A0A077Z4Z3_TRITR Loading...

ATP dependent RNA helicase DDX25

AlphaFold DB , UniProt , Accession A0A077Z4Z3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 444 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.3	Very low	30.1	Very low	253 Å²	253	145.9 Å²	145.9	100%	1.246	86%	0.855	S	S	*	*				0	104.4	0	-78.3	-178.8	176.2	0	0	108.7
2	S	34.7	Very low	29.9	Very low	124 Å²	124	150.8 Å²	150.8	87%	0.867	86%	0.863	S	S	*	*			trans	169	114.1	157.6	173.1	0	0	0	0	106.2
3	K	30.9	Very low	30.2	Very low	193 Å²	193	145.6 Å²	145.6	84%	0.839	86%	0.863	S	S	*	*			trans	-84.5	132.1	-171.7	-79.5	177.7	171.8	177.6	0	110.4
4	S	29	Very low	30.4	Very low	92 Å²	92	141.1 Å²	141.1	64%	0.643	86%	0.862	S	S	*	*				61.8	134.3	114.5	78.3	0	0	0	0	117.8
5	N	31	Very low	30.6	Very low	155 Å²	155	141.5 Å²	141.5	83%	0.829	86%	0.857	S	S	*	*				-172	140.7	108.6	-88.1	-11.3	0	0	0	113.4
6	V	28.5	Very low	30.9	Very low	132 Å²	132	140.4 Å²	140.4	80%	0.8	85%	0.851	S	S	*	*			trans	-116.8	133.3	-178.7	159.8	0	0	0	0	107.1
7	V	29.3	Very low	31	Very low	142 Å²	142	138.8 Å²	138.8	86%	0.861	85%	0.848	S	S	*	*			trans	51.7	134	147	-176.4	0	0	0	0	120.9
8	G	32	Very low	31.3	Very low	79 Å²	79	137.1 Å²	137.1	81%	0.814	85%	0.85	S	S	*	*			trans	-166.5	136.8	158.7	0	0	0	0	0	113.1
9	R	23.7	Very low	31.4	Very low	243 Å²	243	139 Å²	139	92%	0.917	85%	0.854	S	S	*	*			trans	-123.9	136.7	-164.8	-158.7	-178	-177.3	178.9	0.1	110.7
10	A	28.7	Very low	31.5	Very low	98 Å²	98	135.8 Å²	135.8	81%	0.81	85%	0.85	S	S	*	*			trans	49.8	133.9	148.2	0	0	0	0	0	124.4
11	A	31.8	Very low	31.5	Very low	94 Å²	94	138.7 Å²	138.7	78%	0.777	85%	0.85	S	S	*	*			trans	169.2	118.2	136.4	0	0	0	0	0	109.7
12	Q	28.5	Very low	31.5	Very low	204 Å²	204	134.3 Å²	134.3	95%	0.953	83%	0.827	S	S	*	*				75	131	80.4	-81.7	-167.7	5.8	0	0	118.2
13	G	33	Very low	31.3	Very low	84 Å²	84	139.2 Å²	139.2	87%	0.866	83%	0.826	S	S	*	*			trans	114.8	109	161.8	0	0	0	0	0	113.4
14	G	32.8	Very low	31.1	Very low	82 Å²	82	136.6 Å²	136.6	85%	0.845	83%	0.826	S	S	*	*				120.8	151.1	67.6	0	0	0	0	0	106.4
15	D	33.9	Very low	31.1	Very low	148 Å²	148	142 Å²	142	79%	0.791	84%	0.839	S	S	*	*			cis	-173.2	169.2	3	-156.7	-1.8	0	0	0	107.7
16	T	35.2	Very low	30.9	Very low	124 Å²	124	140.2 Å²	140.2	76%	0.761	84%	0.838	S	S	*	*			trans	82	144.7	163.8	73	0	0	0	0	120.9
17	S	32.8	Very low	31	Very low	113 Å²	113	141.8 Å²	141.8	79%	0.79	84%	0.842	S	S	*	*			cis	172.3	127.3	-32.1	-84.3	0	0	0	0	105.9
18	A	37.3	Very low	30.9	Very low	108 Å²	108	143.8 Å²	143.8	89%	0.893	84%	0.842	S	S	*	*			trans	180	128.6	145	0	0	0	0	0	113.2
19	D	32.8	Very low	31	Very low	173 Å²	173	146.1 Å²	146.1	93%	0.925	84%	0.843	S	S	*	*			trans	-63.6	157.7	-177.8	-82.1	-55.1	0	0	0	117
20	G	33.2	Very low	31.4	Very low	75 Å²	75	142 Å²	142	77%	0.773	84%	0.839	S	S	*	*			trans	170.3	59	161.3	0	0	0	0	0	119.9
21	K	31.7	Very low	31.5	Very low	196 Å²	196	140.7 Å²	140.7	85%	0.852	84%	0.835	S	S	*	*			trans	15.2	118.6	148.2	-83.3	176.6	-179.2	171.5	0	120
22	Q	31.3	Very low	31.6	Very low	162 Å²	162	143.4 Å²	143.4	76%	0.757	84%	0.836	S	S	*	*				157.4	127.3	102.1	-100.7	173	19.1	0	0	115.7
23	R	31.1	Very low	32.2	Very low	227 Å²	227	137.2 Å²	137.2	86%	0.857	81%	0.809	S	S	*	*			trans	76	119.9	139.9	-73.8	177.6	169.6	-174.6	-3	121.9
24	T	25.5	Very low	32.3	Very low	137 Å²	137	137.1 Å²	137.1	84%	0.84	79%	0.793	S	S	*	*			trans	-59.9	139.7	174.3	50	0	0	0	0	116.3
25	K	29.8	Very low	32.3	Very low	207 Å²	207	138.9 Å²	138.9	90%	0.9	79%	0.792	S	S	*	*			trans	-148.1	147.4	140.3	-93.9	-174.5	-178	179.3	0	109.5
26	S	27.1	Very low	32.4	Very low	117 Å²	117	140.2 Å²	140.2	82%	0.818	79%	0.794	S	S	*	*			trans	-62.6	132.7	-170.2	49.3	0	0	0	0	116
27	D	30	Very low	32	Very low	165 Å²	165	146.3 Å²	146.3	88%	0.882	80%	0.803	S	S	*	*			trans	-104.3	119.4	167.4	-77.7	-31.9	0	0	0	111.3
28	Q	27	Very low	31.9	Very low	183 Å²	183	143.2 Å²	143.2	86%	0.855	78%	0.784	S	S	*	*			trans	-82.4	135.9	155.6	-74.6	-177.9	-17.3	0	0	108	N30	Q28-N30 PolarHBondContact O-N 3.09Å
29	P	34.3	Very low	31.4	Very low	129 Å²	129	143.8 Å²	143.8	84%	0.838	77%	0.772	S	S	*	*			trans	-80.6	104.3	-179.5	31.2	-29.7	0	0	0	109.9	G31	P29-G31 PolarHBondContact O-N 3.16Å
30	N	32	Very low	31.5	Very low	156 Å²	156	137.8 Å²	137.8	83%	0.834	75%	0.752	S	S	*	*			trans	-65.9	118.6	163.1	-106	-9.3	0	0	0	108.7	Q28 N32	Q28-N30 PolarHBondContact O-N 3.09Å; N30-N32 PolarHBondContact O-N 3.36Å
31	G	30.4	Very low	31.7	Very low	70 Å²	70	139.4 Å²	139.4	72%	0.722	75%	0.747	S	S	*	*			trans	-70.4	86.3	179.1	0	0	0	0	0	112.3	P29	P29-G31 PolarHBondContact O-N 3.16Å
32	N	34	Very low	32.1	Very low	152 Å²	152	137 Å²	137	81%	0.813	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-80.5	121.8	162.7	-88.7	-5.6	0	0	0	109.3	N30 P34	N30-N32 PolarHBondContact O-N 3.36Å; N32-P34 WeakPolarHBondContact O-CD 3.36Å
33	I	40.6	Very low	32.8	Very low	73 Å²	73	131.9 Å²	131.9	37%	0.374	72%	0.715	S	S	.	*	P	Polyproline II helix	trans	-65	120.7	167.3	-58.5	170.7	0	0	0	107	S35 A432	I33-S35 PolarHBondContact O-N 2.88Å; I33-A432 HydrophobicContact CD1-CB 3.6Å
34	P	36.5	Very low	33.9	Very low	83 Å²	83	124 Å²	124	54%	0.539	69%	0.689	S	S	.	*	P	Polyproline II helix	trans	-64.7	118.7	176.7	-17.1	29.8	0	0	0	109.9	N32 E36	N32-P34 WeakPolarHBondContact O-CD 3.36Å; P34-E36 VanDerWaalsContact C-N 3.3Å; P34-E36 PolarHBondContact O-N 2.74Å; P34-E36 VanDerWaalsContact O-N 3.14Å
35	S	32.9	Very low	35.4	Very low	118 Å²	118	120.1 Å²	120.1	83%	0.825	67%	0.668	S	S	*	*			trans	-83.1	72.7	171.7	66.4	0	0	0	0	110	I33 R37	I33-S35 PolarHBondContact O-N 2.88Å; S35-R37 PolarHBondContact O-N 2.77Å
36	E	34.2	Very low	36.8	Very low	176 Å²	176	111.2 Å²	111.2	82%	0.822	63%	0.63	S	S	*	*			trans	-83.2	100.2	165.8	-80.8	-179.7	163.3	0	0	108.3	P34 A38	P34-E36 VanDerWaalsContact C-N 3.3Å; P34-E36 PolarHBondContact O-N 2.74Å; P34-E36 VanDerWaalsContact O-N 3.14Å; E36-A38 PolarHBondContact O-N 3.37Å; E36-A38 VanDerWaalsContact O-N 3.16Å
37	R	26.7	Very low	38.5	Very low	252 Å²	252	106.2 Å²	106.2	95%	0.951	59%	0.593	S	S	*	*			trans	-71.9	96.9	161.2	-78.8	-179.4	175.3	170.4	-1.4	107	S35	S35-R37 PolarHBondContact O-N 2.77Å
38	A	30.8	Very low	40.3	Very low	48 Å²	48	102.2 Å²	102.2	40%	0.397	57%	0.571	S	S	.	*			trans	-76.5	132.8	168.6	0	0	0	0	0	109.3	E36 G40 E43	E36-A38 PolarHBondContact O-N 3.37Å; E36-A38 VanDerWaalsContact O-N 3.16Å; A38-G40 PolarHBondContact O-N 3.17Å; A38-E43 HydrophobicContact CB-CG 3.72Å; A38-E43 WeakPolarHBondContact CB-OE1 3.23Å
39	D	28.2	Very low	42.6	Very low	120 Å²	120	94 Å²	94	64%	0.642	53%	0.533	S	S	*	.			trans	-64.9	123.2	172.2	-157.8	-10.3	0	0	0	108.1	T41 E42	D39-T41 PolarHBondContact O-N 2.88Å; D39-E42 PolarHBondContact O-N 3.28Å
40	G	34	Very low	44.5	Very low	48 Å²	48	91.6 Å²	91.6	50%	0.495	53%	0.532	S	S	.	.	H	α-helix	trans	-62.2	-3.5	-167.5	0	0	0	0	0	115.5	A38	A38-G40 PolarHBondContact O-N 3.17Å
41	T	37.5	Very low	46.9	Very low	109 Å²	109	84.7 Å²	84.7	67%	0.669	50%	0.497	S	S	*	.	H	α-helix	trans	-84.6	-30.2	173.3	45.8	0	0	0	0	113.3	D39	D39-T41 PolarHBondContact O-N 2.88Å
42	E	40	Very low	49.6	Very low	145 Å²	145	83.7 Å²	83.7	68%	0.678	48%	0.479	S	S	*	.	H	α-helix	trans	-79	-34.3	178.9	-74.3	-164.1	159.7	0	0	112.6	D39 N44 S45	D39-E42 PolarHBondContact O-N 3.28Å; E42-N44 PolarHBondContact O-N 2.85Å; E42-S45 VanDerWaalsContact O-CB 3.32Å; E42-S45 WeakPolarHBondContact O-CB 3.23Å; E42-S45 PolarHBondContact O-N 3.4Å; E42-S45 PolarHBondContact O-OG 2.76Å
