Å; S95-S97 PolarHBondContact O-N 3.07Å; S97-V214 VanDerWaalsContact CB-O 3.22Å; S97-V214 WeakPolarHBondContact CB-O 3.44Å; S97-V214 PolarHBondContact OG-O 3.43Å; S97-V214 VanDerWaalsContact OG-O 3.07Å; S97-T216 PolarHBondContact O-OG1 3.03Å; S97-T216 VanDerWaalsContact O-OG1 3.09Å; S97-R224 PolarHBondContact O-NH1 3.28Å; S97-R224 VanDerWaalsContact O-NH1 3.09Å
98	G	86.8	Confident	89.3	Confident	14 Å²	14	26.1 Å²	26.1	14%	0.144	13%	0.133	C	C	.	.	S	Bend	trans	105.4	17.9	177	0	0	0	0	0	115.1	A96 T100 T101 V102	A96-G98 PolarHBondContact O-N 3.08Å; G98-T100 VanDerWaalsContact C-N 3.29Å; G98-T100 PolarHBondContact O-N 3.24Å; G98-T101 WeakPolarHBondContact O-CA 3.32Å; G98-T101 VanDerWaalsContact O-CB 3.28Å; G98-T101 WeakPolarHBondContact O-CB 3.16Å; G98-T101 PolarHBondContact O-N 3.45Å; G98-V102 PolarHBondContact O-N 2.87Å
99	K	91.8	Very high	88.9	Confident	16 Å²	16	28.1 Å²	28.1	7%	0.07	15%	0.15	C	C	.	.	H	α-helix	trans	-41.7	-53.2	172	-65.7	-178.3	-66.4	-82.8	0	113	G93 G94 T101 V102 A103 G195 V214	G93-K99 PolarHBondContact O-NZ 2.91Å; G94-K99 PolarHBondContact O-NZ 3.31Å; K99-T101 PolarHBondContact O-N 3.34Å; K99-V102 CarbonylContact O-C 3.47Å; K99-V102 WeakPolarHBondContact O-CA 3.25Å; K99-V102 WeakPolarHBondContact O-CB 3.37Å; K99-V102 PolarHBondContact O-N 3.11Å; K99-A103 WeakPolarHBondContact O-CB 3.43Å; K99-A103 PolarHBondContact O-N 3.2Å; K99-G195 WeakPolarHBondContact CD-O 3.43Å; K99-G195 VanDerWaalsContact CE-C 3.47Å; K99-G195 WeakPolarHBondContact CE-O 2.92Å; K99-V214 HydrophobicContact CG-CB 3.99Å; K99-V214 HydrophobicContact CG-CG2 4.09Å
100	T	87.5	Confident	88.1	Confident	51 Å²	51	28.2 Å²	28.2	31%	0.313	15%	0.15	S	C	.	.	H	α-helix	trans	-63.2	-27.3	-178.8	-37.3	0	0	0	0	112.8	G98 R104 E194	G98-T100 VanDerWaalsContact C-N 3.29Å; G98-T100 PolarHBondContact O-N 3.24Å; T100-R104 WeakPolarHBondContact O-CB 3.44Å; T100-R104 VanDerWaalsContact O-CG 3.24Å; T100-R104 WeakPolarHBondContact O-CG 3.19Å; T100-R104 PolarHBondContact O-N 3.04Å; T100-R104 VanDerWaalsContact O-N 3.1Å; T100-E194 WeakPolarHBondContact CA-OE2 3.37Å; T100-E194 VanDerWaalsContact CB-OE2 3.27Å; T100-E194 WeakPolarHBondContact CB-OE2 3.2Å; T100-E194 WeakPolarHBondContact CG2-OE1 3.49Å; T100-E194 PolarHBondContact N-OE2 2.95Å; T100-E194 PolarHBondContact OG1-OE1 3.27Å; T100-E194 PolarHBondContact OG1-OE2 3.23Å
101	T	89	Confident	86.9	Confident	75 Å²	75	30.6 Å²	30.6	46%	0.46	16%	0.163	S	C	.	.	H	α-helix	trans	-76	-40.8	173.7	-44.4	0	0	0	0	111.4	G98 K99 K105	G98-T101 WeakPolarHBondContact O-CA 3.32Å; G98-T101 VanDerWaalsContact O-CB 3.28Å; G98-T101 WeakPolarHBondContact O-CB 3.16Å; G98-T101 PolarHBondContact O-N 3.45Å; K99-T101 PolarHBondContact O-N 3.34Å; T101-K105 WeakPolarHBondContact O-CB 3.35Å; T101-K105 WeakPolarHBondContact O-CG 3.26Å; T101-K105 PolarHBondContact O-N 3.33Å
102	V	90	Very high	85.6	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.7	-47.6	172.2	175.8	0	0	0	0	110	G98 K99 R104 K105 I106 V214 I277	G98-V102 PolarHBondContact O-N 2.87Å; K99-V102 CarbonylContact O-C 3.47Å; K99-V102 WeakPolarHBondContact O-CA 3.25Å; K99-V102 WeakPolarHBondContact O-CB 3.37Å; K99-V102 PolarHBondContact O-N 3.11Å; V102-R104 PolarHBondContact O-N 3.1Å; V102-K105 PolarHBondContact O-N 2.88Å; V102-I106 HydrophobicContact CG1-CD1 3.71Å; V102-I106 HydrophobicContact CG1-CG1 4.38Å; V102-I106 WeakPolarHBondContact O-CG1 3.43Å; V102-I106 PolarHBondContact O-N 3.29Å; V102-V214 HydrophobicContact CB-CG2 4.41Å; V102-V214 HydrophobicContact CG2-CG1 4.12Å; V102-V214 HydrophobicContact CG2-CG2 4.14Å; V102-I277 HydrophobicContact CG1-CG1 4.49Å
103	A	88.7	Confident	83.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-54.2	-51.7	176.6	0	0	0	0	0	112.5	L91 K99 K105 I106 I107 L117 I192	L91-A103 HydrophobicContact CD1-CB 3.63Å; K99-A103 WeakPolarHBondContact O-CB 3.43Å; K99-A103 PolarHBondContact O-N 3.2Å; A103-K105 PolarHBondContact O-N 3.49Å; A103-I106 PolarHBondContact O-N 3.18Å; A103-I107 WeakPolarHBondContact O-CD1 3.36Å; A103-I107 VanDerWaalsContact O-CG1 3.27Å; A103-I107 WeakPolarHBondContact O-CG1 3.44Å; A103-I107 PolarHBondContact O-N 3.04Å; A103-L117 HydrophobicContact CB-CD1 3.82Å; A103-I192 HydrophobicContact CB-CG2 3.93Å
104	R	87.5	Confident	82.8	Confident	145 Å²	145	37.1 Å²	37.1	55%	0.547	20%	0.197	S	C	.	.	H	α-helix	trans	-61.7	-43.7	178	-73.5	175.2	-161.9	-178.9	7	112	T100 V102 I106 I107 E108	T100-R104 WeakPolarHBondContact O-CB 3.44Å; T100-R104 VanDerWaalsContact O-CG 3.24Å; T100-R104 WeakPolarHBondContact O-CG 3.19Å; T100-R104 PolarHBondContact O-N 3.04Å; T100-R104 VanDerWaalsContact O-N 3.1Å; V102-R104 PolarHBondContact O-N 3.1Å; R104-I106 PolarHBondContact O-N 3.12Å; R104-I107 PolarHBondContact O-N 2.94Å; R104-E108 WeakPolarHBondContact O-CB 3.27Å; R104-E108 VanDerWaalsContact O-CG 3.24Å; R104-E108 WeakPolarHBondContact O-CG 3.31Å; R104-E108 PolarHBondContact O-N 2.9Å
105	K	87.3	Confident	82.3	Confident	62 Å²	62	38.1 Å²	38.1	27%	0.27	20%	0.202	S	C	.	.	H	α-helix	trans	-64.3	-37.5	177.1	-77.3	-169.4	167.3	-168.9	0	113.5	T101 V102 A103 E108 A109 G271 M274 I277	T101-K105 WeakPolarHBondContact O-CB 3.35Å; T101-K105 WeakPolarHBondContact O-CG 3.26Å; T101-K105 PolarHBondContact O-N 3.33Å; V102-K105 PolarHBondContact O-N 2.88Å; A103-K105 PolarHBondContact O-N 3.49Å; K105-E108 PolarHBondContact O-N 2.78Å; K105-A109 VanDerWaalsContact O-CB 3.23Å; K105-A109 WeakPolarHBondContact O-CB 3.49Å; K105-A109 PolarHBondContact O-N 2.88Å; K105-G271 WeakPolarHBondContact CD-O 3.3Å; K105-G271 WeakPolarHBondContact CE-O 3.3Å; K105-G271 PolarHBondContact NZ-O 3.18Å; K105-M274 HydrophobicContact CD-SD 3.94Å; K105-M274 PolarHBondContact NZ-SD 3.4Å; K105-I277 HydrophobicContact CB-CD1 3.89Å; K105-I277 HydrophobicContact CB-CG2 4.22Å; K105-I277 HydrophobicContact CD-CD1 3.68Å; K105-I277 HydrophobicContact CG-CD1 4.44Å
106	I	86.9	Confident	82.1	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-45.8	172.5	-66.5	164.4	0	0	0	109.7	V102 A103 R104 E108 A109 L110 I192 I277 I280 V281	V102-I106 HydrophobicContact CG1-CD1 3.71Å; V102-I106 HydrophobicContact CG1-CG1 4.38Å; V102-I106 WeakPolarHBondContact O-CG1 3.43Å; V102-I106 PolarHBondContact O-N 3.29Å; A103-I106 PolarHBondContact O-N 3.18Å; R104-I106 PolarHBondContact O-N 3.12Å; I106-E108 PolarHBondContact O-N 3.36Å; I106-A109 PolarHBondContact O-N 3.06Å; I106-L110 HydrophobicContact CG2-CD1 3.58Å; I106-L110 HydrophobicContact CG2-CG 4Å; I106-L110 VanDerWaalsContact O-CB 3.29Å; I106-L110 WeakPolarHBondContact O-CB 3.49Å; I106-L110 WeakPolarHBondContact O-CG 3.38Å; I106-L110 PolarHBondContact O-N 3.3Å; I106-I192 HydrophobicContact CB-CD1 4.07Å; I106-I192 HydrophobicContact CG2-CD1 3.71Å; I106-I277 HydrophobicContact CG1-CG2 4.02Å; I106-I280 HydrophobicContact CD1-CD1 4.24Å; I106-I280 HydrophobicContact CD1-CG2 3.95Å; I106-I280 HydrophobicContact CG1-CG2 4.32Å; I106-V281 HydrophobicContact CG2-CG2 4.41Å
107	I	84.9	Confident	82.2	Confident	38 Å²	38	39.6 Å²	39.6	20%	0.195	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-42.2	176.4	-63.5	160.3	0	0	0	111.8	A103 R104 A109 V115 L117 I192	A103-I107 WeakPolarHBondContact O-CD1 3.36Å; A103-I107 VanDerWaalsContact O-CG1 3.27Å; A103-I107 WeakPolarHBondContact O-CG1 3.44Å; A103-I107 PolarHBondContact O-N 3.04Å; R104-I107 PolarHBondContact O-N 2.94Å; I107-A109 VanDerWaalsContact C-N 3.28Å; I107-A109 PolarHBondContact O-N 2.9Å; I107-V115 HydrophobicContact CG1-CB 4.33Å; I107-V115 HydrophobicContact CG1-CG1 3.8Å; I107-L117 HydrophobicContact CD1-CB 4.03Å; I107-I192 HydrophobicContact CD1-CD1 4.25Å; I107-I192 HydrophobicContact CG1-CD1 3.7Å
108	E	82.9	Confident	82.2	Confident	113 Å²	113	39.6 Å²	39.6	53%	0.528	21%	0.207	S	C	.	.	H	α-helix	trans	-70.6	-20.8	-179.6	-73.8	165.7	-149.6	0	0	113.6	R104 K105 I106	R104-E108 WeakPolarHBondContact O-CB 3.27Å; R104-E108 VanDerWaalsContact O-CG 3.24Å; R104-E108 WeakPolarHBondContact O-CG 3.31Å; R104-E108 PolarHBondContact O-N 2.9Å; K105-E108 PolarHBondContact O-N 2.78Å; I106-E108 PolarHBondContact O-N 3.36Å
109	A	82.3	Confident	82.4	Confident	43 Å²	43	40.3 Å²	40.3	36%	0.355	21%	0.209	S	C	.	.	H	α-helix	trans	-104.8	-22.2	-179.1	0	0	0	0	0	114	K105 I106 I107 D111 V281	K105-A109 VanDerWaalsContact O-CB 3.23Å; K105-A109 WeakPolarHBondContact O-CB 3.49Å; K105-A109 PolarHBondContact O-N 2.88Å; I106-A109 PolarHBondContact O-N 3.06Å; I107-A109 VanDerWaalsContact C-N 3.28Å; I107-A109 PolarHBondContact O-N 2.9Å; A109-D111 VanDerWaalsContact C-N 3.31Å; A109-V281 HydrophobicContact CB-CG1 4.31Å; A109-V281 HydrophobicContact CB-CG2 3.76Å
110	L	78.2	Confident	82.3	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-71.4	-24.1	172.8	-81.3	175.1	0	0	0	113.6	I106 V112 V115 V281 V284 H285	I106-L110 HydrophobicContact CG2-CD1 3.58Å; I106-L110 HydrophobicContact CG2-CG 4Å; I106-L110 VanDerWaalsContact O-CB 3.29Å; I106-L110 WeakPolarHBondContact O-CB 3.49Å; I106-L110 WeakPolarHBondContact O-CG 3.38Å; I106-L110 PolarHBondContact O-N 3.3Å; L110-V112 HydrophobicContact CB-CG2 3.94Å; L110-V112 PolarHBondContact O-N 2.75Å; L110-V115 HydrophobicContact CD1-CG2 3.94Å; L110-V281 HydrophobicContact CD2-CB 4.47Å; L110-V281 HydrophobicContact CD2-CG1 4.19Å; L110-V281 HydrophobicContact CD2-CG2 4.49Å; L110-V281 HydrophobicContact CG-CG2 4.35Å; L110-V284 HydrophobicContact CD1-CG1 4.13Å; L110-V284 HydrophobicContact CD2-CB 3.77Å; L110-V284 HydrophobicContact CD2-CG1 3.48Å; L110-V284 VanDerWaalsContact CD2-CG1 3.48Å; L110-V284 HydrophobicContact CG-CG1 4.49Å; L110-H285 PolarHBondContact O-CE1 3.49Å; L110-H285 PolarHBondContact O-NE2 3.3Å
111	D	69.8	Low	82.2	Confident	50 Å²	50	39.2 Å²	39.2	27%	0.267	20%	0.203	S	C	.	.			trans	53.8	-4.3	-179.4	-141.6	15.6	0	0	0	117.8	P58 L59 A109	P58-D111 VanDerWaalsContact CD-OD2 3.27Å; P58-D111 WeakPolarHBondContact CD-OD2 3.37Å; P58-D111 WeakPolarHBondContact CG-OD2 3.3Å; L59-D111 WeakPolarHBondContact CD1-OD1 3.36Å; L59-D111 WeakPolarHBondContact CG-OD1 3.27Å; A109-D111 VanDerWaalsContact C-N 3.31Å
112	V	66	Low	82.1	Confident	45 Å²	45	37 Å²	37	27%	0.273	19%	0.19	S	C	.	.			trans	-77.4	133.5	177.6	-79.4	0	0	0	0	112.1	L110 W114 V115 L288	L110-V112 HydrophobicContact CB-CG2 3.94Å; L110-V112 PolarHBondContact O-N 2.75Å; V112-W114 PolarHBondContact O-N 2.73Å; V112-W114 VanDerWaalsContact O-N 3.08Å; V112-V115 HydrophobicContact CG2-CG2 3.64Å; V112-L288 HydrophobicContact CG2-CD1 4.35Å
113	P	56.3	Low	82	Confident	31 Å²	31	37 Å²	37	20%	0.201	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-12.8	-179.1	-13.8	22.8	0	0	0	114.8	Y68 V115	Y68-P113 HydrophobicContact CD1-CB 3.63Å; Y68-P113 HydrophobicContact CD1-CG 3.68Å; Y68-P113 HydrophobicContact CD2-CB 4.42Å; Y68-P113 HydrophobicContact CE1-CB 4.08Å; Y68-P113 HydrophobicContact CE1-CG 4.42Å; Y68-P113 HydrophobicContact CG-CB 3.83Å; Y68-P113 HydrophobicContact CG-CG 4.05Å; P113-V115 PolarHBondContact O-N 3.1Å
114	W	72	Confident	82	Confident	62 Å²	62	37.9 Å²	37.9	24%	0.235	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	25.9	-163.2	-46.7	104.9	0	0	0	113.7	G71 R72 V112 S189 V190	G71-W114 PolarHBondContact O-NE1 2.88Å; R72-W114 VanDerWaalsContact CA-CE2 3.47Å; R72-W114 HydrophobicContact CB-CD2 3.75Å; R72-W114 HydrophobicContact CB-CE3 4.11Å; R72-W114 HydrophobicContact CB-CG 4.43Å; R72-W114 HydrophobicContact CB-CH2 3.9Å; R72-W114 HydrophobicContact CB-CZ2 3.52Å; R72-W114 HydrophobicContact CB-CZ3 4.16Å; R72-W114 HydrophobicContact CG-CD2 3.54Å; R72-W114 HydrophobicContact CG-CE3 3.96Å; R72-W114 HydrophobicContact CG-CG 3.83Å; R72-W114 HydrophobicContact CG-CZ2 4.29Å; R72-W114 HydrophobicContact CG-CZ3 4.47Å; R72-W114 VanDerWaalsContact N-CZ2 3.28Å; V112-W114 PolarHBondContact O-N 2.73Å; V112-W114 VanDerWaalsContact O-N 3.08Å; W114-S189 PolarHBondContact O-N 3.31Å; W114-V190 PolarHBondContact O-N 2.83Å
115	V	79.1	Confident	82	Confident	21 Å²	21	35.2 Å²	35.2	13%	0.127	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.8	176.2	-166.7	0	0	0	0	110.9	I107 L110 V112 P113 V190 I192	I107-V115 HydrophobicContact CG1-CB 4.33Å; I107-V115 HydrophobicContact CG1-CG1 3.8Å; L110-V115 HydrophobicContact CD1-CG2 3.94Å; V112-V115 HydrophobicContact CG2-CG2 3.64Å; P113-V115 PolarHBondContact O-N 3.1Å; V115-V190 WeakPolarHBondContact CA-O 3.39Å; V115-V190 HydrophobicContact CG1-CB 4.21Å; V115-V190 HydrophobicContact CG1-CG1 4.21Å; V115-V190 HydrophobicContact CG2-CB 4.28Å; V115-I192 HydrophobicContact CG1-CD1 3.75Å; V115-I192 HydrophobicContact CG1-CG1 3.91Å
116	V	83.4	Confident	82	Confident	17 Å²	17	36.2 Å²	36.2	10%	0.103	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	117.8	177.9	167.4	0	0	0	0	110.6	L118 V185 A188 V190 I192	V116-L118 PolarHBondContact O-N 3.01Å; V116-V185 HydrophobicContact CB-CG1 4.28Å; V116-V185 HydrophobicContact CG1-CG1 3.76Å; V116-V185 HydrophobicContact CG2-CG1 3.45Å; V116-V185 VanDerWaalsContact CG2-CG1 3.45Å; V116-A188 HydrophobicContact CB-CB 3.96Å; V116-A188 HydrophobicContact CG2-CB 3.61Å; V116-V190 PolarHBondContact N-O 3.42Å; V116-I192 PolarHBondContact O-N 3.22Å
117	L	86.8	Confident	81.9	Confident	46 Å²	46	36.6 Å²	36.6	24%	0.241	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	109.7	163.5	-174.8	57.3	0	0	0	110	A103 I107 I192 E194	A103-L117 HydrophobicContact CB-CD1 3.82Å; I107-L117 HydrophobicContact CD1-CB 4.03Å; L117-I192 WeakPolarHBondContact CA-O 3.3Å; L117-I192 HydrophobicContact CD1-CB 4.26Å; L117-I192 HydrophobicContact CD1-CG2 3.97Å; L117-E194 HydrophobicContact CD1-CG 4.01Å
118	L	89.1	Confident	81.9	Confident	1 Å²	1	37 Å²	37	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	118.7	171.1	-177.3	68.5	0	0	0	108.3	V116 F123 L153 T156 L157 L160 I168 I191 I192 F193 E194	V116-L118 PolarHBondContact O-N 3.01Å; L118-F123 HydrophobicContact CD1-CE2 3.74Å; L118-F123 HydrophobicContact CD1-CZ 3.9Å; L118-F123 HydrophobicContact CG-CE2 4.37Å; L118-L153 HydrophobicContact CD2-CD1 4.23Å; L118-T156 HydrophobicContact CD1-CG2 4.31Å; L118-L157 HydrophobicContact CD2-CB 4.42Å; L118-L157 HydrophobicContact CD2-CD1 3.95Å; L118-L160 HydrophobicContact CD1-CD1 4.34Å; L118-L160 HydrophobicContact CD2-CD1 4.27Å; L118-I168 HydrophobicContact CD1-CD1 3.68Å; L118-I168 HydrophobicContact CD1-CG1 4.24Å; L118-I168 HydrophobicContact CD1-CG2 4.47Å; L118-I191 HydrophobicContact CB-CG2 4.36Å; L118-I192 PolarHBondContact N-O 3.41Å; L118-F193 HydrophobicContact CB-CD2 4.39Å; L118-F193 HydrophobicContact CD2-CD2 3.94Å; L118-F193 HydrophobicContact CG-CD2 4.07Å; L118-F193 CarbonylContact O-C 3.58Å; L118-F193 VanDerWaalsContact O-CA 3.32Å; L118-F193 WeakPolarHBondContact O-CA 3.49Å; L118-E194 PolarHBondContact O-N 3.38Å
119	S	89.8	Confident	82	Confident	29 Å²	29	36.3 Å²	36.3	20%	0.203	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.9	178.3	-164.6	0	0	0	0	110.7	D121 S122 F123 E194	S119-D121 PolarHBondContact O-N 3.26Å; S119-S122 WeakPolarHBondContact O-CB 3.18Å; S119-S122 PolarHBondContact O-N 3.49Å; S119-F123 WeakPolarHBondContact O-CD2 3.28Å; S119-E194 PolarHBondContact OG-OE1 3.13Å
120	M	90.1	Very high	82	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-56.6	-27.3	175.2	-169.8	173.5	-171.9	0	0	112.2	S122 F123 F148 F150 L153 F193 E194 M197	M120-S122 PolarHBondContact O-N 3.47Å; M120-S122 VanDerWaalsContact O-N 3.17Å; M120-F123 PolarHBondContact O-N 2.98Å; M120-F148 HydrophobicContact CE-CB 4.11Å; M120-F148 HydrophobicContact CE-CD1 3.83Å; M120-F148 HydrophobicContact CE-CD2 3.96Å; M120-F148 HydrophobicContact CE-CE1 4.21Å; M120-F148 HydrophobicContact CE-CE2 4.34Å; M120-F148 HydrophobicContact CE-CG 3.68Å; M120-F148 HydrophobicContact CE-CZ 4.45Å; M120-F148 HydrophobicContact CG-CD1 3.78Å; M120-F148 HydrophobicContact CG-CE1 3.78Å; M120-F148 HydrophobicContact SD-CD1 4.42Å; M120-F148 HydrophobicContact SD-CE1 4.32Å; M120-F150 HydrophobicContact CE-CD1 4.47Å; M120-F150 HydrophobicContact CE-CE1 3.54Å; M120-F150 HydrophobicContact CE-CZ 3.67Å; M120-L153 HydrophobicContact CE-CD2 4.36Å; M120-L153 HydrophobicContact CG-CD2 3.93Å; M120-F193 HydrophobicContact CB-CE2 3.84Å; M120-F193 HydrophobicContact CB-CZ 4.15Å; M120-F193 HydrophobicContact CG-CE2 4.4Å; M120-F193 HydrophobicContact CG-CZ 4.32Å; M120-F193 HydrophobicContact SD-CZ 4.34Å; M120-E194 VanDerWaalsContact CB-O 3.29Å; M120-E194 WeakPolarHBondContact CB-O 3.46Å; M120-E194 PolarHBondContact N-O 2.71Å; M120-M197 HydrophobicContact CE-CB 3.7Å; M120-M197 HydrophobicContact SD-CB 4.07Å
121	D	86.4	Confident	82.3	Confident	45 Å²	45	44.5 Å²	44.5	24%	0.241	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-61.8	-18	175.7	-84.6	-4.1	0	0	0	113.8	S119 F123 Y124 F173	S119-D121 PolarHBondContact O-N 3.26Å; D121-F123 PolarHBondContact O-N 2.81Å; D121-Y124 HydrophobicContact CB-CE2 3.9Å; D121-Y124 WeakPolarHBondContact O-CD2 3.45Å; D121-Y124 VanDerWaalsContact OD1-CE2 3.24Å; D121-Y124 WeakPolarHBondContact OD1-CE2 3.35Å; D121-Y124 PolarHBondContact OD1-OH 3.4Å; D121-F173 HydrophobicContact CB-CE1 4.3Å; D121-F173 HydrophobicContact CB-CZ 3.86Å
122	S	85.7	Confident	82.9	Confident	28 Å²	28	46 Å²	46	20%	0.196	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-69.4	-18.9	169.8	-86	0	0	0	0	113.1	S119 M120 P169	S119-S122 WeakPolarHBondContact O-CB 3.18Å; S119-S122 PolarHBondContact O-N 3.49Å; M120-S122 PolarHBondContact O-N 3.47Å; M120-S122 VanDerWaalsContact O-N 3.17Å; S122-P169 WeakPolarHBondContact CB-O 3.04Å; S122-P169 WeakPolarHBondContact O-CG 3.24Å; S122-P169 PolarHBondContact OG-O 2.92Å; S122-P169 VanDerWaalsContact OG-O 3.08Å
123	F	89.6	Confident	83.6	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-109.9	18.4	-165.7	-59.5	-95.2	0	0	0	113.6	L118 S119 M120 D121 D149 L152 L153 T156 I168 P169	L118-F123 HydrophobicContact CD1-CE2 3.74Å; L118-F123 HydrophobicContact CD1-CZ 3.9Å; L118-F123 HydrophobicContact CG-CE2 4.37Å; S119-F123 WeakPolarHBondContact O-CD2 3.28Å; M120-F123 PolarHBondContact O-N 2.98Å; D121-F123 PolarHBondContact O-N 2.81Å; F123-D149 VanDerWaalsContact O-CB 3.28Å; F123-D149 WeakPolarHBondContact O-CB 3.39Å; F123-D149 PolarHBondContact O-N 3Å; F123-L152 HydrophobicContact CD1-CB 4.47Å; F123-L152 HydrophobicContact CD1-CD2 4.18Å; F123-L152 HydrophobicContact CD1-CG 4.05Å; F123-L152 HydrophobicContact CE1-CD2 4.48Å; F123-L152 HydrophobicContact CE1-CG 4.14Å; F123-L153 HydrophobicContact CB-CB 4.24Å; F123-L153 HydrophobicContact CB-CD2 4.45Å; F123-L153 HydrophobicContact CD1-CB 3.85Å; F123-L153 HydrophobicContact CD1-CD1 4.22Å; F123-L153 HydrophobicContact CD2-CD1 3.74Å; F123-L153 HydrophobicContact CE1-CB 4.4Å; F123-L153 HydrophobicContact CE1-CD1 4.27Å; F123-L153 HydrophobicContact CE2-CD1 3.8Å; F123-L153 HydrophobicContact CG-CB 3.98Å; F123-L153 HydrophobicContact CG-CD1 3.97Å; F123-L153 HydrophobicContact CG-CG 4.37Å; F123-L153 HydrophobicContact CZ-CD1 4.07Å; F123-T156 HydrophobicContact CE1-CG2 4.18Å; F123-T156 HydrophobicContact CZ-CG2 3.84Å; F123-I168 HydrophobicContact CE2-CG2 4.22Å; F123-I168 HydrophobicContact CZ-CG2 4.01Å; F123-P169 HydrophobicContact CD1-CG 4.38Å; F123-P169 HydrophobicContact CE1-CG 4.27Å
124	Y	88.2	Confident	84.9	Confident	18 Å²	18	50.9 Å²	50.9	7%	0.071	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-56.1	144.9	164.3	-69.9	-71.7	0	0	0	110.6	D121 F142 A147 F148 Y171 F173 R178	D121-Y124 HydrophobicContact CB-CE2 3.9Å; D121-Y124 WeakPolarHBondContact O-CD2 3.45Å; D121-Y124 VanDerWaalsContact OD1-CE2 3.24Å; D121-Y124 WeakPolarHBondContact OD1-CE2 3.35Å; D121-Y124 PolarHBondContact OD1-OH 3.4Å; Y124-F142 HydrophobicContact CD1-CD1 4.4Å; Y124-F142 HydrophobicContact CE1-CB 4.28Å; Y124-F142 HydrophobicContact CE1-CD1 4.38Å; Y124-A147 CarbonylContact C-O 3.58Å; Y124-A147 WeakPolarHBondContact CA-O 3.5Å; Y124-A147 HydrophobicContact CD1-CB 4.22Å; Y124-F148 HydrophobicContact CD1-CD1 4.11Å; Y124-F148 AromaticContact CD1-CE1 3.77Å; Y124-F148 HydrophobicContact CD1-CE1 3.77Å; Y124-F148 HydrophobicContact CD1-CZ 4.12Å; Y124-F148 HydrophobicContact CE1-CD1 4.08Å; Y124-F148 AromaticContact CE1-CE1 3.3Å; Y124-F148 HydrophobicContact CE1-CE1 3.3Å; Y124-F148 HydrophobicContact CE1-CE2 4.1Å; Y124-F148 AromaticContact CE1-CZ 3.31Å; Y124-F148 HydrophobicContact CE1-CZ 3.31Å; Y124-F148 HydrophobicContact CE2-CE1 4.23Å; Y124-F148 HydrophobicContact CG-CE1 4.39Å; Y124-F148 AromaticContact CZ-CE1 3.52Å; Y124-F148 AromaticContact CZ-CZ 3.66Å; Y124-Y171 AromaticContact CD2-CD1 3.63Å; Y124-Y171 HydrophobicContact CD2-CD1 3.63Å; Y124-Y171 AromaticContact CD2-CE1 3.49Å; Y124-Y171 HydrophobicContact CD2-CE1 3.49Å; Y124-Y171 VanDerWaalsContact CD2-CE1 3.49Å; Y124-Y171 HydrophobicContact CD2-CG 4.28Å; Y124-Y171 HydrophobicContact CE2-CE1 4.36Å; Y124-Y171 HydrophobicContact CG-CD1 4.35Å; Y124-Y171 AromaticContact CG-CE1 3.95Å; Y124-Y171 HydrophobicContact CG-CE1 3.95Å; Y124-F173 HydrophobicContact CE2-CE1 4.08Å; Y124-R178 PolarHBondContact O-NE 3.15Å; Y124-R178 VanDerWaalsContact O-NE 3.09Å; Y124-R178 PolarHBondContact O-NH2 3.06Å
125	K	87.3	Confident	85.2	Confident	89 Å²	89	48.1 Å²	48.1	39%	0.387	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-66.8	155.3	167.7	-67.4	178.8	-174.6	151	0	109.8	D146 A147 F148 D149	K125-D146 WeakPolarHBondContact CD-O 3.49Å; K125-D146 WeakPolarHBondContact CE-O 3.36Å; K125-D146 PolarHBondContact NZ-O 2.99Å; K125-A147 PolarHBondContact N-O 3.31Å; K125-F148 WeakPolarHBondContact CE-O 3.46Å; K125-F148 PolarHBondContact NZ-O 3.35Å; K125-D149 HydrophobicContact CG-CB 4.27Å
126	V	86.1	Confident	85.2	Confident	84 Å²	84	51.1 Å²	51.1	51%	0.509	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-78	123	172.7	178.6	0	0	0	0	107.8	R178	V126-R178 HydrophobicContact CG2-CB 4.19Å; V126-R178 HydrophobicContact CG2-CG 3.85Å
127	L	85.4	Confident	85.1	Confident	8 Å²	8	58.7 Å²	58.7	4%	0.042	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-69.7	139.8	-179.1	-62.5	-169.4	0	0	0	111.5	E131 Q132 A135 Y140 F142 H176	L127-E131 HydrophobicContact CB-CB 3.92Å; L127-E131 HydrophobicContact CD1-CB 4.33Å; L127-E131 HydrophobicContact CD2-CB 4.17Å; L127-E131 HydrophobicContact CG-CB 4.36Å; L127-Q132 HydrophobicContact CB-CG 3.75Å; L127-Q132 PolarHBondContact O-NE2 3.42Å; L127-A135 HydrophobicContact CD1-CB 3.85Å; L127-Y140 HydrophobicContact CD1-CD1 4.4Å; L127-Y140 HydrophobicContact CD1-CE1 4.46Å; L127-Y140 HydrophobicContact CD2-CD1 4.38Å; L127-Y140 HydrophobicContact CD2-CE1 3.67Å; L127-Y140 HydrophobicContact CD2-CE2 4.07Å; L127-Y140 VanDerWaalsContact CD2-CZ 3.48Å; L127-Y140 WeakPolarHBondContact CD2-OH 3.49Å; L127-F142 HydrophobicContact CD1-CE1 3.99Å; L127-F142 HydrophobicContact CD1-CZ 3.94Å; L127-H176 HydrophobicContact CB-CB 4.46Å; L127-H176 HydrophobicContact CD1-CB 3.76Å; L127-H176 HydrophobicContact CG-CB 4.04Å
128	S	85.9	Confident	84.7	Confident	46 Å²	46	58.1 Å²	58.1	32%	0.322	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-65.4	162.9	166.8	67.1	0	0	0	0	111.7	E130 E131 Q132	S128-E130 PolarHBondContact O-N 2.98Å; S128-E131 WeakPolarHBondContact CB-OE2 3.42Å; S128-E131 PolarHBondContact N-OE2 3.21Å; S128-E131 PolarHBondContact O-N 3.4Å; S128-E131 VanDerWaalsContact O-N 3.15Å; S128-E131 VanDerWaalsContact OG-CG 3.31Å; S128-E131 WeakPolarHBondContact OG-CG 3.32Å; S128-E131 PolarHBondContact OG-N 2.83Å; S128-E131 PolarHBondContact OG-OE2 2.79Å; S128-Q132 VanDerWaalsContact O-CG 3.31Å; S128-Q132 WeakPolarHBondContact O-CG 3.43Å; S128-Q132 PolarHBondContact O-N 2.92Å
129	P	83.7	Confident	84.4	Confident	99 Å²	99	60.5 Å²	60.5	64%	0.643	32%	0.323	S	S	*	.	H	α-helix	trans	-56.9	-32	178.9	-26.6	36.2	0	0	0	114	L133	P129-L133 WeakPolarHBondContact O-CG 3.12Å; P129-L133 PolarHBondContact O-N 2.85Å
130	E	83.6	Confident	84.2	Confident	153 Å²	153	60.8 Å²	60.8	72%	0.715	32%	0.319	S	S	*	.	H	α-helix	trans	-72.6	-43.7	177.2	-62.3	-177.1	-172.4	0	0	111.5	S128 Q132 L133 L134	S128-E130 PolarHBondContact O-N 2.98Å; E130-Q132 VanDerWaalsContact C-N 3.32Å; E130-Q132 PolarHBondContact O-N 3.03Å; E130-L133 WeakPolarHBondContact O-CB 3.04Å; E130-L133 PolarHBondContact O-N 3.02Å; E130-L134 PolarHBondContact O-N 3.01Å; E130-L134 VanDerWaalsContact O-N 3.07Å
131	E	84.9	Confident	83.9	Confident	62 Å²	62	62.6 Å²	62.6	29%	0.29	33%	0.329	S	S	.	.	H	α-helix	trans	-66	-33.2	175	-67.2	166.5	116.4	0	0	112.2	L127 S128 L133 L134 A135 Y140	L127-E131 HydrophobicContact CB-CB 3.92Å; L127-E131 HydrophobicContact CD1-CB 4.33Å; L127-E131 HydrophobicContact CD2-CB 4.17Å; L127-E131 HydrophobicContact CG-CB 4.36Å; S128-E131 WeakPolarHBondContact CB-OE2 3.42Å; S128-E131 PolarHBondContact N-OE2 3.21Å; S128-E131 PolarHBondContact O-N 3.4Å; S128-E131 VanDerWaalsContact O-N 3.15Å; S128-E131 VanDerWaalsContact OG-CG 3.31Å; S128-E131 WeakPolarHBondContact OG-CG 3.32Å; S128-E131 PolarHBondContact OG-N 2.83Å; S128-E131 PolarHBondContact OG-OE2 2.79Å; E131-L133 VanDerWaalsContact C-N 3.34Å; E131-L134 PolarHBondContact O-N 2.97Å; E131-A135 WeakPolarHBondContact O-CB 3.41Å; E131-A135 PolarHBondContact O-N 2.89Å; E131-Y140 HydrophobicContact CB-CD2 4.03Å; E131-Y140 HydrophobicContact CB-CE2 3.89Å; E131-Y140 HydrophobicContact CG-CD2 4.17Å; E131-Y140 HydrophobicContact CG-CE2 3.73Å; E131-Y140 WeakPolarHBondContact OE1-CE2 3.13Å; E131-Y140 PolarHBondContact OE1-OH 2.89Å
132	Q	81.6	Confident	83.8	Confident	82 Å²	82	61.4 Å²	61.4	38%	0.383	32%	0.322	S	S	.	.	H	α-helix	trans	-62.9	-39.5	172	-70.1	172.9	27.2	0	0	111.7	L127 S128 E130 A135 A136	L127-Q132 HydrophobicContact CB-CG 3.75Å; L127-Q132 PolarHBondContact O-NE2 3.42Å; S128-Q132 VanDerWaalsContact O-CG 3.31Å; S128-Q132 WeakPolarHBondContact O-CG 3.43Å; S128-Q132 PolarHBondContact O-N 2.92Å; E130-Q132 VanDerWaalsContact C-N 3.32Å; E130-Q132 PolarHBondContact O-N 3.03Å; Q132-A135 PolarHBondContact O-N 3.08Å; Q132-A136 WeakPolarHBondContact O-CB 3.17Å; Q132-A136 PolarHBondContact O-N 3.19Å
133	L	81.3	Confident	83.8	Confident	107 Å²	107	60.5 Å²	60.5	56%	0.56	32%	0.315	S	S	*	.	H	α-helix	trans	-67.3	-33.8	174.1	-69.6	169.2	0	0	0	112.5	P129 E130 E131 R137	P129-L133 WeakPolarHBondContact O-CG 3.12Å; P129-L133 PolarHBondContact O-N 2.85Å; E130-L133 WeakPolarHBondContact O-CB 3.04Å; E130-L133 PolarHBondContact O-N 3.02Å; E131-L133 VanDerWaalsContact C-N 3.34Å; L133-R137 WeakPolarHBondContact O-CD 3.35Å; L133-R137 VanDerWaalsContact O-CG 3.3Å; L133-R137 WeakPolarHBondContact O-CG 3.43Å; L133-R137 PolarHBondContact O-N 3.06Å
134	L	82.1	Confident	83.8	Confident	72 Å²	72	62.7 Å²	62.7	38%	0.377	33%	0.325	S	S	.	.	H	α-helix	trans	-69.6	-44.2	171.6	-66.1	174.8	0	0	0	111.6	E130 E131 A136 R137 N138 D139	E130-L134 PolarHBondContact O-N 3.01Å; E130-L134 VanDerWaalsContact O-N 3.07Å; E131-L134 PolarHBondContact O-N 2.97Å; L134-A136 PolarHBondContact O-N 3.46Å; L134-R137 CarbonylContact O-C 3.49Å; L134-R137 WeakPolarHBondContact O-CA 3.28Å; L134-R137 PolarHBondContact O-N 3.01Å; L134-N138 PolarHBondContact O-N 3.46Å; L134-D139 PolarHBondContact O-N 2.85Å
135	A	79.8	Confident	83.7	Confident	4 Å²	4	63.2 Å²	63.2	3%	0.033	33%	0.331	C	S	.	.	H	α-helix	trans	-60.6	-43.6	177.5	0	0	0	0	0	112.1	L127 E131 Q132 R137 N138 F142	L127-A135 HydrophobicContact CD1-CB 3.85Å; E131-A135 WeakPolarHBondContact O-CB 3.41Å; E131-A135 PolarHBondContact O-N 2.89Å; Q132-A135 PolarHBondContact O-N 3.08Å; A135-R137 PolarHBondContact O-N 3.13Å; A135-N138 WeakPolarHBondContact O-CA 3.34Å; A135-N138 PolarHBondContact O-N 3.26Å; A135-F142 HydrophobicContact CB-CE2 4.1Å; A135-F142 HydrophobicContact CB-CZ 3.79Å
136	A	78	Confident	83.7	Confident	83 Å²	83	63.9 Å²	63.9	69%	0.686	34%	0.339	S	S	*	.	H	α-helix	trans	-61.1	-24.1	174.4	0	0	0	0	0	113.4	Q132 L134	Q132-A136 WeakPolarHBondContact O-CB 3.17Å; Q132-A136 PolarHBondContact O-N 3.19Å; L134-A136 PolarHBondContact O-N 3.46Å
137	R	81.4	Confident	83.8	Confident	176 Å²	176	60 Å²	60	66%	0.664	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	8.1	175	-66.1	171.1	-178.2	-176.5	1.7	113.5	L133 L134 A135 D139	L133-R137 WeakPolarHBondContact O-CD 3.35Å; L133-R137 VanDerWaalsContact O-CG 3.3Å; L133-R137 WeakPolarHBondContact O-CG 3.43Å; L133-R137 PolarHBondContact O-N 3.06Å; L134-R137 CarbonylContact O-C 3.49Å; L134-R137 WeakPolarHBondContact O-CA 3.28Å; L134-R137 PolarHBondContact O-N 3.01Å; A135-R137 PolarHBondContact O-N 3.13Å; R137-D139 HydrophobicContact CB-CB 4.37Å; R137-D139 PolarHBondContact O-N 3.29Å
138	N	78.9	Confident	84	Confident	35 Å²	35	59.7 Å²	59.7	19%	0.187	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	27.9	-169.5	-63.3	-73.5	0	0	0	113.5	L134 A135	L134-N138 PolarHBondContact O-N 3.46Å; A135-N138 WeakPolarHBondContact O-CA 3.34Å; A135-N138 PolarHBondContact O-N 3.26Å
139	D	83.4	Confident	84.2	Confident	50 Å²	50	59.1 Å²	59.1	27%	0.267	31%	0.307	S	S	.	.			trans	-113.2	20.2	-172.8	-136.3	44	0	0	0	113.9	L134 R137 K242 K246	L134-D139 PolarHBondContact O-N 2.85Å; R137-D139 HydrophobicContact CB-CB 4.37Å; R137-D139 PolarHBondContact O-N 3.29Å; D139-K242 IonicContact OD1-NZ 2.71Å; D139-K246 IonicContact OD1-NZ 2.72Å; D139-K246 PolarHBondContact OD1-NZ 2.78Å; D139-K246 IonicContact OD2-NZ 3.99Å; D139-K246 PolarHBondContact OD2-NZ 3.3Å
140	Y	83.9	Confident	84.5	Confident	35 Å²	35	56.1 Å²	56.1	14%	0.137	28%	0.284	C	S	.	.	S	Bend	trans	-111.7	140.8	173.1	-174.4	-92	0	0	0	111.4	L127 E131 F142	L127-Y140 HydrophobicContact CD1-CD1 4.4Å; L127-Y140 HydrophobicContact CD1-CE1 4.46Å; L127-Y140 HydrophobicContact CD2-CD1 4.38Å; L127-Y140 HydrophobicContact CD2-CE1 3.67Å; L127-Y140 HydrophobicContact CD2-CE2 4.07Å; L127-Y140 VanDerWaalsContact CD2-CZ 3.48Å; L127-Y140 WeakPolarHBondContact CD2-OH 3.49Å; E131-Y140 HydrophobicContact CB-CD2 4.03Å; E131-Y140 HydrophobicContact CB-CE2 3.89Å; E131-Y140 HydrophobicContact CG-CD2 4.17Å; E131-Y140 HydrophobicContact CG-CE2 3.73Å; E131-Y140 WeakPolarHBondContact OE1-CE2 3.13Å; E131-Y140 PolarHBondContact OE1-OH 2.89Å; Y140-F142 AromaticContact CD1-CD1 3.99Å; Y140-F142 HydrophobicContact CD1-CD1 3.99Å; Y140-F142 AromaticContact CD1-CD2 3.89Å; Y140-F142 HydrophobicContact CD1-CD2 3.89Å; Y140-F142 AromaticContact CD1-CE1 3.85Å; Y140-F142 HydrophobicContact CD1-CE1 3.85Å; Y140-F142 AromaticContact CD1-CE2 3.75Å; Y140-F142 HydrophobicContact CD1-CE2 3.75Å; Y140-F142 HydrophobicContact CD1-CG 4.01Å; Y140-F142 AromaticContact CD1-CZ 3.73Å; Y140-F142 HydrophobicContact CD1-CZ 3.73Å; Y140-F142 HydrophobicContact CE1-CD1 4.05Å; Y140-F142 HydrophobicContact CE1-CE1 4.06Å; Y140-F142 HydrophobicContact CE1-CG 4.37Å; Y140-F142 HydrophobicContact CE1-CZ 4.4Å; Y140-F142 HydrophobicContact CG-CE2 4.47Å; Y140-F142 PolarHBondContact O-N 2.91Å
141	N	85.3	Confident	84.8	Confident	39 Å²	39	55.4 Å²	55.4	21%	0.209	29%	0.285	C	S	.	.			trans	-93.7	92.8	-178.1	-167.5	4.6	0	0	0	112.4	D143 H144 F247	N141-D143 VanDerWaalsContact C-N 3.28Å; N141-D143 WeakPolarHBondContact OD1-CA 3.44Å; N141-D143 PolarHBondContact OD1-N 3.49Å; N141-H144 HydrophobicContact CB-CB 4.37Å; N141-F247 HydrophobicContact CB-CB 4.49Å; N141-F247 HydrophobicContact CB-CD1 3.56Å; N141-F247 HydrophobicContact CB-CE1 3.94Å; N141-F247 HydrophobicContact CB-CG 4.15Å
142	F	83.8	Confident	85.1	Confident	20 Å²	20	54.6 Å²	54.6	9%	0.088	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-19.9	171.3	-64.9	-82.9	0	0	0	113.3	Y124 L127 A135 Y140 H144 H176	Y124-F142 HydrophobicContact CD1-CD1 4.4Å; Y124-F142 HydrophobicContact CE1-CB 4.28Å; Y124-F142 HydrophobicContact CE1-CD1 4.38Å; L127-F142 HydrophobicContact CD1-CE1 3.99Å; L127-F142 HydrophobicContact CD1-CZ 3.94Å; A135-F142 HydrophobicContact CB-CE2 4.1Å; A135-F142 HydrophobicContact CB-CZ 3.79Å; Y140-F142 AromaticContact CD1-CD1 3.99Å; Y140-F142 HydrophobicContact CD1-CD1 3.99Å; Y140-F142 AromaticContact CD1-CD2 3.89Å; Y140-F142 HydrophobicContact CD1-CD2 3.89Å; Y140-F142 AromaticContact CD1-CE1 3.85Å; Y140-F142 HydrophobicContact CD1-CE1 3.85Å; Y140-F142 AromaticContact CD1-CE2 3.75Å; Y140-F142 HydrophobicContact CD1-CE2 3.75Å; Y140-F142 HydrophobicContact CD1-CG 4.01Å; Y140-F142 AromaticContact CD1-CZ 3.73Å; Y140-F142 HydrophobicContact CD1-CZ 3.73Å; Y140-F142 HydrophobicContact CE1-CD1 4.05Å; Y140-F142 HydrophobicContact CE1-CE1 4.06Å; Y140-F142 HydrophobicContact CE1-CG 4.37Å; Y140-F142 HydrophobicContact CE1-CZ 4.4Å; Y140-F142 HydrophobicContact CG-CE2 4.47Å; Y140-F142 PolarHBondContact O-N 2.91Å; F142-H144 PolarHBondContact O-N 3.04Å; F142-H176 AromaticContact CE1-CE1 3.81Å; F142-H176 AromaticContact CE1-ND1 3.69Å; F142-H176 AromaticContact CZ-CE1 3.38Å; F142-H176 WeakPolarHBondContact CZ-CE1 3.37Å; F142-H176 AromaticContact CZ-ND1 3.65Å; F142-H176 AromaticContact CZ-NE2 3.69Å
143	D	85.8	Confident	85.5	Confident	8 Å²	8	50.7 Å²	50.7	4%	0.043	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	34.6	178	-61.2	-103.1	0	0	0	110.2	N141 I196 M197 R225 A251	N141-D143 VanDerWaalsContact C-N 3.28Å; N141-D143 WeakPolarHBondContact OD1-CA 3.44Å; N141-D143 PolarHBondContact OD1-N 3.49Å; D143-I196 HydrophobicContact CB-CD1 4.16Å; D143-I196 WeakPolarHBondContact OD1-CD1 3.46Å; D143-M197 WeakPolarHBondContact O-CE 3.43Å; D143-R225 IonicContact OD1-NH1 3.6Å; D143-R225 IonicContact OD2-NH1 2.72Å; D143-R225 IonicContact OD2-NH2 2.98Å; D143-A251 HydrophobicContact CB-CB 3.72Å; D143-A251 WeakPolarHBondContact O-CB 3.33Å
144	H	88.8	Confident	86	Confident	47 Å²	47	46.2 Å²	46.2	22%	0.218	24%	0.241	C	C	.	.	S	Bend	trans	-113.8	146.2	173.3	-159.2	-112.2	0	0	0	111.2	N141 F142 D146 A147 F148 Y255	N141-H144 HydrophobicContact CB-CB 4.37Å; F142-H144 PolarHBondContact O-N 3.04Å; H144-D146 VanDerWaalsContact C-N 3.26Å; H144-D146 IonicContact CE1-OD2 2.95Å; H144-D146 PolarHBondContact CE1-OD2 3.09Å; H144-D146 IonicContact ND1-OD2 3.3Å; H144-D146 PolarHBondContact ND1-OD2 3.35Å; H144-D146 PolarHBondContact O-N 3.44Å; H144-A147 WeakPolarHBondContact O-CB 3.36Å; H144-A147 PolarHBondContact O-N 2.87Å; H144-F148 WeakPolarHBondContact O-CD2 3.45Å; H144-Y255 AromaticContact CD2-CE2 3.57Å; H144-Y255 AromaticContact CD2-CZ 3.83Å; H144-Y255 AromaticContact NE2-CE2 3.84Å; H144-Y255 AromaticContact NE2-CZ 3.58Å; H144-Y255 PolarHBondContact NE2-OH 2.87Å
145	P	86.8	Confident	86.4	Confident	29 Å²	29	48.5 Å²	48.5	19%	0.188	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-54	-41.2	176.7	-27.7	36.4	0	0	0	113.2	A147 F148 F150 M197 Y255	P145-A147 PolarHBondContact O-N 2.84Å; P145-A147 VanDerWaalsContact O-N 3.08Å; P145-F148 PolarHBondContact O-N 3.33Å; P145-F150 HydrophobicContact CB-CE2 4.07Å; P145-F150 VanDerWaalsContact O-CE2 3.29Å; P145-F150 WeakPolarHBondContact O-CE2 3.18Å; P145-M197 HydrophobicContact CB-SD 4.43Å; P145-M197 HydrophobicContact CG-CE 4.39Å; P145-M197 HydrophobicContact CG-SD 3.9Å; P145-Y255 HydrophobicContact CG-CD1 4.12Å; P145-Y255 HydrophobicContact CG-CE1 4.27Å; P145-Y255 HydrophobicContact CG-CG 4.34Å