43	E	47.2	Very low	52.2	Low	55 Å²	55	76.8 Å²	76.8	26%	0.257	44%	0.441	S	S	.	.	H	α-helix	trans	-68.1	-32.9	-175.4	-68.6	-170.2	146.3	0	0	113.2	A38 S45	A38-E43 HydrophobicContact CB-CG 3.72Å; A38-E43 WeakPolarHBondContact CB-OE1 3.23Å; E43-S45 VanDerWaalsContact C-N 3.31Å; E43-S45 PolarHBondContact O-N 3.08Å
44	N	53.2	Low	54.3	Low	61 Å²	61	78.2 Å²	78.2	33%	0.326	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-78.6	-14.1	178.2	-77.4	-25.8	0	0	0	113.8	E42 Q46 Y47 L48 G393	E42-N44 PolarHBondContact O-N 2.85Å; N44-Q46 PolarHBondContact O-N 3.35Å; N44-Q46 VanDerWaalsContact O-N 3.17Å; N44-Y47 PolarHBondContact O-N 3.17Å; N44-L48 HydrophobicContact CB-CD1 4.48Å; N44-L48 PolarHBondContact O-N 3.46Å; N44-L48 VanDerWaalsContact O-N 3.13Å; N44-G393 WeakPolarHBondContact OD1-CA 3.44Å
45	S	56.1	Low	56.7	Low	56 Å²	56	79.9 Å²	79.9	39%	0.392	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-62.6	-23.9	-177.8	73.5	0	0	0	0	113.4	E42 E43 Y47 R76	E42-S45 VanDerWaalsContact O-CB 3.32Å; E42-S45 WeakPolarHBondContact O-CB 3.23Å; E42-S45 PolarHBondContact O-N 3.4Å; E42-S45 PolarHBondContact O-OG 2.76Å; E43-S45 VanDerWaalsContact C-N 3.31Å; E43-S45 PolarHBondContact O-N 3.08Å; S45-Y47 VanDerWaalsContact C-N 3.29Å; S45-Y47 PolarHBondContact O-N 3.31Å; S45-R76 PolarHBondContact O-NE 2.82Å; S45-R76 PolarHBondContact O-NH2 2.93Å
46	Q	60.9	Low	59.3	Low	20 Å²	20	74.5 Å²	74.5	9%	0.093	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-68.5	-29.8	176.2	-173.9	175	2.7	0	0	112	N44 R76 E263 Y265	N44-Q46 PolarHBondContact O-N 3.35Å; N44-Q46 VanDerWaalsContact O-N 3.17Å; Q46-R76 WeakPolarHBondContact O-CD 3.46Å; Q46-E263 PolarHBondContact NE2-O 3.27Å; Q46-Y265 PolarHBondContact NE2-O 3.22Å; Q46-Y265 VanDerWaalsContact NE2-O 3.12Å
47	Y	62.6	Low	61.8	Low	12 Å²	12	76 Å²	76	5%	0.047	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-44	-174.4	-57.2	-80.9	0	0	0	112.2	N44 S45 S75 R76 H98	N44-Y47 PolarHBondContact O-N 3.17Å; S45-Y47 VanDerWaalsContact C-N 3.29Å; S45-Y47 PolarHBondContact O-N 3.31Å; Y47-S75 CarbonylContact O-C 3.6Å; Y47-S75 WeakPolarHBondContact O-CA 3.32Å; Y47-S75 WeakPolarHBondContact O-CB 3.3Å; Y47-R76 PolarHBondContact O-N 2.85Å; Y47-H98 AromaticContact CD1-CE1 3.49Å; Y47-H98 VanDerWaalsContact CD1-CE1 3.49Å; Y47-H98 WeakPolarHBondContact CD1-CE1 3.25Å; Y47-H98 AromaticContact CD1-NE2 3.66Å; Y47-H98 AromaticContact CE1-CE1 3.16Å; Y47-H98 WeakPolarHBondContact CE1-CE1 3.43Å; Y47-H98 AromaticContact CE1-NE2 3.47Å; Y47-H98 WeakPolarHBondContact CE1-NE2 3.42Å
48	L	67.9	Low	64.8	Low	81 Å²	81	64.9 Å²	64.9	42%	0.424	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-86	142.1	-173.2	-63.8	175.6	0	0	0	112.4	N44	N44-L48 HydrophobicContact CB-CD1 4.48Å; N44-L48 PolarHBondContact O-N 3.46Å; N44-L48 VanDerWaalsContact O-N 3.13Å
49	S	73.5	Confident	67.8	Low	9 Å²	9	65.5 Å²	65.5	6%	0.063	36%	0.364	C	S	.	.			trans	-82	161.5	166.4	67.5	0	0	0	0	111.1	A51 P74 E79	S49-A51 PolarHBondContact OG-N 3.13Å; S49-P74 VanDerWaalsContact CB-O 3.3Å; S49-P74 WeakPolarHBondContact CB-O 3.05Å; S49-P74 PolarHBondContact N-O 3.13Å; S49-P74 WeakPolarHBondContact OG-CD 3.11Å; S49-P74 WeakPolarHBondContact OG-CG 3.43Å; S49-P74 PolarHBondContact OG-O 3.06Å; S49-E79 WeakPolarHBondContact CB-OE2 3.36Å
50	G	75.4	Confident	70.8	Confident	79 Å²	79	67 Å²	67	81%	0.814	36%	0.364	S	S	*	.	S	Bend	trans	-78.8	-4.3	166.5	0	0	0	0	0	113.6
51	A	83.1	Confident	73.7	Confident	11 Å²	11	66.6 Å²	66.6	9%	0.091	35%	0.353	C	S	.	.			trans	-85.3	171.2	-174.9	0	0	0	0	0	112.9	S49 F56 P74	S49-A51 PolarHBondContact OG-N 3.13Å; A51-F56 HydrophobicContact CB-CE2 4.06Å; A51-F56 HydrophobicContact CB-CZ 4.01Å; A51-P74 HydrophobicContact CB-CG 4.28Å; A51-P74 WeakPolarHBondContact O-CD 3.22Å
52	C	86.3	Confident	76.2	Confident	50 Å²	50	61.4 Å²	61.4	34%	0.338	32%	0.321	S	S	.	.			trans	-119.5	148.2	171.8	-66.7	0	0	0	0	108.8	E54 N55 F56	C52-E54 WeakPolarHBondContact CB-OE2 3.3Å; C52-E54 PolarHBondContact O-N 3.17Å; C52-N55 WeakPolarHBondContact O-CB 3.41Å; C52-N55 PolarHBondContact O-N 3.39Å; C52-N55 VanDerWaalsContact O-N 3.09Å; C52-F56 WeakPolarHBondContact O-CD2 3.35Å; C52-F56 VanDerWaalsContact O-CE2 3.3Å; C52-F56 WeakPolarHBondContact O-CE2 3.33Å
53	F	87.5	Confident	78.6	Confident	7 Å²	7	56.1 Å²	56.1	3%	0.031	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-61.5	-29.2	-178	-78.4	-74.3	0	0	0	112.8	N55 F56 L58 L63 L66 L71 K73 P74 L82 L109	F53-N55 PolarHBondContact O-N 2.89Å; F53-N55 VanDerWaalsContact O-N 3.16Å; F53-F56 PolarHBondContact O-N 2.91Å; F53-L58 HydrophobicContact CB-CD1 4.44Å; F53-L58 HydrophobicContact CD1-CD1 4.27Å; F53-L63 HydrophobicContact CB-CD2 3.97Å; F53-L66 HydrophobicContact CB-CD1 4.19Å; F53-L66 HydrophobicContact CD1-CD1 3.65Å; F53-L66 HydrophobicContact CD2-CD1 4.29Å; F53-L66 HydrophobicContact CE1-CD1 4.01Å; F53-L66 HydrophobicContact CE1-CD2 4.5Å; F53-L66 HydrophobicContact CG-CD1 3.8Å; F53-L66 HydrophobicContact CZ-CD1 4.46Å; F53-L66 HydrophobicContact CZ-CD2 4.41Å; F53-L71 HydrophobicContact CE2-CB 4Å; F53-L71 HydrophobicContact CZ-CB 4.35Å; F53-L71 HydrophobicContact CZ-CD1 4.41Å; F53-K73 VanDerWaalsContact CE2-C 3.43Å; F53-P74 HydrophobicContact CD1-CB 4.24Å; F53-P74 HydrophobicContact CD1-CG 4.21Å; F53-P74 HydrophobicContact CD2-CG 4.42Å; F53-P74 HydrophobicContact CE1-CB 3.75Å; F53-P74 HydrophobicContact CE1-CG 4.21Å; F53-P74 HydrophobicContact CE2-CB 4.3Å; F53-P74 HydrophobicContact CE2-CG 4.41Å; F53-P74 HydrophobicContact CG-CG 4.33Å; F53-P74 VanDerWaalsContact CZ-CA 3.46Å; F53-P74 HydrophobicContact CZ-CB 3.79Å; F53-P74 HydrophobicContact CZ-CG 4.31Å; F53-L82 HydrophobicContact CD1-CD1 3.94Å; F53-L82 HydrophobicContact CE1-CD1 3.99Å; F53-L109 HydrophobicContact CE1-CD1 3.99Å
54	E	86.3	Confident	80.7	Confident	103 Å²	103	57 Å²	57	48%	0.481	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-60.3	-22.3	177	-64.6	81.8	176	0	0	112.7	C52 F56	C52-E54 WeakPolarHBondContact CB-OE2 3.3Å; C52-E54 PolarHBondContact O-N 3.17Å; E54-F56 VanDerWaalsContact C-N 3.26Å; E54-F56 PolarHBondContact O-N 3.14Å
55	N	87.1	Confident	82.4	Confident	117 Å²	117	54.1 Å²	54.1	63%	0.626	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-74.8	-13.1	179.9	-64	-14.7	0	0	0	113.4	C52 F53	C52-N55 WeakPolarHBondContact O-CB 3.41Å; C52-N55 PolarHBondContact O-N 3.39Å; C52-N55 VanDerWaalsContact O-N 3.09Å; F53-N55 PolarHBondContact O-N 2.89Å; F53-N55 VanDerWaalsContact O-N 3.16Å
56	F	86.5	Confident	83.9	Confident	5 Å²	5	51.8 Å²	51.8	2%	0.022	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-100.3	16.3	-170.4	-60.3	-83	0	0	0	114.9	A51 C52 F53 E54 L58 P74 E79 L82 H83	A51-F56 HydrophobicContact CB-CE2 4.06Å; A51-F56 HydrophobicContact CB-CZ 4.01Å; C52-F56 WeakPolarHBondContact O-CD2 3.35Å; C52-F56 VanDerWaalsContact O-CE2 3.3Å; C52-F56 WeakPolarHBondContact O-CE2 3.33Å; F53-F56 PolarHBondContact O-N 2.91Å; E54-F56 VanDerWaalsContact C-N 3.26Å; E54-F56 PolarHBondContact O-N 3.14Å; F56-L58 HydrophobicContact CB-CD2 4.47Å; F56-L58 HydrophobicContact CB-CG 4.14Å; F56-L58 PolarHBondContact O-N 3.32Å; F56-L58 VanDerWaalsContact O-N 3.08Å; F56-P74 HydrophobicContact CE2-CG 3.84Å; F56-E79 HydrophobicContact CE1-CG 4.41Å; F56-E79 HydrophobicContact CZ-CB 4.08Å; F56-E79 HydrophobicContact CZ-CG 3.96Å; F56-L82 HydrophobicContact CB-CB 4.21Å; F56-L82 HydrophobicContact CB-CD1 4.46Å; F56-L82 HydrophobicContact CD1-CB 3.4Å; F56-L82 HydrophobicContact CD1-CD1 4.46Å; F56-L82 HydrophobicContact CD2-CB 4.39Å; F56-L82 HydrophobicContact CD2-CD1 3.97Å; F56-L82 HydrophobicContact CE1-CB 3.77Å; F56-L82 HydrophobicContact CE2-CD1 4.33Å; F56-L82 HydrophobicContact CG-CB 3.74Å; F56-L82 HydrophobicContact CG-CD1 4.04Å; F56-L82 HydrophobicContact CG-CG 4.49Å; F56-L82 HydrophobicContact CZ-CB 4.43Å; F56-H83 AromaticContact CE1-CD2 3.73Å; F56-H83 AromaticContact CE1-CE1 3.57Å; F56-H83 AromaticContact CE1-CG 3.79Å; F56-H83 AromaticContact CE1-ND1 3.7Å; F56-H83 AromaticContact CE1-NE2 3.6Å