146	D	87.5	Confident	86.9	Confident	103 Å²	103	48.4 Å²	48.4	55%	0.551	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-63	-17.7	-179.5	-62.6	-48	0	0	0	114.5	K125 H144 F148	K125-D146 WeakPolarHBondContact CD-O 3.49Å; K125-D146 WeakPolarHBondContact CE-O 3.36Å; K125-D146 PolarHBondContact NZ-O 2.99Å; H144-D146 VanDerWaalsContact C-N 3.26Å; H144-D146 IonicContact CE1-OD2 2.95Å; H144-D146 PolarHBondContact CE1-OD2 3.09Å; H144-D146 IonicContact ND1-OD2 3.3Å; H144-D146 PolarHBondContact ND1-OD2 3.35Å; H144-D146 PolarHBondContact O-N 3.44Å; D146-F148 PolarHBondContact O-N 3.02Å
147	A	87.1	Confident	87.4	Confident	3 Å²	3	44.4 Å²	44.4	3%	0.025	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-69	-16.2	175	0	0	0	0	0	112.9	Y124 K125 H144 P145	Y124-A147 CarbonylContact C-O 3.58Å; Y124-A147 WeakPolarHBondContact CA-O 3.5Å; Y124-A147 HydrophobicContact CD1-CB 4.22Å; K125-A147 PolarHBondContact N-O 3.31Å; H144-A147 WeakPolarHBondContact O-CB 3.36Å; H144-A147 PolarHBondContact O-N 2.87Å; P145-A147 PolarHBondContact O-N 2.84Å; P145-A147 VanDerWaalsContact O-N 3.08Å
148	F	90.2	Very high	87.9	Confident	1 Å²	1	41.2 Å²	41.2	0%	0.004	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-105.7	144.5	-174.7	-62.2	-82.6	0	0	0	113.5	M120 Y124 K125 H144 P145 D146 F150 I196 M197	M120-F148 HydrophobicContact CE-CB 4.11Å; M120-F148 HydrophobicContact CE-CD1 3.83Å; M120-F148 HydrophobicContact CE-CD2 3.96Å; M120-F148 HydrophobicContact CE-CE1 4.21Å; M120-F148 HydrophobicContact CE-CE2 4.34Å; M120-F148 HydrophobicContact CE-CG 3.68Å; M120-F148 HydrophobicContact CE-CZ 4.45Å; M120-F148 HydrophobicContact CG-CD1 3.78Å; M120-F148 HydrophobicContact CG-CE1 3.78Å; M120-F148 HydrophobicContact SD-CD1 4.42Å; M120-F148 HydrophobicContact SD-CE1 4.32Å; Y124-F148 HydrophobicContact CD1-CD1 4.11Å; Y124-F148 AromaticContact CD1-CE1 3.77Å; Y124-F148 HydrophobicContact CD1-CE1 3.77Å; Y124-F148 HydrophobicContact CD1-CZ 4.12Å; Y124-F148 HydrophobicContact CE1-CD1 4.08Å; Y124-F148 AromaticContact CE1-CE1 3.3Å; Y124-F148 HydrophobicContact CE1-CE1 3.3Å; Y124-F148 HydrophobicContact CE1-CE2 4.1Å; Y124-F148 AromaticContact CE1-CZ 3.31Å; Y124-F148 HydrophobicContact CE1-CZ 3.31Å; Y124-F148 HydrophobicContact CE2-CE1 4.23Å; Y124-F148 HydrophobicContact CG-CE1 4.39Å; Y124-F148 AromaticContact CZ-CE1 3.52Å; Y124-F148 AromaticContact CZ-CZ 3.66Å; K125-F148 WeakPolarHBondContact CE-O 3.46Å; K125-F148 PolarHBondContact NZ-O 3.35Å; H144-F148 WeakPolarHBondContact O-CD2 3.45Å; P145-F148 PolarHBondContact O-N 3.33Å; D146-F148 PolarHBondContact O-N 3.02Å; F148-F150 HydrophobicContact CB-CD2 4.15Å; F148-F150 HydrophobicContact CB-CE2 3.93Å; F148-F150 HydrophobicContact CB-CZ 4.27Å; F148-F150 PolarHBondContact O-N 2.98Å; F148-I196 HydrophobicContact CE2-CD1 4.2Å; F148-I196 HydrophobicContact CE2-CG1 4.35Å; F148-I196 HydrophobicContact CZ-CD1 3.93Å; F148-I196 HydrophobicContact CZ-CG1 3.93Å; F148-M197 HydrophobicContact CD2-SD 4.48Å; F148-M197 HydrophobicContact CE2-SD 4.21Å
149	D	90.6	Very high	88.3	Confident	33 Å²	33	42.3 Å²	42.3	18%	0.176	21%	0.207	C	C	.	.			trans	-90.3	73.7	175.2	-171	-12.2	0	0	0	109.7	F123 K125 D151 L152 L153 R178	F123-D149 VanDerWaalsContact O-CB 3.28Å; F123-D149 WeakPolarHBondContact O-CB 3.39Å; F123-D149 PolarHBondContact O-N 3Å; K125-D149 HydrophobicContact CG-CB 4.27Å; D149-D151 VanDerWaalsContact C-N 3.26Å; D149-D151 PolarHBondContact O-N 2.99Å; D149-L152 HydrophobicContact CB-CB 4.29Å; D149-L152 PolarHBondContact O-N 2.88Å; D149-L152 WeakPolarHBondContact OD1-CB 3.37Å; D149-L152 PolarHBondContact OD1-N 3.36Å; D149-L152 VanDerWaalsContact OD1-N 3.16Å; D149-L152 WeakPolarHBondContact OD2-CB 3.11Å; D149-L152 WeakPolarHBondContact OD2-CD2 3.11Å; D149-L153 VanDerWaalsContact O-CB 3.3Å; D149-L153 WeakPolarHBondContact O-CB 3.44Å; D149-L153 PolarHBondContact O-N 3.39Å; D149-R178 IonicContact OD2-CZ 3.98Å; D149-R178 VanDerWaalsContact OD2-CZ 3.25Å; D149-R178 IonicContact OD2-NH1 3.86Å; D149-R178 PolarHBondContact OD2-NH1 3.28Å; D149-R178 IonicContact OD2-NH2 3.51Å; D149-R178 PolarHBondContact OD2-NH2 2.83Å
150	F	89.5	Confident	88.3	Confident	37 Å²	37	40 Å²	40	16%	0.162	19%	0.194	C	C	.	.	H	α-helix	trans	-60.5	-31.9	-177	-78.4	-75	0	0	0	113	M120 P145 F148 T154 A200 D201 L204	M120-F150 HydrophobicContact CE-CD1 4.47Å; M120-F150 HydrophobicContact CE-CE1 3.54Å; M120-F150 HydrophobicContact CE-CZ 3.67Å; P145-F150 HydrophobicContact CB-CE2 4.07Å; P145-F150 VanDerWaalsContact O-CE2 3.29Å; P145-F150 WeakPolarHBondContact O-CE2 3.18Å; F148-F150 HydrophobicContact CB-CD2 4.15Å; F148-F150 HydrophobicContact CB-CE2 3.93Å; F148-F150 HydrophobicContact CB-CZ 4.27Å; F148-F150 PolarHBondContact O-N 2.98Å; F150-T154 VanDerWaalsContact O-CB 3.24Å; F150-T154 WeakPolarHBondContact O-CB 3.12Å; F150-T154 PolarHBondContact O-N 2.76Å; F150-T154 PolarHBondContact O-OG1 3.06Å; F150-A200 HydrophobicContact CZ-CB 4.45Å; F150-D201 HydrophobicContact CD1-CB 3.74Å; F150-D201 HydrophobicContact CE1-CB 3.86Å; F150-D201 HydrophobicContact CG-CB 4.44Å; F150-L204 HydrophobicContact CD1-CD1 3.68Å; F150-L204 HydrophobicContact CD1-CG 4.47Å; F150-L204 HydrophobicContact CE1-CD1 3.9Å
151	D	90.6	Very high	88.4	Confident	138 Å²	138	38.8 Å²	38.8	74%	0.738	19%	0.19	S	C	*	.	H	α-helix	trans	-67.4	-50.2	177.6	-67.1	-56.8	0	0	0	111.7	D149 L153 T154 H155	D149-D151 VanDerWaalsContact C-N 3.26Å; D149-D151 PolarHBondContact O-N 2.99Å; D151-L153 VanDerWaalsContact C-N 3.3Å; D151-L153 PolarHBondContact O-N 2.06Å; D151-T154 PolarHBondContact O-N 3.21Å; D151-H155 WeakPolarHBondContact O-CB 3.07Å; D151-H155 PolarHBondContact O-N 3.24Å
152	L	90	Very high	88.2	Confident	45 Å²	45	40.6 Å²	40.6	24%	0.236	20%	0.197	C	C	.	.	H	α-helix	trans	-62.5	-39.3	176	-179.9	61.6	0	0	0	111.8	F123 D149 T156 P169	F123-L152 HydrophobicContact CD1-CB 4.47Å; F123-L152 HydrophobicContact CD1-CD2 4.18Å; F123-L152 HydrophobicContact CD1-CG 4.05Å; F123-L152 HydrophobicContact CE1-CD2 4.48Å; F123-L152 HydrophobicContact CE1-CG 4.14Å; D149-L152 HydrophobicContact CB-CB 4.29Å; D149-L152 PolarHBondContact O-N 2.88Å; D149-L152 WeakPolarHBondContact OD1-CB 3.37Å; D149-L152 PolarHBondContact OD1-N 3.36Å; D149-L152 VanDerWaalsContact OD1-N 3.16Å; D149-L152 WeakPolarHBondContact OD2-CB 3.11Å; D149-L152 WeakPolarHBondContact OD2-CD2 3.11Å; L152-T156 VanDerWaalsContact O-CB 3.22Å; L152-T156 WeakPolarHBondContact O-CB 2.58Å; L152-T156 PolarHBondContact O-N 3.27Å; L152-T156 PolarHBondContact O-OG1 3.44Å; L152-P169 HydrophobicContact CD2-CG 4.3Å
153	L	90.8	Very high	87.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.5	-46.6	178.1	177.6	52	0	0	0	111.5	L118 M120 F123 D149 D151 T156 L157 F193 L204	L118-L153 HydrophobicContact CD2-CD1 4.23Å; M120-L153 HydrophobicContact CE-CD2 4.36Å; M120-L153 HydrophobicContact CG-CD2 3.93Å; F123-L153 HydrophobicContact CB-CB 4.24Å; F123-L153 HydrophobicContact CB-CD2 4.45Å; F123-L153 HydrophobicContact CD1-CB 3.85Å; F123-L153 HydrophobicContact CD1-CD1 4.22Å; F123-L153 HydrophobicContact CD2-CD1 3.74Å; F123-L153 HydrophobicContact CE1-CB 4.4Å; F123-L153 HydrophobicContact CE1-CD1 4.27Å; F123-L153 HydrophobicContact CE2-CD1 3.8Å; F123-L153 HydrophobicContact CG-CB 3.98Å; F123-L153 HydrophobicContact CG-CD1 3.97Å; F123-L153 HydrophobicContact CG-CG 4.37Å; F123-L153 HydrophobicContact CZ-CD1 4.07Å; D149-L153 VanDerWaalsContact O-CB 3.3Å; D149-L153 WeakPolarHBondContact O-CB 3.44Å; D149-L153 PolarHBondContact O-N 3.39Å; D151-L153 VanDerWaalsContact C-N 3.3Å; D151-L153 PolarHBondContact O-N 2.06Å; L153-T156 PolarHBondContact O-N 2.94Å; L153-L157 WeakPolarHBondContact O-CB 3.33Å; L153-L157 PolarHBondContact O-N 3.04Å; L153-F193 HydrophobicContact CD1-CD2 4.48Å; L153-F193 HydrophobicContact CD1-CE2 3.8Å; L153-F193 HydrophobicContact CD1-CZ 4.28Å; L153-F193 HydrophobicContact CD2-CE2 4.09Å; L153-F193 HydrophobicContact CD2-CZ 3.9Å; L153-F193 HydrophobicContact CG-CE2 4.42Å; L153-F193 HydrophobicContact CG-CZ 4.44Å; L153-L204 HydrophobicContact CD2-CD1 3.85Å; L153-L204 HydrophobicContact CG-CD1 4.16Å; L153-L204 HydrophobicContact CG-CD2 4.08Å
154	T	91.4	Very high	87.3	Confident	12 Å²	12	42.2 Å²	42.2	7%	0.074	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-41.8	177.3	-57.1	0	0	0	0	111.5	F150 D151 R158 A203 L204 L207	F150-T154 VanDerWaalsContact O-CB 3.24Å; F150-T154 WeakPolarHBondContact O-CB 3.12Å; F150-T154 PolarHBondContact O-N 2.76Å; F150-T154 PolarHBondContact O-OG1 3.06Å; D151-T154 PolarHBondContact O-N 3.21Å; T154-R158 VanDerWaalsContact O-CB 3.24Å; T154-R158 WeakPolarHBondContact O-CB 3.48Å; T154-R158 PolarHBondContact O-N 3.49Å; T154-A203 HydrophobicContact CG2-CB 4.08Å; T154-L204 HydrophobicContact CG2-CD2 4.46Å; T154-L204 VanDerWaalsContact OG1-CD2 3.27Å; T154-L204 WeakPolarHBondContact OG1-CD2 3.32Å; T154-L207 HydrophobicContact CG2-CD1 4.07Å
155	H	91	Very high	86.6	Confident	120 Å²	120	41 Å²	41	56%	0.556	20%	0.201	S	C	*	.	H	α-helix	trans	-62.9	-43.6	174.7	-175.3	85.5	0	0	0	112	D151 K159	D151-H155 WeakPolarHBondContact O-CB 3.07Å; D151-H155 PolarHBondContact O-N 3.24Å; H155-K159 PolarHBondContact O-N 2.62Å
156	T	89.6	Confident	86.3	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.012	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-50.1	176.7	-67.1	0	0	0	0	111.6	L118 F123 L152 L153 R158 K159 L160 V166 I168	L118-T156 HydrophobicContact CD1-CG2 4.31Å; F123-T156 HydrophobicContact CE1-CG2 4.18Å; F123-T156 HydrophobicContact CZ-CG2 3.84Å; L152-T156 VanDerWaalsContact O-CB 3.22Å; L152-T156 WeakPolarHBondContact O-CB 2.58Å; L152-T156 PolarHBondContact O-N 3.27Å; L152-T156 PolarHBondContact O-OG1 3.44Å; L153-T156 PolarHBondContact O-N 2.94Å; T156-R158 PolarHBondContact O-N 3.4Å; T156-K159 PolarHBondContact O-N 3.11Å; T156-L160 HydrophobicContact CG2-CD1 3.95Å; T156-L160 WeakPolarHBondContact O-CG 3.34Å; T156-L160 PolarHBondContact O-N 3.31Å; T156-V166 HydrophobicContact CG2-CG1 3.78Å; T156-I168 HydrophobicContact CG2-CG1 4.44Å
157	L	89.8	Confident	85.9	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.7	-41.4	-178.4	-176	58.1	0	0	0	111.5	V88 L118 L153 L160 K161 I191 F193 L204 L207 L208	V88-L157 HydrophobicContact CG1-CD1 3.92Å; V88-L157 HydrophobicContact CG1-CD2 4.4Å; L118-L157 HydrophobicContact CD2-CB 4.42Å; L118-L157 HydrophobicContact CD2-CD1 3.95Å; L153-L157 WeakPolarHBondContact O-CB 3.33Å; L153-L157 PolarHBondContact O-N 3.04Å; L157-L160 PolarHBondContact O-N 3.09Å; L157-K161 WeakPolarHBondContact O-CB 3.13Å; L157-K161 PolarHBondContact O-N 3.16Å; L157-I191 HydrophobicContact CD1-CD1 4.49Å; L157-I191 HydrophobicContact CD1-CG2 3.93Å; L157-F193 HydrophobicContact CD2-CD1 4.47Å; L157-L204 HydrophobicContact CD2-CD2 4.14Å; L157-L207 HydrophobicContact CB-CD1 4.11Å; L157-L207 HydrophobicContact CD2-CB 3.96Å; L157-L207 HydrophobicContact CD2-CD1 4.01Å; L157-L207 HydrophobicContact CG-CB 4.31Å; L157-L207 HydrophobicContact CG-CD1 4.01Å; L157-L208 HydrophobicContact CD2-CD2 4.14Å
158	R	90.6	Very high	85.7	Confident	108 Å²	108	41 Å²	41	41%	0.408	19%	0.194	S	C	.	.	H	α-helix	trans	-60.5	-45.7	174.8	-172.5	179.4	-63	145.8	4.5	112	T154 T156 K161 Q162 L207	T154-R158 VanDerWaalsContact O-CB 3.24Å; T154-R158 WeakPolarHBondContact O-CB 3.48Å; T154-R158 PolarHBondContact O-N 3.49Å; T156-R158 PolarHBondContact O-N 3.4Å; R158-K161 PolarHBondContact O-N 3.34Å; R158-Q162 VanDerWaalsContact O-CG 3.3Å; R158-Q162 WeakPolarHBondContact O-CG 3.4Å; R158-Q162 PolarHBondContact O-N 3.33Å; R158-Q162 VanDerWaalsContact O-N 3.08Å; R158-L207 HydrophobicContact CB-CD1 4.28Å; R158-L207 HydrophobicContact CB-CD2 4.45Å
159	K	87.1	Confident	85.3	Confident	58 Å²	58	41 Å²	41	25%	0.252	19%	0.194	S	C	.	.	H	α-helix	trans	-63.2	-41.6	175.8	-82.3	-164.7	167.5	-158	0	112.7	H155 T156 Q162 G163 K164 V166 D461	H155-K159 PolarHBondContact O-N 2.62Å; T156-K159 PolarHBondContact O-N 3.11Å; K159-Q162 CarbonylContact O-C 3.59Å; K159-Q162 PolarHBondContact O-N 3.42Å; K159-G163 PolarHBondContact O-N 3.3Å; K159-K164 PolarHBondContact O-N 2.84Å; K159-K164 VanDerWaalsContact O-N 3.12Å; K159-V166 HydrophobicContact CB-CG2 3.41Å; K159-V166 VanDerWaalsContact CB-CG2 3.41Å; K159-V166 HydrophobicContact CD-CG2 4.23Å; K159-V166 HydrophobicContact CG-CG2 4.47Å; K159-D461 IonicContact NZ-OD2 2.73Å
160	L	84.6	Confident	84.8	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-65.3	-39.5	176.6	-71.6	171.5	0	0	0	112	L118 T156 L157 Q162 G163 V166 V185 I191	L118-L160 HydrophobicContact CD1-CD1 4.34Å; L118-L160 HydrophobicContact CD2-CD1 4.27Å; T156-L160 HydrophobicContact CG2-CD1 3.95Å; T156-L160 WeakPolarHBondContact O-CG 3.34Å; T156-L160 PolarHBondContact O-N 3.31Å; L157-L160 PolarHBondContact O-N 3.09Å; L160-Q162 VanDerWaalsContact C-N 3.28Å; L160-Q162 PolarHBondContact O-N 2.92Å; L160-G163 WeakPolarHBondContact O-CA 3.4Å; L160-G163 PolarHBondContact O-N 3.38Å; L160-V166 HydrophobicContact CD2-CB 3.98Å; L160-V166 HydrophobicContact CD2-CG2 3.8Å; L160-V166 HydrophobicContact CG-CB 4.15Å; L160-V166 HydrophobicContact CG-CG2 3.78Å; L160-V185 HydrophobicContact CD2-CB 4.35Å; L160-V185 HydrophobicContact CD2-CG1 3.97Å; L160-I191 HydrophobicContact CB-CD1 3.62Å
161	K	86.4	Confident	84.3	Confident	10 Å²	10	40.6 Å²	40.6	4%	0.043	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-36.4	175.4	-170.9	174	-178.5	105.3	0	111.9	Q82 E85 A86 V88 L157 R158 G163 L207 D209	Q82-K161 PolarHBondContact NE2-O 2.87Å; E85-K161 HydrophobicContact CB-CG 3.89Å; E85-K161 HydrophobicContact CG-CG 4.33Å; E85-K161 WeakPolarHBondContact OE2-CD 3.33Å; E85-K161 WeakPolarHBondContact OE2-CE 3.03Å; A86-K161 PolarHBondContact N-O 3.46Å; V88-K161 HydrophobicContact CG2-CB 4.36Å; V88-K161 HydrophobicContact CG2-CD 3.97Å; V88-K161 HydrophobicContact CG2-CG 4.07Å; L157-K161 WeakPolarHBondContact O-CB 3.13Å; L157-K161 PolarHBondContact O-N 3.16Å; R158-K161 PolarHBondContact O-N 3.34Å; K161-G163 PolarHBondContact O-N 3.39Å; K161-L207 HydrophobicContact CD-CD2 4.21Å; K161-L207 PolarHBondContact NZ-O 2.97Å; K161-D209 IonicContact NZ-OD1 3.13Å; K161-D209 PolarHBondContact NZ-OD1 3.3Å; K161-D209 IonicContact NZ-OD2 3.53Å; K161-D209 PolarHBondContact NZ-OD2 3.04Å
162	Q	81.1	Confident	83.7	Confident	78 Å²	78	35.6 Å²	35.6	36%	0.364	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	17.6	169.8	-65.2	173.6	-11.8	0	0	114.2	Q82 R158 K159 L160 K164	Q82-Q162 PolarHBondContact OE1-O 3.33Å; Q82-Q162 VanDerWaalsContact OE1-O 3.05Å; R158-Q162 VanDerWaalsContact O-CG 3.3Å; R158-Q162 WeakPolarHBondContact O-CG 3.4Å; R158-Q162 PolarHBondContact O-N 3.33Å; R158-Q162 VanDerWaalsContact O-N 3.08Å; K159-Q162 CarbonylContact O-C 3.59Å; K159-Q162 PolarHBondContact O-N 3.42Å; L160-Q162 VanDerWaalsContact C-N 3.28Å; L160-Q162 PolarHBondContact O-N 2.92Å; Q162-K164 PolarHBondContact O-N 3.42Å
163	G	74.4	Confident	83	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.01	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	-10.7	175.7	0	0	0	0	0	116.5	K159 L160 K161 G187	K159-G163 PolarHBondContact O-N 3.3Å; L160-G163 WeakPolarHBondContact O-CA 3.4Å; L160-G163 PolarHBondContact O-N 3.38Å; K161-G163 PolarHBondContact O-N 3.39Å; G163-G187 WeakPolarHBondContact O-CA 3.1Å; G163-G187 PolarHBondContact O-N 3.34Å
164	K	75.3	Confident	82.2	Confident	60 Å²	60	42.8 Å²	42.8	26%	0.261	21%	0.207	S	C	.	.			trans	-66.2	152.3	-173.7	-72.1	-178	172.9	-76.8	0	112.5	K159 Q162 D461	K159-K164 PolarHBondContact O-N 2.84Å; K159-K164 VanDerWaalsContact O-N 3.12Å; Q162-K164 PolarHBondContact O-N 3.42Å; K164-D461 IonicContact NZ-OD1 3.85Å; K164-D461 PolarHBondContact NZ-OD1 3.44Å
165	S	74.1	Confident	81.3	Confident	23 Å²	23	46.3 Å²	46.3	16%	0.161	23%	0.228	C	C	.	.			trans	-62.8	136.3	169.5	68	0	0	0	0	111.7	V185 Y186 D459	S165-V185 WeakPolarHBondContact CA-O 3.21Å; S165-Y186 VanDerWaalsContact CB-CD1 3.47Å; S165-D459 WeakPolarHBondContact CB-O 3.24Å; S165-D459 PolarHBondContact N-O 3.09Å; S165-D459 PolarHBondContact OG-O 3.09Å
166	V	80.8	Confident	80.5	Confident	12 Å²	12	41.5 Å²	41.5	7%	0.073	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	139.8	176.8	-168.9	0	0	0	0	111.6	T156 K159 L160 T184 V185	T156-V166 HydrophobicContact CG2-CG1 3.78Å; K159-V166 HydrophobicContact CB-CG2 3.41Å; K159-V166 VanDerWaalsContact CB-CG2 3.41Å; K159-V166 HydrophobicContact CD-CG2 4.23Å; K159-V166 HydrophobicContact CG-CG2 4.47Å; L160-V166 HydrophobicContact CD2-CB 3.98Å; L160-V166 HydrophobicContact CD2-CG2 3.8Å; L160-V166 HydrophobicContact CG-CB 4.15Å; L160-V166 HydrophobicContact CG-CG2 3.78Å; V166-T184 WeakPolarHBondContact O-CA 3.41Å; V166-V185 PolarHBondContact N-O 2.93Å; V166-V185 PolarHBondContact O-N 3.02Å
167	K	78.6	Confident	79.9	Confident	116 Å²	116	42.1 Å²	42.1	50%	0.504	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	108.6	173	-66.6	172.9	-174.7	171.6	0	108.1	W182 T184	K167-W182 HydrophobicContact CB-CB 4.08Å; K167-W182 HydrophobicContact CB-CD2 4.3Å; K167-W182 HydrophobicContact CB-CE3 3.87Å; K167-W182 HydrophobicContact CB-CG 4.42Å; K167-T184 HydrophobicContact CG-CG2 4.29Å
168	I	82.4	Confident	79.5	Confident	6 Å²	6	45.4 Å²	45.4	3%	0.031	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	132.1	175.9	-57.3	172.7	0	0	0	108.6	L118 F123 T156 W182 K183 V185	L118-I168 HydrophobicContact CD1-CD1 3.68Å; L118-I168 HydrophobicContact CD1-CG1 4.24Å; L118-I168 HydrophobicContact CD1-CG2 4.47Å; F123-I168 HydrophobicContact CE2-CG2 4.22Å; F123-I168 HydrophobicContact CZ-CG2 4.01Å; T156-I168 HydrophobicContact CG2-CG1 4.44Å; I168-W182 CarbonylContact O-C 3.53Å; I168-W182 WeakPolarHBondContact O-CA 3.4Å; I168-K183 HydrophobicContact CB-CB 4.42Å; I168-K183 WeakPolarHBondContact CB-O 3.4Å; I168-K183 PolarHBondContact N-O 2.7Å; I168-K183 PolarHBondContact O-N 2.9Å; I168-V185 HydrophobicContact CD1-CB 4.12Å; I168-V185 HydrophobicContact CD1-CG2 3.55Å; I168-V185 HydrophobicContact CG1-CG2 4.39Å
169	P	82.7	Confident	78.9	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	143.8	175.7	28.1	-34.1	0	0	0	111.4	S122 F123 L152 R178 W182	S122-P169 WeakPolarHBondContact CB-O 3.04Å; S122-P169 WeakPolarHBondContact O-CG 3.24Å; S122-P169 PolarHBondContact OG-O 2.92Å; S122-P169 VanDerWaalsContact OG-O 3.08Å; F123-P169 HydrophobicContact CD1-CG 4.38Å; F123-P169 HydrophobicContact CE1-CG 4.27Å; L152-P169 HydrophobicContact CD2-CG 4.3Å; P169-R178 HydrophobicContact CB-CG 4.44Å; P169-W182 HydrophobicContact CB-CE3 4.11Å; P169-W182 HydrophobicContact CB-CH2 4.18Å; P169-W182 HydrophobicContact CB-CZ3 3.78Å; P169-W182 HydrophobicContact CG-CZ3 4.23Å
170	V	79.8	Confident	78.2	Confident	46 Å²	46	51.5 Å²	51.5	28%	0.279	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	113	168.9	-178	0	0	0	0	108	Q179 K183	V170-Q179 HydrophobicContact CB-CB 4.26Å; V170-Q179 HydrophobicContact CB-CG 4.48Å; V170-Q179 HydrophobicContact CG1-CG 4.27Å; V170-Q179 PolarHBondContact O-N 3.35Å; V170-K183 HydrophobicContact CG2-CB 4.45Å
171	Y	79.8	Confident	77.6	Confident	16 Å²	16	58.5 Å²	58.5	6%	0.063	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	136.8	175.7	-175.8	-104.5	0	0	0	110.6	Y124 F173 H176 G177 R178	Y124-Y171 AromaticContact CD2-CD1 3.63Å; Y124-Y171 HydrophobicContact CD2-CD1 3.63Å; Y124-Y171 AromaticContact CD2-CE1 3.49Å; Y124-Y171 HydrophobicContact CD2-CE1 3.49Å; Y124-Y171 VanDerWaalsContact CD2-CE1 3.49Å; Y124-Y171 HydrophobicContact CD2-CG 4.28Å; Y124-Y171 HydrophobicContact CE2-CE1 4.36Å; Y124-Y171 HydrophobicContact CG-CD1 4.35Å; Y124-Y171 AromaticContact CG-CE1 3.95Å; Y124-Y171 HydrophobicContact CG-CE1 3.95Å; Y171-F173 HydrophobicContact CD1-CD1 4.21Å; Y171-F173 HydrophobicContact CD1-CE1 4.33Å; Y171-F173 HydrophobicContact CE1-CD1 4.11Å; Y171-F173 HydrophobicContact CE1-CE1 4.5Å; Y171-H176 WeakPolarHBondContact OH-CA 3.5Å; Y171-H176 PolarHBondContact OH-ND1 2.93Å; Y171-G177 WeakPolarHBondContact CD2-O 3.41Å; Y171-R178 HydrophobicContact CD2-CG 4.33Å
172	D	78.1	Confident	77.1	Confident	33 Å²	33	63.9 Å²	63.9	18%	0.176	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	115.3	178.4	174.7	9.1	0	0	0	110.6	T174 T175 H176 G177 Q179	D172-T174 VanDerWaalsContact CG-OG1 3.29Å; D172-T174 PolarHBondContact O-N 3.36Å; D172-T174 WeakPolarHBondContact OD1-CB 3.38Å; D172-T174 PolarHBondContact OD1-N 2.86Å; D172-T174 PolarHBondContact OD1-OG1 3.14Å; D172-T174 PolarHBondContact OD2-OG1 2.91Å; D172-T175 WeakPolarHBondContact CB-OG1 3.47Å; D172-T175 WeakPolarHBondContact OD2-CB 3.21Å; D172-T175 VanDerWaalsContact OD2-CG2 3.31Å; D172-T175 WeakPolarHBondContact OD2-CG2 3.4Å; D172-T175 PolarHBondContact OD2-N 3.43Å; D172-T175 PolarHBondContact OD2-OG1 3.45Å; D172-H176 VanDerWaalsContact O-CA 3.28Å; D172-H176 WeakPolarHBondContact O-CA 3.33Å; D172-H176 PolarHBondContact O-N 3.07Å; D172-G177 PolarHBondContact N-O 3.08Å; D172-Q179 HydrophobicContact CB-CG 4.28Å
173	F	73.9	Confident	76.6	Confident	76 Å²	76	65.8 Å²	65.8	33%	0.333	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-7.3	179.1	-59.8	-84	0	0	0	114.6	D121 Y124 Y171 H176	D121-F173 HydrophobicContact CB-CE1 4.3Å; D121-F173 HydrophobicContact CB-CZ 3.86Å; Y124-F173 HydrophobicContact CE2-CE1 4.08Å; Y171-F173 HydrophobicContact CD1-CD1 4.21Å; Y171-F173 HydrophobicContact CD1-CE1 4.33Å; Y171-F173 HydrophobicContact CE1-CD1 4.11Å; Y171-F173 HydrophobicContact CE1-CE1 4.5Å; F173-H176 PolarHBondContact O-CE1 3.41Å; F173-H176 VanDerWaalsContact O-CE1 3.27Å
174	T	74.2	Confident	76.2	Confident	119 Å²	119	68.2 Å²	68.2	73%	0.73	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-42.9	178.3	68.7	0	0	0	0	112.2	D172	D172-T174 VanDerWaalsContact CG-OG1 3.29Å; D172-T174 PolarHBondContact O-N 3.36Å; D172-T174 WeakPolarHBondContact OD1-CB 3.38Å; D172-T174 PolarHBondContact OD1-N 2.86Å; D172-T174 PolarHBondContact OD1-OG1 3.14Å; D172-T174 PolarHBondContact OD2-OG1 2.91Å
175	T	73.4	Confident	75.9	Confident	86 Å²	86	66.1 Å²	66.1	53%	0.528	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-8.8	176.5	60	0	0	0	0	113.9	D172 G177	D172-T175 WeakPolarHBondContact CB-OG1 3.47Å; D172-T175 WeakPolarHBondContact OD2-CB 3.21Å; D172-T175 VanDerWaalsContact OD2-CG2 3.31Å; D172-T175 WeakPolarHBondContact OD2-CG2 3.4Å; D172-T175 PolarHBondContact OD2-N 3.43Å; D172-T175 PolarHBondContact OD2-OG1 3.45Å; T175-G177 PolarHBondContact O-N 3Å
176	H	74.5	Confident	75.4	Confident	20 Å²	20	70.2 Å²	70.2	9%	0.093	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	29.5	-176	-65.9	-52.9	0	0	0	114.4	L127 F142 Y171 D172 F173	L127-H176 HydrophobicContact CB-CB 4.46Å; L127-H176 HydrophobicContact CD1-CB 3.76Å; L127-H176 HydrophobicContact CG-CB 4.04Å; F142-H176 AromaticContact CE1-CE1 3.81Å; F142-H176 AromaticContact CE1-ND1 3.69Å; F142-H176 AromaticContact CZ-CE1 3.38Å; F142-H176 WeakPolarHBondContact CZ-CE1 3.37Å; F142-H176 AromaticContact CZ-ND1 3.65Å; F142-H176 AromaticContact CZ-NE2 3.69Å; Y171-H176 WeakPolarHBondContact OH-CA 3.5Å; Y171-H176 PolarHBondContact OH-ND1 2.93Å; D172-H176 VanDerWaalsContact O-CA 3.28Å; D172-H176 WeakPolarHBondContact O-CA 3.33Å; D172-H176 PolarHBondContact O-N 3.07Å; F173-H176 PolarHBondContact O-CE1 3.41Å; F173-H176 VanDerWaalsContact O-CE1 3.27Å
177	G	76.3	Confident	74.5	Confident	14 Å²	14	70 Å²	70	14%	0.144	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	165.9	178.9	0	0	0	0	0	113.4	Y171 D172 T175	Y171-G177 WeakPolarHBondContact CD2-O 3.41Å; D172-G177 PolarHBondContact N-O 3.08Å; T175-G177 PolarHBondContact O-N 3Å
178	R	81.3	Confident	74.1	Confident	70 Å²	70	64.6 Å²	64.6	26%	0.264	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	129.6	167.9	-66.2	175.2	-175.3	177.2	-1.3	108.8	Y124 V126 D149 P169 Y171	Y124-R178 PolarHBondContact O-NE 3.15Å; Y124-R178 VanDerWaalsContact O-NE 3.09Å; Y124-R178 PolarHBondContact O-NH2 3.06Å; V126-R178 HydrophobicContact CG2-CB 4.19Å; V126-R178 HydrophobicContact CG2-CG 3.85Å; D149-R178 IonicContact OD2-CZ 3.98Å; D149-R178 VanDerWaalsContact OD2-CZ 3.25Å; D149-R178 IonicContact OD2-NH1 3.86Å; D149-R178 PolarHBondContact OD2-NH1 3.28Å; D149-R178 IonicContact OD2-NH2 3.51Å; D149-R178 PolarHBondContact OD2-NH2 2.83Å; P169-R178 HydrophobicContact CB-CG 4.44Å; Y171-R178 HydrophobicContact CD2-CG 4.33Å
179	Q	78.6	Confident	73.7	Confident	89 Å²	89	65.9 Å²	65.9	42%	0.416	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	161.7	176.9	-61.2	-173.3	-7.7	0	0	111.2	V170 D172 E181	V170-Q179 HydrophobicContact CB-CB 4.26Å; V170-Q179 HydrophobicContact CB-CG 4.48Å; V170-Q179 HydrophobicContact CG1-CG 4.27Å; V170-Q179 PolarHBondContact O-N 3.35Å; D172-Q179 HydrophobicContact CB-CG 4.28Å; Q179-E181 PolarHBondContact O-N 2.91Å
180	K	72.7	Confident	73.8	Confident	204 Å²	204	65.8 Å²	65.8	89%	0.887	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	-17.8	174.6	-65.2	-176.9	-179.8	178.7	0	113
181	E	71.9	Confident	74.3	Confident	148 Å²	148	63.6 Å²	63.6	69%	0.692	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	144.7	177.8	-60	-161.2	170.8	0	0	111.8	Q179	Q179-E181 PolarHBondContact O-N 2.91Å
182	W	74.9	Confident	74.8	Confident	123 Å²	123	62.9 Å²	62.9	47%	0.466	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	128.6	-175.8	-65.6	74.2	0	0	0	110	K167 I168 P169 T184	K167-W182 HydrophobicContact CB-CB 4.08Å; K167-W182 HydrophobicContact CB-CD2 4.3Å; K167-W182 HydrophobicContact CB-CE3 3.87Å; K167-W182 HydrophobicContact CB-CG 4.42Å; I168-W182 CarbonylContact O-C 3.53Å; I168-W182 WeakPolarHBondContact O-CA 3.4Å; P169-W182 HydrophobicContact CB-CE3 4.11Å; P169-W182 HydrophobicContact CB-CH2 4.18Å; P169-W182 HydrophobicContact CB-CZ3 3.78Å; P169-W182 HydrophobicContact CG-CZ3 4.23Å; W182-T184 PolarHBondContact O-N 2.75Å
183	K	71.2	Confident	75.5	Confident	118 Å²	118	61.3 Å²	61.3	51%	0.513	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	103.4	172.9	-177.5	-173	177.1	-171.6	0	108.1	I168 V170 V185	I168-K183 HydrophobicContact CB-CB 4.42Å; I168-K183 WeakPolarHBondContact CB-O 3.4Å; I168-K183 PolarHBondContact N-O 2.7Å; I168-K183 PolarHBondContact O-N 2.9Å; V170-K183 HydrophobicContact CG2-CB 4.45Å; K183-V185 HydrophobicContact CD-CG2 4.37Å; K183-V185 HydrophobicContact CG-CG2 4.22Å
184	T	66.4	Low	76.5	Confident	53 Å²	53	58.2 Å²	58.2	33%	0.325	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	133.5	173.7	-44.8	0	0	0	0	109.5	V166 K167 W182 Y186	V166-T184 WeakPolarHBondContact O-CA 3.41Å; K167-T184 HydrophobicContact CG-CG2 4.29Å; W182-T184 PolarHBondContact O-N 2.75Å; T184-Y186 HydrophobicContact CG2-CD1 4.42Å; T184-Y186 HydrophobicContact CG2-CE1 3.59Å; T184-Y186 HydrophobicContact CG2-CE2 4.17Å; T184-Y186 VanDerWaalsContact CG2-CZ 3.46Å; T184-Y186 WeakPolarHBondContact CG2-OH 3.48Å
185	V	69.2	Low	77.3	Confident	15 Å²	15	52.8 Å²	52.8	9%	0.091	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	146.5	178.3	174.2	0	0	0	0	108.8	V116 L160 S165 V166 I168 K183	V116-V185 HydrophobicContact CB-CG1 4.28Å; V116-V185 HydrophobicContact CG1-CG1 3.76Å; V116-V185 HydrophobicContact CG2-CG1 3.45Å; V116-V185 VanDerWaalsContact CG2-CG1 3.45Å; L160-V185 HydrophobicContact CD2-CB 4.35Å; L160-V185 HydrophobicContact CD2-CG1 3.97Å; S165-V185 WeakPolarHBondContact CA-O 3.21Å; V166-V185 PolarHBondContact N-O 2.93Å; V166-V185 PolarHBondContact O-N 3.02Å; I168-V185 HydrophobicContact CD1-CB 4.12Å; I168-V185 HydrophobicContact CD1-CG2 3.55Å; I168-V185 HydrophobicContact CG1-CG2 4.39Å; K183-V185 HydrophobicContact CD-CG2 4.37Å; K183-V185 HydrophobicContact CG-CG2 4.22Å
186	Y	62.3	Low	78.1	Confident	110 Å²	110	49.3 Å²	49.3	43%	0.431	23%	0.229	S	C	.	.			trans	-131.8	143.8	-171.7	-52.8	-76.3	0	0	0	109.9	S165 T184 A188 H460	S165-Y186 VanDerWaalsContact CB-CD1 3.47Å; T184-Y186 HydrophobicContact CG2-CD1 4.42Å; T184-Y186 HydrophobicContact CG2-CE1 3.59Å; T184-Y186 HydrophobicContact CG2-CE2 4.17Å; T184-Y186 VanDerWaalsContact CG2-CZ 3.46Å; T184-Y186 WeakPolarHBondContact CG2-OH 3.48Å; Y186-A188 PolarHBondContact O-N 3.05Å; Y186-A188 VanDerWaalsContact O-N 3.16Å; Y186-H460 AromaticContact CD1-CE1 3.76Å; Y186-H460 AromaticContact CD1-NE2 3.39Å; Y186-H460 WeakPolarHBondContact CD1-NE2 3.32Å; Y186-H460 AromaticContact CE1-CE1 3.19Å; Y186-H460 WeakPolarHBondContact CE1-CE1 3.36Å; Y186-H460 AromaticContact CE1-NE2 3.35Å; Y186-H460 VanDerWaalsContact CE1-NE2 3.35Å; Y186-H460 WeakPolarHBondContact CE1-NE2 3.39Å; Y186-H460 AromaticContact CZ-CE1 3.89Å
187	G	63	Low	78.9	Confident	6 Å²	6	48.4 Å²	48.4	6%	0.062	23%	0.225	C	C	.	.			trans	45.8	55.3	153.4	0	0	0	0	0	116.4	R72 G163	R72-G187 PolarHBondContact NE-O 2.66Å; R72-G187 PolarHBondContact NH2-O 3.2Å; G163-G187 WeakPolarHBondContact O-CA 3.1Å; G163-G187 PolarHBondContact O-N 3.34Å
188	A	69	Low	79.5	Confident	3 Å²	3	47.8 Å²	47.8	3%	0.025	22%	0.218	C	C	.	.			trans	-67.7	140.6	171.2	0	0	0	0	0	110.3	A86 V116 Y186 I191	A86-A188 WeakPolarHBondContact CB-O 3.17Å; V116-A188 HydrophobicContact CB-CB 3.96Å; V116-A188 HydrophobicContact CG2-CB 3.61Å; Y186-A188 PolarHBondContact O-N 3.05Å; Y186-A188 VanDerWaalsContact O-N 3.16Å; A188-I191 HydrophobicContact CB-CD1 4.09Å; A188-I191 HydrophobicContact CB-CG1 3.43Å; A188-I191 VanDerWaalsContact CB-CG1 3.43Å
189	S	74.3	Confident	80.1	Confident	33 Å²	33	44.5 Å²	44.5	23%	0.231	21%	0.206	C	C	.	.	S	Bend	trans	-94.8	-33.9	162.3	-59.6	0	0	0	0	110.6	F87 W114	F87-S189 PolarHBondContact N-O 3.5Å; W114-S189 PolarHBondContact O-N 3.31Å
190	V	84.8	Confident	80.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.3	171.7	-176.9	0	0	0	0	109.1	F87 I89 W114 V115 V116 I192 V284 L288	F87-V190 CarbonylContact O-C 3.6Å; F87-V190 WeakPolarHBondContact O-CA 3.26Å; I89-V190 HydrophobicContact CD1-CG1 3.77Å; I89-V190 HydrophobicContact CG1-CG1 4.27Å; W114-V190 PolarHBondContact O-N 2.83Å; V115-V190 WeakPolarHBondContact CA-O 3.39Å; V115-V190 HydrophobicContact CG1-CB 4.21Å; V115-V190 HydrophobicContact CG1-CG1 4.21Å; V115-V190 HydrophobicContact CG2-CB 4.28Å; V116-V190 PolarHBondContact N-O 3.42Å; V190-I192 HydrophobicContact CG1-CG1 4.46Å; V190-V284 HydrophobicContact CG1-CG1 4.4Å; V190-V284 HydrophobicContact CG2-CG1 3.85Å; V190-L288 HydrophobicContact CG2-CD1 4.06Å; V190-L288 HydrophobicContact CG2-CD2 4.11Å; V190-L288 HydrophobicContact CG2-CG 4.42Å
191	I	89.4	Confident	81.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	114.4	176.5	-59.3	166	0	0	0	107.9	A86 F87 V88 I89 L118 L157 L160 A188	A86-I191 HydrophobicContact CB-CD1 3.9Å; A86-I191 HydrophobicContact CB-CG1 4.26Å; F87-I191 PolarHBondContact O-N 2.9Å; V88-I191 CarbonylContact C-O 3.49Å; V88-I191 WeakPolarHBondContact CA-O 3.32Å; V88-I191 HydrophobicContact CG1-CB 4.37Å; V88-I191 HydrophobicContact CG1-CG2 4.41Å; V88-I191 HydrophobicContact CG2-CB 4.33Å; V88-I191 HydrophobicContact CG2-CD1 4.19Å; I89-I191 PolarHBondContact N-O 2.92Å; L118-I191 HydrophobicContact CB-CG2 4.36Å; L157-I191 HydrophobicContact CD1-CD1 4.49Å; L157-I191 HydrophobicContact CD1-CG2 3.93Å; L160-I191 HydrophobicContact CB-CD1 3.62Å; A188-I191 HydrophobicContact CB-CD1 4.09Å; A188-I191 HydrophobicContact CB-CG1 3.43Å; A188-I191 VanDerWaalsContact CB-CG1 3.43Å
192	I	91.6	Very high	82.3	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	106.7	169.9	-59.7	177.4	0	0	0	107.2	I89 L91 A103 I106 I107 V115 V116 L117 L118 V190	I89-I192 HydrophobicContact CB-CG1 4.39Å; I89-I192 HydrophobicContact CD1-CG1 4.28Å; I89-I192 CarbonylContact O-C 3.56Å; I89-I192 WeakPolarHBondContact O-CA 3.36Å; L91-I192 HydrophobicContact CD1-CG2 3.63Å; L91-I192 HydrophobicContact CG-CG2 3.96Å; A103-I192 HydrophobicContact CB-CG2 3.93Å; I106-I192 HydrophobicContact CB-CD1 4.07Å; I106-I192 HydrophobicContact CG2-CD1 3.71Å; I107-I192 HydrophobicContact CD1-CD1 4.25Å; I107-I192 HydrophobicContact CG1-CD1 3.7Å; V115-I192 HydrophobicContact CG1-CD1 3.75Å; V115-I192 HydrophobicContact CG1-CG1 3.91Å; V116-I192 PolarHBondContact O-N 3.22Å; L117-I192 WeakPolarHBondContact CA-O 3.3Å; L117-I192 HydrophobicContact CD1-CB 4.26Å; L117-I192 HydrophobicContact CD1-CG2 3.97Å; L118-I192 PolarHBondContact N-O 3.41Å; V190-I192 HydrophobicContact CG1-CG1 4.46Å
193	F	93.6	Very high	83	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	109.8	176.4	169.1	-123.6	0	0	0	109.8	I89 G90 L91 L118 M120 L153 L157 L204 L208	I89-F193 PolarHBondContact O-N 3Å; G90-F193 CarbonylContact C-O 3.43Å; G90-F193 WeakPolarHBondContact CA-O 3.35Å; L91-F193 PolarHBondContact N-O 3.08Å; L118-F193 HydrophobicContact CB-CD2 4.39Å; L118-F193 HydrophobicContact CD2-CD2 3.94Å; L118-F193 HydrophobicContact CG-CD2 4.07Å; L118-F193 CarbonylContact O-C 3.58Å; L118-F193 VanDerWaalsContact O-CA 3.32Å; L118-F193 WeakPolarHBondContact O-CA 3.49Å; M120-F193 HydrophobicContact CB-CE2 3.84Å; M120-F193 HydrophobicContact CB-CZ 4.15Å; M120-F193 HydrophobicContact CG-CE2 4.4Å; M120-F193 HydrophobicContact CG-CZ 4.32Å; M120-F193 HydrophobicContact SD-CZ 4.34Å; L153-F193 HydrophobicContact CD1-CD2 4.48Å; L153-F193 HydrophobicContact CD1-CE2 3.8Å; L153-F193 HydrophobicContact CD1-CZ 4.28Å; L153-F193 HydrophobicContact CD2-CE2 4.09Å; L153-F193 HydrophobicContact CD2-CZ 3.9Å; L153-F193 HydrophobicContact CG-CE2 4.42Å; L153-F193 HydrophobicContact CG-CZ 4.44Å; L157-F193 HydrophobicContact CD2-CD1 4.47Å; F193-L204 HydrophobicContact CE1-CD1 4.32Å; F193-L204 HydrophobicContact CZ-CD1 4.28Å; F193-L208 HydrophobicContact CD1-CD2 3.88Å
194	E	93	Very high	84	Confident	12 Å²	12	25.9 Å²	25.9	6%	0.056	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	147.3	176.1	70.1	162.1	170.6	0	0	113	L91 T100 L117 L118 S119 M120	L91-E194 HydrophobicContact CB-CB 4.18Å; L91-E194 HydrophobicContact CD1-CB 4.43Å; T100-E194 WeakPolarHBondContact CA-OE2 3.37Å; T100-E194 VanDerWaalsContact CB-OE2 3.27Å; T100-E194 WeakPolarHBondContact CB-OE2 3.2Å; T100-E194 WeakPolarHBondContact CG2-OE1 3.49Å; T100-E194 PolarHBondContact N-OE2 2.95Å; T100-E194 PolarHBondContact OG1-OE1 3.27Å; T100-E194 PolarHBondContact OG1-OE2 3.23Å; L117-E194 HydrophobicContact CD1-CG 4.01Å; L118-E194 PolarHBondContact O-N 3.38Å; S119-E194 PolarHBondContact OG-OE1 3.13Å; M120-E194 VanDerWaalsContact CB-O 3.29Å; M120-E194 WeakPolarHBondContact CB-O 3.46Å; M120-E194 PolarHBondContact N-O 2.71Å
195	G	91.8	Very high	85.1	Confident	4 Å²	4	25 Å²	25	4%	0.041	13%	0.134	C	C	.	.			trans	-174.2	163	178	0	0	0	0	0	112.8	L91 K99 M197 S198	L91-G195 PolarHBondContact O-N 3.04Å; L91-G195 VanDerWaalsContact O-N 3.15Å; K99-G195 WeakPolarHBondContact CD-O 3.43Å; K99-G195 VanDerWaalsContact CE-C 3.47Å; K99-G195 WeakPolarHBondContact CE-O 2.92Å; G195-M197 VanDerWaalsContact C-N 3.33Å; G195-S198 WeakPolarHBondContact CA-OG 3.43Å; G195-S198 PolarHBondContact N-OG 2.98Å; G195-S198 PolarHBondContact O-OG 3.34Å; G195-S198 VanDerWaalsContact O-OG 3.14Å
196	I	90.8	Very high	86.2	Confident	14 Å²	14	32.4 Å²	32.4	7%	0.072	17%	0.168	C	C	.	.	S	Bend	trans	-76	-25.6	170.8	53.5	165.8	0	0	0	112	D143 F148 I256	D143-I196 HydrophobicContact CB-CD1 4.16Å; D143-I196 WeakPolarHBondContact OD1-CD1 3.46Å; F148-I196 HydrophobicContact CE2-CD1 4.2Å; F148-I196 HydrophobicContact CE2-CG1 4.35Å; F148-I196 HydrophobicContact CZ-CD1 3.93Å; F148-I196 HydrophobicContact CZ-CG1 3.93Å; I196-I256 HydrophobicContact CB-CD1 4.01Å; I196-I256 WeakPolarHBondContact O-CD1 3.38Å; I196-I256 WeakPolarHBondContact O-CG1 3.44Å; I196-I256 WeakPolarHBondContact O-CG2 3.42Å
197	M	90.3	Very high	87.6	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.152	C	C	.	.	S	Bend	trans	-127.9	30.3	-174.9	-72.9	-177.2	177.7	0	0	112.2	M120 D143 P145 F148 G195 F199 A200 Y255 I256	M120-M197 HydrophobicContact CE-CB 3.7Å; M120-M197 HydrophobicContact SD-CB 4.07Å; D143-M197 WeakPolarHBondContact O-CE 3.43Å; P145-M197 HydrophobicContact CB-SD 4.43Å; P145-M197 HydrophobicContact CG-CE 4.39Å; P145-M197 HydrophobicContact CG-SD 3.9Å; F148-M197 HydrophobicContact CD2-SD 4.48Å; F148-M197 HydrophobicContact CE2-SD 4.21Å; G195-M197 VanDerWaalsContact C-N 3.33Å; M197-F199 PolarHBondContact O-N 2.87Å; M197-A200 HydrophobicContact CB-CB 3.87Å; M197-A200 HydrophobicContact CG-CB 4.44Å; M197-A200 WeakPolarHBondContact O-CB 3.44Å; M197-A200 PolarHBondContact O-N 3Å; M197-Y255 HydrophobicContact CE-CD2 4.11Å; M197-Y255 HydrophobicContact CE-CG 4.15Å; M197-I256 HydrophobicContact CE-CD1 4.43Å; M197-I256 HydrophobicContact CE-CG1 4.21Å; M197-I256 HydrophobicContact CG-CG1 4.14Å
198	S	90.1	Very high	89.1	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-26.2	-178.4	-42.9	0	0	0	0	114	L91 G195	L91-S198 PolarHBondContact O-OG 3.4Å; G195-S198 WeakPolarHBondContact CA-OG 3.43Å; G195-S198 PolarHBondContact N-OG 2.98Å; G195-S198 PolarHBondContact O-OG 3.34Å; G195-S198 VanDerWaalsContact O-OG 3.14Å
199	F	93.1	Very high	90.2	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.009	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	11.6	-177.9	-56.8	-13.6	0	0	0	112.9	G90 C92 M197 L205 L208 K211 I212 F213 T259 A263	G90-F199 WeakPolarHBondContact O-CZ 3.32Å; C92-F199 HydrophobicContact CB-CB 4.48Å; C92-F199 HydrophobicContact CB-CD1 3.91Å; C92-F199 HydrophobicContact CB-CD2 3.35Å; C92-F199 HydrophobicContact CB-CE1 3.79Å; C92-F199 HydrophobicContact CB-CE2 3.25Å; C92-F199 HydrophobicContact CB-CG 3.66Å; C92-F199 HydrophobicContact CB-CZ 3.45Å; C92-F199 VanDerWaalsContact CB-CZ 3.45Å; M197-F199 PolarHBondContact O-N 2.87Å; F199-L205 HydrophobicContact CB-CD2 3.9Å; F199-L205 HydrophobicContact CD1-CD2 4.06Å; F199-L205 HydrophobicContact CG-CD2 4.1Å; F199-L205 WeakPolarHBondContact O-CD1 3.08Å; F199-L208 HydrophobicContact CD1-CD1 3.71Å; F199-L208 HydrophobicContact CE1-CD1 3.75Å; F199-K211 HydrophobicContact CE1-CB 3.93Å; F199-K211 HydrophobicContact CE1-CG 4.02Å; F199-K211 HydrophobicContact CE2-CB 4.23Å; F199-K211 HydrophobicContact CZ-CB 3.69Å; F199-K211 HydrophobicContact CZ-CG 4.31Å; F199-I212 WeakPolarHBondContact CZ-O 3.38Å; F199-F213 HydrophobicContact CE2-CD2 4.41Å; F199-T259 HydrophobicContact CB-CG2 4.15Å; F199-A263 HydrophobicContact CE2-CB 4.02Å
200	A	88.3	Confident	91.1	Very high	44 Å²	44	30.9 Å²	30.9	36%	0.364	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-35.1	-178.3	0	0	0	0	0	112.8	F150 M197	F150-A200 HydrophobicContact CZ-CB 4.45Å; M197-A200 HydrophobicContact CB-CB 3.87Å; M197-A200 HydrophobicContact CG-CB 4.44Å; M197-A200 WeakPolarHBondContact O-CB 3.44Å; M197-A200 PolarHBondContact O-N 3Å
201	D	90.5	Very high	91.6	Very high	45 Å²	45	32.4 Å²	32.4	24%	0.241	17%	0.169	C	C	.	.			trans	-96.5	143.3	178.3	173	54.5	0	0	0	113	F150 A203 L204 L205	F150-D201 HydrophobicContact CD1-CB 3.74Å; F150-D201 HydrophobicContact CE1-CB 3.86Å; F150-D201 HydrophobicContact CG-CB 4.44Å; D201-A203 PolarHBondContact OD1-N 3.32Å; D201-A203 WeakPolarHBondContact OD2-CA 3.3Å; D201-A203 WeakPolarHBondContact OD2-CB 3.47Å; D201-A203 PolarHBondContact OD2-N 2.83Å; D201-L204 HydrophobicContact CB-CB 4.33Å; D201-L204 HydrophobicContact CB-CD1 4.37Å; D201-L204 HydrophobicContact CB-CG 4.28Å; D201-L204 PolarHBondContact OD2-N 3.34Å; D201-L205 WeakPolarHBondContact O-CB 3.47Å; D201-L205 WeakPolarHBondContact O-CD1 3.24Å; D201-L205 VanDerWaalsContact O-CG 3.29Å; D201-L205 WeakPolarHBondContact O-CG 3.43Å; D201-L205 PolarHBondContact O-N 3.25Å; D201-L205 VanDerWaalsContact O-N 3.1Å
202	K	89.9	Confident	91.9	Very high	167 Å²	167	32.4 Å²	32.4	73%	0.726	17%	0.169	S	C	*	.	H	α-helix	trans	-75.9	-34.3	-178.7	-64.8	-178	-178.3	177.5	0	113.2	Q206	K202-Q206 WeakPolarHBondContact O-CG 3.49Å; K202-Q206 PolarHBondContact O-N 2.87Å
203	A	91	Very high	92.1	Very high	34 Å²	34	32.6 Å²	32.6	28%	0.281	17%	0.169	S	C	.	.	H	α-helix	trans	-74.5	-34.5	179.1	0	0	0	0	0	111.3	T154 D201	T154-A203 HydrophobicContact CG2-CB 4.08Å; D201-A203 PolarHBondContact OD1-N 3.32Å; D201-A203 WeakPolarHBondContact OD2-CA 3.3Å; D201-A203 WeakPolarHBondContact OD2-CB 3.47Å; D201-A203 PolarHBondContact OD2-N 2.83Å
204	L	90.8	Very high	92.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63	-50.6	167.2	-70.6	-174.2	0	0	0	111.7	F150 L153 T154 L157 F193 D201 Q206 L207 L208	F150-L204 HydrophobicContact CD1-CD1 3.68Å; F150-L204 HydrophobicContact CD1-CG 4.47Å; F150-L204 HydrophobicContact CE1-CD1 3.9Å; L153-L204 HydrophobicContact CD2-CD1 3.85Å; L153-L204 HydrophobicContact CG-CD1 4.16Å; L153-L204 HydrophobicContact CG-CD2 4.08Å; T154-L204 HydrophobicContact CG2-CD2 4.46Å; T154-L204 VanDerWaalsContact OG1-CD2 3.27Å; T154-L204 WeakPolarHBondContact OG1-CD2 3.32Å; L157-L204 HydrophobicContact CD2-CD2 4.14Å; F193-L204 HydrophobicContact CE1-CD1 4.32Å; F193-L204 HydrophobicContact CZ-CD1 4.28Å; D201-L204 HydrophobicContact CB-CB 4.33Å; D201-L204 HydrophobicContact CB-CD1 4.37Å; D201-L204 HydrophobicContact CB-CG 4.28Å; D201-L204 PolarHBondContact OD2-N 3.34Å; L204-Q206 PolarHBondContact O-N 2.8Å; L204-Q206 VanDerWaalsContact O-N 3.15Å; L204-L207 WeakPolarHBondContact O-CB 3.37Å; L204-L207 PolarHBondContact O-N 3.16Å; L204-L208 WeakPolarHBondContact O-CG 3.48Å
205	L	91.4	Very high	92.1	Very high	36 Å²	36	36 Å²	36	19%	0.188	19%	0.186	C	C	.	.	H	α-helix	trans	-53	-37.2	179.4	-82.9	166.7	0	0	0	113.3	F199 D201 L207 L208 K211 L262	F199-L205 HydrophobicContact CB-CD2 3.9Å; F199-L205 HydrophobicContact CD1-CD2 4.06Å; F199-L205 HydrophobicContact CG-CD2 4.1Å; F199-L205 WeakPolarHBondContact O-CD1 3.08Å; D201-L205 WeakPolarHBondContact O-CB 3.47Å; D201-L205 WeakPolarHBondContact O-CD1 3.24Å; D201-L205 VanDerWaalsContact O-CG 3.29Å; D201-L205 WeakPolarHBondContact O-CG 3.43Å; D201-L205 PolarHBondContact O-N 3.25Å; D201-L205 VanDerWaalsContact O-N 3.1Å; L205-L207 PolarHBondContact O-N 2.99Å; L205-L208 HydrophobicContact CD2-CD1 4.47Å; L205-L208 PolarHBondContact O-N 3.35Å; L205-K211 HydrophobicContact CD2-CD 3.89Å; L205-L262 HydrophobicContact CD1-CD1 3.89Å
206	Q	91.7	Very high	92	Very high	170 Å²	170	36.4 Å²	36.4	79%	0.794	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-16.5	176.5	-73.8	175	-9.9	0	0	114.5	K202 L204	K202-Q206 WeakPolarHBondContact O-CG 3.49Å; K202-Q206 PolarHBondContact O-N 2.87Å; L204-Q206 PolarHBondContact O-N 2.8Å; L204-Q206 VanDerWaalsContact O-N 3.15Å
207	L	91.6	Very high	92	Very high	20 Å²	20	40.5 Å²	40.5	11%	0.105	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-13	175.6	-62.4	172.5	0	0	0	112.9	V88 T154 L157 R158 K161 L204 L205	V88-L207 WeakPolarHBondContact CB-O 3.42Å; T154-L207 HydrophobicContact CG2-CD1 4.07Å; L157-L207 HydrophobicContact CB-CD1 4.11Å; L157-L207 HydrophobicContact CD2-CB 3.96Å; L157-L207 HydrophobicContact CD2-CD1 4.01Å; L157-L207 HydrophobicContact CG-CB 4.31Å; L157-L207 HydrophobicContact CG-CD1 4.01Å; R158-L207 HydrophobicContact CB-CD1 4.28Å; R158-L207 HydrophobicContact CB-CD2 4.45Å; K161-L207 HydrophobicContact CD-CD2 4.21Å; K161-L207 PolarHBondContact NZ-O 2.97Å; L204-L207 WeakPolarHBondContact O-CB 3.37Å; L204-L207 PolarHBondContact O-N 3.16Å; L205-L207 PolarHBondContact O-N 2.99Å
208	L	93.4	Very high	91.9	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.037	23%	0.232	C	C	.	.			trans	-92.8	104.5	-173	-53.6	-179.9	0	0	0	112.3	V88 L157 F193 F199 L204 L205 K211	V88-L208 HydrophobicContact CG1-CD2 3.56Å; L157-L208 HydrophobicContact CD2-CD2 4.14Å; F193-L208 HydrophobicContact CD1-CD2 3.88Å; F199-L208 HydrophobicContact CD1-CD1 3.71Å; F199-L208 HydrophobicContact CE1-CD1 3.75Å; L204-L208 WeakPolarHBondContact O-CG 3.48Å; L205-L208 HydrophobicContact CD2-CD1 4.47Å; L205-L208 PolarHBondContact O-N 3.35Å; L208-K211 HydrophobicContact CB-CD 4.19Å; L208-K211 HydrophobicContact CB-CG 3.7Å; L208-K211 HydrophobicContact CD1-CG 4.04Å; L208-K211 PolarHBondContact O-NZ 3.33Å; L208-K211 VanDerWaalsContact O-NZ 3.11Å
209	D	93.1	Very high	91.9	Very high	72 Å²	72	48.4 Å²	48.4	39%	0.385	26%	0.257	S	S	.	.	S	Bend	trans	-66.6	-40.6	178.6	-51.4	-59.2	0	0	0	111.1	F87 V88 K161	F87-D209 HydrophobicContact CD2-CB 3.66Å; F87-D209 HydrophobicContact CE2-CB 3.51Å; F87-D209 HydrophobicContact CG-CB 4.49Å; F87-D209 HydrophobicContact CZ-CB 4.22Å; V88-D209 PolarHBondContact N-OD2 3.08Å; V88-D209 PolarHBondContact O-N 3.33Å; K161-D209 IonicContact NZ-OD1 3.13Å; K161-D209 PolarHBondContact NZ-OD1 3.3Å; K161-D209 IonicContact NZ-OD2 3.53Å; K161-D209 PolarHBondContact NZ-OD2 3.04Å
210	M	93.2	Very high	91.8	Very high	21 Å²	21	51.5 Å²	51.5	10%	0.103	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	131.1	174.9	-168.7	-176.4	-168.7	0	0	111	F87 V88 I89 G90 I212 L265 I280	F87-M210 HydrophobicContact CE1-CB 4.11Å; F87-M210 HydrophobicContact CZ-CB 3.91Å; V88-M210 PolarHBondContact O-N 2.82Å; V88-M210 VanDerWaalsContact O-N 3.08Å; I89-M210 CarbonylContact C-O 3.54Å; I89-M210 WeakPolarHBondContact CA-O 3.22Å; G90-M210 PolarHBondContact N-O 2.94Å; M210-I212 HydrophobicContact CE-CD1 3.98Å; M210-I212 HydrophobicContact CE-CG1 4.24Å; M210-I212 HydrophobicContact CG-CD1 4.36Å; M210-I212 HydrophobicContact CG-CG1 4.08Å; M210-I212 HydrophobicContact SD-CD1 3.9Å; M210-I212 HydrophobicContact SD-CG1 4.26Å; M210-L265 HydrophobicContact CE-CD2 4.07Å; M210-I280 HydrophobicContact CE-CG1 4.06Å; M210-I280 HydrophobicContact CE-CG2 4.43Å; M210-I280 HydrophobicContact SD-CG2 4.27Å
211	K	95.8	Very high	91.9	Very high	32 Å²	32	49.8 Å²	49.8	14%	0.139	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	109.4	-174.3	-68.2	158.2	-63.7	-49.8	0	109.3	F199 L205 L208 A263 D264 L265	F199-K211 HydrophobicContact CE1-CB 3.93Å; F199-K211 HydrophobicContact CE1-CG 4.02Å; F199-K211 HydrophobicContact CE2-CB 4.23Å; F199-K211 HydrophobicContact CZ-CB 3.69Å; F199-K211 HydrophobicContact CZ-CG 4.31Å; L205-K211 HydrophobicContact CD2-CD 3.89Å; L208-K211 HydrophobicContact CB-CD 4.19Å; L208-K211 HydrophobicContact CB-CG 3.7Å; L208-K211 HydrophobicContact CD1-CG 4.04Å; L208-K211 PolarHBondContact O-NZ 3.33Å; L208-K211 VanDerWaalsContact O-NZ 3.11Å; K211-A263 CarbonylContact O-C 3.57Å; K211-A263 WeakPolarHBondContact O-CA 3.48Å; K211-D264 WeakPolarHBondContact CB-OD2 3.49Å; K211-D264 VanDerWaalsContact CE-OD1 3.24Å; K211-D264 WeakPolarHBondContact CE-OD1 3.38Å; K211-D264 VanDerWaalsContact CE-OD2 3.28Å; K211-D264 WeakPolarHBondContact CE-OD2 3.33Å; K211-D264 PolarHBondContact N-OD2 2.89Å; K211-D264 IonicContact NZ-OD1 2.75Å; K211-D264 PolarHBondContact NZ-OD1 3.35Å; K211-D264 IonicContact NZ-OD2 2.7Å; K211-D264 PolarHBondContact NZ-OD2 3Å; K211-D264 PolarHBondContact O-N 3.38Å; K211-L265 PolarHBondContact O-N 3.41Å
212	I	95.1	Very high	91.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.7	-175.6	-46.2	-176.6	0	0	0	110.3	I89 G90 L91 C92 F199 M210 L265 V267 I280	I89-I212 HydrophobicContact CG2-CD1 3.59Å; I89-I212 HydrophobicContact CG2-CG1 4.12Å; G90-I212 PolarHBondContact O-N 3.26Å; L91-I212 WeakPolarHBondContact CA-O 3.28Å; L91-I212 HydrophobicContact CD2-CB 3.79Å; L91-I212 HydrophobicContact CD2-CD1 3.96Å; L91-I212 HydrophobicContact CD2-CG1 4.2Å; L91-I212 HydrophobicContact CD2-CG2 4.36Å; C92-I212 PolarHBondContact N-O 3.42Å; F199-I212 WeakPolarHBondContact CZ-O 3.38Å; M210-I212 HydrophobicContact CE-CD1 3.98Å; M210-I212 HydrophobicContact CE-CG1 4.24Å; M210-I212 HydrophobicContact CG-CD1 4.36Å; M210-I212 HydrophobicContact CG-CG1 4.08Å; M210-I212 HydrophobicContact SD-CD1 3.9Å; M210-I212 HydrophobicContact SD-CG1 4.26Å; I212-L265 CarbonylContact C-O 3.6Å; I212-L265 WeakPolarHBondContact CA-O 3.23Å; I212-L265 HydrophobicContact CG2-CB 4.46Å; I212-L265 HydrophobicContact CG2-CD2 4.48Å; I212-V267 HydrophobicContact CG2-CB 4.43Å; I212-V267 HydrophobicContact CG2-CG2 3.49Å; I212-V267 VanDerWaalsContact CG2-CG2 3.49Å; I212-I280 HydrophobicContact CD1-CD1 3.64Å; I212-I280 HydrophobicContact CD1-CG1 3.89Å; I212-I280 HydrophobicContact CD1-CG2 3.98Å; I212-I280 HydrophobicContact CG2-CD1 4.49Å
213	F	95.8	Very high	91.9	Very high	3 Å²	3	46.5 Å²	46.5	1%	0.013	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.8	173.6	-162.9	-89.5	0	0	0	110.8	C92 F199 E215 F252 I256 M260 A263 L265 V266 V267	C92-F213 HydrophobicContact CB-CD2 4.08Å; F199-F213 HydrophobicContact CE2-CD2 4.41Å; F213-E215 HydrophobicContact CD1-CB 4.4Å; F213-F252 HydrophobicContact CZ-CE2 4.3Å; F213-I256 HydrophobicContact CE2-CG2 4.22Å; F213-I256 HydrophobicContact CZ-CG2 4.34Å; F213-M260 HydrophobicContact CB-CG 4.36Å; F213-M260 HydrophobicContact CD1-CB 4.23Å; F213-M260 HydrophobicContact CD1-CE 3.88Å; F213-M260 HydrophobicContact CD1-CG 3.85Å; F213-M260 HydrophobicContact CD2-CB 4.09Å; F213-M260 HydrophobicContact CD2-CG 4.42Å; F213-M260 HydrophobicContact CE1-CB 4.21Å; F213-M260 HydrophobicContact CE1-CE 3.55Å; F213-M260 HydrophobicContact CE1-CG 4.18Å; F213-M260 HydrophobicContact CE2-CB 4.08Å; F213-M260 HydrophobicContact CG-CB 4.15Å; F213-M260 HydrophobicContact CG-CG 3.97Å; F213-M260 HydrophobicContact CZ-CB 4.13Å; F213-M260 HydrophobicContact CZ-CE 4.3Å; F213-A263 HydrophobicContact CB-CB 3.77Å; F213-L265 PolarHBondContact N-O 3.08Å; F213-V266 HydrophobicContact CB-CG2 4.44Å; F213-V266 WeakPolarHBondContact O-CA 3.33Å; F213-V267 PolarHBondContact O-N 2.98Å
214	V	94.6	Very high	91.8	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	101.9	-179.8	-179.3	0	0	0	0	109.8	C92 S97 K99 V102	C92-V214 PolarHBondContact O-N 3.48Å; S97-V214 VanDerWaalsContact CB-O 3.22Å; S97-V214 WeakPolarHBondContact CB-O 3.44Å; S97-V214 PolarHBondContact OG-O 3.43Å; S97-V214 VanDerWaalsContact OG-O 3.07Å; K99-V214 HydrophobicContact CG-CB 3.99Å; K99-V214 HydrophobicContact CG-CG2 4.09Å; V102-V214 HydrophobicContact CB-CG2 4.41Å; V102-V214 HydrophobicContact CG2-CG1 4.12Å; V102-V214 HydrophobicContact CG2-CG2 4.14Å
215	E	91.8	Very high	91.7	Very high	83 Å²	83	50.5 Å²	50.5	39%	0.388	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	137.4	-175.8	-175.9	174.8	-134	0	0	111.9	F213 M260 V266 V267 R269	F213-E215 HydrophobicContact CD1-CB 4.4Å; E215-M260 HydrophobicContact CG-CE 4.38Å; E215-M260 WeakPolarHBondContact OE1-CE 3.31Å; E215-V266 HydrophobicContact CB-CG1 3.86Å; E215-V267 PolarHBondContact N-O 3.12Å; E215-V267 VanDerWaalsContact N-O 3.11Å; E215-R269 PolarHBondContact O-N 3.43Å; E215-R269 VanDerWaalsContact O-N 3.13Å
216	T	90.9	Very high	91.6	Very high	13 Å²	13	50.3 Å²	50.3	8%	0.08	26%	0.257	C	S	.	.			trans	-164.1	143.9	175.1	-65.4	0	0	0	0	108	S97 I220 R221	S97-T216 PolarHBondContact O-OG1 3.03Å; S97-T216 VanDerWaalsContact O-OG1 3.09Å; T216-I220 HydrophobicContact CG2-CB 3.83Å; T216-I220 HydrophobicContact CG2-CG2 3.46Å; T216-I220 VanDerWaalsContact CG2-CG2 3.46Å; T216-R221 HydrophobicContact CG2-CG 4.08Å; T216-R221 WeakPolarHBondContact O-CD 3.19Å
217	D	89.9	Confident	91.4	Very high	99 Å²	99	51.5 Å²	51.5	53%	0.529	26%	0.255	S	S	.	.			trans	-59.2	150.4	-176.8	-44.4	-83.6	0	0	0	113.1	D219 I220 R221	D217-D219 VanDerWaalsContact C-N 3.34Å; D217-D219 VanDerWaalsContact CB-OD1 3.24Å; D217-D219 WeakPolarHBondContact CB-OD1 2.97Å; D217-D219 PolarHBondContact O-N 3.27Å; D217-I220 HydrophobicContact CB-CD1 4.17Å; D217-I220 PolarHBondContact O-N 2.99Å; D217-R221 WeakPolarHBondContact O-CB 3.42Å; D217-R221 WeakPolarHBondContact O-CD 3.47Å; D217-R221 VanDerWaalsContact O-CG 3.31Å; D217-R221 WeakPolarHBondContact O-CG 3.41Å; D217-R221 PolarHBondContact O-N 2.86Å
218	S	88.6	Confident	91.1	Very high	70 Å²	70	53.8 Å²	53.8	49%	0.49	26%	0.262	S	S	.	.	H	α-helix	trans	-67.8	-32.1	-170	57.5	0	0	0	0	113.6	L222 Y244	S218-L222 WeakPolarHBondContact O-CB 3.32Å; S218-L222 PolarHBondContact O-N 3.05Å; S218-Y244 PolarHBondContact O-OH 3.34Å
219	D	90.1	Very high	90.6	Very high	98 Å²	98	53.4 Å²	53.4	52%	0.524	26%	0.26	S	S	.	.	H	α-helix	trans	-71	-47.5	175.9	66.5	-39.2	0	0	0	111.4	D217 R221 L222 V223	D217-D219 VanDerWaalsContact C-N 3.34Å; D217-D219 VanDerWaalsContact CB-OD1 3.24Å; D217-D219 WeakPolarHBondContact CB-OD1 2.97Å; D217-D219 PolarHBondContact O-N 3.27Å; D219-R221 VanDerWaalsContact C-N 3.26Å; D219-R221 PolarHBondContact O-N 3.33Å; D219-L222 WeakPolarHBondContact O-CB 3.41Å; D219-L222 PolarHBondContact O-N 3.49Å; D219-L222 VanDerWaalsContact O-N 3.09Å; D219-V223 WeakPolarHBondContact O-CG2 3.48Å; D219-V223 PolarHBondContact O-N 3.12Å
220	I	89.7	Confident	90.3	Very high	66 Å²	66	52.8 Å²	52.8	34%	0.338	26%	0.256	S	S	.	.	H	α-helix	trans	-59.6	-40.7	174.5	-69.1	166.6	0	0	0	110	T216 D217 R224	T216-I220 HydrophobicContact CG2-CB 3.83Å; T216-I220 HydrophobicContact CG2-CG2 3.46Å; T216-I220 VanDerWaalsContact CG2-CG2 3.46Å; D217-I220 HydrophobicContact CB-CD1 4.17Å; D217-I220 PolarHBondContact O-N 2.99Å; I220-R224 WeakPolarHBondContact O-CB 3.45Å; I220-R224 WeakPolarHBondContact O-CG 3.16Å; I220-R224 PolarHBondContact O-N 3.36Å
221	R	90.6	Very high	89.8	Confident	9 Å²	9	57.2 Å²	57.2	3%	0.034	28%	0.284	C	S	.	.	H	α-helix	trans	-63.2	-44.2	173	-76.8	164.8	53.6	-160.7	-8.9	112.6	S95 A96 T216 D217 D219 R224 R225 F252	S95-R221 PolarHBondContact O-NE 2.96Å; A96-R221 WeakPolarHBondContact CB-O 3.49Å; T216-R221 HydrophobicContact CG2-CG 4.08Å; T216-R221 WeakPolarHBondContact O-CD 3.19Å; D217-R221 WeakPolarHBondContact O-CB 3.42Å; D217-R221 WeakPolarHBondContact O-CD 3.47Å; D217-R221 VanDerWaalsContact O-CG 3.31Å; D217-R221 WeakPolarHBondContact O-CG 3.41Å; D217-R221 PolarHBondContact O-N 2.86Å; D219-R221 VanDerWaalsContact C-N 3.26Å; D219-R221 PolarHBondContact O-N 3.33Å; R221-R224 PolarHBondContact O-N 2.67Å; R221-R225 WeakPolarHBondContact O-CB 3.2Å; R221-R225 PolarHBondContact O-N 3.3Å; R221-F252 VanDerWaalsContact NH1-CE2 3.33Å
222	L	90.9	Very high	88.9	Confident	46 Å²	46	62.6 Å²	62.6	24%	0.241	31%	0.31	C	S	.	.	H	α-helix	trans	-61.7	-50.1	177.2	174.2	56.8	0	0	0	111.3	S218 D219 R224 R225 L226 Y244	S218-L222 WeakPolarHBondContact O-CB 3.32Å; S218-L222 PolarHBondContact O-N 3.05Å; D219-L222 WeakPolarHBondContact O-CB 3.41Å; D219-L222 PolarHBondContact O-N 3.49Å; D219-L222 VanDerWaalsContact O-N 3.09Å; L222-R224 VanDerWaalsContact C-N 3.33Å; L222-R224 PolarHBondContact O-N 3.07Å; L222-R225 PolarHBondContact O-N 3.3Å; L222-R225 VanDerWaalsContact O-N 3.15Å; L222-L226 HydrophobicContact CD1-CD1 3.83Å; L222-L226 HydrophobicContact CD1-CG 4.01Å; L222-L226 HydrophobicContact CG-CD1 3.93Å; L222-L226 WeakPolarHBondContact O-CB 3.11Å; L222-L226 WeakPolarHBondContact O-CG 3.5Å; L222-L226 PolarHBondContact O-N 2.89Å; L222-Y244 HydrophobicContact CB-CE1 4.39Å; L222-Y244 HydrophobicContact CB-CE2 4.2Å; L222-Y244 HydrophobicContact CD1-CD1 3.86Å; L222-Y244 HydrophobicContact CD1-CD2 3.88Å; L222-Y244 HydrophobicContact CD1-CE1 4.15Å; L222-Y244 HydrophobicContact CD1-CE2 4.15Å; L222-Y244 HydrophobicContact CD1-CG 3.71Å; L222-Y244 HydrophobicContact CD2-CD1 4.36Å; L222-Y244 HydrophobicContact CD2-CE1 4.14Å; L222-Y244 HydrophobicContact CG-CE1 4.46Å
223	V	90.6	Very high	87.9	Confident	97 Å²	97	66.6 Å²	66.6	59%	0.588	33%	0.325	S	S	*	.	H	α-helix	trans	-59.2	-43.1	177.8	172.3	0	0	0	0	111.4	D219 R227	D219-V223 WeakPolarHBondContact O-CG2 3.48Å; D219-V223 PolarHBondContact O-N 3.12Å; V223-R227 WeakPolarHBondContact O-CB 3.33Å; V223-R227 PolarHBondContact O-N 2.76Å; V223-R227 VanDerWaalsContact O-N 3.08Å
224	R	89	Confident	87	Confident	102 Å²	102	70 Å²	70	39%	0.385	36%	0.36	S	S	.	.	H	α-helix	trans	-64.4	-42.7	174.5	-73.1	171.7	-177.8	178	5	112.4	A96 S97 I220 R221 L222 R228	A96-R224 HydrophobicContact CB-CB 3.87Å; A96-R224 WeakPolarHBondContact O-CD 3.33Å; S97-R224 PolarHBondContact O-NH1 3.28Å; S97-R224 VanDerWaalsContact O-NH1 3.09Å; I220-R224 WeakPolarHBondContact O-CB 3.45Å; I220-R224 WeakPolarHBondContact O-CG 3.16Å; I220-R224 PolarHBondContact O-N 3.36Å; R221-R224 PolarHBondContact O-N 2.67Å; L222-R224 VanDerWaalsContact C-N 3.33Å; L222-R224 PolarHBondContact O-N 3.07Å; R224-R228 WeakPolarHBondContact O-CB 3.36Å; R224-R228 PolarHBondContact O-N 2.76Å
225	R	88.5	Confident	86.3	Confident	16 Å²	16	72.4 Å²	72.4	6%	0.06	37%	0.369	C	S	.	.	H	α-helix	trans	-66.3	-43.9	178.3	-174.3	170.9	-177.6	156.8	-22.6	111.5	S95 A96 D143 R221 L222 R228 D229 V248	S95-R225 PolarHBondContact OG-NH1 2.82Å; A96-R225 HydrophobicContact CB-CB 4.01Å; D143-R225 IonicContact OD1-NH1 3.6Å; D143-R225 IonicContact OD2-NH1 2.72Å; D143-R225 IonicContact OD2-NH2 2.98Å; R221-R225 WeakPolarHBondContact O-CB 3.2Å; R221-R225 PolarHBondContact O-N 3.3Å; L222-R225 PolarHBondContact O-N 3.3Å; L222-R225 VanDerWaalsContact O-N 3.15Å; R225-R228 PolarHBondContact O-N 2.73Å; R225-D229 WeakPolarHBondContact CG-OD2 3.43Å; R225-D229 IonicContact CZ-OD2 2.71Å; R225-D229 IonicContact NE-OD2 3.45Å; R225-D229 PolarHBondContact NE-OD2 3.22Å; R225-D229 WeakPolarHBondContact O-CB 3.24Å; R225-D229 PolarHBondContact O-N 2.87Å; R225-V248 VanDerWaalsContact NH1-CG2 3.32Å
226	L	88.9	Confident	86	Confident	32 Å²	32	73.3 Å²	73.3	17%	0.168	38%	0.377	C	S	.	.	H	α-helix	trans	-55.5	-56.7	174.8	-76.8	164.2	0	0	0	110.5	L222 R228 D229 I230 I237 V240 I241	L222-L226 HydrophobicContact CD1-CD1 3.83Å; L222-L226 HydrophobicContact CD1-CG 4.01Å; L222-L226 HydrophobicContact CG-CD1 3.93Å; L222-L226 WeakPolarHBondContact O-CB 3.11Å; L222-L226 WeakPolarHBondContact O-CG 3.5Å; L222-L226 PolarHBondContact O-N 2.89Å; L226-R228 VanDerWaalsContact C-N 3.3Å; L226-R228 PolarHBondContact O-N 3.43Å; L226-D229 PolarHBondContact O-N 2.88Å; L226-I230 HydrophobicContact CB-CD1 4.24Å; L226-I230 HydrophobicContact CD2-CD1 4.42Å; L226-I230 WeakPolarHBondContact O-CB 3.31Å; L226-I230 VanDerWaalsContact O-CD1 3.29Å; L226-I230 WeakPolarHBondContact O-CD1 3.39Å; L226-I230 WeakPolarHBondContact O-CG1 3.41Å; L226-I230 PolarHBondContact O-N 2.83Å; L226-I237 HydrophobicContact CD2-CG2 4.41Å; L226-V240 HydrophobicContact CD2-CB 4.03Å; L226-V240 HydrophobicContact CD2-CG1 3.66Å; L226-V240 HydrophobicContact CG-CG1 4.34Å; L226-I241 HydrophobicContact CD2-CG1 3.99Å
227	R	88	Confident	85.9	Confident	194 Å²	194	77 Å²	77	73%	0.732	40%	0.396	S	S	*	.	H	α-helix	trans	-55.8	-43.6	-179.9	-173.5	174.9	179.9	172.4	0.4	112.4	V223 T231	V223-R227 WeakPolarHBondContact O-CB 3.33Å; V223-R227 PolarHBondContact O-N 2.76Å; V223-R227 VanDerWaalsContact O-N 3.08Å; R227-T231 VanDerWaalsContact O-CB 3.24Å; R227-T231 WeakPolarHBondContact O-CB 3.33Å; R227-T231 PolarHBondContact O-N 3.18Å; R227-T231 PolarHBondContact O-OG1 2.75Å; R227-T231 VanDerWaalsContact O-OG1 3.14Å
228	R	84.9	Confident	85.7	Confident	68 Å²	68	78.4 Å²	78.4	26%	0.257	40%	0.399	S	S	.	.	H	α-helix	trans	-65.4	-54.6	177.5	-170.3	-161.2	63.5	-170	-6.1	112.1	R224 R225 L226 I230 T231 E232	R224-R228 WeakPolarHBondContact O-CB 3.36Å; R224-R228 PolarHBondContact O-N 2.76Å; R225-R228 PolarHBondContact O-N 2.73Å; L226-R228 VanDerWaalsContact C-N 3.3Å; L226-R228 PolarHBondContact O-N 3.43Å; R228-I230 VanDerWaalsContact C-N 3.3Å; R228-I230 PolarHBondContact O-N 2.72Å; R228-T231 PolarHBondContact O-N 3.15Å; R228-E232 VanDerWaalsContact CG-CD 3.46Å; R228-E232 HydrophobicContact CG-CG 4.29Å; R228-E232 WeakPolarHBondContact CG-OE2 3.39Å; R228-E232 WeakPolarHBondContact O-CA 3.31Å; R228-E232 VanDerWaalsContact O-CB 3.28Å; R228-E232 WeakPolarHBondContact O-CB 3.45Å; R228-E232 PolarHBondContact O-N 3.02Å
229	D	82.8	Confident	85.5	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-71.5	-25.8	-171.7	-69.2	-11.1	0	0	0	112	R225 L226 R233 G234 R235 V240	R225-D229 WeakPolarHBondContact CG-OD2 3.43Å; R225-D229 IonicContact CZ-OD2 2.71Å; R225-D229 IonicContact NE-OD2 3.45Å; R225-D229 PolarHBondContact NE-OD2 3.22Å; R225-D229 WeakPolarHBondContact O-CB 3.24Å; R225-D229 PolarHBondContact O-N 2.87Å; L226-D229 PolarHBondContact O-N 2.88Å; D229-R233 CarbonylContact O-C 3.57Å; D229-R233 WeakPolarHBondContact O-CB 3.42Å; D229-R233 WeakPolarHBondContact OD1-CD 3.43Å; D229-R233 IonicContact OD1-NE 3.15Å; D229-R233 IonicContact OD1-NH1 2.71Å; D229-R233 PolarHBondContact OD1-NH1 3.26Å; D229-G234 PolarHBondContact O-N 2.69Å; D229-R235 WeakPolarHBondContact O-CB 3.5Å; D229-R235 PolarHBondContact O-N 3.18Å; D229-V240 HydrophobicContact CB-CG1 4.47Å; D229-V240 HydrophobicContact CB-CG2 3.91Å
230	I	85.9	Confident	85.3	Confident	59 Å²	59	71 Å²	71	30%	0.303	36%	0.356	S	S	.	.	H	α-helix	trans	-75	-59.2	169.4	-60.5	160	0	0	0	110.5	L226 R228 G234 I237	L226-I230 HydrophobicContact CB-CD1 4.24Å; L226-I230 HydrophobicContact CD2-CD1 4.42Å; L226-I230 WeakPolarHBondContact O-CB 3.31Å; L226-I230 VanDerWaalsContact O-CD1 3.29Å; L226-I230 WeakPolarHBondContact O-CD1 3.39Å; L226-I230 WeakPolarHBondContact O-CG1 3.41Å; L226-I230 PolarHBondContact O-N 2.83Å; R228-I230 VanDerWaalsContact C-N 3.3Å; R228-I230 PolarHBondContact O-N 2.72Å; I230-G234 WeakPolarHBondContact O-CA 3.37Å; I230-G234 PolarHBondContact O-N 3.06Å; I230-I237 HydrophobicContact CD1-CD1 4.43Å; I230-I237 HydrophobicContact CD1-CG1 3.82Å; I230-I237 HydrophobicContact CG1-CG1 4.33Å
231	T	83.8	Confident	85.2	Confident	114 Å²	114	70.6 Å²	70.6	70%	0.699	35%	0.354	S	S	*	.	H	α-helix	trans	-75.6	-37.2	-169.4	-56	0	0	0	0	114	R227 R228	R227-T231 VanDerWaalsContact O-CB 3.24Å; R227-T231 WeakPolarHBondContact O-CB 3.33Å; R227-T231 PolarHBondContact O-N 3.18Å; R227-T231 PolarHBondContact O-OG1 2.75Å; R227-T231 VanDerWaalsContact O-OG1 3.14Å; R228-T231 PolarHBondContact O-N 3.15Å
232	E	75.9	Confident	85.1	Confident	145 Å²	145	74.6 Å²	74.6	68%	0.678	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-23.2	-176.1	-57.7	175	-166.9	0	0	113	R228	R228-E232 VanDerWaalsContact CG-CD 3.46Å; R228-E232 HydrophobicContact CG-CG 4.29Å; R228-E232 WeakPolarHBondContact CG-OE2 3.39Å; R228-E232 WeakPolarHBondContact O-CA 3.31Å; R228-E232 VanDerWaalsContact O-CB 3.28Å; R228-E232 WeakPolarHBondContact O-CB 3.45Å; R228-E232 PolarHBondContact O-N 3.02Å
233	R	74.8	Confident	84.8	Confident	84 Å²	84	72.5 Å²	72.5	32%	0.317	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	1.3	-172.9	-63	172.8	166.2	-173.5	-12.5	114.2	D229 R235	D229-R233 CarbonylContact O-C 3.57Å; D229-R233 WeakPolarHBondContact O-CB 3.42Å; D229-R233 WeakPolarHBondContact OD1-CD 3.43Å; D229-R233 IonicContact OD1-NE 3.15Å; D229-R233 IonicContact OD1-NH1 2.71Å; D229-R233 PolarHBondContact OD1-NH1 3.26Å; R233-R235 HydrophobicContact CB-CG 4.3Å; R233-R235 PolarHBondContact O-N 3.4Å
234	G	77.8	Confident	84.8	Confident	73 Å²	73	68.6 Å²	68.6	75%	0.753	34%	0.336	S	S	*	.			trans	63.1	23.4	174.2	0	0	0	0	0	114.9	D229 I230	D229-G234 PolarHBondContact O-N 2.69Å; I230-G234 WeakPolarHBondContact O-CA 3.37Å; I230-G234 PolarHBondContact O-N 3.06Å
235	R	79.1	Confident	84.8	Confident	52 Å²	52	68.3 Å²	68.3	20%	0.196	34%	0.342	C	S	.	.			trans	-84	146.1	-177.8	-63	-171.8	170.6	-159.7	-5.8	112	D229 R233 V240	D229-R235 WeakPolarHBondContact O-CB 3.5Å; D229-R235 PolarHBondContact O-N 3.18Å; R233-R235 HydrophobicContact CB-CG 4.3Å; R233-R235 PolarHBondContact O-N 3.4Å; R235-V240 HydrophobicContact CB-CG2 3.78Å
236	D	86.2	Confident	84.8	Confident	103 Å²	103	72.5 Å²	72.5	55%	0.551	36%	0.361	S	S	*	.			trans	-67.4	149.6	171.6	169.8	58.8	0	0	0	112.7	E238 G239 V240	D236-E238 WeakPolarHBondContact OD2-CB 3.47Å; D236-E238 PolarHBondContact OD2-N 3.01Å; D236-G239 PolarHBondContact OD2-N 2.79Å; D236-V240 WeakPolarHBondContact O-CG2 3.39Å; D236-V240 PolarHBondContact O-N 3.05Å; D236-V240 VanDerWaalsContact O-N 3.1Å
237	I	87.8	Confident	84.9	Confident	91 Å²	91	72.3 Å²	72.3	47%	0.467	36%	0.358	S	S	.	.	H	α-helix	trans	-64.9	-49	-176.7	-53.9	-176.5	0	0	0	110.9	L226 I230 G239 V240 I241	L226-I237 HydrophobicContact CD2-CG2 4.41Å; I230-I237 HydrophobicContact CD1-CD1 4.43Å; I230-I237 HydrophobicContact CD1-CG1 3.82Å; I230-I237 HydrophobicContact CG1-CG1 4.33Å; I237-G239 VanDerWaalsContact C-N 3.33Å; I237-G239 PolarHBondContact O-N 3.12Å; I237-V240 PolarHBondContact O-N 3.1Å; I237-I241 HydrophobicContact CG2-CD1 3.83Å; I237-I241 HydrophobicContact CG2-CG1 4.44Å; I237-I241 WeakPolarHBondContact O-CG1 3.39Å; I237-I241 PolarHBondContact O-N 3.04Å
238	E	86.8	Confident	84.9	Confident	128 Å²	128	63.2 Å²	63.2	60%	0.598	32%	0.324	S	S	*	.	H	α-helix	trans	-65.5	-40.6	-178	-172.3	58.9	-149.3	0	0	110.3	D236 V240 I241 K242	D236-E238 WeakPolarHBondContact OD2-CB 3.47Å; D236-E238 PolarHBondContact OD2-N 3.01Å; E238-V240 PolarHBondContact O-N 2.97Å; E238-I241 PolarHBondContact O-N 2.75Å; E238-K242 WeakPolarHBondContact O-CB 3.36Å; E238-K242 PolarHBondContact O-N 2.63Å
239	G	84.3	Confident	85.1	Confident	11 Å²	11	64.1 Å²	64.1	11%	0.113	33%	0.33	C	S	.	.	H	α-helix	trans	-56.3	-43	171.7	0	0	0	0	0	114	D236 I237 Q243	D236-G239 PolarHBondContact OD2-N 2.79Å; I237-G239 VanDerWaalsContact C-N 3.33Å; I237-G239 PolarHBondContact O-N 3.12Å; G239-Q243 WeakPolarHBondContact O-CB 3.41Å; G239-Q243 PolarHBondContact O-N 3.45Å
240	V	85.3	Confident	85.6	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.006	35%	0.347	C	S	.	.	H	α-helix	trans	-73	-40.1	178.4	175.5	0	0	0	0	111.9	L226 D229 R235 D236 I237 E238 Q243 Y244	L226-V240 HydrophobicContact CD2-CB 4.03Å; L226-V240 HydrophobicContact CD2-CG1 3.66Å; L226-V240 HydrophobicContact CG-CG1 4.34Å; D229-V240 HydrophobicContact CB-CG1 4.47Å; D229-V240 HydrophobicContact CB-CG2 3.91Å; R235-V240 HydrophobicContact CB-CG2 3.78Å; D236-V240 WeakPolarHBondContact O-CG2 3.39Å; D236-V240 PolarHBondContact O-N 3.05Å; D236-V240 VanDerWaalsContact O-N 3.1Å; I237-V240 PolarHBondContact O-N 3.1Å; E238-V240 PolarHBondContact O-N 2.97Å; V240-Q243 PolarHBondContact O-N 3.45Å; V240-Y244 WeakPolarHBondContact O-CB 3.45Å; V240-Y244 PolarHBondContact O-N 3.38Å
241	I	87.9	Confident	85.8	Confident	57 Å²	57	64 Å²	64	29%	0.292	33%	0.333	S	S	.	.	H	α-helix	trans	-64.7	-45.4	176.5	-67.3	174	0	0	0	110.6	L226 I237 E238 Q243 Y244 N245	L226-I241 HydrophobicContact CD2-CG1 3.99Å; I237-I241 HydrophobicContact CG2-CD1 3.83Å; I237-I241 HydrophobicContact CG2-CG1 4.44Å; I237-I241 WeakPolarHBondContact O-CG1 3.39Å; I237-I241 PolarHBondContact O-N 3.04Å; E238-I241 PolarHBondContact O-N 2.75Å; I241-Q243 PolarHBondContact O-N 2.86Å; I241-Y244 PolarHBondContact O-N 3.28Å; I241-N245 PolarHBondContact O-N 3.11Å
242	K	88.2	Confident	86.2	Confident	94 Å²	94	59.5 Å²	59.5	41%	0.409	30%	0.304	S	S	.	.	H	α-helix	trans	-56.8	-48.8	173.9	-177.6	-168.4	171.5	-159.5	0	111.4	D139 E238 Y244 K246	D139-K242 IonicContact OD1-NZ 2.71Å; E238-K242 WeakPolarHBondContact O-CB 3.36Å; E238-K242 PolarHBondContact O-N 2.63Å; K242-Y244 VanDerWaalsContact C-N 3.33Å; K242-Y244 PolarHBondContact O-N 2.71Å; K242-K246 VanDerWaalsContact O-CB 3.28Å; K242-K246 WeakPolarHBondContact O-CB 3.35Å; K242-K246 PolarHBondContact O-N 2.87Å
243	Q	85.6	Confident	87	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.009	29%	0.292	C	S	.	.	H	α-helix	trans	-62.8	-40.5	177.9	-169.1	177.7	50.9	0	0	111.6	G239 V240 I241 F247 V248	G239-Q243 WeakPolarHBondContact O-CB 3.41Å; G239-Q243 PolarHBondContact O-N 3.45Å; V240-Q243 PolarHBondContact O-N 3.45Å; I241-Q243 PolarHBondContact O-N 2.86Å; Q243-F247 HydrophobicContact CG-CD2 4.09Å; Q243-F247 PolarHBondContact O-N 2.89Å; Q243-V248 HydrophobicContact CG-CG2 4.37Å; Q243-V248 PolarHBondContact O-N 3.05Å
244	Y	89	Confident	87.7	Confident	15 Å²	15	58.5 Å²	58.5	6%	0.059	30%	0.303	C	S	.	.	I	π-helix	trans	-62	-50	180	-177	-93.8	0	0	0	112.3	S218 L222 V240 I241 K242 V248 K249	S218-Y244 PolarHBondContact O-OH 3.34Å; L222-Y244 HydrophobicContact CB-CE1 4.39Å; L222-Y244 HydrophobicContact CB-CE2 4.2Å; L222-Y244 HydrophobicContact CD1-CD1 3.86Å; L222-Y244 HydrophobicContact CD1-CD2 3.88Å; L222-Y244 HydrophobicContact CD1-CE1 4.15Å; L222-Y244 HydrophobicContact CD1-CE2 4.15Å; L222-Y244 HydrophobicContact CD1-CG 3.71Å; L222-Y244 HydrophobicContact CD2-CD1 4.36Å; L222-Y244 HydrophobicContact CD2-CE1 4.14Å; L222-Y244 HydrophobicContact CG-CE1 4.46Å; V240-Y244 WeakPolarHBondContact O-CB 3.45Å; V240-Y244 PolarHBondContact O-N 3.38Å; I241-Y244 PolarHBondContact O-N 3.28Å; K242-Y244 VanDerWaalsContact C-N 3.33Å; K242-Y244 PolarHBondContact O-N 2.71Å; Y244-V248 HydrophobicContact CD2-CB 3.89Å; Y244-V248 HydrophobicContact CD2-CG1 4.01Å; Y244-V248 HydrophobicContact CD2-CG2 4.49Å; Y244-V248 HydrophobicContact CE2-CG1 4.28Å; Y244-V248 HydrophobicContact CG-CB 4.43Å; Y244-V248 PolarHBondContact O-N 3.32Å; Y244-K249 HydrophobicContact CD1-CB 4.38Å; Y244-K249 HydrophobicContact CE1-CB 3.99Å; Y244-K249 PolarHBondContact O-N 3.26Å
245	N	89.8	Confident	88.3	Confident	96 Å²	96	58.1 Å²	58.1	51%	0.513	28%	0.279	S	S	.	.	I	π-helix	trans	-71.7	-38	-178.3	-70.9	-29.9	0	0	0	112.8	I241 P250	I241-N245 PolarHBondContact O-N 3.11Å; N245-P250 WeakPolarHBondContact O-CD 3.39Å
246	K	89.3	Confident	88.9	Confident	104 Å²	104	55.8 Å²	55.8	45%	0.452	27%	0.271	S	S	.	.	I	π-helix	trans	-77	-33	-178.5	-173.7	173.7	172.8	-176.3	0	113.4	D139 K242	D139-K246 IonicContact OD1-NZ 2.72Å; D139-K246 PolarHBondContact OD1-NZ 2.78Å; D139-K246 IonicContact OD2-NZ 3.99Å; D139-K246 PolarHBondContact OD2-NZ 3.3Å; K242-K246 VanDerWaalsContact O-CB 3.28Å; K242-K246 WeakPolarHBondContact O-CB 3.35Å; K242-K246 PolarHBondContact O-N 2.87Å
247	F	89.6	Confident	89.3	Confident	28 Å²	28	55.2 Å²	55.2	12%	0.123	27%	0.265	C	S	.	.	I	π-helix	trans	-129.2	-56.9	-170.9	-56.7	-69.9	0	0	0	113.7	N141 Q243 K249 P250 A251	N141-F247 HydrophobicContact CB-CB 4.49Å; N141-F247 HydrophobicContact CB-CD1 3.56Å; N141-F247 HydrophobicContact CB-CE1 3.94Å; N141-F247 HydrophobicContact CB-CG 4.15Å; Q243-F247 HydrophobicContact CG-CD2 4.09Å; Q243-F247 PolarHBondContact O-N 2.89Å; F247-K249 PolarHBondContact O-N 3.48Å; F247-P250 WeakPolarHBondContact O-CD 3.23Å; F247-A251 WeakPolarHBondContact O-CB 3.27Å; F247-A251 PolarHBondContact O-N 3.05Å
248	V	88.1	Confident	89.5	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.012	26%	0.26	C	S	.	.	I	π-helix	trans	-65.4	-39.9	-166.2	-171	0	0	0	0	112.8	R225 Q243 Y244 F252	R225-V248 VanDerWaalsContact NH1-CG2 3.32Å; Q243-V248 HydrophobicContact CG-CG2 4.37Å; Q243-V248 PolarHBondContact O-N 3.05Å; Y244-V248 HydrophobicContact CD2-CB 3.89Å; Y244-V248 HydrophobicContact CD2-CG1 4.01Å; Y244-V248 HydrophobicContact CD2-CG2 4.49Å; Y244-V248 HydrophobicContact CE2-CG1 4.28Å; Y244-V248 HydrophobicContact CG-CB 4.43Å; Y244-V248 PolarHBondContact O-N 3.32Å; V248-F252 WeakPolarHBondContact O-CB 3.41Å; V248-F252 PolarHBondContact O-N 2.89Å; V248-F252 VanDerWaalsContact O-N 3.16Å