57	R	87.6	Confident	84.6	Confident	208 Å²	208	58 Å²	58	79%	0.785	30%	0.297	S	S	*	.			trans	48.5	37.6	179.2	-60.4	-176.7	179.6	-176.6	0.5	113.6	Q113	R57-Q113 PolarHBondContact O-NE2 3.03Å
58	L	90	Very high	85.1	Confident	18 Å²	18	63.1 Å²	63.1	9%	0.094	33%	0.325	C	S	.	.			trans	-66.7	149.8	177.7	-63.4	177.4	0	0	0	110.8	F53 F56 K60 L63 L66 L82 L109	F53-L58 HydrophobicContact CB-CD1 4.44Å; F53-L58 HydrophobicContact CD1-CD1 4.27Å; F56-L58 HydrophobicContact CB-CD2 4.47Å; F56-L58 HydrophobicContact CB-CG 4.14Å; F56-L58 PolarHBondContact O-N 3.32Å; F56-L58 VanDerWaalsContact O-N 3.08Å; L58-K60 PolarHBondContact O-N 2.84Å; L58-L63 HydrophobicContact CB-CD2 4.12Å; L58-L63 HydrophobicContact CB-CG 4.14Å; L58-L63 HydrophobicContact CD1-CD2 3.97Å; L58-L66 HydrophobicContact CD1-CD1 4.07Å; L58-L82 HydrophobicContact CD2-CD2 4.03Å; L58-L109 HydrophobicContact CD1-CD2 4.46Å
59	K	92.1	Very high	85.2	Confident	62 Å²	62	62.1 Å²	62.1	27%	0.27	32%	0.316	S	S	.	.			trans	-56.6	138.5	170.5	-68.1	171.7	-173.9	162.3	0	109.3	L62 L63 L112 Q113 V115 M148	K59-L62 HydrophobicContact CB-CD1 4.11Å; K59-L62 HydrophobicContact CB-CG 4.04Å; K59-L62 WeakPolarHBondContact O-CB 3.34Å; K59-L62 PolarHBondContact O-N 3.42Å; K59-L63 PolarHBondContact O-N 2.99Å; K59-L112 PolarHBondContact NZ-O 3.42Å; K59-Q113 WeakPolarHBondContact CE-O 3.48Å; K59-Q113 PolarHBondContact NZ-O 3.13Å; K59-V115 PolarHBondContact NZ-O 3.39Å; K59-M148 HydrophobicContact CD-CE 4.22Å
60	K	92.4	Very high	85	Confident	150 Å²	150	67.4 Å²	67.4	65%	0.652	35%	0.35	S	S	*	.	H	α-helix	trans	-51.4	-45	-178.7	-176.4	-176.3	178.2	-166.4	0	113.8	L58 L62 L63 E64	L58-K60 PolarHBondContact O-N 2.84Å; K60-L62 PolarHBondContact O-N 3.35Å; K60-L63 PolarHBondContact O-N 3.35Å; K60-L63 VanDerWaalsContact O-N 3.13Å; K60-E64 VanDerWaalsContact CE-OE1 3.23Å; K60-E64 WeakPolarHBondContact CE-OE1 2.94Å; K60-E64 IonicContact NZ-OE1 3.98Å; K60-E64 PolarHBondContact O-N 3.24Å; K60-E64 VanDerWaalsContact O-N 3.14Å
61	P	93.4	Very high	84.7	Confident	41 Å²	41	64.7 Å²	64.7	27%	0.266	32%	0.317	S	S	.	.	H	α-helix	trans	-57.1	-28.7	174.4	-30.3	38.2	0	0	0	115.4	G65 F147 M148	P61-G65 PolarHBondContact O-N 3.23Å; P61-F147 HydrophobicContact CB-CB 4.08Å; P61-F147 WeakPolarHBondContact CB-O 2.96Å; P61-M148 HydrophobicContact CB-CG 3.76Å
62	L	91.9	Very high	84.3	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-74.4	-38.3	178.1	-56.7	-178.8	0	0	0	111.8	K59 K60 E64 G65 L66 L109 L112 Q113 M148	K59-L62 HydrophobicContact CB-CD1 4.11Å; K59-L62 HydrophobicContact CB-CG 4.04Å; K59-L62 WeakPolarHBondContact O-CB 3.34Å; K59-L62 PolarHBondContact O-N 3.42Å; K60-L62 PolarHBondContact O-N 3.35Å; L62-E64 VanDerWaalsContact C-N 3.32Å; L62-G65 PolarHBondContact O-N 3.44Å; L62-L66 WeakPolarHBondContact O-CB 3.41Å; L62-L66 VanDerWaalsContact O-CG 3.31Å; L62-L66 WeakPolarHBondContact O-CG 3.48Å; L62-L66 PolarHBondContact O-N 2.76Å; L62-L109 HydrophobicContact CB-CD2 4.38Å; L62-L112 HydrophobicContact CD1-CB 4.18Å; L62-L112 HydrophobicContact CD2-CB 3.5Å; L62-L112 VanDerWaalsContact CD2-CB 3.5Å; L62-L112 HydrophobicContact CD2-CD1 4.06Å; L62-L112 HydrophobicContact CD2-CG 4.3Å; L62-Q113 HydrophobicContact CD1-CB 4.11Å; L62-Q113 VanDerWaalsContact CD1-OE1 3.26Å; L62-M148 HydrophobicContact CD2-CG 4.17Å; L62-M148 HydrophobicContact CD2-SD 3.5Å; L62-M148 VanDerWaalsContact CD2-SD 3.5Å; L62-M148 HydrophobicContact CG-SD 4.5Å
63	L	90.3	Very high	84.2	Confident	34 Å²	34	75 Å²	75	18%	0.178	36%	0.356	C	S	.	.	H	α-helix	trans	-62.4	-43.6	173.9	-66.1	173	0	0	0	110	F53 L58 K59 K60 G65 L66 F67	F53-L63 HydrophobicContact CB-CD2 3.97Å; L58-L63 HydrophobicContact CB-CD2 4.12Å; L58-L63 HydrophobicContact CB-CG 4.14Å; L58-L63 HydrophobicContact CD1-CD2 3.97Å; K59-L63 PolarHBondContact O-N 2.99Å; K60-L63 PolarHBondContact O-N 3.35Å; K60-L63 VanDerWaalsContact O-N 3.13Å; L63-G65 PolarHBondContact O-N 3.44Å; L63-L66 PolarHBondContact O-N 3.01Å; L63-F67 WeakPolarHBondContact O-CD2 3.12Å; L63-F67 PolarHBondContact O-N 3.24Å
64	E	90.1	Very high	84.2	Confident	73 Å²	73	74.6 Å²	74.6	34%	0.341	36%	0.355	S	S	.	.	H	α-helix	trans	-60.2	-43.7	174.2	-67.8	178	-161	0	0	112.1	K60 L62 L66 F67 N68 F147	K60-E64 VanDerWaalsContact CE-OE1 3.23Å; K60-E64 WeakPolarHBondContact CE-OE1 2.94Å; K60-E64 IonicContact NZ-OE1 3.98Å; K60-E64 PolarHBondContact O-N 3.24Å; K60-E64 VanDerWaalsContact O-N 3.14Å; L62-E64 VanDerWaalsContact C-N 3.32Å; E64-L66 VanDerWaalsContact C-N 3.32Å; E64-L66 PolarHBondContact O-N 2.98Å; E64-F67 PolarHBondContact O-N 2.98Å; E64-N68 PolarHBondContact O-N 2.94Å; E64-F147 VanDerWaalsContact C-CE2 3.49Å; E64-F147 HydrophobicContact CB-CB 4.3Å; E64-F147 HydrophobicContact CB-CD1 4.39Å; E64-F147 HydrophobicContact CB-CD2 3.7Å; E64-F147 HydrophobicContact CB-CE2 3.98Å; E64-F147 HydrophobicContact CB-CG 3.89Å; E64-F147 HydrophobicContact CB-CZ 4.45Å; E64-F147 WeakPolarHBondContact O-CE2 3.49Å
65	G	89.8	Confident	84.2	Confident	1 Å²	1	70 Å²	70	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-35.2	175.4	0	0	0	0	0	113.6	P61 L62 L63 N68 I144	P61-G65 PolarHBondContact O-N 3.23Å; L62-G65 PolarHBondContact O-N 3.44Å; L63-G65 PolarHBondContact O-N 3.44Å; G65-N68 PolarHBondContact O-N 2.85Å; G65-I144 WeakPolarHBondContact CA-O 3.44Å
66	L	86.7	Confident	84.1	Confident	6 Å²	6	69.3 Å²	69.3	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-68.2	-35.4	174.7	-76.1	170.5	0	0	0	112.4	F53 L58 L62 L63 E64 N68 Y69 L71 L109	F53-L66 HydrophobicContact CB-CD1 4.19Å; F53-L66 HydrophobicContact CD1-CD1 3.65Å; F53-L66 HydrophobicContact CD2-CD1 4.29Å; F53-L66 HydrophobicContact CE1-CD1 4.01Å; F53-L66 HydrophobicContact CE1-CD2 4.5Å; F53-L66 HydrophobicContact CG-CD1 3.8Å; F53-L66 HydrophobicContact CZ-CD1 4.46Å; F53-L66 HydrophobicContact CZ-CD2 4.41Å; L58-L66 HydrophobicContact CD1-CD1 4.07Å; L62-L66 WeakPolarHBondContact O-CB 3.41Å; L62-L66 VanDerWaalsContact O-CG 3.31Å; L62-L66 WeakPolarHBondContact O-CG 3.48Å; L62-L66 PolarHBondContact O-N 2.76Å; L63-L66 PolarHBondContact O-N 3.01Å; E64-L66 VanDerWaalsContact C-N 3.32Å; E64-L66 PolarHBondContact O-N 2.98Å; L66-N68 PolarHBondContact O-N 3.46Å; L66-Y69 CarbonylContact O-C 3.5Å; L66-Y69 WeakPolarHBondContact O-CA 3.18Å; L66-Y69 WeakPolarHBondContact O-CB 3.15Å; L66-Y69 PolarHBondContact O-N 3.33Å; L66-L71 HydrophobicContact CD2-CD1 4.49Å; L66-L109 HydrophobicContact CD1-CD1 4.24Å; L66-L109 HydrophobicContact CD1-CD2 3.79Å; L66-L109 HydrophobicContact CD2-CD1 4.21Å; L66-L109 HydrophobicContact CD2-CD2 4.13Å; L66-L109 HydrophobicContact CG-CD2 4.04Å