249	K	90.3	Very high	89.9	Confident	88 Å²	88	47.9 Å²	47.9	38%	0.383	23%	0.234	S	C	.	.	H	α-helix	trans	-70.9	-55.9	177.6	172.8	178.8	178.2	-175.6	0	111.5	Y244 F247 A251 F252 E253	Y244-K249 HydrophobicContact CD1-CB 4.38Å; Y244-K249 HydrophobicContact CE1-CB 3.99Å; Y244-K249 PolarHBondContact O-N 3.26Å; F247-K249 PolarHBondContact O-N 3.48Å; K249-A251 VanDerWaalsContact C-N 3.28Å; K249-A251 PolarHBondContact O-N 3.16Å; K249-F252 WeakPolarHBondContact O-CB 3.3Å; K249-F252 PolarHBondContact O-N 3.29Å; K249-E253 VanDerWaalsContact CE-CD 3.49Å; K249-E253 WeakPolarHBondContact CE-OE1 3.34Å; K249-E253 IonicContact NZ-OE1 3.61Å; K249-E253 PolarHBondContact O-N 3.1Å; K249-E253 VanDerWaalsContact O-N 3.12Å
250	P	92.7	Very high	90.3	Very high	53 Å²	53	49.8 Å²	49.8	34%	0.344	24%	0.241	S	C	.	.	H	α-helix	trans	-54.6	-41.5	175.6	-27.9	35	0	0	0	113.5	N245 F247 F252 E253 Q254	N245-P250 WeakPolarHBondContact O-CD 3.39Å; F247-P250 WeakPolarHBondContact O-CD 3.23Å; P250-F252 VanDerWaalsContact C-N 3.33Å; P250-F252 PolarHBondContact O-N 3.08Å; P250-E253 PolarHBondContact O-N 3.48Å; P250-Q254 WeakPolarHBondContact O-CB 3.39Å; P250-Q254 PolarHBondContact O-N 2.82Å
251	A	90.1	Very high	90.6	Very high	3 Å²	3	59.8 Å²	59.8	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-62.6	-37.6	176.6	0	0	0	0	0	113.4	D143 F247 K249 Y255	D143-A251 HydrophobicContact CB-CB 3.72Å; D143-A251 WeakPolarHBondContact O-CB 3.33Å; F247-A251 WeakPolarHBondContact O-CB 3.27Å; F247-A251 PolarHBondContact O-N 3.05Å; K249-A251 VanDerWaalsContact C-N 3.28Å; K249-A251 PolarHBondContact O-N 3.16Å; A251-Y255 HydrophobicContact CB-CD2 4.43Å; A251-Y255 WeakPolarHBondContact O-CB 3.41Å; A251-Y255 PolarHBondContact O-N 3.04Å
252	F	91.8	Very high	90.9	Very high	19 Å²	19	60.4 Å²	60.4	8%	0.083	28%	0.282	C	S	.	.	I	π-helix	trans	-64.9	-50.5	175.9	174	-101	0	0	0	111.3	F213 R221 V248 K249 P250 Q254 I256 E257	F213-F252 HydrophobicContact CZ-CE2 4.3Å; R221-F252 VanDerWaalsContact NH1-CE2 3.33Å; V248-F252 WeakPolarHBondContact O-CB 3.41Å; V248-F252 PolarHBondContact O-N 2.89Å; V248-F252 VanDerWaalsContact O-N 3.16Å; K249-F252 WeakPolarHBondContact O-CB 3.3Å; K249-F252 PolarHBondContact O-N 3.29Å; P250-F252 VanDerWaalsContact C-N 3.33Å; P250-F252 PolarHBondContact O-N 3.08Å; F252-Q254 VanDerWaalsContact C-N 3.33Å; F252-Q254 PolarHBondContact O-N 2.83Å; F252-I256 HydrophobicContact CB-CD1 4.49Å; F252-I256 HydrophobicContact CD2-CB 3.66Å; F252-I256 HydrophobicContact CD2-CD1 4.23Å; F252-I256 HydrophobicContact CD2-CG1 4.48Å; F252-I256 HydrophobicContact CD2-CG2 3.75Å; F252-I256 HydrophobicContact CE2-CB 4.14Å; F252-I256 HydrophobicContact CE2-CG2 3.84Å; F252-I256 HydrophobicContact CG-CB 4.47Å; F252-I256 PolarHBondContact O-N 3.36Å; F252-E257 HydrophobicContact CD1-CB 4.27Å; F252-E257 HydrophobicContact CE1-CB 3.78Å; F252-E257 HydrophobicContact CE1-CG 4.07Å; F252-E257 WeakPolarHBondContact CE1-OE1 3.32Å; F252-E257 HydrophobicContact CE2-CB 4.3Å; F252-E257 HydrophobicContact CZ-CB 3.78Å; F252-E257 HydrophobicContact CZ-CG 4.14Å; F252-E257 WeakPolarHBondContact O-CB 3.28Å; F252-E257 PolarHBondContact O-N 3.05Å
253	E	92.1	Very high	91.2	Very high	91 Å²	91	57 Å²	57	43%	0.425	27%	0.271	S	S	.	.	I	π-helix	trans	-63.8	-37.6	-178.6	-65	168.8	155.3	0	0	111.5	K249 P250 P258	K249-E253 VanDerWaalsContact CE-CD 3.49Å; K249-E253 WeakPolarHBondContact CE-OE1 3.34Å; K249-E253 IonicContact NZ-OE1 3.61Å; K249-E253 PolarHBondContact O-N 3.1Å; K249-E253 VanDerWaalsContact O-N 3.12Å; P250-E253 PolarHBondContact O-N 3.48Å; E253-P258 WeakPolarHBondContact O-CD 3.3Å; E253-P258 WeakPolarHBondContact O-CG 3.48Å
254	Q	91.2	Very high	91.6	Very high	118 Å²	118	61.7 Å²	61.7	55%	0.551	30%	0.296	S	S	*	.	I	π-helix	trans	-82	-40.7	-178.1	-172.4	178.5	0.3	0	0	114.1	P250 F252	P250-Q254 WeakPolarHBondContact O-CB 3.39Å; P250-Q254 PolarHBondContact O-N 2.82Å; F252-Q254 VanDerWaalsContact C-N 3.33Å; F252-Q254 PolarHBondContact O-N 2.83Å
255	Y	89.7	Confident	91.8	Very high	65 Å²	65	63.8 Å²	63.8	26%	0.255	31%	0.308	S	S	.	.	I	π-helix	trans	-120.4	-20.9	-165.7	-60.5	-64.6	0	0	0	115.5	H144 P145 M197 A251 T259	H144-Y255 AromaticContact CD2-CE2 3.57Å; H144-Y255 AromaticContact CD2-CZ 3.83Å; H144-Y255 AromaticContact NE2-CE2 3.84Å; H144-Y255 AromaticContact NE2-CZ 3.58Å; H144-Y255 PolarHBondContact NE2-OH 2.87Å; P145-Y255 HydrophobicContact CG-CD1 4.12Å; P145-Y255 HydrophobicContact CG-CE1 4.27Å; P145-Y255 HydrophobicContact CG-CG 4.34Å; M197-Y255 HydrophobicContact CE-CD2 4.11Å; M197-Y255 HydrophobicContact CE-CG 4.15Å; A251-Y255 HydrophobicContact CB-CD2 4.43Å; A251-Y255 WeakPolarHBondContact O-CB 3.41Å; A251-Y255 PolarHBondContact O-N 3.04Å; Y255-T259 WeakPolarHBondContact O-CG2 3.24Å
256	I	92.1	Very high	91.9	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.01	30%	0.299	C	S	.	.	I	π-helix	trans	-109.8	-51.5	-170.7	-54.3	176.7	0	0	0	110.9	I196 M197 F213 F252 T259	I196-I256 HydrophobicContact CB-CD1 4.01Å; I196-I256 WeakPolarHBondContact O-CD1 3.38Å; I196-I256 WeakPolarHBondContact O-CG1 3.44Å; I196-I256 WeakPolarHBondContact O-CG2 3.42Å; M197-I256 HydrophobicContact CE-CD1 4.43Å; M197-I256 HydrophobicContact CE-CG1 4.21Å; M197-I256 HydrophobicContact CG-CG1 4.14Å; F213-I256 HydrophobicContact CE2-CG2 4.22Å; F213-I256 HydrophobicContact CZ-CG2 4.34Å; F252-I256 HydrophobicContact CB-CD1 4.49Å; F252-I256 HydrophobicContact CD2-CB 3.66Å; F252-I256 HydrophobicContact CD2-CD1 4.23Å; F252-I256 HydrophobicContact CD2-CG1 4.48Å; F252-I256 HydrophobicContact CD2-CG2 3.75Å; F252-I256 HydrophobicContact CE2-CB 4.14Å; F252-I256 HydrophobicContact CE2-CG2 3.84Å; F252-I256 HydrophobicContact CG-CB 4.47Å; F252-I256 PolarHBondContact O-N 3.36Å; I256-T259 WeakPolarHBondContact O-CB 3.33Å; I256-T259 PolarHBondContact O-N 3.46Å; I256-T259 PolarHBondContact O-OG1 3.15Å
257	E	93.1	Very high	92.1	Very high	91 Å²	91	56.8 Å²	56.8	43%	0.425	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-56.6	-42.8	178.1	-171.8	163.8	-122.2	0	0	112.5	F252 T259 M260	F252-E257 HydrophobicContact CD1-CB 4.27Å; F252-E257 HydrophobicContact CE1-CB 3.78Å; F252-E257 HydrophobicContact CE1-CG 4.07Å; F252-E257 WeakPolarHBondContact CE1-OE1 3.32Å; F252-E257 HydrophobicContact CE2-CB 4.3Å; F252-E257 HydrophobicContact CZ-CB 3.78Å; F252-E257 HydrophobicContact CZ-CG 4.14Å; F252-E257 WeakPolarHBondContact O-CB 3.28Å; F252-E257 PolarHBondContact O-N 3.05Å; E257-T259 PolarHBondContact O-N 3.24Å; E257-M260 WeakPolarHBondContact O-CB 3.41Å; E257-M260 PolarHBondContact O-N 3.49Å
258	P	93.8	Very high	92.1	Very high	56 Å²	56	58 Å²	58	36%	0.364	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-67.8	-4.4	175.8	-21	35.7	0	0	0	115.1	E253 R261	E253-P258 WeakPolarHBondContact O-CD 3.3Å; E253-P258 WeakPolarHBondContact O-CG 3.48Å; P258-R261 WeakPolarHBondContact O-CD 3.2Å; P258-R261 WeakPolarHBondContact O-CG 3.25Å; P258-R261 PolarHBondContact O-NE 3.43Å
259	T	93.3	Very high	91.7	Very high	10 Å²	10	65.9 Å²	65.9	6%	0.061	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-90.9	-9.4	171.6	75.5	0	0	0	0	113.5	F199 Y255 I256 E257 R261 L262	F199-T259 HydrophobicContact CB-CG2 4.15Å; Y255-T259 WeakPolarHBondContact O-CG2 3.24Å; I256-T259 WeakPolarHBondContact O-CB 3.33Å; I256-T259 PolarHBondContact O-N 3.46Å; I256-T259 PolarHBondContact O-OG1 3.15Å; E257-T259 PolarHBondContact O-N 3.24Å; T259-R261 PolarHBondContact O-N 2.87Å; T259-L262 WeakPolarHBondContact O-CB 3.43Å; T259-L262 PolarHBondContact O-N 3.34Å
260	M	93.2	Very high	91.2	Very high	51 Å²	51	61.7 Å²	61.7	25%	0.251	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-56.4	-37.1	177.3	-173.5	-165.9	-74.5	0	0	111.6	F213 E215 E257 L262 A263 V266	F213-M260 HydrophobicContact CB-CG 4.36Å; F213-M260 HydrophobicContact CD1-CB 4.23Å; F213-M260 HydrophobicContact CD1-CE 3.88Å; F213-M260 HydrophobicContact CD1-CG 3.85Å; F213-M260 HydrophobicContact CD2-CB 4.09Å; F213-M260 HydrophobicContact CD2-CG 4.42Å; F213-M260 HydrophobicContact CE1-CB 4.21Å; F213-M260 HydrophobicContact CE1-CE 3.55Å; F213-M260 HydrophobicContact CE1-CG 4.18Å; F213-M260 HydrophobicContact CE2-CB 4.08Å; F213-M260 HydrophobicContact CG-CB 4.15Å; F213-M260 HydrophobicContact CG-CG 3.97Å; F213-M260 HydrophobicContact CZ-CB 4.13Å; F213-M260 HydrophobicContact CZ-CE 4.3Å; E215-M260 HydrophobicContact CG-CE 4.38Å; E215-M260 WeakPolarHBondContact OE1-CE 3.31Å; E257-M260 WeakPolarHBondContact O-CB 3.41Å; E257-M260 PolarHBondContact O-N 3.49Å; M260-L262 PolarHBondContact O-N 3.32Å; M260-A263 WeakPolarHBondContact O-CB 3.22Å; M260-A263 PolarHBondContact O-N 3.08Å; M260-A263 VanDerWaalsContact O-N 3.09Å; M260-V266 HydrophobicContact CG-CG2 4.12Å
261	R	92.9	Very high	90.4	Very high	210 Å²	210	59.7 Å²	59.7	79%	0.792	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-63.6	-5.5	174	72.3	-172.3	168	144.4	1.6	115.7	P258 T259	P258-R261 WeakPolarHBondContact O-CD 3.2Å; P258-R261 WeakPolarHBondContact O-CG 3.25Å; P258-R261 PolarHBondContact O-NE 3.43Å; T259-R261 PolarHBondContact O-N 2.87Å
262	L	93.1	Very high	89.9	Confident	70 Å²	70	62.4 Å²	62.4	37%	0.366	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-105.8	2	178	-52.5	178.5	0	0	0	112	L205 T259 M260	L205-L262 HydrophobicContact CD1-CD1 3.89Å; T259-L262 WeakPolarHBondContact O-CB 3.43Å; T259-L262 PolarHBondContact O-N 3.34Å; M260-L262 PolarHBondContact O-N 3.32Å
263	A	94	Very high	89.7	Confident	23 Å²	23	62.6 Å²	62.6	19%	0.19	32%	0.319	C	S	.	.			trans	-88.3	138.8	178.2	0	0	0	0	0	111.1	F199 K211 F213 M260 L265	F199-A263 HydrophobicContact CE2-CB 4.02Å; K211-A263 CarbonylContact O-C 3.57Å; K211-A263 WeakPolarHBondContact O-CA 3.48Å; F213-A263 HydrophobicContact CB-CB 3.77Å; M260-A263 WeakPolarHBondContact O-CB 3.22Å; M260-A263 PolarHBondContact O-N 3.08Å; M260-A263 VanDerWaalsContact O-N 3.09Å; A263-L265 VanDerWaalsContact C-N 3.31Å
264	D	93.9	Very high	89.4	Confident	100 Å²	100	62 Å²	62	54%	0.535	32%	0.317	S	S	.	.	S	Bend	trans	-77.2	-23.8	171.9	-42.4	-52.6	0	0	0	110.8	K211	K211-D264 WeakPolarHBondContact CB-OD2 3.49Å; K211-D264 VanDerWaalsContact CE-OD1 3.24Å; K211-D264 WeakPolarHBondContact CE-OD1 3.38Å; K211-D264 VanDerWaalsContact CE-OD2 3.28Å; K211-D264 WeakPolarHBondContact CE-OD2 3.33Å; K211-D264 PolarHBondContact N-OD2 2.89Å; K211-D264 IonicContact NZ-OD1 2.75Å; K211-D264 PolarHBondContact NZ-OD1 3.35Å; K211-D264 IonicContact NZ-OD2 2.7Å; K211-D264 PolarHBondContact NZ-OD2 3Å; K211-D264 PolarHBondContact O-N 3.38Å
265	L	92.9	Very high	89.3	Confident	59 Å²	59	61.1 Å²	61.1	31%	0.309	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	138.8	178.8	-177.6	64.1	0	0	0	111.8	M210 K211 I212 F213 A263 V267 I280	M210-L265 HydrophobicContact CE-CD2 4.07Å; K211-L265 PolarHBondContact O-N 3.41Å; I212-L265 CarbonylContact C-O 3.6Å; I212-L265 WeakPolarHBondContact CA-O 3.23Å; I212-L265 HydrophobicContact CG2-CB 4.46Å; I212-L265 HydrophobicContact CG2-CD2 4.48Å; F213-L265 PolarHBondContact N-O 3.08Å; A263-L265 VanDerWaalsContact C-N 3.31Å; L265-V267 HydrophobicContact CD2-CG2 4.23Å; L265-V267 HydrophobicContact CG-CG2 4.31Å; L265-I280 HydrophobicContact CD2-CD1 3.83Å; L265-I280 HydrophobicContact CD2-CG1 3.58Å
266	V	93.3	Very high	89.2	Confident	53 Å²	53	58.6 Å²	58.6	32%	0.321	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129.2	170	-175.5	0	0	0	0	109.6	F213 E215 M260 P268	F213-V266 HydrophobicContact CB-CG2 4.44Å; F213-V266 WeakPolarHBondContact O-CA 3.33Å; E215-V266 HydrophobicContact CB-CG1 3.86Å; M260-V266 HydrophobicContact CG-CG2 4.12Å; V266-P268 VanDerWaalsContact O-CD 3.29Å; V266-P268 WeakPolarHBondContact O-CD 3.44Å
267	V	92.8	Very high	89.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	95.2	-179.8	-180	0	0	0	0	109.6	I212 F213 E215 L265 N273 A276 I280	I212-V267 HydrophobicContact CG2-CB 4.43Å; I212-V267 HydrophobicContact CG2-CG2 3.49Å; I212-V267 VanDerWaalsContact CG2-CG2 3.49Å; F213-V267 PolarHBondContact O-N 2.98Å; E215-V267 PolarHBondContact N-O 3.12Å; E215-V267 VanDerWaalsContact N-O 3.11Å; L265-V267 HydrophobicContact CD2-CG2 4.23Å; L265-V267 HydrophobicContact CG-CG2 4.31Å; V267-N273 HydrophobicContact CG1-CB 4.39Å; V267-A276 HydrophobicContact CG1-CB 4.09Å; V267-A276 HydrophobicContact CG2-CB 4.29Å; V267-I280 HydrophobicContact CG2-CD1 4.11Å
268	P	89.2	Confident	88.8	Confident	55 Å²	55	57.3 Å²	57.3	36%	0.357	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	148.1	177.9	29.8	-35.7	0	0	0	111.2	V266 G270 N273	V266-P268 VanDerWaalsContact O-CD 3.29Å; V266-P268 WeakPolarHBondContact O-CD 3.44Å; P268-G270 PolarHBondContact O-N 3.34Å; P268-N273 WeakPolarHBondContact O-CB 3.49Å; P268-N273 PolarHBondContact O-ND2 3.23Å
269	R	81.3	Confident	88.6	Confident	167 Å²	167	59.7 Å²	59.7	63%	0.63	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	6.4	-175.8	-50.4	175	-68.3	-173.4	-0.5	114.4	E215 G271 G272	E215-R269 PolarHBondContact O-N 3.43Å; E215-R269 VanDerWaalsContact O-N 3.13Å; R269-G271 PolarHBondContact O-N 2.72Å; R269-G272 PolarHBondContact O-N 2.89Å
270	G	79.9	Confident	88.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	50.7	-131.8	-179.3	0	0	0	0	0	113.6	P268 G272 N273	P268-G270 PolarHBondContact O-N 3.34Å; G270-G272 PolarHBondContact O-N 3.22Å; G270-N273 PolarHBondContact O-N 3.05Å
271	G	74.8	Confident	88.3	Confident	11 Å²	11	57.4 Å²	57.4	11%	0.113	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-62.6	-0.3	-174.9	0	0	0	0	0	116.5	K105 R269	K105-G271 WeakPolarHBondContact CD-O 3.3Å; K105-G271 WeakPolarHBondContact CE-O 3.3Å; K105-G271 PolarHBondContact NZ-O 3.18Å; R269-G271 PolarHBondContact O-N 2.72Å
272	G	80.7	Confident	88	Confident	59 Å²	59	53.6 Å²	53.6	61%	0.608	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-82.2	-16.7	169.4	0	0	0	0	0	114.3	R269 G270 M274	R269-G272 PolarHBondContact O-N 2.89Å; G270-G272 PolarHBondContact O-N 3.22Å; G272-M274 PolarHBondContact O-N 2.97Å
273	N	86.4	Confident	87.7	Confident	23 Å²	23	54.5 Å²	54.5	12%	0.123	30%	0.299	C	S	.	.			trans	-94.4	82.9	-174.7	-169.2	1.4	0	0	0	111.7	V267 P268 G270 A276 I277	V267-N273 HydrophobicContact CG1-CB 4.39Å; P268-N273 WeakPolarHBondContact O-CB 3.49Å; P268-N273 PolarHBondContact O-ND2 3.23Å; G270-N273 PolarHBondContact O-N 3.05Å; N273-A276 HydrophobicContact CB-CB 4.3Å; N273-A276 PolarHBondContact O-N 2.98Å; N273-I277 PolarHBondContact O-N 3.15Å
274	M	86.3	Confident	87.3	Confident	79 Å²	79	53.4 Å²	53.4	39%	0.389	29%	0.29	S	S	.	.	H	α-helix	trans	-57.9	-49	-179.1	-66.1	-52.4	-54	0	0	112.3	K105 G272 A276 I277 D278	K105-M274 HydrophobicContact CD-SD 3.94Å; K105-M274 PolarHBondContact NZ-SD 3.4Å; G272-M274 PolarHBondContact O-N 2.97Å; M274-A276 PolarHBondContact O-N 3.23Å; M274-A276 VanDerWaalsContact O-N 3.08Å; M274-I277 CarbonylContact O-C 3.48Å; M274-I277 WeakPolarHBondContact O-CA 3.4Å; M274-I277 WeakPolarHBondContact O-CB 3.38Å; M274-I277 PolarHBondContact O-N 3.16Å; M274-I277 HydrophobicContact SD-CD1 4.39Å; M274-D278 VanDerWaalsContact C-OD2 3.24Å; M274-D278 PolarHBondContact O-N 3.27Å; M274-D278 VanDerWaalsContact O-OD2 3.09Å
275	V	88.5	Confident	86.7	Confident	99 Å²	99	51.3 Å²	51.3	60%	0.6	28%	0.277	S	S	*	.	H	α-helix	trans	-53.1	-39	-178.4	-175.9	0	0	0	0	112.7	L279	V275-L279 HydrophobicContact CG1-CD1 4.37Å; V275-L279 VanDerWaalsContact O-CG 3.28Å; V275-L279 WeakPolarHBondContact O-CG 3.33Å; V275-L279 PolarHBondContact O-N 2.98Å; V275-L279 VanDerWaalsContact O-N 3.14Å
276	A	88.6	Confident	86.2	Confident	12 Å²	12	50.9 Å²	50.9	10%	0.099	28%	0.279	C	S	.	.	H	α-helix	trans	-70.3	-35.2	175.9	0	0	0	0	0	112.9	V267 N273 M274 I280	V267-A276 HydrophobicContact CG1-CB 4.09Å; V267-A276 HydrophobicContact CG2-CB 4.29Å; N273-A276 HydrophobicContact CB-CB 4.3Å; N273-A276 PolarHBondContact O-N 2.98Å; M274-A276 PolarHBondContact O-N 3.23Å; M274-A276 VanDerWaalsContact O-N 3.08Å; A276-I280 WeakPolarHBondContact O-CD1 3.37Å; A276-I280 WeakPolarHBondContact O-CG1 3.38Å; A276-I280 PolarHBondContact O-N 3.09Å
277	I	88.8	Confident	85.5	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68	-45.2	174.8	-65.8	162.3	0	0	0	110.1	V102 K105 I106 N273 M274 L279 I280 V281	V102-I277 HydrophobicContact CG1-CG1 4.49Å; K105-I277 HydrophobicContact CB-CD1 3.89Å; K105-I277 HydrophobicContact CB-CG2 4.22Å; K105-I277 HydrophobicContact CD-CD1 3.68Å; K105-I277 HydrophobicContact CG-CD1 4.44Å; I106-I277 HydrophobicContact CG1-CG2 4.02Å; N273-I277 PolarHBondContact O-N 3.15Å; M274-I277 CarbonylContact O-C 3.48Å; M274-I277 WeakPolarHBondContact O-CA 3.4Å; M274-I277 WeakPolarHBondContact O-CB 3.38Å; M274-I277 PolarHBondContact O-N 3.16Å; M274-I277 HydrophobicContact SD-CD1 4.39Å; I277-L279 VanDerWaalsContact C-N 3.31Å; I277-L279 PolarHBondContact O-N 3.11Å; I277-I280 WeakPolarHBondContact O-CB 3.13Å; I277-I280 PolarHBondContact O-N 2.92Å; I277-I280 VanDerWaalsContact O-N 3.11Å; I277-V281 HydrophobicContact CG2-CG2 4.22Å; I277-V281 WeakPolarHBondContact O-CB 3.37Å; I277-V281 VanDerWaalsContact O-CG2 3.25Å; I277-V281 WeakPolarHBondContact O-CG2 3.43Å; I277-V281 PolarHBondContact O-N 2.71Å
278	D	87.9	Confident	84.5	Confident	67 Å²	67	51.7 Å²	51.7	36%	0.358	28%	0.28	S	S	.	.	H	α-helix	trans	-61.9	-39.5	-178.8	-52.1	-31	0	0	0	110.9	M274 V281 Q282	M274-D278 VanDerWaalsContact C-OD2 3.24Å; M274-D278 PolarHBondContact O-N 3.27Å; M274-D278 VanDerWaalsContact O-OD2 3.09Å; D278-V281 PolarHBondContact O-N 2.72Å; D278-Q282 WeakPolarHBondContact O-CB 3.41Å; D278-Q282 WeakPolarHBondContact O-CG 3.27Å; D278-Q282 PolarHBondContact O-N 3.01Å
279	L	89.6	Confident	83.5	Confident	105 Å²	105	55 Å²	55	55%	0.55	29%	0.291	S	S	.	.	H	α-helix	trans	-65.1	-40	172.9	-73	169.1	0	0	0	113.3	V275 I277 H283	V275-L279 HydrophobicContact CG1-CD1 4.37Å; V275-L279 VanDerWaalsContact O-CG 3.28Å; V275-L279 WeakPolarHBondContact O-CG 3.33Å; V275-L279 PolarHBondContact O-N 2.98Å; V275-L279 VanDerWaalsContact O-N 3.14Å; I277-L279 VanDerWaalsContact C-N 3.31Å; I277-L279 PolarHBondContact O-N 3.11Å; L279-H283 WeakPolarHBondContact O-CB 3.24Å; L279-H283 PolarHBondContact O-N 3.07Å; L279-H283 VanDerWaalsContact O-N 3.07Å
280	I	89.9	Confident	82.7	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-44.8	174.5	-65.5	155.9	0	0	0	109.9	I106 M210 I212 L265 V267 A276 I277 H283 V284	I106-I280 HydrophobicContact CD1-CD1 4.24Å; I106-I280 HydrophobicContact CD1-CG2 3.95Å; I106-I280 HydrophobicContact CG1-CG2 4.32Å; M210-I280 HydrophobicContact CE-CG1 4.06Å; M210-I280 HydrophobicContact CE-CG2 4.43Å; M210-I280 HydrophobicContact SD-CG2 4.27Å; I212-I280 HydrophobicContact CD1-CD1 3.64Å; I212-I280 HydrophobicContact CD1-CG1 3.89Å; I212-I280 HydrophobicContact CD1-CG2 3.98Å; I212-I280 HydrophobicContact CG2-CD1 4.49Å; L265-I280 HydrophobicContact CD2-CD1 3.83Å; L265-I280 HydrophobicContact CD2-CG1 3.58Å; V267-I280 HydrophobicContact CG2-CD1 4.11Å; A276-I280 WeakPolarHBondContact O-CD1 3.37Å; A276-I280 WeakPolarHBondContact O-CG1 3.38Å; A276-I280 PolarHBondContact O-N 3.09Å; I277-I280 WeakPolarHBondContact O-CB 3.13Å; I277-I280 PolarHBondContact O-N 2.92Å; I277-I280 VanDerWaalsContact O-N 3.11Å; I280-H283 PolarHBondContact O-N 2.83Å; I280-V284 HydrophobicContact CG2-CG2 4.44Å; I280-V284 VanDerWaalsContact O-CG2 3.23Å; I280-V284 WeakPolarHBondContact O-CG2 3.38Å; I280-V284 PolarHBondContact O-N 2.82Å
281	V	88.7	Confident	81.8	Confident	13 Å²	13	55.2 Å²	55.2	8%	0.079	30%	0.297	C	S	.	.	H	α-helix	trans	-60.9	-50.2	179.2	167.1	0	0	0	0	110.5	I106 A109 L110 I277 D278 H283 V284 H285	I106-V281 HydrophobicContact CG2-CG2 4.41Å; A109-V281 HydrophobicContact CB-CG1 4.31Å; A109-V281 HydrophobicContact CB-CG2 3.76Å; L110-V281 HydrophobicContact CD2-CB 4.47Å; L110-V281 HydrophobicContact CD2-CG1 4.19Å; L110-V281 HydrophobicContact CD2-CG2 4.49Å; L110-V281 HydrophobicContact CG-CG2 4.35Å; I277-V281 HydrophobicContact CG2-CG2 4.22Å; I277-V281 WeakPolarHBondContact O-CB 3.37Å; I277-V281 VanDerWaalsContact O-CG2 3.25Å; I277-V281 WeakPolarHBondContact O-CG2 3.43Å; I277-V281 PolarHBondContact O-N 2.71Å; D278-V281 PolarHBondContact O-N 2.72Å; V281-H283 PolarHBondContact O-N 3.21Å; V281-V284 PolarHBondContact O-N 2.67Å; V281-V284 VanDerWaalsContact O-N 3.17Å; V281-H285 PolarHBondContact O-CD2 2.86Å; V281-H285 PolarHBondContact O-N 2.86Å
282	Q	86.9	Confident	80.9	Confident	130 Å²	130	61.2 Å²	61.2	61%	0.607	32%	0.322	S	S	*	.	H	α-helix	trans	-58.9	-43.3	176.5	-76.2	-179.5	-22.7	0	0	113.1	D278 V284 H285 S286	D278-Q282 WeakPolarHBondContact O-CB 3.41Å; D278-Q282 WeakPolarHBondContact O-CG 3.27Å; D278-Q282 PolarHBondContact O-N 3.01Å; Q282-V284 VanDerWaalsContact C-N 3.31Å; Q282-V284 PolarHBondContact O-N 3.11Å; Q282-H285 PolarHBondContact O-N 3.46Å; Q282-S286 PolarHBondContact O-N 2.7Å
283	H	87.9	Confident	79.5	Confident	88 Å²	88	64.2 Å²	64.2	41%	0.407	32%	0.323	S	S	.	.	H	α-helix	trans	-62.7	-39.3	176.8	-179.9	56.6	0	0	0	112	L279 I280 V281 Q287	L279-H283 WeakPolarHBondContact O-CB 3.24Å; L279-H283 PolarHBondContact O-N 3.07Å; L279-H283 VanDerWaalsContact O-N 3.07Å; I280-H283 PolarHBondContact O-N 2.83Å; V281-H283 PolarHBondContact O-N 3.21Å; H283-Q287 WeakPolarHBondContact O-CB 3.37Å; H283-Q287 WeakPolarHBondContact O-CG 3.19Å; H283-Q287 PolarHBondContact O-N 3.49Å
284	V	84.6	Confident	77.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-70.8	-37.4	177.3	173.7	0	0	0	0	112	F87 I89 L110 V190 I280 V281 Q282 Q287 L288	F87-V284 HydrophobicContact CD1-CG2 4.21Å; F87-V284 HydrophobicContact CE1-CG2 3.86Å; I89-V284 HydrophobicContact CD1-CG2 3.61Å; L110-V284 HydrophobicContact CD1-CG1 4.13Å; L110-V284 HydrophobicContact CD2-CB 3.77Å; L110-V284 HydrophobicContact CD2-CG1 3.48Å; L110-V284 VanDerWaalsContact CD2-CG1 3.48Å; L110-V284 HydrophobicContact CG-CG1 4.49Å; V190-V284 HydrophobicContact CG1-CG1 4.4Å; V190-V284 HydrophobicContact CG2-CG1 3.85Å; I280-V284 HydrophobicContact CG2-CG2 4.44Å; I280-V284 VanDerWaalsContact O-CG2 3.23Å; I280-V284 WeakPolarHBondContact O-CG2 3.38Å; I280-V284 PolarHBondContact O-N 2.82Å; V281-V284 PolarHBondContact O-N 2.67Å; V281-V284 VanDerWaalsContact O-N 3.17Å; Q282-V284 VanDerWaalsContact C-N 3.31Å; Q282-V284 PolarHBondContact O-N 3.11Å; V284-Q287 CarbonylContact O-C 3.55Å; V284-Q287 PolarHBondContact O-N 2.97Å; V284-L288 HydrophobicContact CG1-CD1 4.17Å; V284-L288 WeakPolarHBondContact O-CG 3.49Å; V284-L288 PolarHBondContact O-N 2.75Å
285	H	81.9	Confident	76.5	Confident	57 Å²	57	62.7 Å²	62.7	26%	0.264	32%	0.322	S	S	.	.	H	α-helix	trans	-61.9	-50.9	172.8	-83.3	-76.2	0	0	0	111.7	L110 V281 Q282 Q287 L288 E289	L110-H285 PolarHBondContact O-CE1 3.49Å; L110-H285 PolarHBondContact O-NE2 3.3Å; V281-H285 PolarHBondContact O-CD2 2.86Å; V281-H285 PolarHBondContact O-N 2.86Å; Q282-H285 PolarHBondContact O-N 3.46Å; H285-Q287 PolarHBondContact O-N 3.25Å; H285-L288 WeakPolarHBondContact O-CA 3.18Å; H285-L288 WeakPolarHBondContact O-CB 3.49Å; H285-L288 PolarHBondContact O-N 2.94Å; H285-E289 WeakPolarHBondContact O-CG 3.22Å; H285-E289 PolarHBondContact O-N 3.3Å
286	S	81.8	Confident	74.9	Confident	50 Å²	50	59.5 Å²	59.5	35%	0.35	30%	0.299	S	S	.	.	H	α-helix	trans	-55.9	-40.2	173.3	168	0	0	0	0	111.6	Q282 L288 E290	Q282-S286 PolarHBondContact O-N 2.7Å; S286-L288 VanDerWaalsContact C-N 3.27Å; S286-L288 PolarHBondContact O-N 3Å; S286-E290 WeakPolarHBondContact O-CB 3.49Å; S286-E290 WeakPolarHBondContact O-CG 3.29Å; S286-E290 PolarHBondContact O-N 2.97Å
287	Q	78.2	Confident	73.1	Confident	39 Å²	39	62 Å²	62	18%	0.182	32%	0.32	C	S	.	.	H	α-helix	trans	-70.5	-13.3	173.9	-85.1	-58.5	-60.4	0	0	115.1	F87 H283 V284 H285 E290 R291	F87-Q287 HydrophobicContact CE2-CG 4.4Å; H283-Q287 WeakPolarHBondContact O-CB 3.37Å; H283-Q287 WeakPolarHBondContact O-CG 3.19Å; H283-Q287 PolarHBondContact O-N 3.49Å; V284-Q287 CarbonylContact O-C 3.55Å; V284-Q287 PolarHBondContact O-N 2.97Å; H285-Q287 PolarHBondContact O-N 3.25Å; Q287-E290 PolarHBondContact NE2-OE2 3.02Å; Q287-R291 WeakPolarHBondContact O-CD 3.39Å; Q287-R291 VanDerWaalsContact O-CG 3.23Å; Q287-R291 WeakPolarHBondContact O-CG 3.35Å; Q287-R291 PolarHBondContact O-NE 3.49Å
288	L	73.4	Confident	71.6	Confident	30 Å²	30	63.1 Å²	63.1	16%	0.157	33%	0.329	C	S	.	.	H	α-helix	trans	-93	-42.4	171.4	-72.1	168.1	0	0	0	111	V112 V190 V284 H285 S286 E290 R291 E292	V112-L288 HydrophobicContact CG2-CD1 4.35Å; V190-L288 HydrophobicContact CG2-CD1 4.06Å; V190-L288 HydrophobicContact CG2-CD2 4.11Å; V190-L288 HydrophobicContact CG2-CG 4.42Å; V284-L288 HydrophobicContact CG1-CD1 4.17Å; V284-L288 WeakPolarHBondContact O-CG 3.49Å; V284-L288 PolarHBondContact O-N 2.75Å; H285-L288 WeakPolarHBondContact O-CA 3.18Å; H285-L288 WeakPolarHBondContact O-CB 3.49Å; H285-L288 PolarHBondContact O-N 2.94Å; S286-L288 VanDerWaalsContact C-N 3.27Å; S286-L288 PolarHBondContact O-N 3Å; L288-E290 VanDerWaalsContact C-N 3.32Å; L288-E290 PolarHBondContact O-N 3.06Å; L288-R291 WeakPolarHBondContact O-CA 3.44Å; L288-R291 VanDerWaalsContact O-CB 3.28Å; L288-R291 WeakPolarHBondContact O-CB 3.41Å; L288-R291 PolarHBondContact O-N 3.05Å; L288-E292 PolarHBondContact O-N 3.24Å
289	E	68.6	Low	70.2	Confident	126 Å²	126	60.2 Å²	60.2	59%	0.589	31%	0.314	S	S	*	.	H	α-helix	trans	-57.8	-41.5	175.5	-69.8	160.8	-160.8	0	0	111.5	H285 R291 E292	H285-E289 WeakPolarHBondContact O-CG 3.22Å; H285-E289 PolarHBondContact O-N 3.3Å; E289-R291 PolarHBondContact O-N 3.43Å; E289-E292 PolarHBondContact O-N 3.4Å; E289-E292 VanDerWaalsContact O-N 3.15Å
290	E	64.1	Low	68.5	Low	120 Å²	120	56.8 Å²	56.8	56%	0.561	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	5.6	169.9	-75.7	-172.8	171.4	0	0	114.8	K84 S286 Q287 L288	K84-E290 PolarHBondContact NZ-O 3.05Å; S286-E290 WeakPolarHBondContact O-CB 3.49Å; S286-E290 WeakPolarHBondContact O-CG 3.29Å; S286-E290 PolarHBondContact O-N 2.97Å; Q287-E290 PolarHBondContact NE2-OE2 3.02Å; L288-E290 VanDerWaalsContact C-N 3.32Å; L288-E290 PolarHBondContact O-N 3.06Å
291	R	61.1	Low	66.8	Low	51 Å²	51	61 Å²	61	19%	0.192	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	-8.4	178.9	-43.4	-172.1	-177.6	-156.9	-0.1	112.8	K84 E85 Q287 L288 E289 L293	K84-R291 HydrophobicContact CD-CG 3.88Å; E85-R291 PolarHBondContact O-NH1 3.26Å; Q287-R291 WeakPolarHBondContact O-CD 3.39Å; Q287-R291 VanDerWaalsContact O-CG 3.23Å; Q287-R291 WeakPolarHBondContact O-CG 3.35Å; Q287-R291 PolarHBondContact O-NE 3.49Å; L288-R291 WeakPolarHBondContact O-CA 3.44Å; L288-R291 VanDerWaalsContact O-CB 3.28Å; L288-R291 WeakPolarHBondContact O-CB 3.41Å; L288-R291 PolarHBondContact O-N 3.05Å; E289-R291 PolarHBondContact O-N 3.43Å; R291-L293 VanDerWaalsContact C-N 3.32Å; R291-L293 PolarHBondContact O-N 2.96Å
292	E	54.3	Low	65.2	Low	137 Å²	137	61.8 Å²	61.8	64%	0.64	34%	0.338	S	S	*	.			trans	-82	76.5	177.8	-61.8	-159.6	151.4	0	0	111.2	L288 E289	L288-E292 PolarHBondContact O-N 3.24Å; E289-E292 PolarHBondContact O-N 3.4Å; E289-E292 VanDerWaalsContact O-N 3.15Å
293	L	52.6	Low	63.9	Low	121 Å²	121	58 Å²	58	63%	0.634	32%	0.32	S	S	*	.			trans	-72.3	128.4	162.1	-76.1	152.1	0	0	0	108.8	R291 V295	R291-L293 VanDerWaalsContact C-N 3.32Å; R291-L293 PolarHBondContact O-N 2.96Å; L293-V295 VanDerWaalsContact C-N 3.35Å; L293-V295 PolarHBondContact O-N 2.68Å
294	S	52.8	Low	62.2	Low	64 Å²	64	61.8 Å²	61.8	45%	0.448	34%	0.338	S	S	.	.			trans	-70.7	95.4	168.5	177.5	0	0	0	0	109.8	R296 A297 E420	S294-R296 VanDerWaalsContact C-N 3.27Å; S294-R296 PolarHBondContact O-N 3.35Å; S294-A297 PolarHBondContact OG-N 2.7Å; S294-E420 VanDerWaalsContact C-OE1 3.25Å; S294-E420 WeakPolarHBondContact CA-OE1 3.24Å; S294-E420 WeakPolarHBondContact CB-OE1 3.3Å; S294-E420 PolarHBondContact OG-OE1 3.05Å
295	V	55.8	Low	60.8	Low	7 Å²	7	67.1 Å²	67.1	4%	0.042	38%	0.382	C	S	.	.	H	α-helix	trans	-61.1	-37.9	178.3	174.8	0	0	0	0	110.2	P74 Y76 L293 L299 E420	P74-V295 HydrophobicContact CB-CG2 3.97Å; P74-V295 HydrophobicContact CG-CG2 4.38Å; Y76-V295 HydrophobicContact CE2-CG1 4.48Å; L293-V295 VanDerWaalsContact C-N 3.35Å; L293-V295 PolarHBondContact O-N 2.68Å; V295-L299 HydrophobicContact CG1-CD1 3.55Å; V295-L299 HydrophobicContact CG1-CG 4.21Å; V295-L299 WeakPolarHBondContact O-CB 3.08Å; V295-L299 WeakPolarHBondContact O-CD1 3.39Å; V295-L299 WeakPolarHBondContact O-CG 3.47Å; V295-L299 PolarHBondContact O-N 3.26Å; V295-L299 VanDerWaalsContact O-N 3.1Å; V295-E420 PolarHBondContact N-OE1 2.95Å
296	R	54.9	Low	60.2	Low	31 Å²	31	69 Å²	69	12%	0.117	39%	0.391	C	S	.	.	H	α-helix	trans	-68.8	-38.5	-178.9	-85.6	177	171.8	-154.4	2.4	115	S294 A298 L299 A300 T414 G419 E420 A448	S294-R296 VanDerWaalsContact C-N 3.27Å; S294-R296 PolarHBondContact O-N 3.35Å; R296-A298 VanDerWaalsContact C-N 3.35Å; R296-A298 PolarHBondContact O-N 3.01Å; R296-L299 PolarHBondContact O-N 3.03Å; R296-A300 WeakPolarHBondContact O-CB 3.48Å; R296-A300 PolarHBondContact O-N 2.86Å; R296-T414 VanDerWaalsContact NH1-CG2 3.25Å; R296-T414 PolarHBondContact NH2-OG1 3.41Å; R296-G419 WeakPolarHBondContact CD-O 3.15Å; R296-G419 PolarHBondContact NE-O 2.79Å; R296-G419 PolarHBondContact NH1-O 2.92Å; R296-E420 WeakPolarHBondContact CG-OE2 3.02Å; R296-E420 PolarHBondContact N-OE1 2.86Å; R296-E420 PolarHBondContact N-OE2 3.4Å; R296-A448 HydrophobicContact CG-CB 4.1Å
297	A	51.9	Low	60	Low	65 Å²	65	72.1 Å²	72.1	54%	0.537	41%	0.41	S	S	.	.	H	α-helix	trans	-65	-40.5	-178.7	0	0	0	0	0	111.8	S294 S301	S294-A297 PolarHBondContact OG-N 2.7Å; A297-S301 PolarHBondContact O-OG 2.87Å
298	A	56.5	Low	60.2	Low	24 Å²	24	74.1 Å²	74.1	20%	0.198	42%	0.422	C	S	.	.	H	α-helix	trans	-68.7	-46	175.3	0	0	0	0	0	111.8	E78 R296 A300 S301 A302	E78-A298 HydrophobicContact CG-CB 3.86Å; E78-A298 WeakPolarHBondContact OE1-CB 3.24Å; E78-A298 WeakPolarHBondContact OE2-CB 3.43Å; R296-A298 VanDerWaalsContact C-N 3.35Å; R296-A298 PolarHBondContact O-N 3.01Å; A298-A300 VanDerWaalsContact C-N 3.28Å; A298-A300 PolarHBondContact O-N 3.24Å; A298-S301 PolarHBondContact O-N 3.44Å; A298-S301 VanDerWaalsContact O-N 3.13Å; A298-S301 PolarHBondContact O-OG 2.94Å; A298-A302 WeakPolarHBondContact O-CB 3.33Å; A298-A302 PolarHBondContact O-N 2.88Å
299	L	58.8	Low	60.8	Low	5 Å²	5	74.1 Å²	74.1	3%	0.026	42%	0.423	C	S	.	.	H	α-helix	trans	-58.9	-34.7	176	-71.2	168	0	0	0	113.9	V295 R296 S301 A302 M451	V295-L299 HydrophobicContact CG1-CD1 3.55Å; V295-L299 HydrophobicContact CG1-CG 4.21Å; V295-L299 WeakPolarHBondContact O-CB 3.08Å; V295-L299 WeakPolarHBondContact O-CD1 3.39Å; V295-L299 WeakPolarHBondContact O-CG 3.47Å; V295-L299 PolarHBondContact O-N 3.26Å; V295-L299 VanDerWaalsContact O-N 3.1Å; R296-L299 PolarHBondContact O-N 3.03Å; L299-S301 VanDerWaalsContact C-N 3.3Å; L299-S301 PolarHBondContact O-N 3.12Å; L299-A302 PolarHBondContact O-N 2.97Å; L299-M451 HydrophobicContact CD1-CE 3.31Å; L299-M451 HydrophobicContact CD2-CE 3.82Å; L299-M451 HydrophobicContact CD2-SD 4.48Å; L299-M451 HydrophobicContact CG-CE 4.2Å
300	A	54.4	Low	61.7	Low	33 Å²	33	77.2 Å²	77.2	27%	0.273	44%	0.438	S	S	.	.	H	α-helix	trans	-71.7	-23.5	179.5	0	0	0	0	0	113.7	R296 A298 M477	R296-A300 WeakPolarHBondContact O-CB 3.48Å; R296-A300 PolarHBondContact O-N 2.86Å; A298-A300 VanDerWaalsContact C-N 3.28Å; A298-A300 PolarHBondContact O-N 3.24Å; A300-M477 HydrophobicContact CB-SD 4.44Å
301	S	54.3	Low	62.9	Low	91 Å²	91	72.5 Å²	72.5	64%	0.636	42%	0.417	S	S	*	.	H	α-helix	trans	-96.6	-18.2	175.5	51	0	0	0	0	112.9	A297 A298 L299 H303	A297-S301 PolarHBondContact O-OG 2.87Å; A298-S301 PolarHBondContact O-N 3.44Å; A298-S301 VanDerWaalsContact O-N 3.13Å; A298-S301 PolarHBondContact O-OG 2.94Å; L299-S301 VanDerWaalsContact C-N 3.3Å; L299-S301 PolarHBondContact O-N 3.12Å; S301-H303 PolarHBondContact O-N 3.29Å
302	A	54	Low	64.5	Low	29 Å²	29	71.3 Å²	71.3	24%	0.24	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	124.1	176.2	0	0	0	0	0	113.1	A298 L299 Q304	A298-A302 WeakPolarHBondContact O-CB 3.33Å; A298-A302 PolarHBondContact O-N 2.88Å; L299-A302 PolarHBondContact O-N 2.97Å; A302-Q304 PolarHBondContact O-N 2.6Å
303	H	60.1	Low	66.5	Low	50 Å²	50	65.2 Å²	65.2	23%	0.231	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	24.4	154.5	-54.4	21.8	0	0	0	117.8	S301 A305 Q306 H480 Y484	S301-H303 PolarHBondContact O-N 3.29Å; H303-A305 PolarHBondContact O-N 2.73Å; H303-Q306 HydrophobicContact CB-CG 4.27Å; H303-Q306 PolarHBondContact CD2-NE2 3.04Å; H303-Q306 PolarHBondContact CD2-OE1 3.47Å; H303-Q306 VanDerWaalsContact CD2-OE1 3.29Å; H303-Q306 PolarHBondContact O-N 3.08Å; H303-H480 HydrophobicContact CB-CB 4.38Å; H303-Y484 AromaticContact NE2-CD1 3.85Å; H303-Y484 AromaticContact NE2-CD2 3.65Å; H303-Y484 AromaticContact NE2-CE1 3.98Å; H303-Y484 AromaticContact NE2-CE2 3.82Å; H303-Y484 AromaticContact NE2-CG 3.66Å; H303-Y484 AromaticContact NE2-CZ 3.96Å
304	Q	52.8	Low	68.6	Low	168 Å²	168	62.5 Å²	62.5	79%	0.785	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	132.6	161.5	-60.8	-172.2	18.5	0	0	110.1	A302	A302-Q304 PolarHBondContact O-N 2.6Å
305	A	55	Low	70.5	Confident	111 Å²	111	60.6 Å²	60.6	92%	0.917	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	20.3	-179.2	0	0	0	0	0	118.8	H303	H303-A305 PolarHBondContact O-N 2.73Å
306	Q	68.1	Low	72.3	Confident	97 Å²	97	67.3 Å²	67.3	45%	0.453	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-80.8	155.6	162.1	-73.4	-171.6	10	0	0	112.4	H303 H480	H303-Q306 HydrophobicContact CB-CG 4.27Å; H303-Q306 PolarHBondContact CD2-NE2 3.04Å; H303-Q306 PolarHBondContact CD2-OE1 3.47Å; H303-Q306 VanDerWaalsContact CD2-OE1 3.29Å; H303-Q306 PolarHBondContact O-N 3.08Å; Q306-H480 PolarHBondContact O-NE2 3.37Å
307	P	79	Confident	74	Confident	115 Å²	115	69.7 Å²	69.7	75%	0.747	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-75.6	145.5	172.9	31.6	-34.9	0	0	0	111.8	H480	P307-H480 PolarHBondContact O-CE1 3.37Å; P307-H480 VanDerWaalsContact O-CE1 3.28Å
308	L	82.1	Confident	76	Confident	82 Å²	82	68.6 Å²	68.6	43%	0.429	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-54.4	137.5	-177.2	-67.7	173.5	0	0	0	112.7	L312 E476 V496	L308-L312 HydrophobicContact CB-CD2 4.15Å; L308-L312 HydrophobicContact CD1-CD2 4Å; L308-L312 HydrophobicContact CD2-CD2 4.24Å; L308-L312 HydrophobicContact CG-CD2 4.36Å; L308-E476 HydrophobicContact CD2-CG 4.34Å; L308-V496 HydrophobicContact CD2-CG1 4.49Å
309	P	86.1	Confident	78	Confident	29 Å²	29	73.1 Å²	73.1	19%	0.188	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-74.4	149.1	-170.8	30.2	-36.4	0	0	0	113.1	T311 L312 V479 A483	P309-T311 PolarHBondContact O-N 3.44Å; P309-T311 VanDerWaalsContact O-N 3.14Å; P309-L312 HydrophobicContact CG-CB 4.48Å; P309-L312 WeakPolarHBondContact O-CB 3.48Å; P309-L312 PolarHBondContact O-N 3.16Å; P309-V479 HydrophobicContact CG-CG1 3.65Å; P309-A483 HydrophobicContact CB-CB 3.65Å; P309-A483 HydrophobicContact CG-CB 3.46Å; P309-A483 VanDerWaalsContact CG-CB 3.46Å
310	Q	87.2	Confident	79.7	Confident	191 Å²	191	77.8 Å²	77.8	89%	0.893	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-17.2	-179	-59.6	-177.4	6.5	0	0	113.8	L312 K490	Q310-L312 PolarHBondContact O-N 3.35Å; Q310-K490 PolarHBondContact O-NZ 2.98Å
311	T	89.9	Confident	81.7	Confident	21 Å²	21	76.4 Å²	76.4	13%	0.129	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-22.7	170.4	47	0	0	0	0	112.8	P309 A483 P487 V489 K490 I491	P309-T311 PolarHBondContact O-N 3.44Å; P309-T311 VanDerWaalsContact O-N 3.14Å; T311-A483 WeakPolarHBondContact OG1-CB 3.39Å; T311-P487 WeakPolarHBondContact CG2-O 3.44Å; T311-V489 WeakPolarHBondContact CB-O 3.49Å; T311-V489 WeakPolarHBondContact CG2-O 3.42Å; T311-K490 WeakPolarHBondContact O-CD 3.38Å; T311-K490 WeakPolarHBondContact O-CE 3.31Å; T311-K490 PolarHBondContact O-NZ 3.05Å; T311-K490 VanDerWaalsContact O-NZ 3.15Å; T311-I491 PolarHBondContact O-N 3.34Å
312	L	94.4	Very high	83.6	Confident	26 Å²	26	79.7 Å²	79.7	14%	0.136	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	138.7	178.4	-173	67.8	0	0	0	112.6	L308 P309 Q310 V314 V479 I491 T493 V496	L308-L312 HydrophobicContact CB-CD2 4.15Å; L308-L312 HydrophobicContact CD1-CD2 4Å; L308-L312 HydrophobicContact CD2-CD2 4.24Å; L308-L312 HydrophobicContact CG-CD2 4.36Å; P309-L312 HydrophobicContact CG-CB 4.48Å; P309-L312 WeakPolarHBondContact O-CB 3.48Å; P309-L312 PolarHBondContact O-N 3.16Å; Q310-L312 PolarHBondContact O-N 3.35Å; L312-V314 HydrophobicContact CD1-CG2 4.44Å; L312-V314 HydrophobicContact CD2-CG2 3.76Å; L312-V314 HydrophobicContact CG-CG2 3.99Å; L312-V479 HydrophobicContact CB-CG1 4.45Å; L312-V479 HydrophobicContact CD1-CG1 4.02Å; L312-V479 HydrophobicContact CD1-CG2 4.25Å; L312-V479 HydrophobicContact CD2-CG1 4.25Å; L312-V479 HydrophobicContact CG-CG1 4.47Å; L312-I491 CarbonylContact C-O 3.5Å; L312-I491 VanDerWaalsContact CA-O 3.31Å; L312-I491 WeakPolarHBondContact CA-O 3.49Å; L312-I491 HydrophobicContact CD1-CB 4.22Å; L312-I491 HydrophobicContact CD1-CG2 3.75Å; L312-T493 HydrophobicContact CD1-CG2 3.99Å; L312-V496 HydrophobicContact CD2-CG2 4.14Å
313	S	96	Very high	85.6	Confident	10 Å²	10	79.8 Å²	79.8	7%	0.07	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	105.7	161.4	165	0	0	0	0	109.1	R352 F356 I491 I492 T493	S313-R352 PolarHBondContact OG-NE 3.43Å; S313-R352 PolarHBondContact OG-NH2 3.21Å; S313-F356 VanDerWaalsContact CB-CZ 3.46Å; S313-F356 WeakPolarHBondContact OG-CE2 3.43Å; S313-F356 WeakPolarHBondContact OG-CZ 3.29Å; S313-I491 PolarHBondContact N-O 3.4Å; S313-I492 WeakPolarHBondContact O-CA 3.28Å; S313-T493 PolarHBondContact O-N 3.38Å; S313-T493 VanDerWaalsContact O-N 3.13Å
314	V	95.6	Very high	87.4	Confident	63 Å²	63	77.5 Å²	77.5	38%	0.382	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	141.1	167.5	-166	0	0	0	0	109.4	L312 T493 V496	L312-V314 HydrophobicContact CD1-CG2 4.44Å; L312-V314 HydrophobicContact CD2-CG2 3.76Å; L312-V314 HydrophobicContact CG-CG2 3.99Å; V314-T493 CarbonylContact C-O 3.41Å; V314-T493 VanDerWaalsContact CA-O 3.31Å; V314-T493 WeakPolarHBondContact CA-O 3.17Å; V314-T493 HydrophobicContact CG1-CG2 4.49Å; V314-T493 HydrophobicContact CG2-CG2 4.24Å; V314-V496 HydrophobicContact CG2-CG2 4.02Å
315	L	94.4	Very high	89.5	Confident	24 Å²	24	70.3 Å²	70.3	13%	0.126	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-64.3	147.3	170.7	-171.7	66.6	0	0	0	110.2	S317 V321 L345 L348 R352 T493 T494	L315-S317 PolarHBondContact O-N 2.92Å; L315-V321 HydrophobicContact CD2-CG1 4.33Å; L315-V321 HydrophobicContact CD2-CG2 3.93Å; L315-L345 HydrophobicContact CD2-CD1 4.46Å; L315-L348 HydrophobicContact CD2-CB 4.02Å; L315-R352 HydrophobicContact CD1-CB 3.86Å; L315-R352 HydrophobicContact CD1-CG 3.95Å; L315-T493 PolarHBondContact N-O 2.86Å; L315-T494 HydrophobicContact CB-CG2 4.09Å; L315-T494 HydrophobicContact CD2-CG2 3.69Å
316	E	92.1	Very high	91.5	Very high	148 Å²	148	69.7 Å²	69.7	69%	0.692	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-59.2	127.1	178.2	-168.1	-171.7	151.6	0	0	111.6	T318	E316-T318 HydrophobicContact CB-CG2 4.26Å; E316-T318 HydrophobicContact CG-CG2 3.96Å; E316-T318 PolarHBondContact O-N 3.4Å
317	S	90.6	Very high	92.8	Very high	82 Å²	82	67.2 Å²	67.2	57%	0.573	37%	0.368	S	S	*	.			trans	-80.2	51.2	-174.8	-151	0	0	0	0	112.7	L315 R322	L315-S317 PolarHBondContact O-N 2.92Å; S317-R322 WeakPolarHBondContact O-CD 3.46Å; S317-R322 WeakPolarHBondContact OG-CG 3.28Å
318	T	95.8	Very high	93.7	Very high	42 Å²	42	61.7 Å²	61.7	26%	0.258	33%	0.333	S	S	.	.			trans	-58	155.5	176.8	66	0	0	0	0	111.2	E316 Q320 V321 R322	E316-T318 HydrophobicContact CB-CG2 4.26Å; E316-T318 HydrophobicContact CG-CG2 3.96Å; E316-T318 PolarHBondContact O-N 3.4Å; T318-Q320 PolarHBondContact O-N 3.18Å; T318-Q320 VanDerWaalsContact O-N 3.12Å; T318-V321 PolarHBondContact O-N 2.81Å; T318-V321 WeakPolarHBondContact OG1-CB 3.24Å; T318-V321 WeakPolarHBondContact OG1-CG2 3.41Å; T318-V321 PolarHBondContact OG1-N 3.5Å; T318-R322 WeakPolarHBondContact O-CG 3.37Å; T318-R322 PolarHBondContact O-N 2.85Å
319	P	96.4	Very high	94.3	Very high	118 Å²	118	60.9 Å²	60.9	77%	0.766	32%	0.324	S	S	*	.	H	α-helix	trans	-53.5	-34.8	176.4	-27.8	35.9	0	0	0	113.5	G323	P319-G323 PolarHBondContact O-N 2.8Å
320	Q	96.1	Very high	94.7	Very high	104 Å²	104	62.5 Å²	62.5	49%	0.486	33%	0.331	S	S	.	.	H	α-helix	trans	-70.8	-42.1	176.9	-174.9	58.9	42.5	0	0	112.6	T318 G323 M324	T318-Q320 PolarHBondContact O-N 3.18Å; T318-Q320 VanDerWaalsContact O-N 3.12Å; Q320-G323 PolarHBondContact O-N 2.84Å; Q320-M324 HydrophobicContact CG-CE 4.34Å; Q320-M324 WeakPolarHBondContact O-CG 3.44Å; Q320-M324 PolarHBondContact O-N 3.33Å
321	V	95.3	Very high	95.1	Very high	4 Å²	4	62.7 Å²	62.7	2%	0.024	33%	0.329	C	S	.	.	H	α-helix	trans	-63.8	-42.9	174.2	166.9	0	0	0	0	110.3	L315 T318 M324 H325 L345 L348	L315-V321 HydrophobicContact CD2-CG1 4.33Å; L315-V321 HydrophobicContact CD2-CG2 3.93Å; T318-V321 PolarHBondContact O-N 2.81Å; T318-V321 WeakPolarHBondContact OG1-CB 3.24Å; T318-V321 WeakPolarHBondContact OG1-CG2 3.41Å; T318-V321 PolarHBondContact OG1-N 3.5Å; V321-M324 PolarHBondContact O-N 2.71Å; V321-H325 PolarHBondContact O-CD2 2.97Å; V321-H325 PolarHBondContact O-N 2.85Å; V321-L345 HydrophobicContact CG1-CD1 4.14Å; V321-L348 HydrophobicContact CG2-CD1 4Å
322	R	95.1	Very high	95.3	Very high	160 Å²	160	69.8 Å²	69.8	60%	0.604	36%	0.361	S	S	*	.	H	α-helix	trans	-62.7	-43.7	175.4	-70.3	-177.6	63.7	178.3	-0.9	112.5	S317 T318 M324 H325 T326	S317-R322 WeakPolarHBondContact O-CD 3.46Å; S317-R322 WeakPolarHBondContact OG-CG 3.28Å; T318-R322 WeakPolarHBondContact O-CG 3.37Å; T318-R322 PolarHBondContact O-N 2.85Å; R322-M324 PolarHBondContact O-N 3.31Å; R322-H325 WeakPolarHBondContact O-CB 3.36Å; R322-H325 PolarHBondContact O-N 2.81Å; R322-T326 PolarHBondContact O-N 3.1Å; R322-T326 PolarHBondContact O-OG1 2.89Å
323	G	96.7	Very high	95.3	Very high	30 Å²	30	69.6 Å²	69.6	31%	0.309	36%	0.36	S	S	.	.	H	α-helix	trans	-61.5	-42	176.2	0	0	0	0	0	113	P319 Q320 T326 I327	P319-G323 PolarHBondContact O-N 2.8Å; Q320-G323 PolarHBondContact O-N 2.84Å; G323-T326 PolarHBondContact O-N 3.32Å; G323-I327 WeakPolarHBondContact O-CG1 3.34Å; G323-I327 PolarHBondContact O-N 2.91Å; G323-I327 VanDerWaalsContact O-N 3.16Å
324	M	97.4	Very high	95.3	Very high	3 Å²	3	71.9 Å²	71.9	2%	0.015	38%	0.376	C	S	.	.	H	α-helix	trans	-65.7	-37.9	174.2	-65.5	-173.5	-58.9	0	0	111.9	Q320 V321 R322 I327 I328 Y341 R344 L345 L348	Q320-M324 HydrophobicContact CG-CE 4.34Å; Q320-M324 WeakPolarHBondContact O-CG 3.44Å; Q320-M324 PolarHBondContact O-N 3.33Å; V321-M324 PolarHBondContact O-N 2.71Å; R322-M324 PolarHBondContact O-N 3.31Å; M324-I327 PolarHBondContact O-N 2.73Å; M324-I328 PolarHBondContact O-N 2.77Å; M324-I328 VanDerWaalsContact O-N 3.09Å; M324-Y341 HydrophobicContact CG-CD1 3.97Å; M324-Y341 HydrophobicContact SD-CD1 4.5Å; M324-R344 HydrophobicContact SD-CB 3.76Å; M324-L345 HydrophobicContact CE-CD1 4.16Å; M324-L348 HydrophobicContact CE-CD1 3.74Å
325	H	96.1	Very high	95.2	Very high	16 Å²	16	75 Å²	75	7%	0.074	38%	0.381	C	S	.	.	H	α-helix	trans	-59.7	-46.3	170.4	-94.6	-69	0	0	0	112.5	V321 R322 I327 I328 R329 L472 T494 A495	V321-H325 PolarHBondContact O-CD2 2.97Å; V321-H325 PolarHBondContact O-N 2.85Å; R322-H325 WeakPolarHBondContact O-CB 3.36Å; R322-H325 PolarHBondContact O-N 2.81Å; H325-I327 VanDerWaalsContact C-N 3.28Å; H325-I327 PolarHBondContact O-N 2.98Å; H325-I328 WeakPolarHBondContact O-CG1 3.23Å; H325-I328 PolarHBondContact O-N 2.9Å; H325-R329 WeakPolarHBondContact O-CB 3.11Å; H325-R329 WeakPolarHBondContact O-CD 3.47Å; H325-R329 WeakPolarHBondContact O-CG 3.23Å; H325-R329 PolarHBondContact O-N 2.97Å; H325-L472 PolarHBondContact CE1-O 3.45Å; H325-T494 PolarHBondContact CE1-OG1 2.96Å; H325-T494 VanDerWaalsContact NE2-CA 3.27Å; H325-T494 WeakPolarHBondContact NE2-CA 3.33Å; H325-T494 WeakPolarHBondContact NE2-CB 3.38Å; H325-T494 PolarHBondContact NE2-O 3.27Å; H325-T494 PolarHBondContact NE2-OG1 2.99Å; H325-A495 WeakPolarHBondContact CE1-CB 3.49Å
326	T	96.8	Very high	95.2	Very high	99 Å²	99	79.3 Å²	79.3	61%	0.607	40%	0.404	S	S	*	.	H	α-helix	trans	-56.1	-43.7	177.1	-60.2	0	0	0	0	111.7	R322 G323 R329 N330	R322-T326 PolarHBondContact O-N 3.1Å; R322-T326 PolarHBondContact O-OG1 2.89Å; G323-T326 PolarHBondContact O-N 3.32Å; T326-R329 PolarHBondContact O-N 2.66Å; T326-N330 PolarHBondContact O-N 3.16Å
327	I	96.7	Very high	95.4	Very high	44 Å²	44	76.2 Å²	76.2	23%	0.226	39%	0.39	C	S	.	.	H	α-helix	trans	-67.6	-48	-178.9	-62.8	164	0	0	0	111.3	G323 M324 H325 R329 N330 T333 Y341	G323-I327 WeakPolarHBondContact O-CG1 3.34Å; G323-I327 PolarHBondContact O-N 2.91Å; G323-I327 VanDerWaalsContact O-N 3.16Å; M324-I327 PolarHBondContact O-N 2.73Å; H325-I327 VanDerWaalsContact C-N 3.28Å; H325-I327 PolarHBondContact O-N 2.98Å; I327-R329 VanDerWaalsContact C-N 3.26Å; I327-R329 PolarHBondContact O-N 2.85Å; I327-N330 PolarHBondContact O-N 3.17Å; I327-T333 HydrophobicContact CG2-CG2 3.65Å; I327-T333 WeakPolarHBondContact O-CB 3.41Å; I327-T333 PolarHBondContact O-OG1 2.86Å; I327-Y341 HydrophobicContact CB-CD2 4.3Å; I327-Y341 HydrophobicContact CB-CG 4.46Å; I327-Y341 HydrophobicContact CD1-CD1 4.09Å; I327-Y341 HydrophobicContact CD1-CD2 4.07Å; I327-Y341 HydrophobicContact CD1-CE1 3.83Å; I327-Y341 HydrophobicContact CD1-CE2 3.83Å; I327-Y341 HydrophobicContact CD1-CG 4.19Å; I327-Y341 HydrophobicContact CG2-CD2 3.48Å; I327-Y341 VanDerWaalsContact CG2-CD2 3.48Å; I327-Y341 HydrophobicContact CG2-CE2 3.96Å; I327-Y341 HydrophobicContact CG2-CG 4.06Å
328	I	96	Very high	95.7	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-70.2	-22.6	178.7	69	176.8	0	0	0	113	M324 H325 F338 L345 I510 R516	M324-I328 PolarHBondContact O-N 2.77Å; M324-I328 VanDerWaalsContact O-N 3.09Å; H325-I328 WeakPolarHBondContact O-CG1 3.23Å; H325-I328 PolarHBondContact O-N 2.9Å; I328-F338 HydrophobicContact CB-CD2 4.02Å; I328-F338 HydrophobicContact CB-CE2 3.95Å; I328-F338 HydrophobicContact CG2-CD2 4.28Å; I328-F338 WeakPolarHBondContact O-CE2 3.3Å; I328-L345 HydrophobicContact CD1-CD2 3.67Å; I328-I510 HydrophobicContact CG1-CG2 4.21Å; I328-R516 PolarHBondContact O-NH1 3.47Å
329	R	95.6	Very high	95.7	Very high	65 Å²	65	71.8 Å²	71.8	25%	0.245	36%	0.358	C	S	.	.	H	α-helix	trans	-80.9	-24.8	175.4	-70.5	175.7	178.3	-99.4	19.7	113.8	H325 T326 I327 K331 D497 G509 I510	H325-R329 WeakPolarHBondContact O-CB 3.11Å; H325-R329 WeakPolarHBondContact O-CD 3.47Å; H325-R329 WeakPolarHBondContact O-CG 3.23Å; H325-R329 PolarHBondContact O-N 2.97Å; T326-R329 PolarHBondContact O-N 2.66Å; I327-R329 VanDerWaalsContact C-N 3.26Å; I327-R329 PolarHBondContact O-N 2.85Å; R329-K331 PolarHBondContact O-N 3.49Å; R329-D497 IonicContact CZ-OD1 3.47Å; R329-D497 IonicContact CZ-OD2 2.73Å; R329-D497 IonicContact NH1-OD1 2.73Å; R329-D497 IonicContact NH1-OD2 3.08Å; R329-D497 PolarHBondContact NH1-OD2 2.99Å; R329-D497 IonicContact NH2-OD1 3.17Å; R329-D497 PolarHBondContact NH2-OD1 3.46Å; R329-D497 IonicContact NH2-OD2 2.6Å; R329-D497 PolarHBondContact NH2-OD2 3.22Å; R329-G509 WeakPolarHBondContact CG-O 3.19Å; R329-G509 PolarHBondContact NH1-O 2.8Å; R329-I510 HydrophobicContact CB-CG2 4.36Å; R329-I510 HydrophobicContact CG-CG2 3.49Å; R329-I510 VanDerWaalsContact CG-CG2 3.49Å
330	N	95.5	Very high	95.7	Very high	62 Å²	62	71.4 Å²	71.4	33%	0.332	34%	0.344	S	S	.	.			trans	-65	131.8	177.7	-173.9	7.4	0	0	0	110.9	T326 I327 E332 R516	T326-N330 PolarHBondContact O-N 3.16Å; I327-N330 PolarHBondContact O-N 3.17Å; N330-E332 VanDerWaalsContact C-N 3.29Å; N330-E332 PolarHBondContact OD1-N 2.85Å; N330-R516 PolarHBondContact O-NH2 3.22Å
331	K	94.1	Very high	95.7	Very high	196 Å²	196	68.8 Å²	68.8	85%	0.852	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-32.9	173.9	-177.3	-179.9	176.4	-177.2	0	111.9	R329	R329-K331 PolarHBondContact O-N 3.49Å
332	E	94.6	Very high	95.8	Very high	170 Å²	170	68.6 Å²	68.6	79%	0.794	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-12	-173.4	-56.5	170.5	165.7	0	0	113.6	N330 S334	N330-E332 VanDerWaalsContact C-N 3.29Å; N330-E332 PolarHBondContact OD1-N 2.85Å; E332-S334 PolarHBondContact O-N 3.09Å
333	T	94.9	Very high	95.8	Very high	22 Å²	22	65.6 Å²	65.6	14%	0.135	32%	0.32	C	S	.	.	S	Bend	trans	-65.9	129.9	-177.6	-77	0	0	0	0	111.6	I327 E337 F338	I327-T333 HydrophobicContact CG2-CG2 3.65Å; I327-T333 WeakPolarHBondContact O-CB 3.41Å; I327-T333 PolarHBondContact O-OG1 2.86Å; T333-E337 HydrophobicContact CG2-CB 3.86Å; T333-F338 HydrophobicContact CG2-CB 4.22Å
334	S	95.5	Very high	95.7	Very high	57 Å²	57	68.9 Å²	68.9	40%	0.399	32%	0.323	S	S	.	.			trans	-58.6	148.9	-179.3	70.6	0	0	0	0	112.3	E332 D336 E337 F338	E332-S334 PolarHBondContact O-N 3.09Å; S334-D336 VanDerWaalsContact C-N 3.25Å; S334-D336 PolarHBondContact O-N 3.06Å; S334-E337 PolarHBondContact O-N 2.7Å; S334-E337 WeakPolarHBondContact OG-CB 3.3Å; S334-E337 VanDerWaalsContact OG-CG 3.28Å; S334-E337 WeakPolarHBondContact OG-CG 3.46Å; S334-E337 PolarHBondContact OG-N 2.78Å; S334-E337 PolarHBondContact OG-OE2 3.08Å; S334-F338 WeakPolarHBondContact O-CB 3.38Å; S334-F338 PolarHBondContact O-N 2.81Å
335	R	93.5	Very high	95.7	Very high	130 Å²	130	68.7 Å²	68.7	49%	0.491	32%	0.323	S	S	.	.	H	α-helix	trans	-56.7	-40.1	-178.1	-173.1	-176.7	66	180	-7.8	112.3	F338 I339 F518	R335-F338 WeakPolarHBondContact O-CB 3.49Å; R335-F338 PolarHBondContact O-N 3.35Å; R335-I339 HydrophobicContact CG-CD1 3.82Å; R335-I339 HydrophobicContact CG-CG1 4.33Å; R335-I339 WeakPolarHBondContact O-CB 3.17Å; R335-I339 VanDerWaalsContact O-CG1 3.24Å; R335-I339 WeakPolarHBondContact O-CG1 3.47Å; R335-I339 PolarHBondContact O-N 2.93Å; R335-F518 PolarHBondContact NH1-O 3.38Å
336	D	95.1	Very high	95.7	Very high	113 Å²	113	68 Å²	68	60%	0.604	32%	0.319	S	S	*	.	H	α-helix	trans	-73.4	-35.9	-173.9	-61.1	-16.4	0	0	0	111.4	S334 F340	S334-D336 VanDerWaalsContact C-N 3.25Å; S334-D336 PolarHBondContact O-N 3.06Å; D336-F340 VanDerWaalsContact O-CB 3.3Å; D336-F340 WeakPolarHBondContact O-CB 3.19Å; D336-F340 PolarHBondContact O-N 2.86Å
337	E	96.2	Very high	95.7	Very high	84 Å²	84	67.5 Å²	67.5	39%	0.393	31%	0.306	S	S	.	.	H	α-helix	trans	-66.2	-45	167.2	-72.6	178.7	107.5	0	0	112.1	T333 S334 I339 F340 Y341	T333-E337 HydrophobicContact CG2-CB 3.86Å; S334-E337 PolarHBondContact O-N 2.7Å; S334-E337 WeakPolarHBondContact OG-CB 3.3Å; S334-E337 VanDerWaalsContact OG-CG 3.28Å; S334-E337 WeakPolarHBondContact OG-CG 3.46Å; S334-E337 PolarHBondContact OG-N 2.78Å; S334-E337 PolarHBondContact OG-OE2 3.08Å; E337-I339 VanDerWaalsContact C-N 3.29Å; E337-I339 PolarHBondContact O-N 3.23Å; E337-F340 PolarHBondContact O-N 2.79Å; E337-F340 VanDerWaalsContact O-N 3.07Å; E337-Y341 HydrophobicContact CB-CD2 4.12Å; E337-Y341 HydrophobicContact CB-CE2 4.23Å; E337-Y341 HydrophobicContact CG-CE2 4.4Å; E337-Y341 VanDerWaalsContact O-CD2 3.24Å; E337-Y341 WeakPolarHBondContact O-CD2 3.25Å; E337-Y341 PolarHBondContact O-N 2.92Å
338	F	96.3	Very high	95.7	Very high	1 Å²	1	69 Å²	69	0%	0.004	31%	0.314	C	S	.	.	H	α-helix	trans	-55.6	-46.2	177.4	178.1	-95.4	0	0	0	110.8	I328 T333 S334 R335 S342 F513 R516 Y517	I328-F338 HydrophobicContact CB-CD2 4.02Å; I328-F338 HydrophobicContact CB-CE2 3.95Å; I328-F338 HydrophobicContact CG2-CD2 4.28Å; I328-F338 WeakPolarHBondContact O-CE2 3.3Å; T333-F338 HydrophobicContact CG2-CB 4.22Å; S334-F338 WeakPolarHBondContact O-CB 3.38Å; S334-F338 PolarHBondContact O-N 2.81Å; R335-F338 WeakPolarHBondContact O-CB 3.49Å; R335-F338 PolarHBondContact O-N 3.35Å; F338-S342 WeakPolarHBondContact O-CB 3.28Å; F338-S342 PolarHBondContact O-N 3.2Å; F338-S342 PolarHBondContact O-OG 2.94Å; F338-F513 HydrophobicContact CE1-CD2 4.15Å; F338-F513 AromaticContact CE1-CE2 3.84Å; F338-F513 HydrophobicContact CE1-CE2 3.84Å; F338-F513 HydrophobicContact CE1-CZ 4.14Å; F338-F513 HydrophobicContact CE2-CD2 4.49Å; F338-F513 HydrophobicContact CE2-CE2 4.38Å; F338-F513 AromaticContact CZ-CD2 3.54Å; F338-F513 HydrophobicContact CZ-CD2 3.54Å; F338-F513 AromaticContact CZ-CE2 3.49Å; F338-F513 HydrophobicContact CZ-CE2 3.49Å; F338-F513 VanDerWaalsContact CZ-CE2 3.49Å; F338-F513 HydrophobicContact CZ-CG 4.36Å; F338-F513 HydrophobicContact CZ-CZ 4.25Å; F338-R516 HydrophobicContact CD1-CB 4.27Å; F338-R516 HydrophobicContact CE1-CB 3.74Å; F338-R516 HydrophobicContact CE2-CB 4.46Å; F338-R516 HydrophobicContact CZ-CB 3.85Å; F338-Y517 HydrophobicContact CE1-CD2 4.39Å
339	I	95.6	Very high	95.7	Very high	30 Å²	30	69 Å²	69	15%	0.154	31%	0.314	C	S	.	.	H	α-helix	trans	-62.1	-46	173.7	-70.1	167.6	0	0	0	111.1	R335 E337 K343 Y517	R335-I339 HydrophobicContact CG-CD1 3.82Å; R335-I339 HydrophobicContact CG-CG1 4.33Å; R335-I339 WeakPolarHBondContact O-CB 3.17Å; R335-I339 VanDerWaalsContact O-CG1 3.24Å; R335-I339 WeakPolarHBondContact O-CG1 3.47Å; R335-I339 PolarHBondContact O-N 2.93Å; E337-I339 VanDerWaalsContact C-N 3.29Å; E337-I339 PolarHBondContact O-N 3.23Å; I339-K343 HydrophobicContact CG2-CD 3.93Å; I339-K343 VanDerWaalsContact CG2-CE 3.46Å; I339-K343 VanDerWaalsContact CG2-NZ 3.27Å; I339-K343 WeakPolarHBondContact O-CB 3.46Å; I339-K343 VanDerWaalsContact O-CG 3.27Å; I339-K343 WeakPolarHBondContact O-CG 3.41Å; I339-K343 PolarHBondContact O-N 3.11Å; I339-Y517 HydrophobicContact CB-CE2 4.21Å; I339-Y517 WeakPolarHBondContact CD1-O 3.42Å; I339-Y517 HydrophobicContact CG1-CD2 3.87Å; I339-Y517 HydrophobicContact CG1-CE2 3.92Å; I339-Y517 HydrophobicContact CG1-CG 4.24Å; I339-Y517 HydrophobicContact CG2-CE2 4.01Å
340	F	96.3	Very high	95.8	Very high	109 Å²	109	65.9 Å²	65.9	48%	0.478	30%	0.302	S	S	.	.	H	α-helix	trans	-63.3	-52.4	-178.2	174.2	-107.1	0	0	0	112.7	D336 E337 K343 R344	D336-F340 VanDerWaalsContact O-CB 3.3Å; D336-F340 WeakPolarHBondContact O-CB 3.19Å; D336-F340 PolarHBondContact O-N 2.86Å; E337-F340 PolarHBondContact O-N 2.79Å; E337-F340 VanDerWaalsContact O-N 3.07Å; F340-K343 PolarHBondContact O-N 2.92Å; F340-R344 WeakPolarHBondContact O-CG 3.41Å; F340-R344 PolarHBondContact O-N 2.8Å; F340-R344 VanDerWaalsContact O-N 3.08Å
341	Y	96.9	Very high	95.8	Very high	50 Å²	50	66.7 Å²	66.7	20%	0.196	30%	0.304	C	S	.	.	H	α-helix	trans	-70.2	-34.5	179.8	-70.8	-71.5	0	0	0	112.2	M324 I327 E337 R344 L345	M324-Y341 HydrophobicContact CG-CD1 3.97Å; M324-Y341 HydrophobicContact SD-CD1 4.5Å; I327-Y341 HydrophobicContact CB-CD2 4.3Å; I327-Y341 HydrophobicContact CB-CG 4.46Å; I327-Y341 HydrophobicContact CD1-CD1 4.09Å; I327-Y341 HydrophobicContact CD1-CD2 4.07Å; I327-Y341 HydrophobicContact CD1-CE1 3.83Å; I327-Y341 HydrophobicContact CD1-CE2 3.83Å; I327-Y341 HydrophobicContact CD1-CG 4.19Å; I327-Y341 HydrophobicContact CG2-CD2 3.48Å; I327-Y341 VanDerWaalsContact CG2-CD2 3.48Å; I327-Y341 HydrophobicContact CG2-CE2 3.96Å; I327-Y341 HydrophobicContact CG2-CG 4.06Å; E337-Y341 HydrophobicContact CB-CD2 4.12Å; E337-Y341 HydrophobicContact CB-CE2 4.23Å; E337-Y341 HydrophobicContact CG-CE2 4.4Å; E337-Y341 VanDerWaalsContact O-CD2 3.24Å; E337-Y341 WeakPolarHBondContact O-CD2 3.25Å; E337-Y341 PolarHBondContact O-N 2.92Å; Y341-R344 PolarHBondContact O-N 3.31Å; Y341-L345 PolarHBondContact O-N 3.28Å
342	S	96.3	Very high	95.8	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.5	-49.3	170.2	-64.9	0	0	0	0	111.4	F338 R344 L345 M346 F513	F338-S342 WeakPolarHBondContact O-CB 3.28Å; F338-S342 PolarHBondContact O-N 3.2Å; F338-S342 PolarHBondContact O-OG 2.94Å; S342-R344 VanDerWaalsContact C-N 3.3Å; S342-R344 PolarHBondContact O-N 2.96Å; S342-L345 PolarHBondContact O-N 2.75Å; S342-L345 VanDerWaalsContact O-N 3.16Å; S342-M346 WeakPolarHBondContact O-CB 3.33Å; S342-M346 WeakPolarHBondContact O-CG 3.23Å; S342-M346 PolarHBondContact O-N 3.37Å; S342-F513 WeakPolarHBondContact OG-CE2 3.38Å
343	K	95.3	Very high	95.9	Very high	96 Å²	96	54 Å²	54	42%	0.417	24%	0.244	S	C	.	.	H	α-helix	trans	-59.1	-38.8	177.1	-76.6	169.6	-179.2	168.7	0	112.8	I339 F340 R347 Y517	I339-K343 HydrophobicContact CG2-CD 3.93Å; I339-K343 VanDerWaalsContact CG2-CE 3.46Å; I339-K343 VanDerWaalsContact CG2-NZ 3.27Å; I339-K343 WeakPolarHBondContact O-CB 3.46Å; I339-K343 VanDerWaalsContact O-CG 3.27Å; I339-K343 WeakPolarHBondContact O-CG 3.41Å; I339-K343 PolarHBondContact O-N 3.11Å; F340-K343 PolarHBondContact O-N 2.92Å; K343-R347 PolarHBondContact O-N 2.76Å; K343-Y517 WeakPolarHBondContact CE-OH 3.33Å
344	R	96	Very high	95.9	Very high	99 Å²	99	54.5 Å²	54.5	37%	0.374	25%	0.245	S	C	.	.	H	α-helix	trans	-64	-43.6	175.3	-71.5	177.3	66.2	-174.8	1.4	112	M324 F340 Y341 S342 R347 L348	M324-R344 HydrophobicContact SD-CB 3.76Å; F340-R344 WeakPolarHBondContact O-CG 3.41Å; F340-R344 PolarHBondContact O-N 2.8Å; F340-R344 VanDerWaalsContact O-N 3.08Å; Y341-R344 PolarHBondContact O-N 3.31Å; S342-R344 VanDerWaalsContact C-N 3.3Å; S342-R344 PolarHBondContact O-N 2.96Å; R344-R347 PolarHBondContact O-N 3.28Å; R344-L348 PolarHBondContact O-N 3.46Å
345	L	96.1	Very high	95.9	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-70.1	-41.1	178	-173.1	62.2	0	0	0	112	L315 V321 M324 I328 Y341 S342 R347 L348 L349 L472 T494	L315-L345 HydrophobicContact CD2-CD1 4.46Å; V321-L345 HydrophobicContact CG1-CD1 4.14Å; M324-L345 HydrophobicContact CE-CD1 4.16Å; I328-L345 HydrophobicContact CD1-CD2 3.67Å; Y341-L345 PolarHBondContact O-N 3.28Å; S342-L345 PolarHBondContact O-N 2.75Å; S342-L345 VanDerWaalsContact O-N 3.16Å; L345-R347 VanDerWaalsContact C-N 3.29Å; L345-R347 PolarHBondContact O-N 3.35Å; L345-L348 PolarHBondContact O-N 3.21Å; L345-L349 WeakPolarHBondContact O-CB 3.41Å; L345-L349 PolarHBondContact O-N 2.74Å; L345-L472 HydrophobicContact CB-CD2 4.25Å; L345-L472 HydrophobicContact CD2-CD2 4.01Å; L345-L472 HydrophobicContact CG-CD2 3.86Å; L345-T494 HydrophobicContact CD1-CG2 3.92Å; L345-T494 HydrophobicContact CG-CG2 4.09Å
346	M	96.4	Very high	95.9	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-56.6	-41	171.6	-70.4	167.5	179	0	0	111.8	S342 L349 I350 T393 M394 A397 L472 F513 Y517	S342-M346 WeakPolarHBondContact O-CB 3.33Å; S342-M346 WeakPolarHBondContact O-CG 3.23Å; S342-M346 PolarHBondContact O-N 3.37Å; M346-L349 PolarHBondContact O-N 2.52Å; M346-I350 WeakPolarHBondContact O-CG1 3.46Å; M346-I350 PolarHBondContact O-N 3.44Å; M346-T393 VanDerWaalsContact CE-OG1 3.23Å; M346-T393 WeakPolarHBondContact CE-OG1 3.43Å; M346-M394 HydrophobicContact CE-CG 3.94Å; M346-M394 HydrophobicContact CG-CG 4.17Å; M346-M394 HydrophobicContact SD-CG 4.1Å; M346-A397 HydrophobicContact CB-CB 3.75Å; M346-L472 HydrophobicContact CE-CD1 3.86Å; M346-L472 HydrophobicContact CG-CD1 4.04Å; M346-L472 HydrophobicContact CG-CD2 3.9Å; M346-L472 HydrophobicContact CG-CG 4.28Å; M346-F513 HydrophobicContact CE-CE1 3.87Å; M346-F513 HydrophobicContact CE-CZ 3.6Å; M346-Y517 HydrophobicContact CE-CE2 4.49Å
347	R	96.2	Very high	95.9	Very high	90 Å²	90	48.2 Å²	48.2	34%	0.34	22%	0.219	S	C	.	.	H	α-helix	trans	-59.7	-51.6	177.3	-178.2	62.2	-176.6	-133.8	14.8	111	K343 R344 L345 L349 I350 E351 A400	K343-R347 PolarHBondContact O-N 2.76Å; R344-R347 PolarHBondContact O-N 3.28Å; L345-R347 VanDerWaalsContact C-N 3.29Å; L345-R347 PolarHBondContact O-N 3.35Å; R347-L349 VanDerWaalsContact C-N 3.28Å; R347-L349 PolarHBondContact O-N 2.95Å; R347-I350 PolarHBondContact O-N 3.02Å; R347-E351 IonicContact CZ-OE1 2.77Å; R347-E351 IonicContact NE-OE1 2.92Å; R347-E351 PolarHBondContact NE-OE1 3.39Å; R347-E351 IonicContact NH2-OE1 3.83Å; R347-E351 PolarHBondContact NH2-OE1 3.07Å; R347-E351 VanDerWaalsContact O-CG 3.32Å; R347-E351 WeakPolarHBondContact O-CG 3.34Å; R347-E351 PolarHBondContact O-N 3.17Å; R347-A400 PolarHBondContact NH1-O 3.4Å
348	L	96.5	Very high	95.7	Very high	74 Å²	74	46.4 Å²	46.4	39%	0.387	22%	0.215	S	C	.	.	H	α-helix	trans	-59.2	-39.2	177.5	-62.3	-179.4	0	0	0	112.5	L315 V321 M324 R344 L345 R352	L315-L348 HydrophobicContact CD2-CB 4.02Å; V321-L348 HydrophobicContact CG2-CD1 4Å; M324-L348 HydrophobicContact CE-CD1 3.74Å; R344-L348 PolarHBondContact O-N 3.46Å; L345-L348 PolarHBondContact O-N 3.21Å; L348-R352 WeakPolarHBondContact O-CB 3.49Å; L348-R352 PolarHBondContact O-N 3.41Å
349	L	96.9	Very high	95.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.2	-42.2	177.1	176.1	61.5	0	0	0	112.5	L345 M346 R347 R352 A353 M394 V470 S471 L472 I492 T494	L345-L349 WeakPolarHBondContact O-CB 3.41Å; L345-L349 PolarHBondContact O-N 2.74Å; M346-L349 PolarHBondContact O-N 2.52Å; R347-L349 VanDerWaalsContact C-N 3.28Å; R347-L349 PolarHBondContact O-N 2.95Å; L349-R352 PolarHBondContact O-N 3.36Å; L349-A353 WeakPolarHBondContact O-CB 3.43Å; L349-A353 PolarHBondContact O-N 2.89Å; L349-M394 HydrophobicContact CD2-CE 3.73Å; L349-V470 HydrophobicContact CD1-CG1 3.8Å; L349-V470 HydrophobicContact CD2-CG1 3.7Å; L349-V470 HydrophobicContact CG-CG1 3.48Å; L349-V470 VanDerWaalsContact CG-CG1 3.48Å; L349-S471 VanDerWaalsContact CD2-C 3.42Å; L349-S471 WeakPolarHBondContact CD2-O 3.38Å; L349-L472 HydrophobicContact CD2-CD2 3.93Å; L349-L472 HydrophobicContact CD2-CG 4.42Å; L349-I492 HydrophobicContact CD1-CG2 3.96Å; L349-T494 HydrophobicContact CB-CG2 3.74Å; L349-T494 HydrophobicContact CD1-CG2 3.83Å; L349-T494 HydrophobicContact CD2-CG2 4.16Å; L349-T494 HydrophobicContact CG-CG2 4.1Å
350	I	97.1	Very high	95.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-69.1	-43.8	176.9	-64.5	-65.9	0	0	0	111.1	M346 R347 R352 A353 L354 M394 A397 L398 V401 I438 M440 V470	M346-I350 WeakPolarHBondContact O-CG1 3.46Å; M346-I350 PolarHBondContact O-N 3.44Å; R347-I350 PolarHBondContact O-N 3.02Å; I350-R352 PolarHBondContact O-N 2.9Å; I350-A353 WeakPolarHBondContact O-CB 3.32Å; I350-A353 PolarHBondContact O-N 3.19Å; I350-L354 HydrophobicContact CG2-CD1 4Å; I350-L354 HydrophobicContact CG2-CG 4.26Å; I350-L354 WeakPolarHBondContact O-CG 3.43Å; I350-L354 PolarHBondContact O-N 3.2Å; I350-M394 HydrophobicContact CD1-CE 4.47Å; I350-A397 HydrophobicContact CG1-CB 4.43Å; I350-L398 HydrophobicContact CD1-CB 4.29Å; I350-L398 HydrophobicContact CD1-CD1 4.43Å; I350-L398 HydrophobicContact CG2-CD1 3.76Å; I350-V401 HydrophobicContact CB-CG2 4.35Å; I350-V401 HydrophobicContact CG2-CB 4.42Å; I350-V401 HydrophobicContact CG2-CG2 3.67Å; I350-I438 HydrophobicContact CD1-CG2 4.39Å; I350-M440 HydrophobicContact CD1-SD 4.37Å; I350-V470 HydrophobicContact CD1-CG1 4.32Å
351	E	95.4	Very high	95.4	Very high	80 Å²	80	50.3 Å²	50.3	37%	0.374	25%	0.246	S	C	.	.	H	α-helix	trans	-58	-41	175	-59.6	-70.9	-173.9	0	0	110.7	R347 L354 S355 V401	R347-E351 IonicContact CZ-OE1 2.77Å; R347-E351 IonicContact NE-OE1 2.92Å; R347-E351 PolarHBondContact NE-OE1 3.39Å; R347-E351 IonicContact NH2-OE1 3.83Å; R347-E351 PolarHBondContact NH2-OE1 3.07Å; R347-E351 VanDerWaalsContact O-CG 3.32Å; R347-E351 WeakPolarHBondContact O-CG 3.34Å; R347-E351 PolarHBondContact O-N 3.17Å; E351-L354 PolarHBondContact O-N 3.31Å; E351-S355 PolarHBondContact O-N 3.28Å; E351-V401 WeakPolarHBondContact OE2-CG1 3.36Å
352	R	95.8	Very high	95.3	Very high	100 Å²	100	52.2 Å²	52.2	38%	0.377	26%	0.257	S	S	.	.	H	α-helix	trans	-64.7	-40.3	173	-179.3	57	173.5	-176.3	-4.8	112.3	S313 L315 L348 L349 I350 S355 F356 I492	S313-R352 PolarHBondContact OG-NE 3.43Å; S313-R352 PolarHBondContact OG-NH2 3.21Å; L315-R352 HydrophobicContact CD1-CB 3.86Å; L315-R352 HydrophobicContact CD1-CG 3.95Å; L348-R352 WeakPolarHBondContact O-CB 3.49Å; L348-R352 PolarHBondContact O-N 3.41Å; L349-R352 PolarHBondContact O-N 3.36Å; I350-R352 PolarHBondContact O-N 2.9Å; R352-S355 PolarHBondContact O-N 3.01Å; R352-S355 PolarHBondContact O-OG 3.46Å; R352-F356 HydrophobicContact CG-CE2 4.36Å; R352-F356 VanDerWaalsContact O-CD2 3.31Å; R352-F356 WeakPolarHBondContact O-CD2 3.32Å; R352-I492 HydrophobicContact CG-CG2 4.32Å
353	A	96	Very high	95.3	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.5	-42.9	177.6	0	0	0	0	0	112.3	L349 I350 S355 F356 L468 V470 I492	L349-A353 WeakPolarHBondContact O-CB 3.43Å; L349-A353 PolarHBondContact O-N 2.89Å; I350-A353 WeakPolarHBondContact O-CB 3.32Å; I350-A353 PolarHBondContact O-N 3.19Å; A353-S355 PolarHBondContact O-N 2.85Å; A353-F356 PolarHBondContact O-N 2.75Å; A353-F356 VanDerWaalsContact O-N 3.13Å; A353-L468 WeakPolarHBondContact O-CD1 3.31Å; A353-V470 HydrophobicContact CB-CG1 4.3Å; A353-V470 HydrophobicContact CB-CG2 3.78Å; A353-I492 HydrophobicContact CB-CD1 3.94Å
354	L	94.9	Very high	95.4	Very high	31 Å²	31	55.6 Å²	55.6	16%	0.162	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-27.9	177.2	-66.4	170.6	0	0	0	112.7	I350 E351 F356 L357 I382 V401 I438	I350-L354 HydrophobicContact CG2-CD1 4Å; I350-L354 HydrophobicContact CG2-CG 4.26Å; I350-L354 WeakPolarHBondContact O-CG 3.43Å; I350-L354 PolarHBondContact O-N 3.2Å; E351-L354 PolarHBondContact O-N 3.31Å; L354-F356 PolarHBondContact O-N 3.23Å; L354-L357 HydrophobicContact CD2-CD1 3.53Å; L354-L357 WeakPolarHBondContact O-CB 3.45Å; L354-L357 PolarHBondContact O-N 2.81Å; L354-L357 VanDerWaalsContact O-N 3.08Å; L354-I382 HydrophobicContact CD2-CD1 4.01Å; L354-V401 HydrophobicContact CD1-CB 4.01Å; L354-V401 HydrophobicContact CD1-CG1 3.51Å; L354-V401 HydrophobicContact CD1-CG2 4.48Å; L354-I438 HydrophobicContact CD2-CD1 3.87Å
355	S	94.8	Very high	95.4	Very high	76 Å²	76	57.7 Å²	57.7	53%	0.531	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-12	175.8	76.5	0	0	0	0	115.1	E351 R352 A353	E351-S355 PolarHBondContact O-N 3.28Å; R352-S355 PolarHBondContact O-N 3.01Å; R352-S355 PolarHBondContact O-OG 3.46Å; A353-S355 PolarHBondContact O-N 2.85Å
356	F	94.5	Very high	95.4	Very high	72 Å²	72	59.6 Å²	59.6	32%	0.316	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-1.9	172.8	-68.3	-81.8	0	0	0	113.7	S313 R352 A353 L354 L468 K490 I492	S313-F356 VanDerWaalsContact CB-CZ 3.46Å; S313-F356 WeakPolarHBondContact OG-CE2 3.43Å; S313-F356 WeakPolarHBondContact OG-CZ 3.29Å; R352-F356 HydrophobicContact CG-CE2 4.36Å; R352-F356 VanDerWaalsContact O-CD2 3.31Å; R352-F356 WeakPolarHBondContact O-CD2 3.32Å; A353-F356 PolarHBondContact O-N 2.75Å; A353-F356 VanDerWaalsContact O-N 3.13Å; L354-F356 PolarHBondContact O-N 3.23Å; F356-L468 HydrophobicContact CB-CD2 4.41Å; F356-K490 HydrophobicContact CD1-CD 4.43Å; F356-K490 HydrophobicContact CD1-CG 4.35Å; F356-K490 HydrophobicContact CG-CG 4.41Å; F356-I492 HydrophobicContact CD2-CD1 3.56Å; F356-I492 HydrophobicContact CE2-CD1 4.1Å; F356-I492 HydrophobicContact CG-CD1 4.24Å
357	L	93.9	Very high	95.5	Very high	20 Å²	20	65.9 Å²	65.9	11%	0.105	35%	0.347	C	S	.	.	S	Bend	trans	-72.6	146.2	175.5	-68.5	177.1	0	0	0	111.2	L354 S359 F377 I382 H436 L468	L354-L357 HydrophobicContact CD2-CD1 3.53Å; L354-L357 WeakPolarHBondContact O-CB 3.45Å; L354-L357 PolarHBondContact O-N 2.81Å; L354-L357 VanDerWaalsContact O-N 3.08Å; L357-S359 PolarHBondContact O-N 2.86Å; L357-F377 HydrophobicContact CB-CD2 3.94Å; L357-F377 HydrophobicContact CB-CE2 3.89Å; L357-F377 HydrophobicContact CD1-CD2 4.25Å; L357-F377 HydrophobicContact CD1-CE2 4.01Å; L357-F377 HydrophobicContact CD2-CE2 4.28Å; L357-F377 HydrophobicContact CG-CE2 4.3Å; L357-I382 HydrophobicContact CD1-CD1 3.46Å; L357-I382 VanDerWaalsContact CD1-CD1 3.46Å; L357-I382 HydrophobicContact CD1-CG1 3.89Å; L357-H436 HydrophobicContact CD2-CB 3.61Å; L357-L468 HydrophobicContact CD2-CD1 3.83Å; L357-L468 HydrophobicContact CG-CD1 4.28Å
358	P	93.6	Very high	95.4	Very high	46 Å²	46	68.9 Å²	68.9	30%	0.299	37%	0.365	S	S	.	.			trans	-57.9	138.2	176.3	24.5	-35.6	0	0	0	111.4	F377 H378	P358-F377 HydrophobicContact CG-CE2 4.2Å; P358-F377 WeakPolarHBondContact O-CD2 3.21Å; P358-H378 HydrophobicContact CB-CB 4.41Å; P358-H378 WeakPolarHBondContact CB-O 3.29Å; P358-H378 WeakPolarHBondContact CG-O 3.36Å; P358-H378 PolarHBondContact O-N 2.84Å
359	S	92.3	Very high	95.3	Very high	65 Å²	65	67.6 Å²	67.6	46%	0.455	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	144.9	175.9	63.3	0	0	0	0	111.9	L357 S376	L357-S359 PolarHBondContact O-N 2.86Å; S359-S376 CarbonylContact C-O 3.56Å; S359-S376 WeakPolarHBondContact CA-O 3.33Å; S359-S376 WeakPolarHBondContact CB-O 3.37Å
360	Q	93.9	Very high	95.3	Very high	86 Å²	86	74.2 Å²	74.2	40%	0.402	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	155	174.5	63.2	-174.4	0.2	0	0	110	R375 S376 H378	Q360-R375 WeakPolarHBondContact O-CA 3.2Å; Q360-R375 WeakPolarHBondContact O-CD 3.28Å; Q360-S376 WeakPolarHBondContact CG-OG 3.21Å; Q360-S376 PolarHBondContact N-O 2.74Å; Q360-S376 PolarHBondContact NE2-OG 2.85Å; Q360-S376 PolarHBondContact O-N 3.18Å; Q360-H378 HydrophobicContact CB-CB 3.99Å; Q360-H378 HydrophobicContact CG-CB 4.12Å; Q360-H378 PolarHBondContact OE1-CD2 2.99Å
361	V	95.4	Very high	95.3	Very high	71 Å²	71	79.3 Å²	79.3	43%	0.43	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	136.8	167.5	174.5	0	0	0	0	109.1	I363 E373	V361-I363 HydrophobicContact CG1-CG1 4.44Å; V361-E373 HydrophobicContact CG1-CG 3.51Å
362	H	94.9	Very high	95.4	Very high	91 Å²	91	82.5 Å²	82.5	42%	0.421	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	99.9	179	-175.6	-77.3	0	0	0	109.9	V364 G374	H362-V364 VanDerWaalsContact CE1-CG1 3.5Å; H362-V364 WeakPolarHBondContact CE1-CG1 3.25Å; H362-V364 WeakPolarHBondContact ND1-CG1 3.47Å; H362-G374 PolarHBondContact N-O 3.01Å; H362-G374 CarbonylContact O-C 3.57Å; H362-G374 VanDerWaalsContact O-CA 3.28Å; H362-G374 WeakPolarHBondContact O-CA 3.29Å; H362-G374 PolarHBondContact O-N 3.03Å
363	I	95.9	Very high	95.4	Very high	104 Å²	104	83.4 Å²	83.4	53%	0.533	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	136.2	178.3	-58.5	170.8	0	0	0	109.2	V361 D371 Y372 E373	V361-I363 HydrophobicContact CG1-CG1 4.44Å; I363-D371 HydrophobicContact CG2-CB 3.86Å; I363-Y372 WeakPolarHBondContact CA-O 3.48Å; I363-E373 HydrophobicContact CG1-CG 4.4Å
364	V	96.4	Very high	95.4	Very high	62 Å²	62	83.9 Å²	83.9	38%	0.376	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	143.4	173	-64.2	0	0	0	0	110	H362 Y372	H362-V364 VanDerWaalsContact CE1-CG1 3.5Å; H362-V364 WeakPolarHBondContact CE1-CG1 3.25Å; H362-V364 WeakPolarHBondContact ND1-CG1 3.47Å; V364-Y372 HydrophobicContact CG2-CD1 4.04Å; V364-Y372 PolarHBondContact N-O 3.02Å; V364-Y372 PolarHBondContact O-N 3.02Å