67	F	76.5	Confident	84.1	Confident	152 Å²	152	69.7 Å²	69.7	67%	0.667	33%	0.325	S	S	*	.	H	α-helix	trans	-64.4	-27.7	175.9	-76.8	-64.3	0	0	0	113.4	L63 E64 Y69	L63-F67 WeakPolarHBondContact O-CD2 3.12Å; L63-F67 PolarHBondContact O-N 3.24Å; E64-F67 PolarHBondContact O-N 2.98Å; F67-Y69 PolarHBondContact O-N 2.8Å
68	N	71.8	Confident	84.3	Confident	119 Å²	119	59.8 Å²	59.8	64%	0.636	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-6.9	172.4	-80.2	-11.6	0	0	0	113.4	E64 G65 L66 F147	E64-N68 PolarHBondContact O-N 2.94Å; G65-N68 PolarHBondContact O-N 2.85Å; L66-N68 PolarHBondContact O-N 3.46Å; N68-F147 WeakPolarHBondContact ND2-CE2 3.4Å; N68-F147 WeakPolarHBondContact ND2-CZ 3.09Å
69	Y	71.1	Confident	84.3	Confident	59 Å²	59	61.6 Å²	61.6	23%	0.231	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	141.6	176.2	-165.3	-94	0	0	0	108.6	L66 F67 L71 M140	L66-Y69 CarbonylContact O-C 3.5Å; L66-Y69 WeakPolarHBondContact O-CA 3.18Å; L66-Y69 WeakPolarHBondContact O-CB 3.15Å; L66-Y69 PolarHBondContact O-N 3.33Å; F67-Y69 PolarHBondContact O-N 2.8Å; Y69-L71 HydrophobicContact CD1-CB 3.95Å; Y69-L71 HydrophobicContact CD1-CD1 3.31Å; Y69-L71 HydrophobicContact CD1-CG 3.34Å; Y69-L71 HydrophobicContact CE1-CD1 3.38Å; Y69-L71 HydrophobicContact CE1-CD2 4.33Å; Y69-L71 HydrophobicContact CE1-CG 3.45Å; Y69-L71 VanDerWaalsContact CE1-CG 3.45Å; Y69-L71 PolarHBondContact O-N 2.89Å; Y69-M140 HydrophobicContact CD2-SD 4.41Å; Y69-M140 HydrophobicContact CE2-CE 3.85Å; Y69-M140 HydrophobicContact CE2-SD 3.95Å
70	P	68.2	Low	84.1	Confident	120 Å²	120	60.1 Å²	60.1	78%	0.779	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	56.8	-177.9	31.8	-36.7	0	0	0	112
71	L	69.5	Low	84	Confident	23 Å²	23	53 Å²	53	12%	0.12	26%	0.264	C	S	.	.			trans	-119.6	93.5	172.5	-77.4	170.1	0	0	0	108.8	F53 L66 Y69 K73 A105 F392	F53-L71 HydrophobicContact CE2-CB 4Å; F53-L71 HydrophobicContact CZ-CB 4.35Å; F53-L71 HydrophobicContact CZ-CD1 4.41Å; L66-L71 HydrophobicContact CD2-CD1 4.49Å; Y69-L71 HydrophobicContact CD1-CB 3.95Å; Y69-L71 HydrophobicContact CD1-CD1 3.31Å; Y69-L71 HydrophobicContact CD1-CG 3.34Å; Y69-L71 HydrophobicContact CE1-CD1 3.38Å; Y69-L71 HydrophobicContact CE1-CD2 4.33Å; Y69-L71 HydrophobicContact CE1-CG 3.45Å; Y69-L71 VanDerWaalsContact CE1-CG 3.45Å; Y69-L71 PolarHBondContact O-N 2.89Å; L71-K73 VanDerWaalsContact C-N 3.32Å; L71-A105 HydrophobicContact CD1-CB 4.33Å; L71-F392 HydrophobicContact CD2-CE1 4.49Å
72	E	74.6	Confident	83.7	Confident	182 Å²	182	51.1 Å²	51.1	85%	0.85	25%	0.252	S	S	*	.	S	Bend	trans	-70	-32.2	173.9	-63.8	-175.9	171	0	0	112.1
73	K	84.1	Confident	83.4	Confident	94 Å²	94	55.3 Å²	55.3	41%	0.409	27%	0.271	S	S	.	.	S	Bend	trans	-138.9	150.3	-177	-66.9	-175.2	-178.8	178.8	0	110.9	F53 L71	F53-K73 VanDerWaalsContact CE2-C 3.43Å; L71-K73 VanDerWaalsContact C-N 3.32Å
74	P	87.8	Confident	83	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.269	C	S	.	.			trans	-64.8	147.7	173.8	8.9	-2.2	0	0	0	110.6	S49 A51 F53 F56 Q78	S49-P74 VanDerWaalsContact CB-O 3.3Å; S49-P74 WeakPolarHBondContact CB-O 3.05Å; S49-P74 PolarHBondContact N-O 3.13Å; S49-P74 WeakPolarHBondContact OG-CD 3.11Å; S49-P74 WeakPolarHBondContact OG-CG 3.43Å; S49-P74 PolarHBondContact OG-O 3.06Å; A51-P74 HydrophobicContact CB-CG 4.28Å; A51-P74 WeakPolarHBondContact O-CD 3.22Å; F53-P74 HydrophobicContact CD1-CB 4.24Å; F53-P74 HydrophobicContact CD1-CG 4.21Å; F53-P74 HydrophobicContact CD2-CG 4.42Å; F53-P74 HydrophobicContact CE1-CB 3.75Å; F53-P74 HydrophobicContact CE1-CG 4.21Å; F53-P74 HydrophobicContact CE2-CB 4.3Å; F53-P74 HydrophobicContact CE2-CG 4.41Å; F53-P74 HydrophobicContact CG-CG 4.33Å; F53-P74 VanDerWaalsContact CZ-CA 3.46Å; F53-P74 HydrophobicContact CZ-CB 3.79Å; F53-P74 HydrophobicContact CZ-CG 4.31Å; F56-P74 HydrophobicContact CE2-CG 3.84Å; P74-Q78 VanDerWaalsContact CA-OE1 3.27Å; P74-Q78 HydrophobicContact CB-CB 3.85Å
75	S	86.1	Confident	82.4	Confident	7 Å²	7	52.5 Å²	52.5	5%	0.049	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-71.2	162.8	162.9	74.4	0	0	0	0	111.2	Y47 V77 Q78 E79 S101	Y47-S75 CarbonylContact O-C 3.6Å; Y47-S75 WeakPolarHBondContact O-CA 3.32Å; Y47-S75 WeakPolarHBondContact O-CB 3.3Å; S75-V77 PolarHBondContact O-N 2.78Å; S75-V77 VanDerWaalsContact OG-CG1 3.28Å; S75-V77 WeakPolarHBondContact OG-CG1 3.4Å; S75-Q78 WeakPolarHBondContact O-CA 3.45Å; S75-Q78 WeakPolarHBondContact O-CB 3.33Å; S75-Q78 PolarHBondContact O-N 2.65Å; S75-Q78 VanDerWaalsContact OG-CG 3.28Å; S75-Q78 WeakPolarHBondContact OG-CG 3.31Å; S75-Q78 PolarHBondContact OG-N 2.68Å; S75-E79 PolarHBondContact O-N 2.65Å; S75-S101 VanDerWaalsContact CB-O 3.24Å; S75-S101 WeakPolarHBondContact CB-O 3.45Å; S75-S101 PolarHBondContact OG-O 3.26Å
76	R	85.8	Confident	81.6	Confident	101 Å²	101	54 Å²	54	38%	0.381	27%	0.272	S	S	.	.	H	α-helix	trans	-55.2	-39.2	177	-67	-171.1	-179.9	-171.9	-1.4	112.9	S45 Q46 Y47 A80 E263	S45-R76 PolarHBondContact O-NE 2.82Å; S45-R76 PolarHBondContact O-NH2 2.93Å; Q46-R76 WeakPolarHBondContact O-CD 3.46Å; Y47-R76 PolarHBondContact O-N 2.85Å; R76-A80 WeakPolarHBondContact O-CB 3.14Å; R76-A80 PolarHBondContact O-N 3.46Å; R76-E263 IonicContact NH1-OE1 3.41Å; R76-E263 PolarHBondContact NH1-OE1 3.27Å
77	V	86.9	Confident	80.6	Confident	13 Å²	13	58.4 Å²	58.4	8%	0.079	30%	0.296	C	S	.	.	H	α-helix	trans	-70.4	-35.4	176.4	69	0	0	0	0	111.5	S75 V81 V95 S101	S75-V77 PolarHBondContact O-N 2.78Å; S75-V77 VanDerWaalsContact OG-CG1 3.28Å; S75-V77 WeakPolarHBondContact OG-CG1 3.4Å; V77-V81 HydrophobicContact CG2-CG2 4.29Å; V77-V81 WeakPolarHBondContact O-CB 3.22Å; V77-V81 WeakPolarHBondContact O-CG2 3.42Å; V77-V81 PolarHBondContact O-N 3.43Å; V77-V95 HydrophobicContact CG2-CG1 3.5Å; V77-V95 VanDerWaalsContact CG2-CG1 3.5Å; V77-S101 WeakPolarHBondContact CG1-O 3.46Å; V77-S101 WeakPolarHBondContact CG1-OG 3.44Å
78	Q	90.4	Very high	79.8	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-66.4	-47.3	176.1	-72.4	164.8	-3.1	0	0	110.1	P74 S75 A80 V81 L82 G102 A106	P74-Q78 VanDerWaalsContact CA-OE1 3.27Å; P74-Q78 HydrophobicContact CB-CB 3.85Å; S75-Q78 WeakPolarHBondContact O-CA 3.45Å; S75-Q78 WeakPolarHBondContact O-CB 3.33Å; S75-Q78 PolarHBondContact O-N 2.65Å; S75-Q78 VanDerWaalsContact OG-CG 3.28Å; S75-Q78 WeakPolarHBondContact OG-CG 3.31Å; S75-Q78 PolarHBondContact OG-N 2.68Å; Q78-A80 PolarHBondContact O-N 3.21Å; Q78-V81 PolarHBondContact O-N 2.88Å; Q78-L82 WeakPolarHBondContact O-CB 3.16Å; Q78-L82 WeakPolarHBondContact O-CG 3.04Å; Q78-L82 PolarHBondContact O-N 3.23Å; Q78-G102 PolarHBondContact NE2-O 3.2Å; Q78-G102 VanDerWaalsContact NE2-O 3.09Å; Q78-A106 HydrophobicContact CB-CB 4.41Å; Q78-A106 HydrophobicContact CG-CB 3.76Å
79	E	90	Very high	79.4	Confident	55 Å²	55	60 Å²	60	26%	0.257	31%	0.305	S	S	.	.	H	α-helix	trans	-54.6	-51.5	173.6	168.7	176.5	-138.9	0	0	111.5	S49 F56 S75 V81 L82 H83	S49-E79 WeakPolarHBondContact CB-OE2 3.36Å; F56-E79 HydrophobicContact CE1-CG 4.41Å; F56-E79 HydrophobicContact CZ-CB 4.08Å; F56-E79 HydrophobicContact CZ-CG 3.96Å; S75-E79 PolarHBondContact O-N 2.65Å; E79-V81 VanDerWaalsContact C-N 3.35Å; E79-V81 PolarHBondContact O-N 3.32Å; E79-L82 PolarHBondContact O-N 3.21Å; E79-H83 PolarHBondContact O-CD2 3.05Å; E79-H83 PolarHBondContact O-N 2.98Å; E79-H83 IonicContact OE1-NE2 3.08Å
80	A	88	Confident	79.6	Confident	31 Å²	31	60 Å²	60	26%	0.256	31%	0.313	S	S	.	.	H	α-helix	trans	-60.5	-42.9	-178.7	0	0	0	0	0	112.5	R76 Q78 I257	R76-A80 WeakPolarHBondContact O-CB 3.14Å; R76-A80 PolarHBondContact O-N 3.46Å; Q78-A80 PolarHBondContact O-N 3.21Å; A80-I257 HydrophobicContact CB-CD1 3.93Å; A80-I257 HydrophobicContact CB-CG2 4.23Å
81	V	90.1	Very high	80.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-70.5	-43.7	178	171.5	0	0	0	0	111.6	V77 Q78 E79 H83 V84 I85 V95 A106 C110 F235 I257	V77-V81 HydrophobicContact CG2-CG2 4.29Å; V77-V81 WeakPolarHBondContact O-CB 3.22Å; V77-V81 WeakPolarHBondContact O-CG2 3.42Å; V77-V81 PolarHBondContact O-N 3.43Å; Q78-V81 PolarHBondContact O-N 2.88Å; E79-V81 VanDerWaalsContact C-N 3.35Å; E79-V81 PolarHBondContact O-N 3.32Å; V81-H83 VanDerWaalsContact C-N 3.33Å; V81-H83 PolarHBondContact O-N 2.98Å; V81-V84 PolarHBondContact O-N 3.25Å; V81-I85 HydrophobicContact CG1-CD1 4.16Å; V81-I85 PolarHBondContact O-N 3.47Å; V81-V95 HydrophobicContact CG2-CG1 4.25Å; V81-V95 HydrophobicContact CG2-CG2 3.88Å; V81-A106 HydrophobicContact CB-CB 4.3Å; V81-A106 HydrophobicContact CG1-CB 4.31Å; V81-A106 HydrophobicContact CG2-CB 4.47Å; V81-C110 WeakPolarHBondContact CG1-SG 3.49Å; V81-F235 HydrophobicContact CG1-CZ 4.41Å; V81-F235 HydrophobicContact CG2-CE1 4.01Å; V81-F235 HydrophobicContact CG2-CZ 4.17Å; V81-I257 HydrophobicContact CG2-CD1 4.46Å
82	L	88.9	Confident	81.6	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-66.1	-34.4	-178.6	-72.7	175.5	0	0	0	112	F53 F56 L58 Q78 E79 V84 I85 A86 L109	F53-L82 HydrophobicContact CD1-CD1 3.94Å; F53-L82 HydrophobicContact CE1-CD1 3.99Å; F56-L82 HydrophobicContact CB-CB 4.21Å; F56-L82 HydrophobicContact CB-CD1 4.46Å; F56-L82 HydrophobicContact CD1-CB 3.4Å; F56-L82 HydrophobicContact CD1-CD1 4.46Å; F56-L82 HydrophobicContact CD2-CB 4.39Å; F56-L82 HydrophobicContact CD2-CD1 3.97Å; F56-L82 HydrophobicContact CE1-CB 3.77Å; F56-L82 HydrophobicContact CE2-CD1 4.33Å; F56-L82 HydrophobicContact CG-CB 3.74Å; F56-L82 HydrophobicContact CG-CD1 4.04Å; F56-L82 HydrophobicContact CG-CG 4.49Å; F56-L82 HydrophobicContact CZ-CB 4.43Å; L58-L82 HydrophobicContact CD2-CD2 4.03Å; Q78-L82 WeakPolarHBondContact O-CB 3.16Å; Q78-L82 WeakPolarHBondContact O-CG 3.04Å; Q78-L82 PolarHBondContact O-N 3.23Å; E79-L82 PolarHBondContact O-N 3.21Å; L82-V84 VanDerWaalsContact C-N 3.32Å; L82-V84 PolarHBondContact O-N 3.47Å; L82-I85 PolarHBondContact O-N 3.36Å; L82-A86 VanDerWaalsContact O-CB 3.23Å; L82-A86 WeakPolarHBondContact O-CB 3.29Å; L82-A86 PolarHBondContact O-N 3.45Å; L82-L109 HydrophobicContact CD1-CD1 4.32Å; L82-L109 HydrophobicContact CD2-CB 4.15Å; L82-L109 HydrophobicContact CD2-CD1 4.31Å
83	H	84.8	Confident	82.5	Confident	87 Å²	87	47 Å²	47	40%	0.403	25%	0.248	S	C	.	.	H	α-helix	trans	-59.8	-41.2	173.3	-84.8	-54.7	0	0	0	112.8	F56 E79 V81 I85 N87	F56-H83 AromaticContact CE1-CD2 3.73Å; F56-H83 AromaticContact CE1-CE1 3.57Å; F56-H83 AromaticContact CE1-CG 3.79Å; F56-H83 AromaticContact CE1-ND1 3.7Å; F56-H83 AromaticContact CE1-NE2 3.6Å; E79-H83 PolarHBondContact O-CD2 3.05Å; E79-H83 PolarHBondContact O-N 2.98Å; E79-H83 IonicContact OE1-NE2 3.08Å; V81-H83 VanDerWaalsContact C-N 3.33Å; V81-H83 PolarHBondContact O-N 2.98Å; H83-I85 VanDerWaalsContact C-N 3.25Å; H83-I85 PolarHBondContact O-N 3.14Å; H83-N87 VanDerWaalsContact O-CG 3.28Å; H83-N87 PolarHBondContact O-N 2.84Å; H83-N87 PolarHBondContact O-ND2 3.2Å
84	V	81.5	Confident	82.9	Confident	21 Å²	21	43.3 Å²	43.3	13%	0.127	23%	0.232	C	C	.	.	H	α-helix	trans	-68.9	-28.5	-179.8	-179.9	0	0	0	0	111.3	V81 L82 M93 I255	V81-V84 PolarHBondContact O-N 3.25Å; L82-V84 VanDerWaalsContact C-N 3.32Å; L82-V84 PolarHBondContact O-N 3.47Å; V84-M93 HydrophobicContact CB-CE 3.67Å; V84-M93 HydrophobicContact CB-SD 3.53Å; V84-M93 VanDerWaalsContact CB-SD 3.53Å; V84-M93 HydrophobicContact CG1-CE 3.43Å; V84-M93 VanDerWaalsContact CG1-CE 3.43Å; V84-M93 HydrophobicContact CG1-CG 3.93Å; V84-M93 HydrophobicContact CG1-SD 3.5Å; V84-M93 VanDerWaalsContact CG1-SD 3.5Å; V84-M93 HydrophobicContact CG2-SD 3.84Å; V84-I255 HydrophobicContact CG1-CD1 3.83Å; V84-I255 HydrophobicContact CG2-CD1 4.3Å
85	I	77.8	Confident	83.1	Confident	28 Å²	28	43.3 Å²	43.3	14%	0.144	23%	0.232	C	C	.	.	H	α-helix	trans	-90.8	-31.8	-177.7	-66.8	174.3	0	0	0	112.7	V81 L82 H83 N87 M93 C110 Q113 L233	V81-I85 HydrophobicContact CG1-CD1 4.16Å; V81-I85 PolarHBondContact O-N 3.47Å; L82-I85 PolarHBondContact O-N 3.36Å; H83-I85 VanDerWaalsContact C-N 3.25Å; H83-I85 PolarHBondContact O-N 3.14Å; I85-N87 VanDerWaalsContact C-N 3.26Å; I85-M93 HydrophobicContact CD1-CE 3.97Å; I85-M93 HydrophobicContact CG1-CE 3.66Å; I85-C110 HydrophobicContact CD1-CB 3.32Å; I85-C110 WeakPolarHBondContact CD1-SG 3.29Å; I85-Q113 HydrophobicContact CG2-CG 4.32Å; I85-L233 HydrophobicContact CD1-CD1 4.32Å
86	A	72.5	Confident	83.3	Confident	33 Å²	33	43.8 Å²	43.8	27%	0.273	23%	0.234	S	C	.	.	H	α-helix	trans	-69	-29.1	175.6	0	0	0	0	0	111.9	L82	L82-A86 VanDerWaalsContact O-CB 3.23Å; L82-A86 WeakPolarHBondContact O-CB 3.29Å; L82-A86 PolarHBondContact O-N 3.45Å
87	N	67.4	Low	83.2	Confident	98 Å²	98	39 Å²	39	52%	0.524	22%	0.216	S	C	.	.	S	Bend	trans	-81.9	117.7	168.1	-62.5	-36.8	0	0	0	106.8	H83 I85 D89	H83-N87 VanDerWaalsContact O-CG 3.28Å; H83-N87 PolarHBondContact O-N 2.84Å; H83-N87 PolarHBondContact O-ND2 3.2Å; I85-N87 VanDerWaalsContact C-N 3.26Å; N87-D89 CarbonylContact O-C 3.52Å; N87-D89 PolarHBondContact O-N 3.44Å
88	E	59.6	Low	82.6	Confident	179 Å²	179	39.1 Å²	39.1	84%	0.836	22%	0.216	S	C	*	.	S	Bend	trans	-52.8	-10.7	-170.1	-64.7	176.1	175.6	0	0	115.5	S90	E88-S90 PolarHBondContact O-N 2.94Å; E88-S90 PolarHBondContact O-OG 2.85Å
89	D	61.8	Low	81.7	Confident	126 Å²	126	39.6 Å²	39.6	67%	0.674	22%	0.219	S	C	*	.			trans	-58	91.4	166.2	-63	-32.6	0	0	0	110.9	N87 A91	N87-D89 CarbonylContact O-C 3.52Å; N87-D89 PolarHBondContact O-N 3.44Å; D89-A91 PolarHBondContact O-N 3.13Å
90	S	75.5	Confident	80.8	Confident	57 Å²	57	37.7 Å²	37.7	40%	0.399	21%	0.214	S	C	.	.			trans	-72.6	49.6	175.9	-59.9	0	0	0	0	112	E88 K114	E88-S90 PolarHBondContact O-N 2.94Å; E88-S90 PolarHBondContact O-OG 2.85Å; S90-K114 PolarHBondContact OG-NZ 3.2Å
91	A	87.5	Confident	80.3	Confident	30 Å²	30	36.6 Å²	36.6	25%	0.248	20%	0.204	C	C	.	.			trans	-66.9	143.9	179.4	0	0	0	0	0	110.8	D89 Q231 I255	D89-A91 PolarHBondContact O-N 3.13Å; A91-Q231 PolarHBondContact O-NE2 3.1Å; A91-I255 HydrophobicContact CB-CD1 3.71Å; A91-I255 HydrophobicContact CB-CG1 4.12Å
92	D	93.1	Very high	79.9	Confident	23 Å²	23	37 Å²	37	12%	0.123	21%	0.209	C	C	.	.			trans	-63.5	150.3	169.4	-71.2	-8.5	0	0	0	109.5	K232 T251 P254 I255	D92-K232 CarbonylContact C-O 3.54Å; D92-K232 WeakPolarHBondContact CA-O 3.39Å; D92-K232 HydrophobicContact CB-CB 4.45Å; D92-K232 WeakPolarHBondContact CB-O 3.44Å; D92-K232 PolarHBondContact OD1-N 3Å; D92-K232 IonicContact OD1-NZ 2.65Å; D92-K232 IonicContact OD2-NZ 3.07Å; D92-K232 PolarHBondContact OD2-NZ 2.83Å; D92-T251 HydrophobicContact CB-CG2 3.96Å; D92-P254 HydrophobicContact CB-CB 4.32Å; D92-P254 CarbonylContact O-C 3.48Å; D92-P254 VanDerWaalsContact O-CA 3.29Å; D92-P254 WeakPolarHBondContact O-CA 3.31Å; D92-I255 PolarHBondContact O-N 3.44Å