365	Q	96.9	Very high	95.3	Very high	143 Å²	143	90.3 Å²	90.3	67%	0.668	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	130.4	167.5	-80	-176.8	-13.4	0	0	110.1	D371	Q365-D371 WeakPolarHBondContact CG-OD1 3.27Å; Q365-D371 PolarHBondContact NE2-OD1 2.65Å
366	T	96.4	Very high	95.2	Very high	40 Å²	40	88.1 Å²	88.1	25%	0.245	46%	0.458	C	S	.	.			trans	-72.6	160.7	171.6	60.4	0	0	0	0	110.4	Q368 G369 E370	T366-Q368 PolarHBondContact O-N 2.71Å; T366-G369 PolarHBondContact O-N 3.02Å; T366-E370 WeakPolarHBondContact CB-O 3.27Å; T366-E370 WeakPolarHBondContact CG2-O 3.37Å; T366-E370 PolarHBondContact N-O 3.22Å; T366-E370 PolarHBondContact OG1-N 2.67Å; T366-E370 PolarHBondContact OG1-O 2.91Å
367	P	97	Very high	95.1	Very high	133 Å²	133	88.2 Å²	88.2	86%	0.864	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-13.6	172.1	-25.9	35.6	0	0	0	114.9
368	Q	95.9	Very high	94.8	Very high	152 Å²	152	92.4 Å²	92.4	71%	0.71	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-11.2	175.7	-67.5	76.9	7.2	0	0	113.4	T366	T366-Q368 PolarHBondContact O-N 2.71Å
369	G	93.6	Very high	94.3	Very high	47 Å²	47	91.8 Å²	91.8	49%	0.485	48%	0.478	S	S	.	.	S	Bend	trans	93.2	-9.2	-176.4	0	0	0	0	0	115	T366	T366-G369 PolarHBondContact O-N 3.02Å
370	E	96.5	Very high	93.9	Very high	140 Å²	140	94.6 Å²	94.6	65%	0.654	48%	0.482	S	S	*	.			trans	-77.2	141.1	176.1	-60.1	-61.6	152.7	0	0	111.3	T366	T366-E370 WeakPolarHBondContact CB-O 3.27Å; T366-E370 WeakPolarHBondContact CG2-O 3.37Å; T366-E370 PolarHBondContact N-O 3.22Å; T366-E370 PolarHBondContact OG1-N 2.67Å; T366-E370 PolarHBondContact OG1-O 2.91Å
371	D	96.9	Very high	93.8	Very high	107 Å²	107	94 Å²	94	57%	0.572	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	133.1	174.1	-76.8	-20.1	0	0	0	111.6	I363 Q365	I363-D371 HydrophobicContact CG2-CB 3.86Å; Q365-D371 WeakPolarHBondContact CG-OD1 3.27Å; Q365-D371 PolarHBondContact NE2-OD1 2.65Å
372	Y	97.4	Very high	93.8	Very high	147 Å²	147	92 Å²	92	58%	0.576	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.2	174.9	175	-99.5	0	0	0	110.9	I363 V364 G374	I363-Y372 WeakPolarHBondContact CA-O 3.48Å; V364-Y372 HydrophobicContact CG2-CD1 4.04Å; V364-Y372 PolarHBondContact N-O 3.02Å; V364-Y372 PolarHBondContact O-N 3.02Å; Y372-G374 PolarHBondContact O-N 3.14Å
373	E	97.1	Very high	93.9	Very high	119 Å²	119	87.7 Å²	87.7	56%	0.556	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	90.5	175	-165.5	-166.9	134.3	0	0	110.9	V361 I363 R375	V361-E373 HydrophobicContact CG1-CG 3.51Å; I363-E373 HydrophobicContact CG1-CG 4.4Å; E373-R375 IonicContact OE1-NH2 3.01Å
374	G	95.4	Very high	93.9	Very high	10 Å²	10	82.8 Å²	82.8	10%	0.103	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-177.4	175	0	0	0	0	0	114.1	H362 Y372	H362-G374 PolarHBondContact N-O 3.01Å; H362-G374 CarbonylContact O-C 3.57Å; H362-G374 VanDerWaalsContact O-CA 3.28Å; H362-G374 WeakPolarHBondContact O-CA 3.29Å; H362-G374 PolarHBondContact O-N 3.03Å; Y372-G374 PolarHBondContact O-N 3.14Å
375	R	93.5	Very high	94	Very high	165 Å²	165	79.8 Å²	79.8	62%	0.623	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.8	169.7	-66.5	-71.2	166.3	139.9	-7.5	109.8	Q360 E373	Q360-R375 WeakPolarHBondContact O-CA 3.2Å; Q360-R375 WeakPolarHBondContact O-CD 3.28Å; E373-R375 IonicContact OE1-NH2 3.01Å
376	S	92.4	Very high	94	Very high	31 Å²	31	73 Å²	73	22%	0.217	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	154.3	169.6	63.9	0	0	0	0	110.4	S359 Q360 H378	S359-S376 CarbonylContact C-O 3.56Å; S359-S376 WeakPolarHBondContact CA-O 3.33Å; S359-S376 WeakPolarHBondContact CB-O 3.37Å; Q360-S376 WeakPolarHBondContact CG-OG 3.21Å; Q360-S376 PolarHBondContact N-O 2.74Å; Q360-S376 PolarHBondContact NE2-OG 2.85Å; Q360-S376 PolarHBondContact O-N 3.18Å; S376-H378 PolarHBondContact O-N 2.77Å
377	F	91.4	Very high	94	Very high	74 Å²	74	71.3 Å²	71.3	33%	0.325	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	130.7	175.3	169.3	-118.4	0	0	0	110.5	L357 P358 G379 I382 H436	L357-F377 HydrophobicContact CB-CD2 3.94Å; L357-F377 HydrophobicContact CB-CE2 3.89Å; L357-F377 HydrophobicContact CD1-CD2 4.25Å; L357-F377 HydrophobicContact CD1-CE2 4.01Å; L357-F377 HydrophobicContact CD2-CE2 4.28Å; L357-F377 HydrophobicContact CG-CE2 4.3Å; P358-F377 HydrophobicContact CG-CE2 4.2Å; P358-F377 WeakPolarHBondContact O-CD2 3.21Å; F377-G379 VanDerWaalsContact CE1-C 3.49Å; F377-G379 WeakPolarHBondContact CE1-O 3.4Å; F377-I382 HydrophobicContact CE1-CG1 4.06Å; F377-I382 HydrophobicContact CE2-CG1 4.42Å; F377-I382 HydrophobicContact CZ-CD1 4.48Å; F377-I382 HydrophobicContact CZ-CG1 3.85Å; F377-H436 AromaticContact CZ-CD2 3.89Å
378	H	87.8	Confident	93.8	Very high	108 Å²	108	66.4 Å²	66.4	50%	0.5	32%	0.324	S	S	.	.			trans	-110.5	74.9	179.7	177.3	-97.2	0	0	0	110.1	P358 Q360 S376	P358-H378 HydrophobicContact CB-CB 4.41Å; P358-H378 WeakPolarHBondContact CB-O 3.29Å; P358-H378 WeakPolarHBondContact CG-O 3.36Å; P358-H378 PolarHBondContact O-N 2.84Å; Q360-H378 HydrophobicContact CB-CB 3.99Å; Q360-H378 HydrophobicContact CG-CB 4.12Å; Q360-H378 PolarHBondContact OE1-CD2 2.99Å; S376-H378 PolarHBondContact O-N 2.77Å
379	G	82.6	Confident	93.6	Very high	32 Å²	32	64.9 Å²	64.9	33%	0.33	31%	0.312	S	S	.	.	S	Bend	trans	-165.9	164.4	176.1	0	0	0	0	0	110.6	F377	F377-G379 VanDerWaalsContact CE1-C 3.49Å; F377-G379 WeakPolarHBondContact CE1-O 3.4Å
380	K	85.1	Confident	93.5	Very high	124 Å²	124	63.2 Å²	63.2	54%	0.539	29%	0.294	S	S	.	.	S	Bend	trans	-68.4	-51.6	-172.2	-161	174.8	-167.1	179.9	0	112.4	E434	K380-E434 HydrophobicContact CD-CB 3.87Å; K380-E434 HydrophobicContact CD-CG 4.36Å; K380-E434 WeakPolarHBondContact CD-OE2 3.48Å; K380-E434 WeakPolarHBondContact CE-OE2 3.05Å; K380-E434 IonicContact NZ-OE1 3.25Å; K380-E434 PolarHBondContact NZ-OE1 2.86Å; K380-E434 IonicContact NZ-OE2 2.66Å; K380-E434 PolarHBondContact NZ-OE2 2.82Å
381	R	91.7	Very high	93.3	Very high	75 Å²	75	56.6 Å²	56.6	28%	0.283	26%	0.262	S	S	.	.			trans	-158.9	167.8	-179.5	-66.5	172.6	-63.6	-116.5	-11.9	109.4	D431 E434 D435 H436	R381-D431 PolarHBondContact NH2-O 2.89Å; R381-E434 IonicContact NH2-OE2 2.65Å; R381-E434 PolarHBondContact NH2-OE2 3.43Å; R381-E434 VanDerWaalsContact NH2-OE2 3.08Å; R381-D435 WeakPolarHBondContact CB-OD2 3.48Å; R381-D435 IonicContact CZ-OD1 3.7Å; R381-D435 IonicContact NE-OD1 3.3Å; R381-D435 PolarHBondContact NE-OD1 2.85Å; R381-D435 IonicContact NE-OD2 2.71Å; R381-D435 PolarHBondContact NE-OD2 2.91Å; R381-D435 IonicContact NH2-OD1 3.37Å; R381-D435 PolarHBondContact NH2-OD1 3.32Å; R381-H436 PolarHBondContact O-N 3.46Å
382	I	94.6	Very high	93.3	Very high	29 Å²	29	54.9 Å²	54.9	15%	0.149	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	134.1	168.3	-55.9	164.5	0	0	0	108.2	L354 L357 F377 V405 H436 I438	L354-I382 HydrophobicContact CD2-CD1 4.01Å; L357-I382 HydrophobicContact CD1-CD1 3.46Å; L357-I382 VanDerWaalsContact CD1-CD1 3.46Å; L357-I382 HydrophobicContact CD1-CG1 3.89Å; F377-I382 HydrophobicContact CE1-CG1 4.06Å; F377-I382 HydrophobicContact CE2-CG1 4.42Å; F377-I382 HydrophobicContact CZ-CD1 4.48Å; F377-I382 HydrophobicContact CZ-CG1 3.85Å; I382-V405 HydrophobicContact CG2-CG2 4.33Å; I382-H436 WeakPolarHBondContact CA-O 3.19Å; I382-I438 HydrophobicContact CG2-CD1 3.7Å; I382-I438 HydrophobicContact CG2-CG1 4.09Å
383	T	96.9	Very high	93.2	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.6	171.8	-75.9	0	0	0	0	109.1	V385 R406 P429 I432 D435 H436 V437 I438	T383-V385 HydrophobicContact CG2-CG2 4.04Å; T383-R406 CarbonylContact C-O 3.51Å; T383-R406 WeakPolarHBondContact CA-O 3.49Å; T383-R406 HydrophobicContact CG2-CB 4.48Å; T383-R406 PolarHBondContact OG1-NE 2.83Å; T383-P429 HydrophobicContact CG2-CG 3.88Å; T383-I432 HydrophobicContact CG2-CD1 4Å; T383-I432 HydrophobicContact CG2-CG1 4.26Å; T383-D435 PolarHBondContact OG1-OD2 3.35Å; T383-H436 PolarHBondContact N-O 3.08Å; T383-V437 CarbonylContact O-C 3.54Å; T383-V437 VanDerWaalsContact O-CA 3.32Å; T383-V437 WeakPolarHBondContact O-CA 3.43Å; T383-I438 PolarHBondContact O-N 2.82Å
384	G	97.3	Very high	93.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	145.4	167.4	0	0	0	0	0	110.7	R406 I407 G408 I438	G384-R406 PolarHBondContact N-O 3.03Å; G384-I407 CarbonylContact O-C 3.45Å; G384-I407 VanDerWaalsContact O-CA 3.31Å; G384-I407 WeakPolarHBondContact O-CA 3.37Å; G384-G408 PolarHBondContact O-N 3.49Å; G384-I438 CarbonylContact C-O 3.47Å; G384-I438 WeakPolarHBondContact CA-O 3.49Å
385	V	98.1	Very high	93.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	115.4	176	176.9	0	0	0	0	109.2	T383 G408 I410 L428 I432 V437 I438 L439 M440 L457	T383-V385 HydrophobicContact CG2-CG2 4.04Å; V385-G408 WeakPolarHBondContact CA-O 3.46Å; V385-I410 HydrophobicContact CG1-CD1 3.59Å; V385-I410 HydrophobicContact CG1-CG1 3.69Å; V385-L428 HydrophobicContact CG1-CD2 3.97Å; V385-L428 HydrophobicContact CG2-CD2 3.98Å; V385-I432 HydrophobicContact CG2-CD1 4.01Å; V385-V437 HydrophobicContact CB-CG1 4.14Å; V385-V437 HydrophobicContact CG2-CG1 3.63Å; V385-I438 PolarHBondContact N-O 2.73Å; V385-L439 HydrophobicContact CB-CD1 4.14Å; V385-L439 HydrophobicContact CG1-CD1 3.89Å; V385-M440 PolarHBondContact O-N 3.19Å; V385-L457 HydrophobicContact CG2-CD2 4.25Å
386	S	97.4	Very high	93.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	123	-177.4	-48.7	0	0	0	0	110.9	E395 G408 I410	S386-E395 WeakPolarHBondContact CB-OE1 3.17Å; S386-E395 VanDerWaalsContact OG-CD 3.3Å; S386-E395 WeakPolarHBondContact OG-CG 3.35Å; S386-E395 PolarHBondContact OG-OE1 2.93Å; S386-G408 PolarHBondContact N-O 3.08Å; S386-I410 PolarHBondContact O-N 2.85Å
387	I	96	Very high	93.3	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.021	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	117.1	162.5	-56.7	-177.2	0	0	0	107.5	G391 I410 L439 M440 D441 A453	I387-G391 VanDerWaalsContact O-CA 3.3Å; I387-G391 WeakPolarHBondContact O-CA 3.41Å; I387-G391 PolarHBondContact O-N 3.39Å; I387-I410 WeakPolarHBondContact CA-O 3.19Å; I387-L439 HydrophobicContact CD1-CD1 4.03Å; I387-L439 HydrophobicContact CD1-CG 4.33Å; I387-L439 HydrophobicContact CG1-CD1 3.78Å; I387-M440 PolarHBondContact N-O 3.23Å; I387-D441 HydrophobicContact CB-CB 4.08Å; I387-D441 HydrophobicContact CD1-CB 4.08Å; I387-D441 HydrophobicContact CG1-CB 4.37Å; I387-A453 HydrophobicContact CD1-CB 3.55Å; I387-A453 HydrophobicContact CG1-CB 3.92Å
388	L	93.1	Very high	93.5	Very high	30 Å²	30	33 Å²	33	16%	0.157	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	142.8	-176.5	-58.1	-176	0	0	0	111.1	E392 K409 I410 L411	L388-E392 HydrophobicContact CD2-CB 3.83Å; L388-E392 WeakPolarHBondContact CD2-OE2 3.43Å; L388-K409 HydrophobicContact CD1-CB 4.22Å; L388-K409 HydrophobicContact CD1-CD 4.27Å; L388-K409 HydrophobicContact CD2-CD 4.07Å; L388-K409 HydrophobicContact CD2-CG 4.29Å; L388-K409 HydrophobicContact CG-CB 4.42Å; L388-I410 PolarHBondContact N-O 2.74Å; L388-L411 HydrophobicContact CB-CB 4.39Å; L388-L411 HydrophobicContact CB-CD1 3.81Å; L388-L411 HydrophobicContact CD1-CB 4.36Å
389	R	91	Very high	93.9	Very high	120 Å²	120	33.1 Å²	33.1	45%	0.453	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	cis	-86.9	-28	3.3	-66.9	-173.5	-70.9	141.3	0.1	114.7	E392 D515 F518 T520	R389-E392 PolarHBondContact O-N 2.83Å; R389-D515 IonicContact CZ-OD1 2.79Å; R389-D515 VanDerWaalsContact CZ-OD1 3.3Å; R389-D515 IonicContact NH1-OD1 2.75Å; R389-D515 PolarHBondContact NH1-OD1 2.91Å; R389-D515 VanDerWaalsContact NH2-CG 3.26Å; R389-D515 IonicContact NH2-OD1 3.12Å; R389-D515 PolarHBondContact NH2-OD1 2.88Å; R389-D515 IonicContact NH2-OD2 2.81Å; R389-D515 PolarHBondContact NH2-OD2 3.19Å; R389-F518 HydrophobicContact CB-CE2 4.25Å; R389-T520 PolarHBondContact NH1-OG1 3.23Å; R389-T520 VanDerWaalsContact NH1-OG1 3.11Å
390	A	91.3	Very high	94.4	Very high	13 Å²	13	34.5 Å²	34.5	11%	0.107	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-71	-40.6	-163.3	0	0	0	0	0	113.8	E392 T393 C442	A390-E392 PolarHBondContact O-N 3.29Å; A390-T393 WeakPolarHBondContact O-CB 3.5Å; A390-T393 WeakPolarHBondContact O-CG2 3.37Å; A390-T393 PolarHBondContact O-N 3.38Å; A390-T393 VanDerWaalsContact O-N 3.11Å; A390-T393 PolarHBondContact O-OG1 3.11Å; A390-C442 HydrophobicContact CB-CB 4.14Å; A390-C442 PolarHBondContact O-SG 3.12Å; A390-C442 VanDerWaalsContact O-SG 3.33Å
391	G	93.2	Very high	94.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-61.5	-24.6	179.4	0	0	0	0	0	115.1	I387 T393 M394 M440	I387-G391 VanDerWaalsContact O-CA 3.3Å; I387-G391 WeakPolarHBondContact O-CA 3.41Å; I387-G391 PolarHBondContact O-N 3.39Å; G391-T393 PolarHBondContact O-N 3.36Å; G391-M394 WeakPolarHBondContact O-CB 3.37Å; G391-M394 PolarHBondContact O-N 3.14Å; G391-M394 VanDerWaalsContact O-N 3.09Å; G391-M440 WeakPolarHBondContact CA-O 3.33Å
392	E	95.4	Very high	94.8	Very high	72 Å²	72	28 Å²	28	34%	0.336	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-61.3	-28.9	175.4	171.7	154.5	-161.9	0	0	112.3	L388 R389 A390 M394 E395 K409	L388-E392 HydrophobicContact CD2-CB 3.83Å; L388-E392 WeakPolarHBondContact CD2-OE2 3.43Å; R389-E392 PolarHBondContact O-N 2.83Å; A390-E392 PolarHBondContact O-N 3.29Å; E392-M394 PolarHBondContact O-N 3Å; E392-M394 VanDerWaalsContact O-N 3.16Å; E392-E395 PolarHBondContact O-N 3.01Å; E392-E395 VanDerWaalsContact O-N 3.15Å; E392-K409 IonicContact OE1-NZ 3.85Å; E392-K409 PolarHBondContact OE1-NZ 3.18Å; E392-K409 IonicContact OE2-NZ 3.47Å; E392-K409 PolarHBondContact OE2-NZ 3.32Å
393	T	95.4	Very high	94.4	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.018	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-64.3	-19.1	177.6	69.2	0	0	0	0	113.5	M346 A390 G391 P396 C442 F513 Y517 F518	M346-T393 VanDerWaalsContact CE-OG1 3.23Å; M346-T393 WeakPolarHBondContact CE-OG1 3.43Å; A390-T393 WeakPolarHBondContact O-CB 3.5Å; A390-T393 WeakPolarHBondContact O-CG2 3.37Å; A390-T393 PolarHBondContact O-N 3.38Å; A390-T393 VanDerWaalsContact O-N 3.11Å; A390-T393 PolarHBondContact O-OG1 3.11Å; G391-T393 PolarHBondContact O-N 3.36Å; T393-P396 WeakPolarHBondContact O-CD 3.42Å; T393-C442 PolarHBondContact OG1-SG 2.83Å; T393-F513 HydrophobicContact CG2-CE1 4.18Å; T393-F513 WeakPolarHBondContact OG1-CE1 3.36Å; T393-Y517 HydrophobicContact CG2-CD1 3.26Å; T393-Y517 HydrophobicContact CG2-CD2 4.21Å; T393-Y517 HydrophobicContact CG2-CE1 3.46Å; T393-Y517 VanDerWaalsContact CG2-CE1 3.46Å; T393-Y517 HydrophobicContact CG2-CE2 4.38Å; T393-Y517 HydrophobicContact CG2-CG 3.66Å; T393-F518 HydrophobicContact CG2-CE1 4.28Å; T393-F518 HydrophobicContact CG2-CE2 3.92Å; T393-F518 HydrophobicContact CG2-CZ 3.59Å
394	M	96.3	Very high	93.9	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-88.5	-18.7	178.4	-58.2	179	66	0	0	113	M346 L349 I350 G391 E392 P396 A397 L398 M440 V470	M346-M394 HydrophobicContact CE-CG 3.94Å; M346-M394 HydrophobicContact CG-CG 4.17Å; M346-M394 HydrophobicContact SD-CG 4.1Å; L349-M394 HydrophobicContact CD2-CE 3.73Å; I350-M394 HydrophobicContact CD1-CE 4.47Å; G391-M394 WeakPolarHBondContact O-CB 3.37Å; G391-M394 PolarHBondContact O-N 3.14Å; G391-M394 VanDerWaalsContact O-N 3.09Å; E392-M394 PolarHBondContact O-N 3Å; E392-M394 VanDerWaalsContact O-N 3.16Å; M394-P396 VanDerWaalsContact C-CD 3.44Å; M394-A397 WeakPolarHBondContact O-CB 3.34Å; M394-A397 PolarHBondContact O-N 3.08Å; M394-L398 PolarHBondContact O-N 2.75Å; M394-M440 HydrophobicContact CB-CB 4.23Å; M394-M440 HydrophobicContact CB-CG 4.38Å; M394-M440 HydrophobicContact CB-SD 3.75Å; M394-M440 HydrophobicContact CE-CB 4.49Å; M394-M440 HydrophobicContact CE-CG 4.5Å; M394-M440 HydrophobicContact SD-CB 4.01Å; M394-V470 HydrophobicContact CE-CG1 3.97Å
395	E	95.4	Very high	93.7	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.019	22%	0.224	C	C	.	.	H	α-helix	trans	-56.3	-39.3	179.1	-60.2	178.6	-163	0	0	114.3	S386 E392 A397 L398 R399 I407 K409 M440	S386-E395 WeakPolarHBondContact CB-OE1 3.17Å; S386-E395 VanDerWaalsContact OG-CD 3.3Å; S386-E395 WeakPolarHBondContact OG-CG 3.35Å; S386-E395 PolarHBondContact OG-OE1 2.93Å; E392-E395 PolarHBondContact O-N 3.01Å; E392-E395 VanDerWaalsContact O-N 3.15Å; E395-A397 VanDerWaalsContact C-N 3.31Å; E395-A397 PolarHBondContact O-N 3.05Å; E395-L398 PolarHBondContact O-N 3.3Å; E395-R399 VanDerWaalsContact CB-NH1 3.29Å; E395-R399 WeakPolarHBondContact O-CB 3.43Å; E395-R399 WeakPolarHBondContact O-CG 3.07Å; E395-R399 PolarHBondContact O-N 3.23Å; E395-R399 IonicContact OE2-CZ 3.8Å; E395-R399 IonicContact OE2-NH1 3.2Å; E395-R399 PolarHBondContact OE2-NH1 3.03Å; E395-R399 IonicContact OE2-NH2 2.95Å; E395-R399 PolarHBondContact OE2-NH2 2.89Å; E395-I407 HydrophobicContact CG-CD1 4.47Å; E395-I407 HydrophobicContact CG-CG2 4.18Å; E395-K409 WeakPolarHBondContact OE1-CE 3.29Å; E395-K409 IonicContact OE1-NZ 2.71Å; E395-M440 HydrophobicContact CG-CE 3.95Å
396	P	94.6	Very high	93.6	Very high	66 Å²	66	46.6 Å²	46.6	43%	0.429	24%	0.235	S	C	.	.	H	α-helix	trans	-64.4	-34.9	176.1	-21.2	34.4	0	0	0	112.6	T393 M394 A400	T393-P396 WeakPolarHBondContact O-CD 3.42Å; M394-P396 VanDerWaalsContact C-CD 3.44Å; P396-A400 WeakPolarHBondContact O-CB 3Å; P396-A400 PolarHBondContact O-N 2.79Å; P396-A400 VanDerWaalsContact O-N 3.11Å
397	A	95.1	Very high	93.5	Very high	12 Å²	12	48.5 Å²	48.5	10%	0.099	25%	0.245	C	C	.	.	H	α-helix	trans	-68	-44.5	175.6	0	0	0	0	0	110.7	M346 I350 M394 E395 A400 V401	M346-A397 HydrophobicContact CB-CB 3.75Å; I350-A397 HydrophobicContact CG1-CB 4.43Å; M394-A397 WeakPolarHBondContact O-CB 3.34Å; M394-A397 PolarHBondContact O-N 3.08Å; E395-A397 VanDerWaalsContact C-N 3.31Å; E395-A397 PolarHBondContact O-N 3.05Å; A397-A400 PolarHBondContact O-N 3.09Å; A397-V401 WeakPolarHBondContact O-CG2 3.44Å; A397-V401 PolarHBondContact O-N 3.17Å
398	L	95.7	Very high	93.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-48.2	177.7	179.7	56.9	0	0	0	112.7	I350 M394 E395 A400 V401 C402 V405 I407 I438 M440	I350-L398 HydrophobicContact CD1-CB 4.29Å; I350-L398 HydrophobicContact CD1-CD1 4.43Å; I350-L398 HydrophobicContact CG2-CD1 3.76Å; M394-L398 PolarHBondContact O-N 2.75Å; E395-L398 PolarHBondContact O-N 3.3Å; L398-A400 PolarHBondContact O-N 2.91Å; L398-V401 PolarHBondContact O-N 3.07Å; L398-C402 HydrophobicContact CD1-CB 4.46Å; L398-C402 PolarHBondContact O-N 3.08Å; L398-V405 HydrophobicContact CD1-CG2 4.49Å; L398-V405 HydrophobicContact CD2-CG2 4.01Å; L398-V405 HydrophobicContact CG-CG1 4.2Å; L398-V405 HydrophobicContact CG-CG2 4.13Å; L398-I407 HydrophobicContact CD2-CD1 4.06Å; L398-I438 HydrophobicContact CD1-CD1 3.9Å; L398-I438 HydrophobicContact CD2-CB 4.49Å; L398-M440 HydrophobicContact CB-SD 4.13Å; L398-M440 HydrophobicContact CD2-CE 3.95Å; L398-M440 HydrophobicContact CD2-SD 3.68Å
399	R	95.4	Very high	93.6	Very high	112 Å²	112	49.4 Å²	49.4	42%	0.423	25%	0.247	S	C	.	.	H	α-helix	trans	-61.5	-28.8	175.6	-71.5	-177.7	-175.6	109	3.1	112.9	E395 V401 V405	E395-R399 VanDerWaalsContact CB-NH1 3.29Å; E395-R399 WeakPolarHBondContact O-CB 3.43Å; E395-R399 WeakPolarHBondContact O-CG 3.07Å; E395-R399 PolarHBondContact O-N 3.23Å; E395-R399 IonicContact OE2-CZ 3.8Å; E395-R399 IonicContact OE2-NH1 3.2Å; E395-R399 PolarHBondContact OE2-NH1 3.03Å; E395-R399 IonicContact OE2-NH2 2.95Å; E395-R399 PolarHBondContact OE2-NH2 2.89Å; R399-V401 VanDerWaalsContact C-N 3.3Å; R399-V405 HydrophobicContact CB-CG1 4.49Å; R399-V405 HydrophobicContact CG-CG1 3.81Å
400	A	93.8	Very high	93.8	Very high	61 Å²	61	43.7 Å²	43.7	50%	0.504	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-14.1	176	0	0	0	0	0	113.8	R347 P396 A397 L398	R347-A400 PolarHBondContact NH1-O 3.4Å; P396-A400 WeakPolarHBondContact O-CB 3Å; P396-A400 PolarHBondContact O-N 2.79Å; P396-A400 VanDerWaalsContact O-N 3.11Å; A397-A400 PolarHBondContact O-N 3.09Å; L398-A400 PolarHBondContact O-N 2.91Å
401	V	93.5	Very high	93.8	Very high	37 Å²	37	44.9 Å²	44.9	22%	0.224	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-54.5	167.3	-157.7	0	0	0	0	110.4	I350 E351 L354 A397 L398 R399	I350-V401 HydrophobicContact CB-CG2 4.35Å; I350-V401 HydrophobicContact CG2-CB 4.42Å; I350-V401 HydrophobicContact CG2-CG2 3.67Å; E351-V401 WeakPolarHBondContact OE2-CG1 3.36Å; L354-V401 HydrophobicContact CD1-CB 4.01Å; L354-V401 HydrophobicContact CD1-CG1 3.51Å; L354-V401 HydrophobicContact CD1-CG2 4.48Å; A397-V401 WeakPolarHBondContact O-CG2 3.44Å; A397-V401 PolarHBondContact O-N 3.17Å; L398-V401 PolarHBondContact O-N 3.07Å; R399-V401 VanDerWaalsContact C-N 3.3Å
402	C	92.1	Very high	93.5	Very high	24 Å²	24	45.5 Å²	45.5	16%	0.162	23%	0.233	C	C	.	.			trans	-106.5	94.8	-173.6	-63.3	0	0	0	0	109.7	L398 D404 V405	L398-C402 HydrophobicContact CD1-CB 4.46Å; L398-C402 PolarHBondContact O-N 3.08Å; C402-D404 VanDerWaalsContact C-N 3.35Å; C402-D404 PolarHBondContact O-N 2.95Å; C402-V405 HydrophobicContact CB-CB 3.85Å; C402-V405 HydrophobicContact CB-CG1 4.36Å; C402-V405 HydrophobicContact CB-CG2 4.48Å; C402-V405 WeakPolarHBondContact O-CB 3.49Å; C402-V405 WeakPolarHBondContact O-CG1 3.45Å; C402-V405 PolarHBondContact O-N 3.46Å
403	K	86.3	Confident	93	Very high	188 Å²	188	46.8 Å²	46.8	82%	0.817	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-44.2	-174.4	-68.9	-176.6	178.5	177.9	0	113.4	V405	K403-V405 VanDerWaalsContact C-N 3.33Å; K403-V405 PolarHBondContact O-N 2.9Å
404	D	85.9	Confident	92.3	Very high	157 Å²	157	49.9 Å²	49.9	84%	0.84	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	19.5	-173.6	-51.9	-71.1	0	0	0	113.5	C402 R406	C402-D404 VanDerWaalsContact C-N 3.35Å; C402-D404 PolarHBondContact O-N 2.95Å; D404-R406 PolarHBondContact O-N 2.89Å
405	V	93.6	Very high	91.3	Very high	15 Å²	15	51.5 Å²	51.5	9%	0.091	27%	0.267	C	S	.	.			trans	-67.6	124.4	-177.6	70.4	0	0	0	0	111.7	I382 L398 R399 C402 K403 I407	I382-V405 HydrophobicContact CG2-CG2 4.33Å; L398-V405 HydrophobicContact CD1-CG2 4.49Å; L398-V405 HydrophobicContact CD2-CG2 4.01Å; L398-V405 HydrophobicContact CG-CG1 4.2Å; L398-V405 HydrophobicContact CG-CG2 4.13Å; R399-V405 HydrophobicContact CB-CG1 4.49Å; R399-V405 HydrophobicContact CG-CG1 3.81Å; C402-V405 HydrophobicContact CB-CB 3.85Å; C402-V405 HydrophobicContact CB-CG1 4.36Å; C402-V405 HydrophobicContact CB-CG2 4.48Å; C402-V405 WeakPolarHBondContact O-CB 3.49Å; C402-V405 WeakPolarHBondContact O-CG1 3.45Å; C402-V405 PolarHBondContact O-N 3.46Å; K403-V405 VanDerWaalsContact C-N 3.33Å; K403-V405 PolarHBondContact O-N 2.9Å; V405-I407 HydrophobicContact CG1-CD1 4.21Å; V405-I407 HydrophobicContact CG2-CD1 4.38Å
406	R	94.8	Very high	90.2	Very high	61 Å²	61	60.3 Å²	60.3	23%	0.23	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	140.9	171.1	-54.1	-167.3	-63.5	-179.3	1.3	108.7	T383 G384 D404 P429 D431 D435	T383-R406 CarbonylContact C-O 3.51Å; T383-R406 WeakPolarHBondContact CA-O 3.49Å; T383-R406 HydrophobicContact CG2-CB 4.48Å; T383-R406 PolarHBondContact OG1-NE 2.83Å; G384-R406 PolarHBondContact N-O 3.03Å; D404-R406 PolarHBondContact O-N 2.89Å; R406-P429 HydrophobicContact CB-CG 3.95Å; R406-D431 IonicContact NH1-OD2 3.84Å; R406-D431 PolarHBondContact NH2-O 3.29Å; R406-D435 IonicContact CZ-OD2 3.59Å; R406-D435 IonicContact NE-OD2 2.75Å; R406-D435 PolarHBondContact NE-OD2 2.8Å; R406-D435 IonicContact NH2-OD1 2.74Å; R406-D435 PolarHBondContact NH2-OD1 3.42Å; R406-D435 VanDerWaalsContact NH2-OD1 3.12Å; R406-D435 IonicContact NH2-OD2 3.25Å; R406-D435 PolarHBondContact NH2-OD2 3.38Å
407	I	96.2	Very high	89	Confident	40 Å²	40	64.7 Å²	64.7	21%	0.205	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.6	177.1	-63.2	-59.8	0	0	0	110.7	G384 E395 L398 V405 K409 M440	G384-I407 CarbonylContact O-C 3.45Å; G384-I407 VanDerWaalsContact O-CA 3.31Å; G384-I407 WeakPolarHBondContact O-CA 3.37Å; E395-I407 HydrophobicContact CG-CD1 4.47Å; E395-I407 HydrophobicContact CG-CG2 4.18Å; L398-I407 HydrophobicContact CD2-CD1 4.06Å; V405-I407 HydrophobicContact CG1-CD1 4.21Å; V405-I407 HydrophobicContact CG2-CD1 4.38Å; I407-K409 HydrophobicContact CG2-CG 4.45Å; I407-M440 HydrophobicContact CD1-CE 4.4Å
408	G	95.9	Very high	87.7	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	159.9	162.5	0	0	0	0	0	111.8	G384 V385 S386 R427	G384-G408 PolarHBondContact O-N 3.49Å; V385-G408 WeakPolarHBondContact CA-O 3.46Å; S386-G408 PolarHBondContact N-O 3.08Å; G408-R427 CarbonylContact C-O 3.52Å; G408-R427 WeakPolarHBondContact CA-O 3.45Å
409	K	95.6	Very high	86.5	Confident	52 Å²	52	69.4 Å²	69.4	23%	0.226	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	137.8	177.1	-70.2	-171.5	166.9	-165.3	0	111	L388 E392 E395 I407 Y425 R427	L388-K409 HydrophobicContact CD1-CB 4.22Å; L388-K409 HydrophobicContact CD1-CD 4.27Å; L388-K409 HydrophobicContact CD2-CD 4.07Å; L388-K409 HydrophobicContact CD2-CG 4.29Å; L388-K409 HydrophobicContact CG-CB 4.42Å; E392-K409 IonicContact OE1-NZ 3.85Å; E392-K409 PolarHBondContact OE1-NZ 3.18Å; E392-K409 IonicContact OE2-NZ 3.47Å; E392-K409 PolarHBondContact OE2-NZ 3.32Å; E395-K409 WeakPolarHBondContact OE1-CE 3.29Å; E395-K409 IonicContact OE1-NZ 2.71Å; I407-K409 HydrophobicContact CG2-CG 4.45Å; K409-Y425 HydrophobicContact CB-CE1 4.42Å; K409-R427 PolarHBondContact N-O 2.81Å; K409-R427 PolarHBondContact O-N 2.8Å
410	I	93.6	Very high	85.4	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	124.7	176.8	-49.5	-175.4	0	0	0	107.6	V385 S386 I387 L388 I412 L423 Y425 L426 L428 A453 V456	V385-I410 HydrophobicContact CG1-CD1 3.59Å; V385-I410 HydrophobicContact CG1-CG1 3.69Å; S386-I410 PolarHBondContact O-N 2.85Å; I387-I410 WeakPolarHBondContact CA-O 3.19Å; L388-I410 PolarHBondContact N-O 2.74Å; I410-I412 HydrophobicContact CG2-CD1 3.84Å; I410-I412 HydrophobicContact CG2-CG1 3.91Å; I410-L423 HydrophobicContact CG2-CD1 3.39Å; I410-Y425 WeakPolarHBondContact CA-O 3.07Å; I410-L426 HydrophobicContact CD1-CD1 4.25Å; I410-L426 HydrophobicContact CG1-CD1 3.8Å; I410-L426 HydrophobicContact CG2-CD1 4.44Å; I410-L428 HydrophobicContact CD1-CD2 4.45Å; I410-L428 HydrophobicContact CG1-CD2 4.27Å; I410-A453 HydrophobicContact CD1-CB 4.08Å; I410-V456 HydrophobicContact CD1-CB 4.36Å; I410-V456 HydrophobicContact CD1-CG1 4.01Å
411	L	91.8	Very high	84.8	Confident	39 Å²	39	62 Å²	62	20%	0.204	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	112.9	171.3	-179.9	60.9	0	0	0	108.9	L388 Q413 H424 Y425	L388-L411 HydrophobicContact CB-CB 4.39Å; L388-L411 HydrophobicContact CB-CD1 3.81Å; L388-L411 HydrophobicContact CD1-CB 4.36Å; L411-Q413 HydrophobicContact CD1-CG 3.97Å; L411-Q413 HydrophobicContact CG-CG 4.21Å; L411-H424 HydrophobicContact CD2-CB 4.07Å; L411-H424 HydrophobicContact CG-CB 4.31Å; L411-H424 PolarHBondContact O-N 3.11Å; L411-Y425 PolarHBondContact N-O 3.41Å; L411-Y425 PolarHBondContact O-N 3.45Å
412	I	88.2	Confident	84.1	Confident	13 Å²	13	61 Å²	61	7%	0.067	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.8	171.3	-63.8	156.2	0	0	0	106.7	I410 P421 E422 L423 A449 M452 A453	I410-I412 HydrophobicContact CG2-CD1 3.84Å; I410-I412 HydrophobicContact CG2-CG1 3.91Å; I412-P421 HydrophobicContact CG2-CB 3.83Å; I412-E422 CarbonylContact C-O 3.55Å; I412-E422 VanDerWaalsContact CA-O 3.25Å; I412-E422 WeakPolarHBondContact CA-O 3.27Å; I412-L423 HydrophobicContact CG1-CD1 4.12Å; I412-A449 HydrophobicContact CB-CB 4.42Å; I412-A449 VanDerWaalsContact CD1-O 3.3Å; I412-A449 WeakPolarHBondContact CD1-O 3.45Å; I412-A449 HydrophobicContact CG2-CB 3.96Å; I412-M452 HydrophobicContact CD1-CB 3.88Å; I412-M452 HydrophobicContact CD1-CG 3.8Å; I412-M452 HydrophobicContact CD1-SD 4.22Å; I412-M452 HydrophobicContact CG1-CG 4.12Å; I412-M452 HydrophobicContact CG1-SD 3.9Å; I412-M452 HydrophobicContact CG2-SD 3.91Å; I412-A453 HydrophobicContact CD1-CB 3.89Å
413	Q	84.6	Confident	83.7	Confident	98 Å²	98	60.4 Å²	60.4	46%	0.458	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	166.5	174	-60.2	-177.3	-126.3	0	0	109.1	L411 P421 E422	L411-Q413 HydrophobicContact CD1-CG 3.97Å; L411-Q413 HydrophobicContact CG-CG 4.21Å; Q413-P421 CarbonylContact O-C 3.59Å; Q413-P421 VanDerWaalsContact O-CA 3.3Å; Q413-P421 WeakPolarHBondContact O-CA 3.48Å; Q413-E422 PolarHBondContact N-O 2.69Å; Q413-E422 PolarHBondContact O-N 3.1Å
414	T	79.9	Confident	83.4	Confident	69 Å²	69	54.5 Å²	54.5	42%	0.423	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	125.4	170	-61	0	0	0	0	107.4	R296 G419	R296-T414 VanDerWaalsContact NH1-CG2 3.25Å; R296-T414 PolarHBondContact NH2-OG1 3.41Å; T414-G419 WeakPolarHBondContact CG2-O 3.35Å
415	N	75.6	Confident	83.3	Confident	33 Å²	33	51.9 Å²	51.9	18%	0.176	26%	0.263	C	S	.	.			trans	-66.3	131.2	168	179.3	-38.3	0	0	0	108.2	D417 T418 G419 E420 E422	N415-D417 PolarHBondContact OD1-N 3.15Å; N415-T418 WeakPolarHBondContact CB-OG1 3.33Å; N415-T418 VanDerWaalsContact CG-OG1 3.27Å; N415-T418 PolarHBondContact OD1-N 2.91Å; N415-T418 VanDerWaalsContact OD1-N 3.12Å; N415-G419 WeakPolarHBondContact O-CA 3.23Å; N415-G419 PolarHBondContact O-N 2.89Å; N415-E420 PolarHBondContact N-O 3.21Å; N415-E422 HydrophobicContact CB-CG 4.27Å; N415-E422 WeakPolarHBondContact CB-OE1 3.47Å; N415-E422 PolarHBondContact ND2-OE1 3.44Å
416	Q	73.1	Confident	82.9	Confident	190 Å²	190	53.7 Å²	53.7	89%	0.888	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-26.7	-174.4	-68.2	-176.1	-34.2	0	0	112.9
417	D	68.9	Low	82.5	Confident	158 Å²	158	59.1 Å²	59.1	85%	0.845	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-45.4	-178.1	-52.7	-54.7	0	0	0	111.6	N415	N415-D417 PolarHBondContact OD1-N 3.15Å
418	T	67.8	Low	82.3	Confident	83 Å²	83	58.6 Å²	58.6	51%	0.509	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-18.1	179.9	67.8	0	0	0	0	113.2	N415 E420	N415-T418 WeakPolarHBondContact CB-OG1 3.33Å; N415-T418 VanDerWaalsContact CG-OG1 3.27Å; N415-T418 PolarHBondContact OD1-N 2.91Å; N415-T418 VanDerWaalsContact OD1-N 3.12Å; T418-E420 PolarHBondContact O-N 2.88Å; T418-E420 PolarHBondContact OG1-N 2.78Å
419	G	69.9	Low	82	Confident	28 Å²	28	59.6 Å²	59.6	29%	0.289	30%	0.296	S	S	.	.			trans	71.9	-5.1	-174.9	0	0	0	0	0	115.2	R296 T414 N415	R296-G419 WeakPolarHBondContact CD-O 3.15Å; R296-G419 PolarHBondContact NE-O 2.79Å; R296-G419 PolarHBondContact NH1-O 2.92Å; T414-G419 WeakPolarHBondContact CG2-O 3.35Å; N415-G419 WeakPolarHBondContact O-CA 3.23Å; N415-G419 PolarHBondContact O-N 2.89Å
420	E	73.3	Confident	81.3	Confident	15 Å²	15	66 Å²	66	7%	0.07	32%	0.324	C	S	.	.			trans	-85.3	159	-176	-71.7	-61.2	166.4	0	0	113.3	S294 V295 R296 N415 T418	S294-E420 VanDerWaalsContact C-OE1 3.25Å; S294-E420 WeakPolarHBondContact CA-OE1 3.24Å; S294-E420 WeakPolarHBondContact CB-OE1 3.3Å; S294-E420 PolarHBondContact OG-OE1 3.05Å; V295-E420 PolarHBondContact N-OE1 2.95Å; R296-E420 WeakPolarHBondContact CG-OE2 3.02Å; R296-E420 PolarHBondContact N-OE1 2.86Å; R296-E420 PolarHBondContact N-OE2 3.4Å; N415-E420 PolarHBondContact N-O 3.21Å; T418-E420 PolarHBondContact O-N 2.88Å; T418-E420 PolarHBondContact OG1-N 2.78Å
421	P	80.3	Confident	81	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.006	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	140.3	175.6	34.3	-33.9	0	0	0	111.4	P74 I412 Q413 A448 M452	P74-P421 HydrophobicContact CG-CG 3.97Å; I412-P421 HydrophobicContact CG2-CB 3.83Å; Q413-P421 CarbonylContact O-C 3.59Å; Q413-P421 VanDerWaalsContact O-CA 3.3Å; Q413-P421 WeakPolarHBondContact O-CA 3.48Å; P421-A448 HydrophobicContact CG-CB 4.13Å; P421-M452 HydrophobicContact CB-CE 4.42Å; P421-M452 HydrophobicContact CB-SD 4.47Å; P421-M452 HydrophobicContact CG-CE 4.17Å; P421-M452 WeakPolarHBondContact O-CE 3.27Å
422	E	79.9	Confident	81	Confident	17 Å²	17	67.8 Å²	67.8	8%	0.079	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.6	-179.9	-78.9	-174.1	-165.7	0	0	112.4	G71 R72 I412 Q413 N415 H424	G71-E422 WeakPolarHBondContact CA-OE2 3.33Å; G71-E422 PolarHBondContact N-OE2 3.5Å; R72-E422 VanDerWaalsContact O-CA 3.31Å; R72-E422 WeakPolarHBondContact O-CA 3.41Å; I412-E422 CarbonylContact C-O 3.55Å; I412-E422 VanDerWaalsContact CA-O 3.25Å; I412-E422 WeakPolarHBondContact CA-O 3.27Å; Q413-E422 PolarHBondContact N-O 2.69Å; Q413-E422 PolarHBondContact O-N 3.1Å; N415-E422 HydrophobicContact CB-CG 4.27Å; N415-E422 WeakPolarHBondContact CB-OE1 3.47Å; N415-E422 PolarHBondContact ND2-OE1 3.44Å; E422-H424 PolarHBondContact O-CD2 2.86Å; E422-H424 IonicContact OE2-CE1 3.01Å; E422-H424 PolarHBondContact OE2-CE1 3.01Å; E422-H424 IonicContact OE2-NE2 3Å
423	L	82.9	Confident	81.1	Confident	12 Å²	12	69.3 Å²	69.3	6%	0.063	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	111.5	172.8	177.4	69.9	0	0	0	110.9	G71 R72 W75 I410 I412 M452 V456	G71-L423 CarbonylContact C-O 3.55Å; G71-L423 VanDerWaalsContact CA-O 3.23Å; G71-L423 WeakPolarHBondContact CA-O 3.33Å; R72-L423 HydrophobicContact CB-CB 3.96Å; R72-L423 PolarHBondContact N-O 3.33Å; R72-L423 PolarHBondContact O-N 2.85Å; W75-L423 HydrophobicContact CH2-CD2 4.2Å; I410-L423 HydrophobicContact CG2-CD1 3.39Å; I412-L423 HydrophobicContact CG1-CD1 4.12Å; L423-M452 HydrophobicContact CB-SD 3.87Å; L423-V456 HydrophobicContact CD1-CG2 4.5Å; L423-V456 HydrophobicContact CD2-CG2 3.89Å
424	H	79.6	Confident	81.3	Confident	63 Å²	63	68.2 Å²	68.2	29%	0.292	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-27.1	179.3	-60.1	-94.2	0	0	0	113.9	T69 G71 L411 E422	T69-H424 PolarHBondContact O-CE1 2.9Å; T69-H424 PolarHBondContact O-ND1 3.23Å; G71-H424 PolarHBondContact N-CE1 2.76Å; G71-H424 VanDerWaalsContact N-CE1 3.28Å; G71-H424 PolarHBondContact N-ND1 3.38Å; L411-H424 HydrophobicContact CD2-CB 4.07Å; L411-H424 HydrophobicContact CG-CB 4.31Å; L411-H424 PolarHBondContact O-N 3.11Å; E422-H424 PolarHBondContact O-CD2 2.86Å; E422-H424 IonicContact OE2-CE1 3.01Å; E422-H424 PolarHBondContact OE2-CE1 3.01Å; E422-H424 IonicContact OE2-NE2 3Å
425	Y	83.1	Confident	81.9	Confident	103 Å²	103	65 Å²	65	40%	0.404	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	141.5	-179.1	175	-91.8	0	0	0	112.5	K409 I410 L411 R427	K409-Y425 HydrophobicContact CB-CE1 4.42Å; I410-Y425 WeakPolarHBondContact CA-O 3.07Å; L411-Y425 PolarHBondContact N-O 3.41Å; L411-Y425 PolarHBondContact O-N 3.45Å; Y425-R427 HydrophobicContact CE1-CB 3.79Å; Y425-R427 VanDerWaalsContact OH-CD 3.23Å; Y425-R427 WeakPolarHBondContact OH-CD 3.08Å
426	L	85.8	Confident	82.9	Confident	52 Å²	52	64.4 Å²	64.4	27%	0.272	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	126.9	-178.9	-177.8	57	0	0	0	111	I410 L428 V456	I410-L426 HydrophobicContact CD1-CD1 4.25Å; I410-L426 HydrophobicContact CG1-CD1 3.8Å; I410-L426 HydrophobicContact CG2-CD1 4.44Å; L426-L428 HydrophobicContact CD1-CD1 3.94Å; L426-L428 HydrophobicContact CD1-CD2 4.21Å; L426-L428 HydrophobicContact CD1-CG 3.7Å; L426-L428 HydrophobicContact CG-CG 4.47Å; L426-V456 HydrophobicContact CD1-CG1 3.55Å; L426-V456 HydrophobicContact CD2-CG1 3.73Å; L426-V456 HydrophobicContact CG-CG1 4.31Å