93	M	92.5	Very high	79.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	144.9	-178.5	-67.3	-178.8	-106.1	0	0	112.9	V84 I85 V95 K232 L233 L234 I255	V84-M93 HydrophobicContact CB-CE 3.67Å; V84-M93 HydrophobicContact CB-SD 3.53Å; V84-M93 VanDerWaalsContact CB-SD 3.53Å; V84-M93 HydrophobicContact CG1-CE 3.43Å; V84-M93 VanDerWaalsContact CG1-CE 3.43Å; V84-M93 HydrophobicContact CG1-CG 3.93Å; V84-M93 HydrophobicContact CG1-SD 3.5Å; V84-M93 VanDerWaalsContact CG1-SD 3.5Å; V84-M93 HydrophobicContact CG2-SD 3.84Å; I85-M93 HydrophobicContact CD1-CE 3.97Å; I85-M93 HydrophobicContact CG1-CE 3.66Å; M93-V95 HydrophobicContact CB-CG2 4.27Å; M93-K232 PolarHBondContact N-O 2.82Å; M93-L233 HydrophobicContact CB-CD2 3.84Å; M93-L233 HydrophobicContact CE-CD1 4.39Å; M93-L233 HydrophobicContact CE-CD2 3.31Å; M93-L233 HydrophobicContact CG-CD2 4.03Å; M93-L233 HydrophobicContact SD-CD2 4.23Å; M93-L234 PolarHBondContact O-N 2.87Å; M93-I255 CarbonylContact C-O 3.59Å; M93-I255 VanDerWaalsContact CA-O 3.28Å; M93-I255 WeakPolarHBondContact CA-O 3.4Å; M93-I255 HydrophobicContact CG-CB 4.3Å
94	I	92.8	Very high	80.2	Confident	17 Å²	17	34.5 Å²	34.5	9%	0.087	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121.4	162.1	-63.3	168.1	0	0	0	107.8	L234 I239 A247 P254 I255 V256 I257	I94-L234 CarbonylContact C-O 3.59Å; I94-L234 WeakPolarHBondContact CA-O 3.22Å; I94-L234 HydrophobicContact CG1-CB 4.34Å; I94-L234 HydrophobicContact CG2-CD2 4.09Å; I94-I239 HydrophobicContact CG2-CD1 4.43Å; I94-A247 HydrophobicContact CD1-CB 3.44Å; I94-A247 VanDerWaalsContact CD1-CB 3.44Å; I94-A247 HydrophobicContact CG1-CB 4.05Å; I94-P254 HydrophobicContact CD1-CB 4.11Å; I94-P254 HydrophobicContact CD1-CG 3.44Å; I94-P254 VanDerWaalsContact CD1-CG 3.44Å; I94-P254 HydrophobicContact CG1-CB 3.94Å; I94-P254 HydrophobicContact CG1-CG 3.86Å; I94-I255 PolarHBondContact N-O 2.82Å; I94-V256 HydrophobicContact CB-CG1 4.33Å; I94-V256 HydrophobicContact CB-CG2 4.44Å; I94-V256 HydrophobicContact CD1-CG2 4.44Å; I94-V256 HydrophobicContact CG2-CG1 4.38Å; I94-V256 CarbonylContact O-C 3.26Å; I94-V256 WeakPolarHBondContact O-CA 3.48Å; I94-I257 PolarHBondContact O-N 2.96Å
95	V	91.8	Very high	80.7	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	114	-177.2	-173.4	0	0	0	0	109.6	V77 V81 M93 L234 F235 S236 I257	V77-V95 HydrophobicContact CG2-CG1 3.5Å; V77-V95 VanDerWaalsContact CG2-CG1 3.5Å; V81-V95 HydrophobicContact CG2-CG1 4.25Å; V81-V95 HydrophobicContact CG2-CG2 3.88Å; M93-V95 HydrophobicContact CB-CG2 4.27Å; V95-L234 PolarHBondContact N-O 2.81Å; V95-F235 HydrophobicContact CB-CD1 3.59Å; V95-F235 HydrophobicContact CB-CE1 3.62Å; V95-F235 HydrophobicContact CB-CG 4.34Å; V95-F235 HydrophobicContact CB-CZ 4.38Å; V95-F235 HydrophobicContact CG1-CD1 3.91Å; V95-F235 HydrophobicContact CG1-CE1 3.83Å; V95-F235 HydrophobicContact CG2-CD1 4.16Å; V95-F235 HydrophobicContact CG2-CE1 3.71Å; V95-F235 HydrophobicContact CG2-CZ 4.03Å; V95-F235 WeakPolarHBondContact O-CA 3.19Å; V95-S236 PolarHBondContact O-N 2.92Å; V95-I257 HydrophobicContact CG1-CB 4.37Å; V95-I257 HydrophobicContact CG1-CG2 4.39Å; V95-I257 HydrophobicContact CG2-CB 4.45Å; V95-I257 HydrophobicContact CG2-CD1 4.21Å
96	Q	90	Very high	81.3	Confident	16 Å²	16	32.4 Å²	32.4	8%	0.075	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	124.7	166.6	-168.8	-177.6	3.9	0	0	109.7	S236 I239 I257	Q96-S236 VanDerWaalsContact CA-O 3.31Å; Q96-S236 WeakPolarHBondContact CA-O 2.99Å; Q96-I239 HydrophobicContact CB-CD1 3.73Å; Q96-I239 HydrophobicContact CB-CG1 4.05Å; Q96-I239 HydrophobicContact CG-CD1 4.16Å; Q96-I239 HydrophobicContact CG-CG1 4Å; Q96-I257 PolarHBondContact N-O 2.93Å
97	S	83.9	Confident	82.4	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.014	17%	0.174	C	C	.	.			trans	-156.5	159.8	164.8	82.7	0	0	0	0	112.2	S101 K103 S236 T237	S97-S101 WeakPolarHBondContact CB-OG 3.28Å; S97-S101 PolarHBondContact OG-OG 3.01Å; S97-K103 PolarHBondContact O-NZ 2.84Å; S97-K103 WeakPolarHBondContact OG-CD 3.31Å; S97-K103 WeakPolarHBondContact OG-CG 3.2Å; S97-K103 PolarHBondContact OG-NZ 3.14Å; S97-S236 PolarHBondContact N-O 2.76Å; S97-S236 VanDerWaalsContact N-O 3.1Å; S97-T237 WeakPolarHBondContact O-CA 3.28Å
98	H	75.4	Confident	83.7	Confident	15 Å²	15	26.1 Å²	26.1	7%	0.069	15%	0.15	C	C	.	.			trans	-70.2	163.6	179.9	63.5	75	0	0	0	113.2	Y47 S101 K103 L266	Y47-H98 AromaticContact CD1-CE1 3.49Å; Y47-H98 VanDerWaalsContact CD1-CE1 3.49Å; Y47-H98 WeakPolarHBondContact CD1-CE1 3.25Å; Y47-H98 AromaticContact CD1-NE2 3.66Å; Y47-H98 AromaticContact CE1-CE1 3.16Å; Y47-H98 WeakPolarHBondContact CE1-CE1 3.43Å; Y47-H98 AromaticContact CE1-NE2 3.47Å; Y47-H98 WeakPolarHBondContact CE1-NE2 3.42Å; H98-S101 WeakPolarHBondContact CE1-CA 3.19Å; H98-S101 WeakPolarHBondContact CE1-CB 3.36Å; H98-S101 PolarHBondContact CE1-N 3.34Å; H98-S101 WeakPolarHBondContact NE2-CB 3.13Å; H98-S101 WeakPolarHBondContact O-CB 3.36Å; H98-S101 PolarHBondContact O-N 3.3Å; H98-S101 PolarHBondContact O-OG 3.17Å; H98-K103 PolarHBondContact O-NZ 3.11Å; H98-L266 HydrophobicContact CB-CD2 3.82Å
99	S	70.6	Confident	85.3	Confident	11 Å²	11	17.6 Å²	17.6	8%	0.077	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	138.5	169.9	-81.2	0	0	0	0	110.8	S101	S99-S101 VanDerWaalsContact C-N 3.32Å; S99-S101 PolarHBondContact O-N 2.75Å
100	G	72	Confident	86.8	Confident	15 Å²	15	11.7 Å²	11.7	16%	0.155	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	5.8	-179.4	0	0	0	0	0	115.8	G102	G100-G102 PolarHBondContact O-N 2.73Å
101	S	76.4	Confident	87.8	Confident	7 Å²	7	9 Å²	9	5%	0.049	6%	0.059	C	C	.	.	S	Bend	trans	-73.2	-3.1	176.4	79.6	0	0	0	0	114.2	S75 V77 S97 H98 S99 K103	S75-S101 VanDerWaalsContact CB-O 3.24Å; S75-S101 WeakPolarHBondContact CB-O 3.45Å; S75-S101 PolarHBondContact OG-O 3.26Å; V77-S101 WeakPolarHBondContact CG1-O 3.46Å; V77-S101 WeakPolarHBondContact CG1-OG 3.44Å; S97-S101 WeakPolarHBondContact CB-OG 3.28Å; S97-S101 PolarHBondContact OG-OG 3.01Å; H98-S101 WeakPolarHBondContact CE1-CA 3.19Å; H98-S101 WeakPolarHBondContact CE1-CB 3.36Å; H98-S101 PolarHBondContact CE1-N 3.34Å; H98-S101 WeakPolarHBondContact NE2-CB 3.13Å; H98-S101 WeakPolarHBondContact O-CB 3.36Å; H98-S101 PolarHBondContact O-N 3.3Å; H98-S101 PolarHBondContact O-OG 3.17Å; S99-S101 VanDerWaalsContact C-N 3.32Å; S99-S101 PolarHBondContact O-N 2.75Å; S101-K103 WeakPolarHBondContact OG-CG 3.39Å
102	G	82.9	Confident	88.2	Confident	9 Å²	9	7.5 Å²	7.5	9%	0.093	5%	0.047	C	C	.	.	S	Bend	trans	89.3	15.8	-173.6	0	0	0	0	0	115.7	Q78 G100 T104 A105 A106	Q78-G102 PolarHBondContact NE2-O 3.2Å; Q78-G102 VanDerWaalsContact NE2-O 3.09Å; G100-G102 PolarHBondContact O-N 2.73Å; G102-T104 VanDerWaalsContact C-N 3.33Å; G102-T104 PolarHBondContact O-N 2.93Å; G102-A105 PolarHBondContact O-N 3.49Å; G102-A106 PolarHBondContact O-N 3.48Å
103	K	89.1	Confident	88.2	Confident	14 Å²	14	8.8 Å²	8.8	6%	0.061	5%	0.052	C	C	.	.	H	α-helix	trans	-51.3	-47.5	177.3	-68.1	-167.8	-75.6	-85.4	0	113.7	S97 H98 S101 A105 A106 F107 F235	S97-K103 PolarHBondContact O-NZ 2.84Å; S97-K103 WeakPolarHBondContact OG-CD 3.31Å; S97-K103 WeakPolarHBondContact OG-CG 3.2Å; S97-K103 PolarHBondContact OG-NZ 3.14Å; H98-K103 PolarHBondContact O-NZ 3.11Å; S101-K103 WeakPolarHBondContact OG-CG 3.39Å; K103-A105 VanDerWaalsContact C-N 3.32Å; K103-A105 PolarHBondContact O-N 2.84Å; K103-A106 WeakPolarHBondContact O-CA 3.1Å; K103-A106 VanDerWaalsContact O-CB 3.25Å; K103-A106 WeakPolarHBondContact O-CB 3.28Å; K103-A106 PolarHBondContact O-N 3.3Å; K103-F107 HydrophobicContact CB-CE1 4.46Å; K103-F107 WeakPolarHBondContact O-CD1 3.42Å; K103-F107 PolarHBondContact O-N 3.29Å; K103-F235 HydrophobicContact CB-CD1 4.22Å; K103-F235 HydrophobicContact CD-CB 4.2Å; K103-F235 HydrophobicContact CD-CD1 3.94Å; K103-F235 HydrophobicContact CG-CD1 4.17Å
104	T	90.8	Very high	88.2	Confident	24 Å²	24	11.7 Å²	11.7	15%	0.147	7%	0.065	C	C	.	.	H	α-helix	trans	-60.3	-44.1	-175.4	-50.5	0	0	0	0	111.8	G102 A106 F107 A108 V137 M140	G102-T104 VanDerWaalsContact C-N 3.33Å; G102-T104 PolarHBondContact O-N 2.93Å; T104-A106 VanDerWaalsContact C-N 3.35Å; T104-F107 VanDerWaalsContact CA-CE1 3.49Å; T104-F107 HydrophobicContact CG2-CE2 4.09Å; T104-F107 HydrophobicContact CG2-CZ 3.86Å; T104-A108 WeakPolarHBondContact O-CB 3.33Å; T104-A108 PolarHBondContact O-N 3.41Å; T104-V137 HydrophobicContact CG2-CG2 3.96Å; T104-M140 HydrophobicContact CG2-CB 4.01Å; T104-M140 HydrophobicContact CG2-CG 4.07Å
105	A	90.8	Very high	88.4	Confident	4 Å²	4	10.9 Å²	10.9	3%	0.033	6%	0.061	C	C	.	.	H	α-helix	trans	-66.6	-37.5	173.6	0	0	0	0	0	111.6	L71 G102 K103 A108 L109 I144	L71-A105 HydrophobicContact CD1-CB 4.33Å; G102-A105 PolarHBondContact O-N 3.49Å; K103-A105 VanDerWaalsContact C-N 3.32Å; K103-A105 PolarHBondContact O-N 2.84Å; A105-A108 PolarHBondContact O-N 3.26Å; A105-L109 WeakPolarHBondContact O-CB 3.33Å; A105-L109 VanDerWaalsContact O-CG 3.28Å; A105-L109 WeakPolarHBondContact O-CG 3.28Å; A105-L109 PolarHBondContact O-N 2.97Å; A105-I144 HydrophobicContact CB-CD1 4.09Å
106	A	91.9	Very high	88.5	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-56.7	-57.3	176.3	0	0	0	0	0	111.2	Q78 V81 G102 K103 T104 A108 L109 C110	Q78-A106 HydrophobicContact CB-CB 4.41Å; Q78-A106 HydrophobicContact CG-CB 3.76Å; V81-A106 HydrophobicContact CB-CB 4.3Å; V81-A106 HydrophobicContact CG1-CB 4.31Å; V81-A106 HydrophobicContact CG2-CB 4.47Å; G102-A106 PolarHBondContact O-N 3.48Å; K103-A106 WeakPolarHBondContact O-CA 3.1Å; K103-A106 VanDerWaalsContact O-CB 3.25Å; K103-A106 WeakPolarHBondContact O-CB 3.28Å; K103-A106 PolarHBondContact O-N 3.3Å; T104-A106 VanDerWaalsContact C-N 3.35Å; A106-A108 PolarHBondContact O-N 3.29Å; A106-L109 WeakPolarHBondContact O-CB 3.43Å; A106-L109 PolarHBondContact O-N 3.11Å; A106-C110 PolarHBondContact O-N 3.06Å; A106-C110 VanDerWaalsContact O-N 3.11Å; A106-C110 PolarHBondContact O-SG 2.97Å
107	F	93.9	Very high	88.8	Confident	0 Å²	0	15 Å²	15	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-73.6	-25.6	-178.7	64.6	-116.4	0	0	0	114.3	K103 T104 C110 M111 V137 V202 D204 F235	K103-F107 HydrophobicContact CB-CE1 4.46Å; K103-F107 WeakPolarHBondContact O-CD1 3.42Å; K103-F107 PolarHBondContact O-N 3.29Å; T104-F107 VanDerWaalsContact CA-CE1 3.49Å; T104-F107 HydrophobicContact CG2-CE2 4.09Å; T104-F107 HydrophobicContact CG2-CZ 3.86Å; F107-C110 VanDerWaalsContact CA-SG 3.53Å; F107-C110 VanDerWaalsContact O-CB 3.29Å; F107-C110 WeakPolarHBondContact O-CB 3.13Å; F107-C110 PolarHBondContact O-N 3.38Å; F107-M111 HydrophobicContact CD2-CE 4.13Å; F107-M111 WeakPolarHBondContact O-CG 3.25Å; F107-M111 PolarHBondContact O-N 2.66Å; F107-V137 HydrophobicContact CE2-CB 4.49Å; F107-V137 HydrophobicContact CE2-CG1 3.71Å; F107-V137 HydrophobicContact CE2-CG2 3.97Å; F107-V137 HydrophobicContact CZ-CG1 4.41Å; F107-V137 HydrophobicContact CZ-CG2 3.81Å; F107-V202 HydrophobicContact CB-CG1 3.89Å; F107-V202 HydrophobicContact CB-CG2 4.28Å; F107-V202 HydrophobicContact CD1-CG1 4.16Å; F107-V202 HydrophobicContact CD2-CG1 3.93Å; F107-V202 HydrophobicContact CE2-CG1 4.46Å; F107-V202 HydrophobicContact CG-CG1 3.77Å; F107-D204 HydrophobicContact CE1-CB 4.1Å; F107-D204 HydrophobicContact CZ-CB 4.1Å; F107-D204 WeakPolarHBondContact CZ-OD2 3.29Å; F107-F235 HydrophobicContact CB-CD2 4.28Å; F107-F235 HydrophobicContact CB-CE2 3.54Å; F107-F235 HydrophobicContact CB-CZ 3.77Å; F107-F235 HydrophobicContact CD1-CD1 4.31Å; F107-F235 AromaticContact CD1-CD2 3.8Å; F107-F235 HydrophobicContact CD1-CD2 3.8Å; F107-F235 HydrophobicContact CD1-CE1 4.37Å; F107-F235 AromaticContact CD1-CE2 3.87Å; F107-F235 HydrophobicContact CD1-CE2 3.87Å; F107-F235 HydrophobicContact CD1-CG 4.04Å; F107-F235 HydrophobicContact CD1-CZ 4.17Å; F107-F235 HydrophobicContact CG-CD2 4.42Å; F107-F235 HydrophobicContact CG-CE2 4.14Å; F107-F235 HydrophobicContact CG-CZ 4.49Å
108	A	94.8	Very high	89.4	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62	-46.2	169.9	0	0	0	0	0	110.7	T104 A105 A106 C110 M111 L112 M140 V141 I144	T104-A108 WeakPolarHBondContact O-CB 3.33Å; T104-A108 PolarHBondContact O-N 3.41Å; A105-A108 PolarHBondContact O-N 3.26Å; A106-A108 PolarHBondContact O-N 3.29Å; A108-C110 VanDerWaalsContact C-N 3.27Å; A108-C110 PolarHBondContact O-N 3.34Å; A108-M111 PolarHBondContact O-N 3.24Å; A108-L112 WeakPolarHBondContact O-CB 3.47Å; A108-L112 WeakPolarHBondContact O-CD1 3.28Å; A108-L112 VanDerWaalsContact O-CG 3.23Å; A108-L112 WeakPolarHBondContact O-CG 3.46Å; A108-L112 PolarHBondContact O-N 3.36Å; A108-M140 HydrophobicContact CB-CG 4.26Å; A108-V141 HydrophobicContact CB-CG2 3.84Å; A108-I144 HydrophobicContact CB-CD1 3.99Å
109	L	93.6	Very high	90.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59	-39	173.3	-73	166.1	0	0	0	111.8	F53 L58 L62 L66 L82 A105 A106 L112 Q113 I144	F53-L109 HydrophobicContact CE1-CD1 3.99Å; L58-L109 HydrophobicContact CD1-CD2 4.46Å; L62-L109 HydrophobicContact CB-CD2 4.38Å; L66-L109 HydrophobicContact CD1-CD1 4.24Å; L66-L109 HydrophobicContact CD1-CD2 3.79Å; L66-L109 HydrophobicContact CD2-CD1 4.21Å; L66-L109 HydrophobicContact CD2-CD2 4.13Å; L66-L109 HydrophobicContact CG-CD2 4.04Å; L82-L109 HydrophobicContact CD1-CD1 4.32Å; L82-L109 HydrophobicContact CD2-CB 4.15Å; L82-L109 HydrophobicContact CD2-CD1 4.31Å; A105-L109 WeakPolarHBondContact O-CB 3.33Å; A105-L109 VanDerWaalsContact O-CG 3.28Å; A105-L109 WeakPolarHBondContact O-CG 3.28Å; A105-L109 PolarHBondContact O-N 2.97Å; A106-L109 WeakPolarHBondContact O-CB 3.43Å; A106-L109 PolarHBondContact O-N 3.11Å; L109-L112 PolarHBondContact O-N 3.46Å; L109-Q113 WeakPolarHBondContact O-CB 3.47Å; L109-Q113 PolarHBondContact O-N 2.82Å; L109-I144 HydrophobicContact CD2-CG2 3.6Å; L109-I144 HydrophobicContact CG-CD1 4.48Å; L109-I144 HydrophobicContact CG-CG2 4.33Å
110	C	94.1	Very high	91.6	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-58.1	-52.2	176.7	-54.9	0	0	0	0	111.7	V81 I85 A106 F107 A108 Q113 K114 M200 L233	V81-C110 WeakPolarHBondContact CG1-SG 3.49Å; I85-C110 HydrophobicContact CD1-CB 3.32Å; I85-C110 WeakPolarHBondContact CD1-SG 3.29Å; A106-C110 PolarHBondContact O-N 3.06Å; A106-C110 VanDerWaalsContact O-N 3.11Å; A106-C110 PolarHBondContact O-SG 2.97Å; F107-C110 VanDerWaalsContact CA-SG 3.53Å; F107-C110 VanDerWaalsContact O-CB 3.29Å; F107-C110 WeakPolarHBondContact O-CB 3.13Å; F107-C110 PolarHBondContact O-N 3.38Å; A108-C110 VanDerWaalsContact C-N 3.27Å; A108-C110 PolarHBondContact O-N 3.34Å; C110-Q113 PolarHBondContact O-N 2.85Å; C110-K114 PolarHBondContact O-N 3.09Å; C110-M200 HydrophobicContact CB-CE 4.11Å; C110-M200 HydrophobicContact CB-SD 3.82Å; C110-L233 HydrophobicContact CB-CD1 3.81Å