427	R	87.6	Confident	84	Confident	176 Å²	176	55.3 Å²	55.3	66%	0.664	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.6	99.6	171.3	-177.5	173.3	177.1	175.6	-0.9	110.6	G408 K409 Y425	G408-R427 CarbonylContact C-O 3.52Å; G408-R427 WeakPolarHBondContact CA-O 3.45Å; K409-R427 PolarHBondContact N-O 2.81Å; K409-R427 PolarHBondContact O-N 2.8Å; Y425-R427 HydrophobicContact CE1-CB 3.79Å; Y425-R427 VanDerWaalsContact OH-CD 3.23Å; Y425-R427 WeakPolarHBondContact OH-CD 3.08Å
428	L	90.3	Very high	85.4	Confident	28 Å²	28	47.8 Å²	47.8	15%	0.147	23%	0.234	C	C	.	.			trans	-109.9	157.2	176.7	-58.7	179.3	0	0	0	111.4	V385 I410 L426 I432 V456 L457 H460	V385-L428 HydrophobicContact CG1-CD2 3.97Å; V385-L428 HydrophobicContact CG2-CD2 3.98Å; I410-L428 HydrophobicContact CD1-CD2 4.45Å; I410-L428 HydrophobicContact CG1-CD2 4.27Å; L426-L428 HydrophobicContact CD1-CD1 3.94Å; L426-L428 HydrophobicContact CD1-CD2 4.21Å; L426-L428 HydrophobicContact CD1-CG 3.7Å; L426-L428 HydrophobicContact CG-CG 4.47Å; L428-I432 HydrophobicContact CB-CD1 4.28Å; L428-I432 HydrophobicContact CD1-CD1 4.21Å; L428-I432 HydrophobicContact CD2-CD1 4.16Å; L428-I432 HydrophobicContact CG-CD1 4.44Å; L428-V456 HydrophobicContact CD1-CG1 4.28Å; L428-L457 HydrophobicContact CD1-CD2 4.07Å; L428-H460 HydrophobicContact CD1-CB 4.45Å
429	P	90.1	Very high	86.9	Confident	22 Å²	22	43.9 Å²	43.9	14%	0.143	21%	0.21	C	C	.	.			trans	-57.5	144.4	165.8	-23.9	35.4	0	0	0	111.9	T383 R406 D431 I432	T383-P429 HydrophobicContact CG2-CG 3.88Å; R406-P429 HydrophobicContact CB-CG 3.95Å; P429-D431 PolarHBondContact O-N 3.19Å; P429-I432 PolarHBondContact O-N 2.88Å
430	K	81.8	Confident	88.2	Confident	187 Å²	187	42.5 Å²	42.5	81%	0.813	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-25.5	-175.4	-69.5	-174.6	176.7	-177.9	0	114.4
431	D	86.6	Confident	89.3	Confident	73 Å²	73	42.6 Å²	42.6	39%	0.39	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.2	50.4	-173.6	-24.6	-69.6	0	0	0	109.3	R381 R406 P429	R381-D431 PolarHBondContact NH2-O 2.89Å; R406-D431 IonicContact NH1-OD2 3.84Å; R406-D431 PolarHBondContact NH2-O 3.29Å; P429-D431 PolarHBondContact O-N 3.19Å
432	I	91.9	Very high	89.9	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.015	20%	0.197	C	C	.	.			trans	-79.7	-25.9	-178.6	-169.2	172.9	0	0	0	113	T383 V385 L428 P429 E434 D435 V437 L457 H460 V462	T383-I432 HydrophobicContact CG2-CD1 4Å; T383-I432 HydrophobicContact CG2-CG1 4.26Å; V385-I432 HydrophobicContact CG2-CD1 4.01Å; L428-I432 HydrophobicContact CB-CD1 4.28Å; L428-I432 HydrophobicContact CD1-CD1 4.21Å; L428-I432 HydrophobicContact CD2-CD1 4.16Å; L428-I432 HydrophobicContact CG-CD1 4.44Å; P429-I432 PolarHBondContact O-N 2.88Å; I432-E434 PolarHBondContact O-N 3.02Å; I432-E434 VanDerWaalsContact O-N 3.1Å; I432-D435 WeakPolarHBondContact O-CB 3.31Å; I432-D435 PolarHBondContact O-N 3.47Å; I432-V437 HydrophobicContact CD1-CG2 3.96Å; I432-V437 HydrophobicContact CG1-CG2 3.8Å; I432-L457 HydrophobicContact CD1-CD2 3.71Å; I432-H460 HydrophobicContact CG2-CB 4.07Å; I432-V462 HydrophobicContact CB-CG2 4.44Å; I432-V462 HydrophobicContact CD1-CG2 4.45Å; I432-V462 HydrophobicContact CG1-CG2 4.01Å; I432-V462 HydrophobicContact CG2-CG2 3.95Å
433	S	90.6	Very high	90.5	Very high	44 Å²	44	43.7 Å²	43.7	31%	0.308	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-27.9	-177.7	47.8	0	0	0	0	115	D461	S433-D461 WeakPolarHBondContact CB-O 3.42Å
434	E	88.2	Confident	91	Very high	76 Å²	76	43.3 Å²	43.3	36%	0.355	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-21.9	-179.7	-52.6	-178.6	108.1	0	0	113.5	K380 R381 I432 K466	K380-E434 HydrophobicContact CD-CB 3.87Å; K380-E434 HydrophobicContact CD-CG 4.36Å; K380-E434 WeakPolarHBondContact CD-OE2 3.48Å; K380-E434 WeakPolarHBondContact CE-OE2 3.05Å; K380-E434 IonicContact NZ-OE1 3.25Å; K380-E434 PolarHBondContact NZ-OE1 2.86Å; K380-E434 IonicContact NZ-OE2 2.66Å; K380-E434 PolarHBondContact NZ-OE2 2.82Å; R381-E434 IonicContact NH2-OE2 2.65Å; R381-E434 PolarHBondContact NH2-OE2 3.43Å; R381-E434 VanDerWaalsContact NH2-OE2 3.08Å; I432-E434 PolarHBondContact O-N 3.02Å; I432-E434 VanDerWaalsContact O-N 3.1Å; E434-K466 PolarHBondContact O-NZ 2.87Å
435	D	93.3	Very high	91.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	-83	159.9	-169.2	-73.1	26.2	0	0	0	112.3	R381 T383 R406 I432	R381-D435 WeakPolarHBondContact CB-OD2 3.48Å; R381-D435 IonicContact CZ-OD1 3.7Å; R381-D435 IonicContact NE-OD1 3.3Å; R381-D435 PolarHBondContact NE-OD1 2.85Å; R381-D435 IonicContact NE-OD2 2.71Å; R381-D435 PolarHBondContact NE-OD2 2.91Å; R381-D435 IonicContact NH2-OD1 3.37Å; R381-D435 PolarHBondContact NH2-OD1 3.32Å; T383-D435 PolarHBondContact OG1-OD2 3.35Å; R406-D435 IonicContact CZ-OD2 3.59Å; R406-D435 IonicContact NE-OD2 2.75Å; R406-D435 PolarHBondContact NE-OD2 2.8Å; R406-D435 IonicContact NH2-OD1 2.74Å; R406-D435 PolarHBondContact NH2-OD1 3.42Å; R406-D435 VanDerWaalsContact NH2-OD1 3.12Å; R406-D435 IonicContact NH2-OD2 3.25Å; R406-D435 PolarHBondContact NH2-OD2 3.38Å; I432-D435 WeakPolarHBondContact O-CB 3.31Å; I432-D435 PolarHBondContact O-N 3.47Å
436	H	95.4	Very high	91.4	Very high	21 Å²	21	37.2 Å²	37.2	10%	0.097	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	131	159.9	-70.2	-96.3	0	0	0	109.5	L357 F377 R381 I382 T383	L357-H436 HydrophobicContact CD2-CB 3.61Å; F377-H436 AromaticContact CZ-CD2 3.89Å; R381-H436 PolarHBondContact O-N 3.46Å; I382-H436 WeakPolarHBondContact CA-O 3.19Å; T383-H436 PolarHBondContact N-O 3.08Å
437	V	97.6	Very high	91.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.1	-172.3	-179.6	0	0	0	0	110.8	T383 V385 I432 L457 V462 K466 L468	T383-V437 CarbonylContact O-C 3.54Å; T383-V437 VanDerWaalsContact O-CA 3.32Å; T383-V437 WeakPolarHBondContact O-CA 3.43Å; V385-V437 HydrophobicContact CB-CG1 4.14Å; V385-V437 HydrophobicContact CG2-CG1 3.63Å; I432-V437 HydrophobicContact CD1-CG2 3.96Å; I432-V437 HydrophobicContact CG1-CG2 3.8Å; V437-L457 HydrophobicContact CB-CD1 4.48Å; V437-L457 HydrophobicContact CG1-CD1 3.7Å; V437-L457 HydrophobicContact CG1-CD2 4.07Å; V437-V462 HydrophobicContact CG2-CG1 3.87Å; V437-V462 HydrophobicContact CG2-CG2 4.41Å; V437-K466 PolarHBondContact N-O 2.78Å; V437-L468 PolarHBondContact O-N 3.33Å
438	I	97.9	Very high	91.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	97.5	171.5	-59.4	177.9	0	0	0	107.5	I350 L354 I382 T383 G384 V385 L398 M440 L468 V470	I350-I438 HydrophobicContact CD1-CG2 4.39Å; L354-I438 HydrophobicContact CD2-CD1 3.87Å; I382-I438 HydrophobicContact CG2-CD1 3.7Å; I382-I438 HydrophobicContact CG2-CG1 4.09Å; T383-I438 PolarHBondContact O-N 2.82Å; G384-I438 CarbonylContact C-O 3.47Å; G384-I438 WeakPolarHBondContact CA-O 3.49Å; V385-I438 PolarHBondContact N-O 2.73Å; L398-I438 HydrophobicContact CD1-CD1 3.9Å; L398-I438 HydrophobicContact CD2-CB 4.49Å; I438-M440 HydrophobicContact CG2-CG 3.92Å; I438-M440 HydrophobicContact CG2-SD 4.49Å; I438-L468 HydrophobicContact CG1-CD1 4.34Å; I438-V470 HydrophobicContact CG2-CB 4.33Å; I438-V470 HydrophobicContact CG2-CG2 3.81Å
439	L	98.1	Very high	91.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	117.7	177.5	-179.9	60	0	0	0	109.1	V385 I387 A453 V454 L457 I467 L468 L469 V470	V385-L439 HydrophobicContact CB-CD1 4.14Å; V385-L439 HydrophobicContact CG1-CD1 3.89Å; I387-L439 HydrophobicContact CD1-CD1 4.03Å; I387-L439 HydrophobicContact CD1-CG 4.33Å; I387-L439 HydrophobicContact CG1-CD1 3.78Å; L439-A453 HydrophobicContact CD1-CB 3.9Å; L439-A453 HydrophobicContact CD2-CB 3.93Å; L439-V454 HydrophobicContact CD2-CG2 3.7Å; L439-L457 HydrophobicContact CD2-CD1 4.3Å; L439-I467 HydrophobicContact CB-CG2 4.32Å; L439-L468 PolarHBondContact N-O 3.13Å; L439-L469 HydrophobicContact CB-CD1 4.39Å; L439-L469 HydrophobicContact CD2-CD1 4Å; L439-L469 HydrophobicContact CG-CD1 3.97Å; L439-V470 PolarHBondContact O-N 2.79Å
440	M	97.6	Very high	91.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.8	-169.6	-61.7	-180	-62.2	0	0	111.7	I350 V385 I387 G391 M394 E395 L398 I407 I438	I350-M440 HydrophobicContact CD1-SD 4.37Å; V385-M440 PolarHBondContact O-N 3.19Å; I387-M440 PolarHBondContact N-O 3.23Å; G391-M440 WeakPolarHBondContact CA-O 3.33Å; M394-M440 HydrophobicContact CB-CB 4.23Å; M394-M440 HydrophobicContact CB-CG 4.38Å; M394-M440 HydrophobicContact CB-SD 3.75Å; M394-M440 HydrophobicContact CE-CB 4.49Å; M394-M440 HydrophobicContact CE-CG 4.5Å; M394-M440 HydrophobicContact SD-CB 4.01Å; E395-M440 HydrophobicContact CG-CE 3.95Å; L398-M440 HydrophobicContact CB-SD 4.13Å; L398-M440 HydrophobicContact CD2-CE 3.95Å; L398-M440 HydrophobicContact CD2-SD 3.68Å; I407-M440 HydrophobicContact CD1-CE 4.4Å; I438-M440 HydrophobicContact CG2-CG 3.92Å; I438-M440 HydrophobicContact CG2-SD 4.49Å
441	D	95.9	Very high	91.7	Very high	17 Å²	17	16.7 Å²	16.7	9%	0.091	10%	0.098	C	C	.	.			trans	-152.6	138.4	167.7	-170.5	2.4	0	0	0	109.7	I387 T443 V470 S471	I387-D441 HydrophobicContact CB-CB 4.08Å; I387-D441 HydrophobicContact CD1-CB 4.08Å; I387-D441 HydrophobicContact CG1-CB 4.37Å; D441-T443 PolarHBondContact O-N 3.17Å; D441-V470 PolarHBondContact N-O 3.48Å; D441-S471 WeakPolarHBondContact O-CA 3.35Å; D441-S471 WeakPolarHBondContact O-CB 3.43Å; D441-S471 PolarHBondContact O-OG 3.21Å
442	C	93.8	Very high	91.8	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	8%	0.08	C	C	.	.	S	Bend	trans	-76.7	-24.4	-172	-66.7	0	0	0	0	114.3	A390 T393 S471 L472 L473 F513	A390-C442 HydrophobicContact CB-CB 4.14Å; A390-C442 PolarHBondContact O-SG 3.12Å; A390-C442 VanDerWaalsContact O-SG 3.33Å; T393-C442 PolarHBondContact OG1-SG 2.83Å; C442-S471 PolarHBondContact O-OG 3.15Å; C442-S471 VanDerWaalsContact O-OG 3.11Å; C442-L472 HydrophobicContact CB-CD1 4.37Å; C442-L472 PolarHBondContact O-N 3.18Å; C442-L473 PolarHBondContact O-N 3.18Å; C442-F513 HydrophobicContact CB-CB 4.16Å; C442-F513 HydrophobicContact CB-CD1 3.4Å; C442-F513 VanDerWaalsContact CB-CD1 3.4Å; C442-F513 HydrophobicContact CB-CD2 4.24Å; C442-F513 HydrophobicContact CB-CE1 3.88Å; C442-F513 HydrophobicContact CB-CG 3.63Å; C442-F513 HydrophobicContact CB-CZ 4.45Å; C442-F513 WeakPolarHBondContact SG-CE1 3.47Å
443	T	92.8	Very high	91.8	Very high	40 Å²	40	13 Å²	13	25%	0.245	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	112.9	-175.3	47.4	0	0	0	0	112.4	D441 S471 L473 I510 F513	D441-T443 PolarHBondContact O-N 3.17Å; T443-S471 PolarHBondContact N-OG 3.07Å; T443-L473 WeakPolarHBondContact CA-O 3.28Å; T443-I510 HydrophobicContact CG2-CD1 3.61Å; T443-I510 HydrophobicContact CG2-CG1 3.9Å; T443-F513 HydrophobicContact CG2-CB 3.97Å
444	V	92.2	Very high	91.9	Very high	5 Å²	5	11 Å²	11	3%	0.03	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	102.4	177.9	-174.2	0	0	0	0	110.4	A450 L473 M474 A475	V444-A450 HydrophobicContact CG1-CB 4.22Å; V444-L473 PolarHBondContact N-O 3.24Å; V444-M474 HydrophobicContact CB-CB 4.32Å; V444-M474 HydrophobicContact CB-CG 3.98Å; V444-M474 HydrophobicContact CG2-CE 4.29Å; V444-M474 HydrophobicContact CG2-CG 4.26Å; V444-M474 CarbonylContact O-C 3.55Å; V444-M474 WeakPolarHBondContact O-CA 3.45Å; V444-A475 PolarHBondContact O-N 3.25Å
445	S	88.6	Confident	92	Very high	29 Å²	29	8.7 Å²	8.7	20%	0.203	5%	0.052	C	C	.	.	S	Bend	trans	-89.3	-75.2	-178.8	60.4	0	0	0	0	113.5	G478 F504	S445-G478 WeakPolarHBondContact O-CA 3.42Å; S445-G478 PolarHBondContact O-N 3.27Å; S445-F504 WeakPolarHBondContact CB-O 3.37Å; S445-F504 PolarHBondContact OG-O 3.04Å
446	T	84.3	Confident	91.7	Very high	8 Å²	8	8.8 Å²	8.8	5%	0.049	5%	0.053	C	C	.	.	S	Bend	trans	-84.4	-11	177.8	56.2	0	0	0	0	113.6	A448 M477 S481 F504	T446-A448 PolarHBondContact O-N 2.6Å; T446-A448 WeakPolarHBondContact OG1-CB 3.09Å; T446-A448 PolarHBondContact OG1-N 3.4Å; T446-M477 HydrophobicContact CG2-CE 3.9Å; T446-S481 WeakPolarHBondContact O-CB 3.49Å; T446-S481 PolarHBondContact O-OG 3Å; T446-S481 VanDerWaalsContact O-OG 3.04Å; T446-F504 HydrophobicContact CG2-CB 3.76Å; T446-F504 HydrophobicContact CG2-CD1 3.45Å; T446-F504 VanDerWaalsContact CG2-CD1 3.45Å; T446-F504 HydrophobicContact CG2-CE1 4.23Å; T446-F504 HydrophobicContact CG2-CG 3.81Å
447	G	85.8	Confident	91.6	Very high	3 Å²	3	7.8 Å²	7.8	3%	0.031	5%	0.049	C	C	.	.	S	Bend	trans	80	-12.8	-171.3	0	0	0	0	0	114.5	A449 A450 M451	G447-A449 PolarHBondContact O-N 2.87Å; G447-A450 WeakPolarHBondContact O-CB 3.15Å; G447-A450 PolarHBondContact O-N 2.83Å; G447-M451 PolarHBondContact O-N 3.41Å
448	A	85	Confident	91.2	Very high	1 Å²	1	9.5 Å²	9.5	1%	0.008	6%	0.057	C	C	.	.	H	α-helix	trans	-57.2	-45.6	-168.4	0	0	0	0	0	114.4	Y76 R296 P421 T446 M452	Y76-A448 PolarHBondContact OH-O 2.72Å; R296-A448 HydrophobicContact CG-CB 4.1Å; P421-A448 HydrophobicContact CG-CB 4.13Å; T446-A448 PolarHBondContact O-N 2.6Å; T446-A448 WeakPolarHBondContact OG1-CB 3.09Å; T446-A448 PolarHBondContact OG1-N 3.4Å; A448-M452 PolarHBondContact O-N 2.83Å; A448-M452 VanDerWaalsContact O-N 3.08Å
449	A	89.1	Confident	90.5	Very high	26 Å²	26	9.9 Å²	9.9	22%	0.215	6%	0.06	C	C	.	.	H	α-helix	trans	-69.8	-36.6	176.5	0	0	0	0	0	112.6	I412 G447 M452 A453	I412-A449 HydrophobicContact CB-CB 4.42Å; I412-A449 VanDerWaalsContact CD1-O 3.3Å; I412-A449 WeakPolarHBondContact CD1-O 3.45Å; I412-A449 HydrophobicContact CG2-CB 3.96Å; G447-A449 PolarHBondContact O-N 2.87Å; A449-M452 PolarHBondContact O-N 2.94Å; A449-A453 WeakPolarHBondContact O-CB 3.24Å; A449-A453 PolarHBondContact O-N 3.41Å
450	A	92.3	Very high	90	Very high	2 Å²	2	11 Å²	11	2%	0.017	7%	0.065	C	C	.	.	H	α-helix	trans	-65	-42	175.7	0	0	0	0	0	111.4	V444 G447 A453 V454 L469 V482	V444-A450 HydrophobicContact CG1-CB 4.22Å; G447-A450 WeakPolarHBondContact O-CB 3.15Å; G447-A450 PolarHBondContact O-N 2.83Å; A450-A453 PolarHBondContact O-N 3.03Å; A450-V454 WeakPolarHBondContact O-CG2 3.47Å; A450-V454 PolarHBondContact O-N 3.34Å; A450-L469 HydrophobicContact CB-CD1 4.15Å; A450-L469 HydrophobicContact CB-CD2 3.92Å; A450-V482 HydrophobicContact CB-CG2 3.98Å
451	M	89.5	Confident	89.5	Confident	2 Å²	2	13.9 Å²	13.9	1%	0.01	8%	0.08	C	C	.	.	H	α-helix	trans	-65.5	-42.4	176.3	-72	-171.9	-68.1	0	0	112.8	Y76 L299 G447 A453 V454 R455 S481 V482 A485 F486	Y76-M451 HydrophobicContact CE2-CB 4.05Å; L299-M451 HydrophobicContact CD1-CE 3.31Å; L299-M451 HydrophobicContact CD2-CE 3.82Å; L299-M451 HydrophobicContact CD2-SD 4.48Å; L299-M451 HydrophobicContact CG-CE 4.2Å; G447-M451 PolarHBondContact O-N 3.41Å; M451-A453 VanDerWaalsContact C-N 3.31Å; M451-A453 PolarHBondContact O-N 2.84Å; M451-V454 PolarHBondContact O-N 2.67Å; M451-R455 WeakPolarHBondContact O-CB 3.02Å; M451-R455 PolarHBondContact O-N 3.27Å; M451-S481 VanDerWaalsContact SD-O 3.39Å; M451-V482 HydrophobicContact CG-CB 4.42Å; M451-V482 HydrophobicContact CG-CG2 3.8Å; M451-A485 HydrophobicContact CG-CB 4.41Å; M451-A485 HydrophobicContact SD-CB 3.62Å; M451-F486 HydrophobicContact CB-CE2 3.88Å; M451-F486 HydrophobicContact CG-CD2 4.26Å; M451-F486 HydrophobicContact CG-CE2 3.91Å
452	M	87.2	Confident	89.4	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-60.1	-42	172.6	179	168.2	-79.4	0	0	111.4	R72 P74 W75 Y76 I412 P421 L423 A448 A449 R455 V456	R72-M452 WeakPolarHBondContact O-CE 3.37Å; P74-M452 HydrophobicContact CG-CE 4.17Å; W75-M452 HydrophobicContact CE3-CE 4.44Å; W75-M452 HydrophobicContact CH2-CG 4.09Å; W75-M452 HydrophobicContact CZ3-CE 3.85Å; W75-M452 HydrophobicContact CZ3-CG 4.2Å; W75-M452 HydrophobicContact CZ3-SD 4.31Å; Y76-M452 HydrophobicContact CE1-CB 4Å; Y76-M452 HydrophobicContact CE1-CE 4.14Å; Y76-M452 HydrophobicContact CE1-CG 4.35Å; Y76-M452 WeakPolarHBondContact OH-CB 3.46Å; Y76-M452 PolarHBondContact OH-N 3.28Å; I412-M452 HydrophobicContact CD1-CB 3.88Å; I412-M452 HydrophobicContact CD1-CG 3.8Å; I412-M452 HydrophobicContact CD1-SD 4.22Å; I412-M452 HydrophobicContact CG1-CG 4.12Å; I412-M452 HydrophobicContact CG1-SD 3.9Å; I412-M452 HydrophobicContact CG2-SD 3.91Å; P421-M452 HydrophobicContact CB-CE 4.42Å; P421-M452 HydrophobicContact CB-SD 4.47Å; P421-M452 HydrophobicContact CG-CE 4.17Å; P421-M452 WeakPolarHBondContact O-CE 3.27Å; L423-M452 HydrophobicContact CB-SD 3.87Å; A448-M452 PolarHBondContact O-N 2.83Å; A448-M452 VanDerWaalsContact O-N 3.08Å; A449-M452 PolarHBondContact O-N 2.94Å; M452-R455 PolarHBondContact O-N 3.43Å; M452-V456 VanDerWaalsContact O-CG2 3.32Å; M452-V456 WeakPolarHBondContact O-CG2 3.41Å; M452-V456 PolarHBondContact O-N 2.99Å
453	A	92.9	Very high	89.4	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-66.8	-39.9	177.2	0	0	0	0	0	113	I387 I410 I412 L439 A449 A450 M451 V456 L457	I387-A453 HydrophobicContact CD1-CB 3.55Å; I387-A453 HydrophobicContact CG1-CB 3.92Å; I410-A453 HydrophobicContact CD1-CB 4.08Å; I412-A453 HydrophobicContact CD1-CB 3.89Å; L439-A453 HydrophobicContact CD1-CB 3.9Å; L439-A453 HydrophobicContact CD2-CB 3.93Å; A449-A453 WeakPolarHBondContact O-CB 3.24Å; A449-A453 PolarHBondContact O-N 3.41Å; A450-A453 PolarHBondContact O-N 3.03Å; M451-A453 VanDerWaalsContact C-N 3.31Å; M451-A453 PolarHBondContact O-N 2.84Å; A453-V456 PolarHBondContact O-N 2.65Å; A453-L457 WeakPolarHBondContact O-CG 3.28Å; A453-L457 PolarHBondContact O-N 3.38Å
454	V	93.5	Very high	89.4	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.8	-46.7	171.3	173	0	0	0	0	110.4	L439 A450 M451 V456 L457 L458 I467 F486 V489	L439-V454 HydrophobicContact CD2-CG2 3.7Å; A450-V454 WeakPolarHBondContact O-CG2 3.47Å; A450-V454 PolarHBondContact O-N 3.34Å; M451-V454 PolarHBondContact O-N 2.67Å; V454-V456 VanDerWaalsContact C-N 3.31Å; V454-V456 PolarHBondContact O-N 3.38Å; V454-L457 WeakPolarHBondContact O-CA 3.1Å; V454-L457 WeakPolarHBondContact O-CB 3.22Å; V454-L457 PolarHBondContact O-N 3.12Å; V454-L458 HydrophobicContact CG1-CD1 4.35Å; V454-L458 HydrophobicContact CG1-CG 4.43Å; V454-L458 WeakPolarHBondContact O-CG 3.41Å; V454-L458 PolarHBondContact O-N 2.99Å; V454-I467 HydrophobicContact CG1-CD1 4.1Å; V454-I467 HydrophobicContact CG2-CG2 4.37Å; V454-F486 HydrophobicContact CB-CD2 3.97Å; V454-F486 HydrophobicContact CB-CE2 3.91Å; V454-F486 HydrophobicContact CB-CG 4.42Å; V454-F486 HydrophobicContact CB-CZ 4.31Å; V454-F486 HydrophobicContact CG1-CB 4.21Å; V454-F486 HydrophobicContact CG1-CD1 3.71Å; V454-F486 HydrophobicContact CG1-CD2 3.61Å; V454-F486 HydrophobicContact CG1-CE1 3.92Å; V454-F486 HydrophobicContact CG1-CE2 3.81Å; V454-F486 HydrophobicContact CG1-CG 3.55Å; V454-F486 HydrophobicContact CG1-CZ 3.96Å; V454-F486 HydrophobicContact CG2-CD2 4.49Å; V454-V489 HydrophobicContact CG1-CG2 4.01Å; V454-V489 HydrophobicContact CG2-CG2 4.43Å
455	R	88.7	Confident	89.6	Confident	28 Å²	28	21.9 Å²	21.9	11%	0.106	11%	0.114	C	C	.	.	H	α-helix	trans	-58.4	-41.6	178	-176.1	66.8	-139.5	-156	-3.4	112.6	W75 Y76 G80 M451 M452 L457 L458 D459 F486	W75-R455 HydrophobicContact CZ2-CB 4.4Å; W75-R455 HydrophobicContact CZ2-CG 3.83Å; Y76-R455 HydrophobicContact CD1-CB 4.06Å; Y76-R455 HydrophobicContact CD1-CG 3.85Å; Y76-R455 HydrophobicContact CE1-CB 4.44Å; Y76-R455 HydrophobicContact CG-CB 4.42Å; Y76-R455 HydrophobicContact CG-CG 4.17Å; G80-R455 PolarHBondContact O-NH1 3.24Å; M451-R455 WeakPolarHBondContact O-CB 3.02Å; M451-R455 PolarHBondContact O-N 3.27Å; M452-R455 PolarHBondContact O-N 3.43Å; R455-L457 VanDerWaalsContact C-N 3.29Å; R455-L457 PolarHBondContact O-N 3.03Å; R455-L458 PolarHBondContact O-N 2.91Å; R455-D459 IonicContact CZ-OD1 3.52Å; R455-D459 VanDerWaalsContact CZ-OD1 3.25Å; R455-D459 IonicContact NE-OD1 3.57Å; R455-D459 PolarHBondContact NE-OD1 3.39Å; R455-D459 IonicContact NE-OD2 2.75Å; R455-D459 IonicContact NH2-OD1 3.36Å; R455-D459 PolarHBondContact NH2-OD1 3.29Å; R455-D459 PolarHBondContact O-N 3.16Å; R455-F486 HydrophobicContact CB-CZ 4.37Å
456	V	88.1	Confident	89.9	Confident	3 Å²	3	22.2 Å²	22.2	2%	0.018	11%	0.112	C	C	.	.	H	α-helix	trans	-59.6	-38	173.8	168.2	0	0	0	0	112	W75 I410 L423 L426 L428 M452 A453 V454 H460	W75-V456 HydrophobicContact CH2-CG2 3.58Å; W75-V456 HydrophobicContact CZ2-CG2 3.83Å; I410-V456 HydrophobicContact CD1-CB 4.36Å; I410-V456 HydrophobicContact CD1-CG1 4.01Å; L423-V456 HydrophobicContact CD1-CG2 4.5Å; L423-V456 HydrophobicContact CD2-CG2 3.89Å; L426-V456 HydrophobicContact CD1-CG1 3.55Å; L426-V456 HydrophobicContact CD2-CG1 3.73Å; L426-V456 HydrophobicContact CG-CG1 4.31Å; L428-V456 HydrophobicContact CD1-CG1 4.28Å; M452-V456 VanDerWaalsContact O-CG2 3.32Å; M452-V456 WeakPolarHBondContact O-CG2 3.41Å; M452-V456 PolarHBondContact O-N 2.99Å; A453-V456 PolarHBondContact O-N 2.65Å; V454-V456 VanDerWaalsContact C-N 3.31Å; V454-V456 PolarHBondContact O-N 3.38Å; V456-H460 PolarHBondContact O-CD2 3.06Å; V456-H460 VanDerWaalsContact O-CD2 3.23Å; V456-H460 PolarHBondContact O-N 3.13Å
457	L	92.2	Very high	90.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-67.9	-41.4	176	-64.6	169.1	0	0	0	111.7	V385 L428 I432 V437 L439 A453 V454 R455 D459 H460 V462 I467	V385-L457 HydrophobicContact CG2-CD2 4.25Å; L428-L457 HydrophobicContact CD1-CD2 4.07Å; I432-L457 HydrophobicContact CD1-CD2 3.71Å; V437-L457 HydrophobicContact CB-CD1 4.48Å; V437-L457 HydrophobicContact CG1-CD1 3.7Å; V437-L457 HydrophobicContact CG1-CD2 4.07Å; L439-L457 HydrophobicContact CD2-CD1 4.3Å; A453-L457 WeakPolarHBondContact O-CG 3.28Å; A453-L457 PolarHBondContact O-N 3.38Å; V454-L457 WeakPolarHBondContact O-CA 3.1Å; V454-L457 WeakPolarHBondContact O-CB 3.22Å; V454-L457 PolarHBondContact O-N 3.12Å; R455-L457 VanDerWaalsContact C-N 3.29Å; R455-L457 PolarHBondContact O-N 3.03Å; L457-D459 PolarHBondContact O-N 3.07Å; L457-H460 CarbonylContact O-C 3.57Å; L457-H460 WeakPolarHBondContact O-CA 3.46Å; L457-H460 WeakPolarHBondContact O-CB 3.5Å; L457-H460 PolarHBondContact O-N 3.46Å; L457-H460 VanDerWaalsContact O-N 3.08Å; L457-V462 HydrophobicContact CB-CB 4.11Å; L457-V462 HydrophobicContact CB-CG2 4.15Å; L457-V462 HydrophobicContact CD2-CG2 4.36Å; L457-V462 VanDerWaalsContact O-CB 3.26Å; L457-V462 WeakPolarHBondContact O-CB 3.5Å; L457-V462 VanDerWaalsContact O-CG2 3.31Å; L457-V462 WeakPolarHBondContact O-CG2 3.46Å; L457-V462 PolarHBondContact O-N 2.88Å; L457-V462 VanDerWaalsContact O-N 3.1Å; L457-I467 HydrophobicContact CB-CD1 3.84Å; L457-I467 HydrophobicContact CD1-CD1 4Å; L457-I467 HydrophobicContact CD1-CG1 4.26Å; L457-I467 HydrophobicContact CD1-CG2 4.13Å
458	L	90.1	Very high	91.1	Very high	35 Å²	35	22.1 Å²	22.1	18%	0.183	11%	0.11	C	C	.	.	H	α-helix	trans	-64.2	-37	176	-60	178.9	0	0	0	112.6	V454 R455 H460 D461 V462 E464 I467 F486	V454-L458 HydrophobicContact CG1-CD1 4.35Å; V454-L458 HydrophobicContact CG1-CG 4.43Å; V454-L458 WeakPolarHBondContact O-CG 3.41Å; V454-L458 PolarHBondContact O-N 2.99Å; R455-L458 PolarHBondContact O-N 2.91Å; L458-H460 PolarHBondContact O-N 3.25Å; L458-D461 PolarHBondContact O-N 3.3Å; L458-V462 WeakPolarHBondContact CD2-O 3.42Å; L458-E464 HydrophobicContact CD2-CB 4.01Å; L458-E464 HydrophobicContact CD2-CG 4.44Å; L458-I467 HydrophobicContact CD2-CD1 4.24Å; L458-F486 HydrophobicContact CD1-CD1 3.81Å; L458-F486 HydrophobicContact CD1-CE1 3.5Å
459	D	83.7	Confident	91.8	Very high	9 Å²	9	22.1 Å²	22.1	5%	0.048	11%	0.11	C	C	.	.	H	α-helix	trans	-67.8	-19.1	174.3	-66.9	-16.8	0	0	0	112.7	W75 S165 R455 L457 D461	W75-D459 VanDerWaalsContact CE2-OD2 3.31Å; W75-D459 WeakPolarHBondContact CZ2-OD2 3.47Å; W75-D459 PolarHBondContact NE1-OD2 3.2Å; S165-D459 WeakPolarHBondContact CB-O 3.24Å; S165-D459 PolarHBondContact N-O 3.09Å; S165-D459 PolarHBondContact OG-O 3.09Å; R455-D459 IonicContact CZ-OD1 3.52Å; R455-D459 VanDerWaalsContact CZ-OD1 3.25Å; R455-D459 IonicContact NE-OD1 3.57Å; R455-D459 PolarHBondContact NE-OD1 3.39Å; R455-D459 IonicContact NE-OD2 2.75Å; R455-D459 IonicContact NH2-OD1 3.36Å; R455-D459 PolarHBondContact NH2-OD1 3.29Å; R455-D459 PolarHBondContact O-N 3.16Å; L457-D459 PolarHBondContact O-N 3.07Å; D459-D461 VanDerWaalsContact C-N 3.32Å
460	H	86.6	Confident	92.2	Very high	24 Å²	24	20.9 Å²	20.9	11%	0.111	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	16.4	170.9	-84.9	-110.2	0	0	0	113.6	Y186 L428 I432 V456 L457 L458 V462	Y186-H460 AromaticContact CD1-CE1 3.76Å; Y186-H460 AromaticContact CD1-NE2 3.39Å; Y186-H460 WeakPolarHBondContact CD1-NE2 3.32Å; Y186-H460 AromaticContact CE1-CE1 3.19Å; Y186-H460 WeakPolarHBondContact CE1-CE1 3.36Å; Y186-H460 AromaticContact CE1-NE2 3.35Å; Y186-H460 VanDerWaalsContact CE1-NE2 3.35Å; Y186-H460 WeakPolarHBondContact CE1-NE2 3.39Å; Y186-H460 AromaticContact CZ-CE1 3.89Å; L428-H460 HydrophobicContact CD1-CB 4.45Å; I432-H460 HydrophobicContact CG2-CB 4.07Å; V456-H460 PolarHBondContact O-CD2 3.06Å; V456-H460 VanDerWaalsContact O-CD2 3.23Å; V456-H460 PolarHBondContact O-N 3.13Å; L457-H460 CarbonylContact O-C 3.57Å; L457-H460 WeakPolarHBondContact O-CA 3.46Å; L457-H460 WeakPolarHBondContact O-CB 3.5Å; L457-H460 PolarHBondContact O-N 3.46Å; L457-H460 VanDerWaalsContact O-N 3.08Å; L458-H460 PolarHBondContact O-N 3.25Å; H460-V462 PolarHBondContact O-N 3.01Å
461	D	87.9	Confident	92.4	Very high	60 Å²	60	20.8 Å²	20.8	32%	0.321	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	25.7	-177.9	-71.1	-38.2	0	0	0	113.7	K159 K164 S433 L458 D459	K159-D461 IonicContact NZ-OD2 2.73Å; K164-D461 IonicContact NZ-OD1 3.85Å; K164-D461 PolarHBondContact NZ-OD1 3.44Å; S433-D461 WeakPolarHBondContact CB-O 3.42Å; L458-D461 PolarHBondContact O-N 3.3Å; D459-D461 VanDerWaalsContact C-N 3.32Å
462	V	93.1	Very high	92.7	Very high	6 Å²	6	20.7 Å²	20.7	4%	0.036	10%	0.099	C	C	.	.			trans	-73	136.5	166.8	-176.5	0	0	0	0	109.2	I432 V437 L457 L458 H460 I467	I432-V462 HydrophobicContact CB-CG2 4.44Å; I432-V462 HydrophobicContact CD1-CG2 4.45Å; I432-V462 HydrophobicContact CG1-CG2 4.01Å; I432-V462 HydrophobicContact CG2-CG2 3.95Å; V437-V462 HydrophobicContact CG2-CG1 3.87Å; V437-V462 HydrophobicContact CG2-CG2 4.41Å; L457-V462 HydrophobicContact CB-CB 4.11Å; L457-V462 HydrophobicContact CB-CG2 4.15Å; L457-V462 HydrophobicContact CD2-CG2 4.36Å; L457-V462 VanDerWaalsContact O-CB 3.26Å; L457-V462 WeakPolarHBondContact O-CB 3.5Å; L457-V462 VanDerWaalsContact O-CG2 3.31Å; L457-V462 WeakPolarHBondContact O-CG2 3.46Å; L457-V462 PolarHBondContact O-N 2.88Å; L457-V462 VanDerWaalsContact O-N 3.1Å; L458-V462 WeakPolarHBondContact CD2-O 3.42Å; H460-V462 PolarHBondContact O-N 3.01Å; V462-I467 HydrophobicContact CG1-CD1 4.19Å; V462-I467 HydrophobicContact CG1-CG1 3.88Å
463	Q	93.4	Very high	93	Very high	82 Å²	82	20.7 Å²	20.7	38%	0.383	10%	0.099	S	C	.	.			trans	-75.5	136.1	175.7	-65.5	173.8	-76.5	0	0	110.8	E465 K466	Q463-E465 VanDerWaalsContact C-N 3.33Å; Q463-E465 HydrophobicContact CB-CG 4.11Å; Q463-E465 PolarHBondContact O-N 3.37Å; Q463-K466 HydrophobicContact CB-CB 4.48Å; Q463-K466 HydrophobicContact CB-CD 4.2Å; Q463-K466 HydrophobicContact CB-CG 4.13Å; Q463-K466 WeakPolarHBondContact O-CB 3.39Å; Q463-K466 PolarHBondContact O-N 3.06Å
464	E	94.3	Very high	93.1	Very high	33 Å²	33	20.7 Å²	20.7	15%	0.154	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-58.3	-43.8	-175.4	-165.5	-164.9	153.3	0	0	112.2	L458 K466 I467 F486 P487 Q488 V489	L458-E464 HydrophobicContact CD2-CB 4.01Å; L458-E464 HydrophobicContact CD2-CG 4.44Å; E464-K466 PolarHBondContact O-N 2.92Å; E464-I467 PolarHBondContact O-N 3.08Å; E464-I467 VanDerWaalsContact O-N 3.09Å; E464-F486 HydrophobicContact CG-CB 4.4Å; E464-F486 WeakPolarHBondContact OE1-CA 3.49Å; E464-P487 WeakPolarHBondContact OE1-CD 3.33Å; E464-Q488 HydrophobicContact CB-CB 4.15Å; E464-Q488 HydrophobicContact CG-CB 3.87Å; E464-Q488 WeakPolarHBondContact OE1-CB 3.24Å; E464-Q488 PolarHBondContact OE1-N 2.97Å; E464-Q488 PolarHBondContact OE2-NE2 3.11Å; E464-V489 HydrophobicContact CG-CG2 3.9Å
465	E	94.9	Very high	93	Very high	109 Å²	109	20.7 Å²	20.7	51%	0.509	10%	0.099	S	C	.	.	G	3₁₀ helix	trans	-59.2	-16	175.9	72.2	-135.6	-123.3	0	0	114.7	Q463 Q488	Q463-E465 VanDerWaalsContact C-N 3.33Å; Q463-E465 HydrophobicContact CB-CG 4.11Å; Q463-E465 PolarHBondContact O-N 3.37Å; E465-Q488 HydrophobicContact CB-CB 4.47Å
466	K	95.8	Very high	93.1	Very high	36 Å²	36	22 Å²	22	16%	0.157	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-96.2	-2	-179.5	-68.3	-172.2	173.1	164.6	0	113.3	E434 V437 Q463 E464	E434-K466 PolarHBondContact O-NZ 2.87Å; V437-K466 PolarHBondContact N-O 2.78Å; Q463-K466 HydrophobicContact CB-CB 4.48Å; Q463-K466 HydrophobicContact CB-CD 4.2Å; Q463-K466 HydrophobicContact CB-CG 4.13Å; Q463-K466 WeakPolarHBondContact O-CB 3.39Å; Q463-K466 PolarHBondContact O-N 3.06Å; E464-K466 PolarHBondContact O-N 2.92Å
467	I	97.8	Very high	93	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	120	-178.6	-55.7	172.4	0	0	0	109.4	L439 V454 L457 L458 V462 E464 V489 K490	L439-I467 HydrophobicContact CB-CG2 4.32Å; V454-I467 HydrophobicContact CG1-CD1 4.1Å; V454-I467 HydrophobicContact CG2-CG2 4.37Å; L457-I467 HydrophobicContact CB-CD1 3.84Å; L457-I467 HydrophobicContact CD1-CD1 4Å; L457-I467 HydrophobicContact CD1-CG1 4.26Å; L457-I467 HydrophobicContact CD1-CG2 4.13Å; L458-I467 HydrophobicContact CD2-CD1 4.24Å; V462-I467 HydrophobicContact CG1-CD1 4.19Å; V462-I467 HydrophobicContact CG1-CG1 3.88Å; E464-I467 PolarHBondContact O-N 3.08Å; E464-I467 VanDerWaalsContact O-N 3.09Å; I467-V489 HydrophobicContact CB-CG2 4.21Å; I467-V489 HydrophobicContact CG2-CG1 4.21Å; I467-V489 HydrophobicContact CG2-CG2 4.42Å; I467-K490 PolarHBondContact O-N 2.85Å; I467-K490 VanDerWaalsContact O-N 3.16Å
468	L	97.9	Very high	92.7	Very high	8 Å²	8	24 Å²	24	4%	0.042	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	110.8	170	-52.3	-178	0	0	0	107.9	A353 F356 L357 V437 I438 L439 V470 K490 I492	A353-L468 WeakPolarHBondContact O-CD1 3.31Å; F356-L468 HydrophobicContact CB-CD2 4.41Å; L357-L468 HydrophobicContact CD2-CD1 3.83Å; L357-L468 HydrophobicContact CG-CD1 4.28Å; V437-L468 PolarHBondContact O-N 3.33Å; I438-L468 HydrophobicContact CG1-CD1 4.34Å; L439-L468 PolarHBondContact N-O 3.13Å; L468-V470 HydrophobicContact CB-CG2 4.2Å; L468-K490 CarbonylContact C-O 3.49Å; L468-K490 WeakPolarHBondContact CA-O 3.3Å; L468-K490 HydrophobicContact CD2-CB 3.67Å; L468-K490 HydrophobicContact CD2-CG 4.43Å; L468-I492 HydrophobicContact CB-CD1 4.44Å
469	L	98.1	Very high	92.8	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	120.4	171.5	175.3	63.3	0	0	0	109.2	L439 A450 M474 V482 V489 K490 I492	L439-L469 HydrophobicContact CB-CD1 4.39Å; L439-L469 HydrophobicContact CD2-CD1 4Å; L439-L469 HydrophobicContact CG-CD1 3.97Å; A450-L469 HydrophobicContact CB-CD1 4.15Å; A450-L469 HydrophobicContact CB-CD2 3.92Å; L469-M474 HydrophobicContact CD2-CE 4.25Å; L469-M474 HydrophobicContact CG-CE 4.05Å; L469-V482 HydrophobicContact CD2-CB 4.38Å; L469-V482 HydrophobicContact CD2-CG1 3.84Å; L469-V482 HydrophobicContact CD2-CG2 4.05Å; L469-V489 HydrophobicContact CB-CG1 4.03Å; L469-K490 PolarHBondContact N-O 3.31Å; L469-I492 PolarHBondContact O-N 3.46Å
470	V	97.9	Very high	93	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	122.6	-169.3	-174.2	0	0	0	0	110.7	L349 I350 A353 M394 I438 L439 D441 L468 I492	L349-V470 HydrophobicContact CD1-CG1 3.8Å; L349-V470 HydrophobicContact CD2-CG1 3.7Å; L349-V470 HydrophobicContact CG-CG1 3.48Å; L349-V470 VanDerWaalsContact CG-CG1 3.48Å; I350-V470 HydrophobicContact CD1-CG1 4.32Å; A353-V470 HydrophobicContact CB-CG1 4.3Å; A353-V470 HydrophobicContact CB-CG2 3.78Å; M394-V470 HydrophobicContact CE-CG1 3.97Å; I438-V470 HydrophobicContact CG2-CB 4.33Å; I438-V470 HydrophobicContact CG2-CG2 3.81Å; L439-V470 PolarHBondContact O-N 2.79Å; D441-V470 PolarHBondContact N-O 3.48Å; L468-V470 HydrophobicContact CB-CG2 4.2Å; V470-I492 WeakPolarHBondContact CA-O 3.45Å; V470-I492 HydrophobicContact CG2-CB 4.37Å
471	S	97	Very high	93	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	155	-176.6	-163.2	0	0	0	0	114.6	L349 D441 C442 T443 L473 I492 T493 T494	L349-S471 VanDerWaalsContact CD2-C 3.42Å; L349-S471 WeakPolarHBondContact CD2-O 3.38Å; D441-S471 WeakPolarHBondContact O-CA 3.35Å; D441-S471 WeakPolarHBondContact O-CB 3.43Å; D441-S471 PolarHBondContact O-OG 3.21Å; C442-S471 PolarHBondContact O-OG 3.15Å; C442-S471 VanDerWaalsContact O-OG 3.11Å; T443-S471 PolarHBondContact N-OG 3.07Å; S471-L473 PolarHBondContact OG-O 2.89Å; S471-I492 PolarHBondContact N-O 3.21Å; S471-T493 WeakPolarHBondContact O-CA 3.37Å; S471-T493 PolarHBondContact O-OG1 2.99Å; S471-T494 PolarHBondContact O-N 2.72Å
472	L	95	Very high	93.1	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	-75.1	-38.1	174.9	-69.1	173.8	0	0	0	111.6	H325 L345 M346 L349 C442 T493 T494 A495 F513	H325-L472 PolarHBondContact CE1-O 3.45Å; L345-L472 HydrophobicContact CB-CD2 4.25Å; L345-L472 HydrophobicContact CD2-CD2 4.01Å; L345-L472 HydrophobicContact CG-CD2 3.86Å; M346-L472 HydrophobicContact CE-CD1 3.86Å; M346-L472 HydrophobicContact CG-CD1 4.04Å; M346-L472 HydrophobicContact CG-CD2 3.9Å; M346-L472 HydrophobicContact CG-CG 4.28Å; L349-L472 HydrophobicContact CD2-CD2 3.93Å; L349-L472 HydrophobicContact CD2-CG 4.42Å; C442-L472 HydrophobicContact CB-CD1 4.37Å; C442-L472 PolarHBondContact O-N 3.18Å; L472-T493 PolarHBondContact O-OG1 3.34Å; L472-T494 PolarHBondContact O-OG1 3.27Å; L472-A495 PolarHBondContact O-N 3.48Å; L472-F513 HydrophobicContact CD1-CD2 4.45Å; L472-F513 HydrophobicContact CD1-CE2 3.73Å; L472-F513 HydrophobicContact CD1-CZ 3.9Å
473	L	94.9	Very high	92.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	124.2	-173	-161.7	164.8	0	0	0	110.1	C442 T443 V444 S471 A495 D497 I506 I510	C442-L473 PolarHBondContact O-N 3.18Å; T443-L473 WeakPolarHBondContact CA-O 3.28Å; V444-L473 PolarHBondContact N-O 3.24Å; S471-L473 PolarHBondContact OG-O 2.89Å; L473-A495 HydrophobicContact CG-CB 4.49Å; L473-D497 HydrophobicContact CD2-CB 4.14Å; L473-I506 HydrophobicContact CD2-CB 4.11Å; L473-I506 HydrophobicContact CD2-CD1 3.63Å; L473-I506 HydrophobicContact CD2-CG1 4.45Å; L473-I506 HydrophobicContact CD2-CG2 3.59Å; L473-I510 HydrophobicContact CB-CD1 4.21Å; L473-I510 HydrophobicContact CD1-CB 4.37Å; L473-I510 HydrophobicContact CD1-CD1 4.04Å; L473-I510 HydrophobicContact CD1-CG1 4.1Å; L473-I510 HydrophobicContact CD1-CG2 3.71Å
474	M	94.6	Very high	92.5	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	152.7	175.2	-54.4	-174.6	173.4	0	0	110.2	V444 L469 V479 I491 T493 A495 V496 D497	V444-M474 HydrophobicContact CB-CB 4.32Å; V444-M474 HydrophobicContact CB-CG 3.98Å; V444-M474 HydrophobicContact CG2-CE 4.29Å; V444-M474 HydrophobicContact CG2-CG 4.26Å; V444-M474 CarbonylContact O-C 3.55Å; V444-M474 WeakPolarHBondContact O-CA 3.45Å; L469-M474 HydrophobicContact CD2-CE 4.25Å; L469-M474 HydrophobicContact CG-CE 4.05Å; M474-V479 HydrophobicContact CB-CG2 3.65Å; M474-V479 HydrophobicContact CG-CG2 4.35Å; M474-V479 HydrophobicContact SD-CG2 3.77Å; M474-I491 HydrophobicContact CE-CG2 3.6Å; M474-I491 HydrophobicContact SD-CG2 3.37Å; M474-I491 WeakPolarHBondContact SD-CG2 3.47Å; M474-T493 HydrophobicContact CG-CG2 4.31Å; M474-T493 HydrophobicContact SD-CG2 4.24Å; M474-A495 PolarHBondContact N-O 3.4Å; M474-A495 VanDerWaalsContact N-O 3.11Å; M474-V496 CarbonylContact O-C 3.54Å; M474-V496 VanDerWaalsContact O-CA 3.27Å; M474-V496 WeakPolarHBondContact O-CA 3.39Å; M474-D497 PolarHBondContact O-N 2.8Å
475	A	92	Very high	92	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	152.1	164.9	0	0	0	0	0	110.8	V444 M477 G478 V479 D497 V500 I506	V444-A475 PolarHBondContact O-N 3.25Å; A475-M477 VanDerWaalsContact C-N 3.28Å; A475-M477 PolarHBondContact O-N 3.45Å; A475-G478 PolarHBondContact O-N 2.89Å; A475-G478 VanDerWaalsContact O-N 3.12Å; A475-V479 WeakPolarHBondContact O-CG2 3.46Å; A475-V479 PolarHBondContact O-N 3.25Å; A475-V479 VanDerWaalsContact O-N 3.08Å; A475-D497 CarbonylContact C-O 3.46Å; A475-D497 VanDerWaalsContact CA-O 3.28Å; A475-D497 WeakPolarHBondContact CA-O 3.45Å; A475-V500 HydrophobicContact CB-CG2 3.43Å; A475-V500 VanDerWaalsContact CB-CG2 3.43Å; A475-I506 HydrophobicContact CB-CD1 4.42Å; A475-I506 HydrophobicContact CB-CG1 4.2Å; A475-I506 HydrophobicContact CB-CG2 4.04Å
476	E	89.5	Confident	91.9	Very high	56 Å²	56	14.6 Å²	14.6	26%	0.262	7%	0.069	S	C	.	.	H	α-helix	trans	-50.7	-48.8	174.7	-69.2	179.5	161.5	0	0	110.7	L308 G478 V479 H480 V496 D497 K498	L308-E476 HydrophobicContact CD2-CG 4.34Å; E476-G478 PolarHBondContact O-N 3.21Å; E476-V479 PolarHBondContact O-N 2.62Å; E476-H480 PolarHBondContact O-CD2 2.82Å; E476-H480 PolarHBondContact O-N 3.48Å; E476-V496 HydrophobicContact CB-CG1 4.39Å; E476-V496 HydrophobicContact CG-CG1 3.59Å; E476-D497 PolarHBondContact N-O 3.05Å; E476-K498 WeakPolarHBondContact OE1-CE 3.39Å; E476-K498 IonicContact OE1-NZ 4Å
477	M	85.4	Confident	91.6	Very high	43 Å²	43	17 Å²	17	21%	0.212	9%	0.087	C	C	.	.	H	α-helix	trans	-51.1	-55.1	173.7	173.5	174.7	51.3	0	0	113	A300 T446 A475 V479 H480 S481 V500	A300-M477 HydrophobicContact CB-SD 4.44Å; T446-M477 HydrophobicContact CG2-CE 3.9Å; A475-M477 VanDerWaalsContact C-N 3.28Å; A475-M477 PolarHBondContact O-N 3.45Å; M477-V479 VanDerWaalsContact C-N 3.27Å; M477-V479 PolarHBondContact O-N 3.15Å; M477-H480 PolarHBondContact O-N 2.69Å; M477-H480 VanDerWaalsContact O-N 3.07Å; M477-S481 PolarHBondContact O-N 2.89Å; M477-S481 PolarHBondContact O-OG 2.91Å; M477-S481 VanDerWaalsContact O-OG 3.1Å; M477-V500 HydrophobicContact CE-CB 4.21Å; M477-V500 HydrophobicContact CE-CG1 3.62Å; M477-V500 HydrophobicContact CE-CG2 3.5Å
478	G	87.4	Confident	91.4	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-63.8	-29.7	-177.2	0	0	0	0	0	114.1	S445 A475 E476 V482	S445-G478 WeakPolarHBondContact O-CA 3.42Å; S445-G478 PolarHBondContact O-N 3.27Å; A475-G478 PolarHBondContact O-N 2.89Å; A475-G478 VanDerWaalsContact O-N 3.12Å; E476-G478 PolarHBondContact O-N 3.21Å; G478-V482 WeakPolarHBondContact O-CG2 3.1Å; G478-V482 PolarHBondContact O-N 3.19Å
479	V	90.8	Very high	91.2	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	11%	0.11	C	C	.	.	H	α-helix	trans	-67.7	-46.4	170.8	174.8	0	0	0	0	110.8	P309 L312 M474 A475 E476 M477 A483 I491 V496	P309-V479 HydrophobicContact CG-CG1 3.65Å; L312-V479 HydrophobicContact CB-CG1 4.45Å; L312-V479 HydrophobicContact CD1-CG1 4.02Å; L312-V479 HydrophobicContact CD1-CG2 4.25Å; L312-V479 HydrophobicContact CD2-CG1 4.25Å; L312-V479 HydrophobicContact CG-CG1 4.47Å; M474-V479 HydrophobicContact CB-CG2 3.65Å; M474-V479 HydrophobicContact CG-CG2 4.35Å; M474-V479 HydrophobicContact SD-CG2 3.77Å; A475-V479 WeakPolarHBondContact O-CG2 3.46Å; A475-V479 PolarHBondContact O-N 3.25Å; A475-V479 VanDerWaalsContact O-N 3.08Å; E476-V479 PolarHBondContact O-N 2.62Å; M477-V479 VanDerWaalsContact C-N 3.27Å; M477-V479 PolarHBondContact O-N 3.15Å; V479-A483 VanDerWaalsContact O-CB 3.25Å; V479-A483 WeakPolarHBondContact O-CB 3.45Å; V479-A483 PolarHBondContact O-N 2.95Å; V479-I491 HydrophobicContact CG1-CD1 4.37Å; V479-V496 HydrophobicContact CG2-CG2 4.45Å
480	H	88.3	Confident	91.2	Very high	17 Å²	17	24.3 Å²	24.3	8%	0.079	12%	0.121	C	C	.	.	H	α-helix	trans	-62.3	-47.5	177.6	-79.5	-76.2	0	0	0	112	H303 Q306 P307 E476 M477 V482 A483 Y484	H303-H480 HydrophobicContact CB-CB 4.38Å; Q306-H480 PolarHBondContact O-NE2 3.37Å; P307-H480 PolarHBondContact O-CE1 3.37Å; P307-H480 VanDerWaalsContact O-CE1 3.28Å; E476-H480 PolarHBondContact O-CD2 2.82Å; E476-H480 PolarHBondContact O-N 3.48Å; M477-H480 PolarHBondContact O-N 2.69Å; M477-H480 VanDerWaalsContact O-N 3.07Å; H480-V482 PolarHBondContact O-N 3.06Å; H480-A483 PolarHBondContact O-N 3.3Å; H480-Y484 VanDerWaalsContact O-CB 3.24Å; H480-Y484 WeakPolarHBondContact O-CB 2.74Å; H480-Y484 PolarHBondContact O-N 3.16Å
481	S	86.1	Confident	91.2	Very high	8 Å²	8	24.3 Å²	24.3	6%	0.056	12%	0.121	C	C	.	.	H	α-helix	trans	-51.1	-54.4	176.4	-59.3	0	0	0	0	112.1	T446 M451 M477 A485	T446-S481 WeakPolarHBondContact O-CB 3.49Å; T446-S481 PolarHBondContact O-OG 3Å; T446-S481 VanDerWaalsContact O-OG 3.04Å; M451-S481 VanDerWaalsContact SD-O 3.39Å; M477-S481 PolarHBondContact O-N 2.89Å; M477-S481 PolarHBondContact O-OG 2.91Å; M477-S481 VanDerWaalsContact O-OG 3.1Å; S481-A485 WeakPolarHBondContact O-CB 3.36Å; S481-A485 PolarHBondContact O-N 2.93Å; S481-A485 VanDerWaalsContact O-N 3.08Å
482	V	90.8	Very high	91.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-67.5	-43.4	-177.8	176.8	0	0	0	0	111.6	A450 M451 L469 G478 H480 Y484 A485 F486 I491	A450-V482 HydrophobicContact CB-CG2 3.98Å; M451-V482 HydrophobicContact CG-CB 4.42Å; M451-V482 HydrophobicContact CG-CG2 3.8Å; L469-V482 HydrophobicContact CD2-CB 4.38Å; L469-V482 HydrophobicContact CD2-CG1 3.84Å; L469-V482 HydrophobicContact CD2-CG2 4.05Å; G478-V482 WeakPolarHBondContact O-CG2 3.1Å; G478-V482 PolarHBondContact O-N 3.19Å; H480-V482 PolarHBondContact O-N 3.06Å; V482-Y484 VanDerWaalsContact C-N 3.3Å; V482-Y484 PolarHBondContact O-N 3.2Å; V482-A485 PolarHBondContact O-N 3.42Å; V482-F486 PolarHBondContact O-N 3.4Å; V482-I491 HydrophobicContact CB-CD1 3.94Å; V482-I491 HydrophobicContact CG1-CD1 3.84Å; V482-I491 HydrophobicContact CG1-CG1 4.29Å
483	A	89.9	Confident	91.3	Very high	11 Å²	11	24.3 Å²	24.3	9%	0.091	12%	0.121	C	C	.	.	H	α-helix	trans	-70.2	-25.9	-177.7	0	0	0	0	0	113.7	P309 T311 V479 H480 P487 I491	P309-A483 HydrophobicContact CB-CB 3.65Å; P309-A483 HydrophobicContact CG-CB 3.46Å; P309-A483 VanDerWaalsContact CG-CB 3.46Å; T311-A483 WeakPolarHBondContact OG1-CB 3.39Å; V479-A483 VanDerWaalsContact O-CB 3.25Å; V479-A483 WeakPolarHBondContact O-CB 3.45Å; V479-A483 PolarHBondContact O-N 2.95Å; H480-A483 PolarHBondContact O-N 3.3Å; A483-P487 WeakPolarHBondContact O-CA 3.31Å; A483-I491 HydrophobicContact CB-CD1 3.82Å
484	Y	85.4	Confident	91.4	Very high	114 Å²	114	24.5 Å²	24.5	45%	0.447	12%	0.122	S	C	.	.	H	α-helix	trans	-80	-43.3	175.4	-177.5	-116.9	0	0	0	111.7	H79 H303 H480 V482	H79-Y484 AromaticContact CE1-CE1 3.77Å; H79-Y484 AromaticContact CE1-CZ 3.89Å; H79-Y484 PolarHBondContact CE1-OH 3.24Å; H79-Y484 VanDerWaalsContact CE1-OH 3.3Å; H79-Y484 AromaticContact ND1-CE1 3.26Å; H79-Y484 VanDerWaalsContact ND1-CE1 3.26Å; H79-Y484 WeakPolarHBondContact ND1-CE1 3.47Å; H79-Y484 AromaticContact ND1-CZ 3.55Å; H79-Y484 PolarHBondContact ND1-OH 2.97Å; H303-Y484 AromaticContact NE2-CD1 3.85Å; H303-Y484 AromaticContact NE2-CD2 3.65Å; H303-Y484 AromaticContact NE2-CE1 3.98Å; H303-Y484 AromaticContact NE2-CE2 3.82Å; H303-Y484 AromaticContact NE2-CG 3.66Å; H303-Y484 AromaticContact NE2-CZ 3.96Å; H480-Y484 VanDerWaalsContact O-CB 3.24Å; H480-Y484 WeakPolarHBondContact O-CB 2.74Å; H480-Y484 PolarHBondContact O-N 3.16Å; V482-Y484 VanDerWaalsContact C-N 3.3Å; V482-Y484 PolarHBondContact O-N 3.2Å
485	A	83.4	Confident	91.4	Very high	7 Å²	7	25.1 Å²	25.1	6%	0.058	13%	0.127	C	C	.	.	H	α-helix	trans	-70.1	-32.1	176.8	0	0	0	0	0	113.2	H79 M451 S481 V482	H79-A485 VanDerWaalsContact O-O 3.12Å; M451-A485 HydrophobicContact CG-CB 4.41Å; M451-A485 HydrophobicContact SD-CB 3.62Å; S481-A485 WeakPolarHBondContact O-CB 3.36Å; S481-A485 PolarHBondContact O-N 2.93Å; S481-A485 VanDerWaalsContact O-N 3.08Å; V482-A485 PolarHBondContact O-N 3.42Å
486	F	91.2	Very high	91.4	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.018	14%	0.137	C	C	.	.			trans	-139.8	76.2	-175	-53.2	-70.4	0	0	0	111.1	G80 M451 V454 R455 L458 E464 V482 Q488 V489	G80-F486 VanDerWaalsContact CA-CZ 3.5Å; M451-F486 HydrophobicContact CB-CE2 3.88Å; M451-F486 HydrophobicContact CG-CD2 4.26Å; M451-F486 HydrophobicContact CG-CE2 3.91Å; V454-F486 HydrophobicContact CB-CD2 3.97Å; V454-F486 HydrophobicContact CB-CE2 3.91Å; V454-F486 HydrophobicContact CB-CG 4.42Å; V454-F486 HydrophobicContact CB-CZ 4.31Å; V454-F486 HydrophobicContact CG1-CB 4.21Å; V454-F486 HydrophobicContact CG1-CD1 3.71Å; V454-F486 HydrophobicContact CG1-CD2 3.61Å; V454-F486 HydrophobicContact CG1-CE1 3.92Å; V454-F486 HydrophobicContact CG1-CE2 3.81Å; V454-F486 HydrophobicContact CG1-CG 3.55Å; V454-F486 HydrophobicContact CG1-CZ 3.96Å; V454-F486 HydrophobicContact CG2-CD2 4.49Å; R455-F486 HydrophobicContact CB-CZ 4.37Å; L458-F486 HydrophobicContact CD1-CD1 3.81Å; L458-F486 HydrophobicContact CD1-CE1 3.5Å; E464-F486 HydrophobicContact CG-CB 4.4Å; E464-F486 WeakPolarHBondContact OE1-CA 3.49Å; V482-F486 PolarHBondContact O-N 3.4Å; F486-Q488 PolarHBondContact O-N 3.35Å; F486-Q488 VanDerWaalsContact O-N 3.13Å; F486-V489 HydrophobicContact CB-CB 4.19Å; F486-V489 HydrophobicContact CB-CG2 3.52Å; F486-V489 HydrophobicContact CG-CG2 4.41Å; F486-V489 PolarHBondContact O-N 3.18Å; F486-V489 VanDerWaalsContact O-N 3.17Å
487	P	89.8	Confident	91.5	Very high	85 Å²	85	24.7 Å²	24.7	55%	0.552	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-7.3	-172.3	29.4	-37	0	0	0	115.6	T311 E464 A483	T311-P487 WeakPolarHBondContact CG2-O 3.44Å; E464-P487 WeakPolarHBondContact OE1-CD 3.33Å; A483-P487 WeakPolarHBondContact O-CA 3.31Å
488	Q	93.3	Very high	91.4	Very high	108 Å²	108	30.1 Å²	30.1	51%	0.505	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-12.3	175.1	-49.4	-176.6	93.1	0	0	113.1	E464 E465 F486 K490	E464-Q488 HydrophobicContact CB-CB 4.15Å; E464-Q488 HydrophobicContact CG-CB 3.87Å; E464-Q488 WeakPolarHBondContact OE1-CB 3.24Å; E464-Q488 PolarHBondContact OE1-N 2.97Å; E464-Q488 PolarHBondContact OE2-NE2 3.11Å; E465-Q488 HydrophobicContact CB-CB 4.47Å; F486-Q488 PolarHBondContact O-N 3.35Å; F486-Q488 VanDerWaalsContact O-N 3.13Å; Q488-K490 PolarHBondContact O-N 2.89Å
489	V	95.6	Very high	91	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.18	C	C	.	.	S	Bend	trans	-68.2	126.3	175.2	174.2	0	0	0	0	109.6	T311 V454 E464 I467 L469 F486 I491	T311-V489 WeakPolarHBondContact CB-O 3.49Å; T311-V489 WeakPolarHBondContact CG2-O 3.42Å; V454-V489 HydrophobicContact CG1-CG2 4.01Å; V454-V489 HydrophobicContact CG2-CG2 4.43Å; E464-V489 HydrophobicContact CG-CG2 3.9Å; I467-V489 HydrophobicContact CB-CG2 4.21Å; I467-V489 HydrophobicContact CG2-CG1 4.21Å; I467-V489 HydrophobicContact CG2-CG2 4.42Å; L469-V489 HydrophobicContact CB-CG1 4.03Å; F486-V489 HydrophobicContact CB-CB 4.19Å; F486-V489 HydrophobicContact CB-CG2 3.52Å; F486-V489 HydrophobicContact CG-CG2 4.41Å; F486-V489 PolarHBondContact O-N 3.18Å; F486-V489 VanDerWaalsContact O-N 3.17Å; V489-I491 HydrophobicContact CG1-CG1 4.49Å
490	K	96.6	Very high	90.5	Very high	55 Å²	55	38.7 Å²	38.7	24%	0.239	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.9	173.4	-162.7	74.4	-165.9	164.9	0	109.5	Q310 T311 F356 I467 L468 L469 Q488 I492	Q310-K490 PolarHBondContact O-NZ 2.98Å; T311-K490 WeakPolarHBondContact O-CD 3.38Å; T311-K490 WeakPolarHBondContact O-CE 3.31Å; T311-K490 PolarHBondContact O-NZ 3.05Å; T311-K490 VanDerWaalsContact O-NZ 3.15Å; F356-K490 HydrophobicContact CD1-CD 4.43Å; F356-K490 HydrophobicContact CD1-CG 4.35Å; F356-K490 HydrophobicContact CG-CG 4.41Å; I467-K490 PolarHBondContact O-N 2.85Å; I467-K490 VanDerWaalsContact O-N 3.16Å; L468-K490 CarbonylContact C-O 3.49Å; L468-K490 WeakPolarHBondContact CA-O 3.3Å; L468-K490 HydrophobicContact CD2-CB 3.67Å; L468-K490 HydrophobicContact CD2-CG 4.43Å; L469-K490 PolarHBondContact N-O 3.31Å; Q488-K490 PolarHBondContact O-N 2.89Å; K490-I492 HydrophobicContact CG-CD1 4.29Å; K490-I492 HydrophobicContact CG-CG1 4.17Å
491	I	97.4	Very high	90	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.5	-178.1	-56	-178.8	0	0	0	108.5	T311 L312 S313 M474 V479 V482 A483 V489	T311-I491 PolarHBondContact O-N 3.34Å; L312-I491 CarbonylContact C-O 3.5Å; L312-I491 VanDerWaalsContact CA-O 3.31Å; L312-I491 WeakPolarHBondContact CA-O 3.49Å; L312-I491 HydrophobicContact CD1-CB 4.22Å; L312-I491 HydrophobicContact CD1-CG2 3.75Å; S313-I491 PolarHBondContact N-O 3.4Å; M474-I491 HydrophobicContact CE-CG2 3.6Å; M474-I491 HydrophobicContact SD-CG2 3.37Å; M474-I491 WeakPolarHBondContact SD-CG2 3.47Å; V479-I491 HydrophobicContact CG1-CD1 4.37Å; V482-I491 HydrophobicContact CB-CD1 3.94Å; V482-I491 HydrophobicContact CG1-CD1 3.84Å; V482-I491 HydrophobicContact CG1-CG1 4.29Å; A483-I491 HydrophobicContact CB-CD1 3.82Å; V489-I491 HydrophobicContact CG1-CG1 4.49Å
492	I	97.6	Very high	89.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	123.3	-171.2	-46.6	-176.4	0	0	0	109.4	S313 L349 R352 A353 F356 L468 L469 V470 S471 K490	S313-I492 WeakPolarHBondContact O-CA 3.28Å; L349-I492 HydrophobicContact CD1-CG2 3.96Å; R352-I492 HydrophobicContact CG-CG2 4.32Å; A353-I492 HydrophobicContact CB-CD1 3.94Å; F356-I492 HydrophobicContact CD2-CD1 3.56Å; F356-I492 HydrophobicContact CE2-CD1 4.1Å; F356-I492 HydrophobicContact CG-CD1 4.24Å; L468-I492 HydrophobicContact CB-CD1 4.44Å; L469-I492 PolarHBondContact O-N 3.46Å; V470-I492 WeakPolarHBondContact CA-O 3.45Å; V470-I492 HydrophobicContact CG2-CB 4.37Å; S471-I492 PolarHBondContact N-O 3.21Å; K490-I492 HydrophobicContact CG-CD1 4.29Å; K490-I492 HydrophobicContact CG-CG1 4.17Å
493	T	97.1	Very high	88.2	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	163.5	-178.1	-174.6	0	0	0	0	113.3	L312 S313 V314 L315 S471 L472 M474 A495 V496	L312-T493 HydrophobicContact CD1-CG2 3.99Å; S313-T493 PolarHBondContact O-N 3.38Å; S313-T493 VanDerWaalsContact O-N 3.13Å; V314-T493 CarbonylContact C-O 3.41Å; V314-T493 VanDerWaalsContact CA-O 3.31Å; V314-T493 WeakPolarHBondContact CA-O 3.17Å; V314-T493 HydrophobicContact CG1-CG2 4.49Å; V314-T493 HydrophobicContact CG2-CG2 4.24Å; L315-T493 PolarHBondContact N-O 2.86Å; S471-T493 WeakPolarHBondContact O-CA 3.37Å; S471-T493 PolarHBondContact O-OG1 2.99Å; L472-T493 PolarHBondContact O-OG1 3.34Å; M474-T493 HydrophobicContact CG-CG2 4.31Å; M474-T493 HydrophobicContact SD-CG2 4.24Å; T493-A495 WeakPolarHBondContact CG2-O 3.46Å; T493-A495 PolarHBondContact OG1-N 3.47Å; T493-A495 PolarHBondContact OG1-O 2.93Å; T493-V496 HydrophobicContact CG2-CG2 3.65Å
494	T	96.4	Very high	87.4	Confident	4 Å²	4	55.5 Å²	55.5	3%	0.025	28%	0.278	C	S	.	.	S	Bend	trans	-96.1	-16.5	171.7	74.7	0	0	0	0	114.2	L315 H325 L345 L349 S471 L472	L315-T494 HydrophobicContact CB-CG2 4.09Å; L315-T494 HydrophobicContact CD2-CG2 3.69Å; H325-T494 PolarHBondContact CE1-OG1 2.96Å; H325-T494 VanDerWaalsContact NE2-CA 3.27Å; H325-T494 WeakPolarHBondContact NE2-CA 3.33Å; H325-T494 WeakPolarHBondContact NE2-CB 3.38Å; H325-T494 PolarHBondContact NE2-O 3.27Å; H325-T494 PolarHBondContact NE2-OG1 2.99Å; L345-T494 HydrophobicContact CD1-CG2 3.92Å; L345-T494 HydrophobicContact CG-CG2 4.09Å; L349-T494 HydrophobicContact CB-CG2 3.74Å; L349-T494 HydrophobicContact CD1-CG2 3.83Å; L349-T494 HydrophobicContact CD2-CG2 4.16Å; L349-T494 HydrophobicContact CG-CG2 4.1Å; S471-T494 PolarHBondContact O-N 2.72Å; L472-T494 PolarHBondContact O-OG1 3.27Å
495	A	94.6	Very high	87.2	Confident	13 Å²	13	54.1 Å²	54.1	11%	0.107	28%	0.275	C	S	.	.			trans	-152	151.6	171.9	0	0	0	0	0	111.7	H325 L472 L473 M474 T493	H325-A495 WeakPolarHBondContact CE1-CB 3.49Å; L472-A495 PolarHBondContact O-N 3.48Å; L473-A495 HydrophobicContact CG-CB 4.49Å; M474-A495 PolarHBondContact N-O 3.4Å; M474-A495 VanDerWaalsContact N-O 3.11Å; T493-A495 WeakPolarHBondContact CG2-O 3.46Å; T493-A495 PolarHBondContact OG1-N 3.47Å; T493-A495 PolarHBondContact OG1-O 2.93Å
496	V	93.4	Very high	87.4	Confident	34 Å²	34	54.7 Å²	54.7	21%	0.206	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.2	167.4	-177.5	0	0	0	0	108.6	L308 L312 V314 M474 E476 V479 T493	L308-V496 HydrophobicContact CD2-CG1 4.49Å; L312-V496 HydrophobicContact CD2-CG2 4.14Å; V314-V496 HydrophobicContact CG2-CG2 4.02Å; M474-V496 CarbonylContact O-C 3.54Å; M474-V496 VanDerWaalsContact O-CA 3.27Å; M474-V496 WeakPolarHBondContact O-CA 3.39Å; E476-V496 HydrophobicContact CB-CG1 4.39Å; E476-V496 HydrophobicContact CG-CG1 3.59Å; V479-V496 HydrophobicContact CG2-CG2 4.45Å; T493-V496 HydrophobicContact CG2-CG2 3.65Å
497	D	91.9	Very high	87.2	Confident	13 Å²	13	58.4 Å²	58.4	7%	0.07	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	145.3	179.9	-79.2	11.8	0	0	0	110.7	R329 L473 M474 A475 E476 I506 P508 G509	R329-D497 IonicContact CZ-OD1 3.47Å; R329-D497 IonicContact CZ-OD2 2.73Å; R329-D497 IonicContact NH1-OD1 2.73Å; R329-D497 IonicContact NH1-OD2 3.08Å; R329-D497 PolarHBondContact NH1-OD2 2.99Å; R329-D497 IonicContact NH2-OD1 3.17Å; R329-D497 PolarHBondContact NH2-OD1 3.46Å; R329-D497 IonicContact NH2-OD2 2.6Å; R329-D497 PolarHBondContact NH2-OD2 3.22Å; L473-D497 HydrophobicContact CD2-CB 4.14Å; M474-D497 PolarHBondContact O-N 2.8Å; A475-D497 CarbonylContact C-O 3.46Å; A475-D497 VanDerWaalsContact CA-O 3.28Å; A475-D497 WeakPolarHBondContact CA-O 3.45Å; E476-D497 PolarHBondContact N-O 3.05Å; D497-I506 HydrophobicContact CB-CG2 3.47Å; D497-I506 VanDerWaalsContact CB-CG2 3.47Å; D497-P508 WeakPolarHBondContact OD2-CD 3.42Å; D497-G509 WeakPolarHBondContact OD2-CA 3.48Å; D497-G509 PolarHBondContact OD2-N 2.89Å
498	K	83	Confident	87.1	Confident	158 Å²	158	59.3 Å²	59.3	69%	0.687	30%	0.302	S	S	*	.	S	Bend	trans	-78.5	-24.8	-166.2	-60.9	-145.6	166.5	-158.6	0	116.3	E476	E476-K498 WeakPolarHBondContact OE1-CE 3.39Å; E476-K498 IonicContact OE1-NZ 4Å
499	K	78.6	Confident	86.9	Confident	146 Å²	146	54.3 Å²	54.3	64%	0.635	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.1	154.5	-168.7	-69.9	-167	174.5	-167.5	0	111	I507	K499-I507 HydrophobicContact CB-CB 4.17Å; K499-I507 PolarHBondContact O-N 2.85Å
500	V	79.8	Confident	86.7	Confident	35 Å²	35	54.7 Å²	54.7	21%	0.212	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	151.5	159.8	116.8	0	0	0	0	107.3	A475 M477 F504 H505	A475-V500 HydrophobicContact CB-CG2 3.43Å; A475-V500 VanDerWaalsContact CB-CG2 3.43Å; M477-V500 HydrophobicContact CE-CB 4.21Å; M477-V500 HydrophobicContact CE-CG1 3.62Å; M477-V500 HydrophobicContact CE-CG2 3.5Å; V500-F504 HydrophobicContact CG1-CB 3.88Å; V500-F504 HydrophobicContact CG1-CD1 4.32Å; V500-H505 CarbonylContact C-O 3.58Å; V500-H505 WeakPolarHBondContact CA-O 3.18Å; V500-H505 WeakPolarHBondContact CB-O 3.28Å
501	N	77.7	Confident	86.3	Confident	50 Å²	50	54.4 Å²	54.4	27%	0.267	30%	0.295	S	S	.	.			trans	-90.2	178.2	179.8	73	-2.9	0	0	0	112.2	V503 F504 H505 I507	N501-V503 PolarHBondContact O-N 3.15Å; N501-V503 VanDerWaalsContact O-N 3.08Å; N501-V503 PolarHBondContact OD1-N 2.87Å; N501-V503 VanDerWaalsContact OD1-N 3.15Å; N501-F504 PolarHBondContact O-N 3.39Å; N501-F504 PolarHBondContact OD1-N 3.46Å; N501-H505 PolarHBondContact N-O 3.37Å; N501-H505 WeakPolarHBondContact OD1-CB 3.4Å; N501-H505 PolarHBondContact OD1-N 2.82Å; N501-H505 PolarHBondContact OD1-O 3.06Å; N501-I507 HydrophobicContact CB-CD1 3.86Å
502	D	70.8	Confident	85.9	Confident	155 Å²	155	57.7 Å²	57.7	83%	0.829	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.3	-178	-39.6	-80.1	0	0	0	112.7
503	V	68.9	Low	85.6	Confident	101 Å²	101	57.8 Å²	57.8	61%	0.612	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	24	178.1	-155.5	0	0	0	0	111.9	N501 H505	N501-V503 PolarHBondContact O-N 3.15Å; N501-V503 VanDerWaalsContact O-N 3.08Å; N501-V503 PolarHBondContact OD1-N 2.87Å; N501-V503 VanDerWaalsContact OD1-N 3.15Å; V503-H505 PolarHBondContact O-N 3.31Å; V503-H505 VanDerWaalsContact O-N 3.14Å; V503-H505 PolarHBondContact O-ND1 3.27Å
504	F	73.8	Confident	85.2	Confident	83 Å²	83	57.9 Å²	57.9	36%	0.364	31%	0.314	S	S	.	.	S	Bend	trans	82.1	-8.8	173.1	29.3	-132.7	0	0	0	115.3	S445 T446 V500 N501	S445-F504 WeakPolarHBondContact CB-O 3.37Å; S445-F504 PolarHBondContact OG-O 3.04Å; T446-F504 HydrophobicContact CG2-CB 3.76Å; T446-F504 HydrophobicContact CG2-CD1 3.45Å; T446-F504 VanDerWaalsContact CG2-CD1 3.45Å; T446-F504 HydrophobicContact CG2-CE1 4.23Å; T446-F504 HydrophobicContact CG2-CG 3.81Å; V500-F504 HydrophobicContact CG1-CB 3.88Å; V500-F504 HydrophobicContact CG1-CD1 4.32Å; N501-F504 PolarHBondContact O-N 3.39Å; N501-F504 PolarHBondContact OD1-N 3.46Å
505	H	81.3	Confident	84.9	Confident	86 Å²	86	58.8 Å²	58.8	40%	0.398	32%	0.319	S	S	.	.			trans	-94.2	137.2	-168	-70	98.3	0	0	0	112.5	V500 N501 V503	V500-H505 CarbonylContact C-O 3.58Å; V500-H505 WeakPolarHBondContact CA-O 3.18Å; V500-H505 WeakPolarHBondContact CB-O 3.28Å; N501-H505 PolarHBondContact N-O 3.37Å; N501-H505 WeakPolarHBondContact OD1-CB 3.4Å; N501-H505 PolarHBondContact OD1-N 2.82Å; N501-H505 PolarHBondContact OD1-O 3.06Å; V503-H505 PolarHBondContact O-N 3.31Å; V503-H505 VanDerWaalsContact O-N 3.14Å; V503-H505 PolarHBondContact O-ND1 3.27Å
506	I	85.9	Confident	84.8	Confident	18 Å²	18	60 Å²	60	9%	0.092	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	140.8	-177.7	-47.8	173.8	0	0	0	110.1	L473 A475 D497 G509	L473-I506 HydrophobicContact CD2-CB 4.11Å; L473-I506 HydrophobicContact CD2-CD1 3.63Å; L473-I506 HydrophobicContact CD2-CG1 4.45Å; L473-I506 HydrophobicContact CD2-CG2 3.59Å; A475-I506 HydrophobicContact CB-CD1 4.42Å; A475-I506 HydrophobicContact CB-CG1 4.2Å; A475-I506 HydrophobicContact CB-CG2 4.04Å; D497-I506 HydrophobicContact CB-CG2 3.47Å; D497-I506 VanDerWaalsContact CB-CG2 3.47Å; I506-G509 VanDerWaalsContact O-CA 3.24Å; I506-G509 WeakPolarHBondContact O-CA 3.5Å; I506-G509 PolarHBondContact O-N 2.85Å
507	I	86.8	Confident	84.8	Confident	82 Å²	82	59.5 Å²	59.5	42%	0.421	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.8	178.9	-69.1	-174.8	0	0	0	109.9	K499 N501	K499-I507 HydrophobicContact CB-CB 4.17Å; K499-I507 PolarHBondContact O-N 2.85Å; N501-I507 HydrophobicContact CB-CD1 3.86Å
508	P	88.3	Confident	84.8	Confident	104 Å²	104	62.7 Å²	62.7	68%	0.675	33%	0.328	S	S	*	.	S	Bend	cis	-70.6	-20.2	2.8	25.6	-33.2	0	0	0	115.5	D497	D497-P508 WeakPolarHBondContact OD2-CD 3.42Å
509	G	89.8	Confident	85	Confident	4 Å²	4	57.1 Å²	57.1	4%	0.041	32%	0.316	C	S	.	.			trans	61.6	-159.4	170.7	0	0	0	0	0	115.4	R329 D497 I506	R329-G509 WeakPolarHBondContact CG-O 3.19Å; R329-G509 PolarHBondContact NH1-O 2.8Å; D497-G509 WeakPolarHBondContact OD2-CA 3.48Å; D497-G509 PolarHBondContact OD2-N 2.89Å; I506-G509 VanDerWaalsContact O-CA 3.24Å; I506-G509 WeakPolarHBondContact O-CA 3.5Å; I506-G509 PolarHBondContact O-N 2.85Å
510	I	90.8	Very high	85.4	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.041	31%	0.305	C	S	.	.			trans	-138.3	9.8	178.5	52.6	-167.6	0	0	0	112.9	I328 R329 T443 L473 F513 R516	I328-I510 HydrophobicContact CG1-CG2 4.21Å; R329-I510 HydrophobicContact CB-CG2 4.36Å; R329-I510 HydrophobicContact CG-CG2 3.49Å; R329-I510 VanDerWaalsContact CG-CG2 3.49Å; T443-I510 HydrophobicContact CG2-CD1 3.61Å; T443-I510 HydrophobicContact CG2-CG1 3.9Å; L473-I510 HydrophobicContact CB-CD1 4.21Å; L473-I510 HydrophobicContact CD1-CB 4.37Å; L473-I510 HydrophobicContact CD1-CD1 4.04Å; L473-I510 HydrophobicContact CD1-CG1 4.1Å; L473-I510 HydrophobicContact CD1-CG2 3.71Å; I510-F513 HydrophobicContact CD1-CB 4.28Å; I510-F513 HydrophobicContact CD1-CD2 3.64Å; I510-F513 HydrophobicContact CD1-CG 4.38Å; I510-F513 HydrophobicContact CG1-CD2 4.47Å; I510-R516 WeakPolarHBondContact O-CD 3.33Å; I510-R516 PolarHBondContact O-NH1 3.04Å
511	G	88.3	Confident	85.1	Confident	49 Å²	49	55.8 Å²	55.8	51%	0.505	32%	0.317	S	S	.	.	S	Bend	trans	70.4	-162.9	-163.8	0	0	0	0	0	112.3	F513	G511-F513 PolarHBondContact O-N 2.87Å
512	N	89.1	Confident	83.8	Confident	69 Å²	69	56 Å²	56	37%	0.369	33%	0.326	S	S	.	.			trans	-72.8	108.2	171.9	179.5	-29.2	0	0	0	109.6	G514 D515 R516	N512-G514 VanDerWaalsContact C-N 3.34Å; N512-G514 PolarHBondContact O-N 2.99Å; N512-G514 PolarHBondContact OD1-N 2.86Å; N512-D515 HydrophobicContact CB-CB 4.48Å; N512-D515 VanDerWaalsContact CG-OD2 3.27Å; N512-D515 PolarHBondContact ND2-OD2 3.1Å; N512-D515 PolarHBondContact OD1-N 3.4Å; N512-D515 PolarHBondContact OD1-OD2 3.05Å; N512-R516 WeakPolarHBondContact O-CG 3.33Å; N512-R516 PolarHBondContact O-N 3.46Å
513	F	92.1	Very high	82.6	Confident	1 Å²	1	52 Å²	52	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-39.3	-176.5	-174	-86.3	0	0	0	112.8	F338 S342 M346 T393 C442 T443 L472 I510 G511 Y517	F338-F513 HydrophobicContact CE1-CD2 4.15Å; F338-F513 AromaticContact CE1-CE2 3.84Å; F338-F513 HydrophobicContact CE1-CE2 3.84Å; F338-F513 HydrophobicContact CE1-CZ 4.14Å; F338-F513 HydrophobicContact CE2-CD2 4.49Å; F338-F513 HydrophobicContact CE2-CE2 4.38Å; F338-F513 AromaticContact CZ-CD2 3.54Å; F338-F513 HydrophobicContact CZ-CD2 3.54Å; F338-F513 AromaticContact CZ-CE2 3.49Å; F338-F513 HydrophobicContact CZ-CE2 3.49Å; F338-F513 VanDerWaalsContact CZ-CE2 3.49Å; F338-F513 HydrophobicContact CZ-CG 4.36Å; F338-F513 HydrophobicContact CZ-CZ 4.25Å; S342-F513 WeakPolarHBondContact OG-CE2 3.38Å; M346-F513 HydrophobicContact CE-CE1 3.87Å; M346-F513 HydrophobicContact CE-CZ 3.6Å; T393-F513 HydrophobicContact CG2-CE1 4.18Å; T393-F513 WeakPolarHBondContact OG1-CE1 3.36Å; C442-F513 HydrophobicContact CB-CB 4.16Å; C442-F513 HydrophobicContact CB-CD1 3.4Å; C442-F513 VanDerWaalsContact CB-CD1 3.4Å; C442-F513 HydrophobicContact CB-CD2 4.24Å; C442-F513 HydrophobicContact CB-CE1 3.88Å; C442-F513 HydrophobicContact CB-CG 3.63Å; C442-F513 HydrophobicContact CB-CZ 4.45Å; C442-F513 WeakPolarHBondContact SG-CE1 3.47Å; T443-F513 HydrophobicContact CG2-CB 3.97Å; L472-F513 HydrophobicContact CD1-CD2 4.45Å; L472-F513 HydrophobicContact CD1-CE2 3.73Å; L472-F513 HydrophobicContact CD1-CZ 3.9Å; I510-F513 HydrophobicContact CD1-CB 4.28Å; I510-F513 HydrophobicContact CD1-CD2 3.64Å; I510-F513 HydrophobicContact CD1-CG 4.38Å; I510-F513 HydrophobicContact CG1-CD2 4.47Å; G511-F513 PolarHBondContact O-N 2.87Å; F513-Y517 AromaticContact CE1-CD2 3.83Å; F513-Y517 HydrophobicContact CE1-CD2 3.83Å; F513-Y517 HydrophobicContact CE1-CG 4.08Å; F513-Y517 AromaticContact CZ-CD2 3.83Å; F513-Y517 HydrophobicContact CZ-CD2 3.83Å; F513-Y517 HydrophobicContact CZ-CG 4.48Å; F513-Y517 WeakPolarHBondContact O-CB 3.22Å; F513-Y517 PolarHBondContact O-N 3.09Å
514	G	89.1	Confident	81.3	Confident	3 Å²	3	52.9 Å²	52.9	3%	0.031	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-49.4	-176.8	0	0	0	0	0	111.5	N512 Y517 F518	N512-G514 VanDerWaalsContact C-N 3.34Å; N512-G514 PolarHBondContact O-N 2.99Å; N512-G514 PolarHBondContact OD1-N 2.86Å; G514-Y517 PolarHBondContact O-N 2.94Å; G514-F518 WeakPolarHBondContact O-CD2 3.5Å; G514-F518 PolarHBondContact O-N 3.36Å
515	D	89.9	Confident	79.7	Confident	23 Å²	23	55.6 Å²	55.6	12%	0.123	33%	0.334	C	S	.	.	H	α-helix	trans	-70.2	-37.5	-176.2	-69	-49.3	0	0	0	112.5	R389 N512 Y517 G519 T520 D521	R389-D515 IonicContact CZ-OD1 2.79Å; R389-D515 VanDerWaalsContact CZ-OD1 3.3Å; R389-D515 IonicContact NH1-OD1 2.75Å; R389-D515 PolarHBondContact NH1-OD1 2.91Å; R389-D515 VanDerWaalsContact NH2-CG 3.26Å; R389-D515 IonicContact NH2-OD1 3.12Å; R389-D515 PolarHBondContact NH2-OD1 2.88Å; R389-D515 IonicContact NH2-OD2 2.81Å; R389-D515 PolarHBondContact NH2-OD2 3.19Å; N512-D515 HydrophobicContact CB-CB 4.48Å; N512-D515 VanDerWaalsContact CG-OD2 3.27Å; N512-D515 PolarHBondContact ND2-OD2 3.1Å; N512-D515 PolarHBondContact OD1-N 3.4Å; N512-D515 PolarHBondContact OD1-OD2 3.05Å; D515-Y517 PolarHBondContact O-N 2.93Å; D515-G519 CarbonylContact O-C 3.6Å; D515-G519 VanDerWaalsContact O-CA 3.25Å; D515-G519 WeakPolarHBondContact O-CA 3.29Å; D515-G519 PolarHBondContact O-N 3.41Å; D515-T520 PolarHBondContact O-N 3.05Å; D515-T520 VanDerWaalsContact OD1-CB 3.3Å; D515-T520 WeakPolarHBondContact OD1-CB 3.24Å; D515-T520 PolarHBondContact OD1-OG1 3.14Å; D515-D521 VanDerWaalsContact CB-OD1 3.3Å; D515-D521 WeakPolarHBondContact CB-OD1 3.37Å
516	R	92.1	Very high	77.7	Confident	37 Å²	37	60.9 Å²	60.9	14%	0.14	35%	0.351	C	S	.	.	H	α-helix	trans	-64.1	-37.3	169.6	-68.2	-174.9	70.4	-163.1	0.3	113.7	I328 N330 F338 I510 N512 D521	I328-R516 PolarHBondContact O-NH1 3.47Å; N330-R516 PolarHBondContact O-NH2 3.22Å; F338-R516 HydrophobicContact CD1-CB 4.27Å; F338-R516 HydrophobicContact CE1-CB 3.74Å; F338-R516 HydrophobicContact CE2-CB 4.46Å; F338-R516 HydrophobicContact CZ-CB 3.85Å; I510-R516 WeakPolarHBondContact O-CD 3.33Å; I510-R516 PolarHBondContact O-NH1 3.04Å; N512-R516 WeakPolarHBondContact O-CG 3.33Å; N512-R516 PolarHBondContact O-N 3.46Å; R516-D521 WeakPolarHBondContact CA-OD2 3.15Å; R516-D521 PolarHBondContact N-OD2 3.03Å
517	Y	92.2	Very high	75.1	Confident	25 Å²	25	62.7 Å²	62.7	10%	0.098	37%	0.365	C	S	.	.	H	α-helix	trans	-74.5	-41.9	-179.1	-171.4	-86	0	0	0	112.3	F338 I339 K343 M346 T393 F513 G514 D515	F338-Y517 HydrophobicContact CE1-CD2 4.39Å; I339-Y517 HydrophobicContact CB-CE2 4.21Å; I339-Y517 WeakPolarHBondContact CD1-O 3.42Å; I339-Y517 HydrophobicContact CG1-CD2 3.87Å; I339-Y517 HydrophobicContact CG1-CE2 3.92Å; I339-Y517 HydrophobicContact CG1-CG 4.24Å; I339-Y517 HydrophobicContact CG2-CE2 4.01Å; K343-Y517 WeakPolarHBondContact CE-OH 3.33Å; M346-Y517 HydrophobicContact CE-CE2 4.49Å; T393-Y517 HydrophobicContact CG2-CD1 3.26Å; T393-Y517 HydrophobicContact CG2-CD2 4.21Å; T393-Y517 HydrophobicContact CG2-CE1 3.46Å; T393-Y517 VanDerWaalsContact CG2-CE1 3.46Å; T393-Y517 HydrophobicContact CG2-CE2 4.38Å; T393-Y517 HydrophobicContact CG2-CG 3.66Å; F513-Y517 AromaticContact CE1-CD2 3.83Å; F513-Y517 HydrophobicContact CE1-CD2 3.83Å; F513-Y517 HydrophobicContact CE1-CG 4.08Å; F513-Y517 AromaticContact CZ-CD2 3.83Å; F513-Y517 HydrophobicContact CZ-CD2 3.83Å; F513-Y517 HydrophobicContact CZ-CG 4.48Å; F513-Y517 WeakPolarHBondContact O-CB 3.22Å; F513-Y517 PolarHBondContact O-N 3.09Å; G514-Y517 PolarHBondContact O-N 2.94Å; D515-Y517 PolarHBondContact O-N 2.93Å
518	F	91.9	Very high	72.9	Confident	80 Å²	80	65.4 Å²	65.4	35%	0.351	38%	0.38	S	S	.	.	H	α-helix	trans	-84.5	-21.6	179.7	-65	-61.9	0	0	0	112.8	R335 R389 T393 G514 T520	R335-F518 PolarHBondContact NH1-O 3.38Å; R389-F518 HydrophobicContact CB-CE2 4.25Å; T393-F518 HydrophobicContact CG2-CE1 4.28Å; T393-F518 HydrophobicContact CG2-CE2 3.92Å; T393-F518 HydrophobicContact CG2-CZ 3.59Å; G514-F518 WeakPolarHBondContact O-CD2 3.5Å; G514-F518 PolarHBondContact O-N 3.36Å; F518-T520 HydrophobicContact CB-CG2 4.45Å
519	G	88.1	Confident	70.4	Confident	41 Å²	41	68.7 Å²	68.7	42%	0.423	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	46	-170.3	0	0	0	0	0	111.8	D515	D515-G519 CarbonylContact O-C 3.6Å; D515-G519 VanDerWaalsContact O-CA 3.25Å; D515-G519 WeakPolarHBondContact O-CA 3.29Å; D515-G519 PolarHBondContact O-N 3.41Å
520	T	86.8	Confident	67.7	Low	66 Å²	66	75.1 Å²	75.1	41%	0.405	42%	0.42	S	S	.	.			trans	-111.6	8.7	178.2	40.8	0	0	0	0	113.9	R389 D515 F518	R389-T520 PolarHBondContact NH1-OG1 3.23Å; R389-T520 VanDerWaalsContact NH1-OG1 3.11Å; D515-T520 PolarHBondContact O-N 3.05Å; D515-T520 VanDerWaalsContact OD1-CB 3.3Å; D515-T520 WeakPolarHBondContact OD1-CB 3.24Å; D515-T520 PolarHBondContact OD1-OG1 3.14Å; F518-T520 HydrophobicContact CB-CG2 4.45Å
521	D	72.7	Confident	65.2	Low	86 Å²	86	81.2 Å²	81.2	46%	0.46	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-52.1	145.9	166.4	-58.4	-61.2	0	0	0	111	D515 R516	D515-D521 VanDerWaalsContact CB-OD1 3.3Å; D515-D521 WeakPolarHBondContact CB-OD1 3.37Å; R516-D521 WeakPolarHBondContact CA-OD2 3.15Å; R516-D521 PolarHBondContact N-OD2 3.03Å
522	A	52.3	Low	62.7	Low	56 Å²	56	86.3 Å²	86.3	46%	0.463	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-77.1	153.3	170.5	0	0	0	0	0	110.6
523	P	43.8	Very low	59.9	Low	71 Å²	71	92 Å²	92	46%	0.461	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-57.6	149.4	166.8	-19.8	32.7	0	0	0	110.7	D525	P523-D525 PolarHBondContact O-N 3.13Å
524	P	43.4	Very low	57.2	Low	119 Å²	119	97.2 Å²	97.2	77%	0.773	53%	0.526	S	S	*	.	S	Bend	trans	-57.4	-31.9	179.7	-26.6	36.1	0	0	0	114.2	W526	P524-W526 PolarHBondContact O-N 3.08Å
525	D	38.7	Very low	54.8	Low	139 Å²	139	102.8 Å²	102.8	74%	0.743	57%	0.565	S	S	*	*	S	Bend	trans	-75.6	31.5	-176.1	-36.8	-34	0	0	0	113.2	P523	P523-D525 PolarHBondContact O-N 3.13Å
526	W	40	Very low	52.4	Low	197 Å²	197	116.1 Å²	116.1	75%	0.746	62%	0.615	S	S	*	*			trans	-135.2	41.3	179.9	-75.3	68.7	0	0	0	110.5	P524	P524-W526 PolarHBondContact O-N 3.08Å
527	S	31.6	Very low	50.4	Low	56 Å²	56	120.1 Å²	120.1	39%	0.392	64%	0.639	S	S	.	*			trans	-72.6	127.4	160.4	35.4	0	0	0	0	109.6	E529	S527-E529 PolarHBondContact O-N 3.02Å
528	D	39.4	Very low	48.2	Very low	139 Å²	139	125.1 Å²	125.1	74%	0.743	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-67.8	3.8	177.2	-64.1	-64.8	0	0	0	113.7	D530	D528-D530 VanDerWaalsContact C-N 3.35Å
529	E	36.2	Very low	45.8	Very low	174 Å²	174	127.6 Å²	127.6	81%	0.813	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-72	-22.5	177.9	-61.3	-175.5	152.1	0	0	113.1	S527 L531	S527-E529 PolarHBondContact O-N 3.02Å; E529-L531 VanDerWaalsContact C-N 3.26Å; E529-L531 PolarHBondContact O-N 2.71Å
530	D	33.5	Very low	43.3	Very low	138 Å²	138	132.7 Å²	132.7	74%	0.738	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-82.7	10.8	-178.7	-69.5	-47.1	0	0	0	114.3	D528	D528-D530 VanDerWaalsContact C-N 3.35Å
531	L	38.4	Very low	40.6	Very low	136 Å²	136	136.9 Å²	136.9	71%	0.712	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-95.6	-8.5	-176	-76.9	170.5	0	0	0	115.3	E529	E529-L531 VanDerWaalsContact C-N 3.26Å; E529-L531 PolarHBondContact O-N 2.71Å
532	D	35.9	Very low	38.4	Very low	156 Å²	156	140.3 Å²	140.3	83%	0.834	74%	0.737	S	S	*	*			trans	-108.1	15.5	-168.5	-97.3	-17.7	0	0	0	115.8	P534	D532-P534 WeakPolarHBondContact O-CD 3.34Å
533	E	29.1	Very low	37.4	Very low	188 Å²	188	146.3 Å²	146.3	88%	0.879	76%	0.756	S	S	*	*			trans	-104	106.6	165.1	-76.3	-148.7	152.5	0	0	112.7	S535	E533-S535 PolarHBondContact O-N 2.72Å
534	P	35.9	Very low	36.9	Very low	111 Å²	111	152.1 Å²	152.1	72%	0.721	78%	0.779	S	S	*	*			trans	-76	105.7	170.4	30.1	-32.5	0	0	0	110.7	D532 Y536	D532-P534 WeakPolarHBondContact O-CD 3.34Å; P534-Y536 PolarHBondContact O-N 2.61Å
535	S	38.2	Very low	36.4	Very low	120 Å²	120	154.8 Å²	154.8	84%	0.839	78%	0.779	S	S	*	*			trans	-62.3	122.3	172	61.4	0	0	0	0	111.4	E533	E533-S535 PolarHBondContact O-N 2.72Å
536	Y	39.7	Very low	36.2	Very low	304 Å²	304	156.3 Å²	156.3	100%	1.192	78%	0.783	S	S	*	*			trans	-69.2	0	175.1	-83.5	-88.2	0	0	0	113.9	P534	P534-Y536 PolarHBondContact O-N 2.61Å

Retrieved 536 of 536 residues in 1019.6 ms (Link to these results)

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