111	M	95.7	Very high	92.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.4	-45.6	-179.6	-67.7	-173.7	-65.6	0	0	111.2	F107 A108 Q113 K114 V115 C124 C126 V141 I175 M200 V202	F107-M111 HydrophobicContact CD2-CE 4.13Å; F107-M111 WeakPolarHBondContact O-CG 3.25Å; F107-M111 PolarHBondContact O-N 2.66Å; A108-M111 PolarHBondContact O-N 3.24Å; M111-Q113 VanDerWaalsContact C-N 3.34Å; M111-Q113 PolarHBondContact O-N 3.46Å; M111-K114 PolarHBondContact O-N 3.05Å; M111-K114 VanDerWaalsContact O-N 3.13Å; M111-V115 WeakPolarHBondContact O-CB 3.02Å; M111-V115 PolarHBondContact O-N 2.96Å; M111-C124 HydrophobicContact CB-CB 3.94Å; M111-C124 HydrophobicContact CG-CB 3.92Å; M111-C124 HydrophobicContact SD-CB 4.13Å; M111-C126 HydrophobicContact CE-CB 4.09Å; M111-C126 HydrophobicContact SD-CB 3.86Å; M111-V141 HydrophobicContact CE-CG2 3.6Å; M111-I175 HydrophobicContact CB-CD1 4.27Å; M111-I175 HydrophobicContact CE-CG2 4.49Å; M111-I175 HydrophobicContact SD-CG2 4.19Å; M111-M200 HydrophobicContact CG-SD 3.91Å; M111-V202 HydrophobicContact CG-CG2 3.87Å; M111-V202 HydrophobicContact SD-CG2 3.95Å
112	L	95.7	Very high	93.7	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.3	-32.8	-179.3	-67.1	168	0	0	0	112.7	K59 L62 A108 L109 K114 V141 I144 M148 L151 I175	K59-L112 PolarHBondContact NZ-O 3.42Å; L62-L112 HydrophobicContact CD1-CB 4.18Å; L62-L112 HydrophobicContact CD2-CB 3.5Å; L62-L112 VanDerWaalsContact CD2-CB 3.5Å; L62-L112 HydrophobicContact CD2-CD1 4.06Å; L62-L112 HydrophobicContact CD2-CG 4.3Å; A108-L112 WeakPolarHBondContact O-CB 3.47Å; A108-L112 WeakPolarHBondContact O-CD1 3.28Å; A108-L112 VanDerWaalsContact O-CG 3.23Å; A108-L112 WeakPolarHBondContact O-CG 3.46Å; A108-L112 PolarHBondContact O-N 3.36Å; L109-L112 PolarHBondContact O-N 3.46Å; L112-K114 VanDerWaalsContact C-N 3.33Å; L112-V141 HydrophobicContact CD1-CG1 4.46Å; L112-V141 HydrophobicContact CD2-CG1 3.89Å; L112-V141 HydrophobicContact CG-CG1 4.21Å; L112-I144 HydrophobicContact CD1-CB 3.7Å; L112-I144 HydrophobicContact CD1-CG2 3.54Å; L112-M148 HydrophobicContact CB-SD 4.12Å; L112-M148 HydrophobicContact CD2-SD 3.86Å; L112-L151 HydrophobicContact CD2-CD1 4.21Å; L112-L151 HydrophobicContact CD2-CD2 3.46Å; L112-L151 VanDerWaalsContact CD2-CD2 3.46Å; L112-L151 HydrophobicContact CD2-CG 4.49Å; L112-I175 HydrophobicContact CD2-CD1 3.77Å; L112-I175 HydrophobicContact CG-CD1 4.37Å
113	Q	94	Very high	94.4	Very high	49 Å²	49	30.6 Å²	30.6	23%	0.229	14%	0.144	C	C	.	.	H	α-helix	trans	-67.7	-34.7	171.8	-174	66.4	13.4	0	0	111.2	R57 K59 L62 I85 L109 C110 M111	R57-Q113 PolarHBondContact O-NE2 3.03Å; K59-Q113 WeakPolarHBondContact CE-O 3.48Å; K59-Q113 PolarHBondContact NZ-O 3.13Å; L62-Q113 HydrophobicContact CD1-CB 4.11Å; L62-Q113 VanDerWaalsContact CD1-OE1 3.26Å; I85-Q113 HydrophobicContact CG2-CG 4.32Å; L109-Q113 WeakPolarHBondContact O-CB 3.47Å; L109-Q113 PolarHBondContact O-N 2.82Å; C110-Q113 PolarHBondContact O-N 2.85Å; M111-Q113 VanDerWaalsContact C-N 3.34Å; M111-Q113 PolarHBondContact O-N 3.46Å
114	K	93.2	Very high	94.9	Very high	62 Å²	62	30 Å²	30	27%	0.27	14%	0.141	S	C	.	.	H	α-helix	trans	-80.7	-34.1	-179.6	-158.8	77	171.2	-165.1	0	114	S90 C110 M111 L112 K199 M200	S90-K114 PolarHBondContact OG-NZ 3.2Å; C110-K114 PolarHBondContact O-N 3.09Å; M111-K114 PolarHBondContact O-N 3.05Å; M111-K114 VanDerWaalsContact O-N 3.13Å; L112-K114 VanDerWaalsContact C-N 3.33Å; K114-K199 HydrophobicContact CG-CB 4.06Å; K114-M200 HydrophobicContact CB-CE 4.25Å; K114-M200 HydrophobicContact CD-CE 4.42Å; K114-M200 HydrophobicContact CG-CE 4.39Å
115	V	95.3	Very high	95.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.134	C	C	.	.			trans	-68.6	139.5	-171.4	75.4	0	0	0	0	113.1	K59 M111 Q123 M148 L151 Q174 I175	K59-V115 PolarHBondContact NZ-O 3.39Å; M111-V115 WeakPolarHBondContact O-CB 3.02Å; M111-V115 PolarHBondContact O-N 2.96Å; V115-Q123 HydrophobicContact CG2-CB 4.29Å; V115-M148 HydrophobicContact CG1-CE 3.83Å; V115-L151 HydrophobicContact CG1-CD1 4.05Å; V115-Q174 HydrophobicContact CG2-CB 3.34Å; V115-Q174 HydrophobicContact CG2-CG 4.18Å; V115-I175 HydrophobicContact CG1-CD1 4.41Å; V115-I175 HydrophobicContact CG2-CG1 4.29Å
116	E	95.6	Very high	95.6	Very high	70 Å²	70	28.6 Å²	28.6	33%	0.327	13%	0.132	S	C	.	.			trans	-108.3	106.9	170.8	-70.8	177.2	-101.3	0	0	109.7	K118 F119 Q123 K199	E116-K118 PolarHBondContact O-N 2.97Å; E116-K118 WeakPolarHBondContact OE2-CE 3.23Å; E116-K118 IonicContact OE2-NZ 3.94Å; E116-K118 PolarHBondContact OE2-NZ 3.27Å; E116-F119 HydrophobicContact CB-CD2 3.84Å; E116-F119 HydrophobicContact CB-CE2 4.29Å; E116-F119 PolarHBondContact O-N 3.33Å; E116-F119 WeakPolarHBondContact OE2-CE2 3.4Å; E116-Q123 VanDerWaalsContact N-OE1 3.16Å; E116-Q123 PolarHBondContact O-NE2 3.39Å; E116-K199 IonicContact OE1-NZ 2.76Å; E116-K199 PolarHBondContact OE1-NZ 3.25Å
117	T	95.9	Very high	95.8	Very high	33 Å²	33	28.6 Å²	28.6	20%	0.202	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-23	-171	54.9	0	0	0	0	114.1	F119 M148 D149 L151 Q174	T117-F119 PolarHBondContact O-N 2.84Å; T117-M148 HydrophobicContact CG2-CB 4.32Å; T117-M148 HydrophobicContact CG2-CE 3.86Å; T117-D149 WeakPolarHBondContact CB-O 3.4Å; T117-D149 WeakPolarHBondContact CG2-O 3.45Å; T117-D149 PolarHBondContact OG1-O 2.91Å; T117-L151 HydrophobicContact CG2-CB 3.88Å; T117-L151 HydrophobicContact CG2-CD1 4.14Å; T117-Q174 PolarHBondContact O-NE2 3.09Å
118	K	95.6	Very high	95.8	Very high	141 Å²	141	28.6 Å²	28.6	61%	0.613	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.5	175.4	73.9	-171.4	-178.3	-156.6	0	114	E116	E116-K118 PolarHBondContact O-N 2.97Å; E116-K118 WeakPolarHBondContact OE2-CE 3.23Å; E116-K118 IonicContact OE2-NZ 3.94Å; E116-K118 PolarHBondContact OE2-NZ 3.27Å
119	F	96.1	Very high	95.5	Very high	90 Å²	90	29.1 Å²	29.1	40%	0.395	14%	0.135	S	C	.	.	S	Bend	trans	-96.3	112.9	179.3	-60.3	-60.7	0	0	0	109.8	E116 T117 L121 Q123 Q174	E116-F119 HydrophobicContact CB-CD2 3.84Å; E116-F119 HydrophobicContact CB-CE2 4.29Å; E116-F119 PolarHBondContact O-N 3.33Å; E116-F119 WeakPolarHBondContact OE2-CE2 3.4Å; T117-F119 PolarHBondContact O-N 2.84Å; F119-L121 HydrophobicContact CB-CD2 4.33Å; F119-L121 HydrophobicContact CB-CG 4.18Å; F119-L121 PolarHBondContact O-N 2.83Å; F119-Q123 PolarHBondContact O-NE2 2.84Å; F119-Q174 WeakPolarHBondContact O-CG 3.38Å
120	K	95.9	Very high	95.1	Very high	97 Å²	97	29.8 Å²	29.8	42%	0.422	14%	0.14	S	C	.	.			trans	-84.1	66.1	179.4	-59.2	-65	-178.2	168.2	0	111.3	D150 T172	K120-D150 PolarHBondContact NZ-O 2.7Å; K120-D150 IonicContact NZ-OD1 3.97Å; K120-D150 PolarHBondContact NZ-OD1 3.44Å; K120-T172 CarbonylContact C-O 3.43Å; K120-T172 WeakPolarHBondContact CA-O 3.06Å; K120-T172 WeakPolarHBondContact O-CB 3.43Å
121	L	96.1	Very high	94.7	Very high	52 Å²	52	31.4 Å²	31.4	27%	0.272	15%	0.146	S	C	.	.	S	Bend	trans	-153.8	153.8	176.9	59.8	89.6	0	0	0	110.5	F119 Q123 T172 D173 Q174 N197	F119-L121 HydrophobicContact CB-CD2 4.33Å; F119-L121 HydrophobicContact CB-CG 4.18Å; F119-L121 PolarHBondContact O-N 2.83Å; L121-Q123 HydrophobicContact CD1-CG 3.81Å; L121-Q123 PolarHBondContact O-N 3.07Å; L121-T172 PolarHBondContact N-O 3.02Å; L121-D173 CarbonylContact C-O 3.6Å; L121-Q174 WeakPolarHBondContact O-CA 3.34Å; L121-N197 HydrophobicContact CD1-CB 3.33Å
122	P	97.5	Very high	94.2	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.032	15%	0.149	C	C	.	.			trans	-57.9	126.5	176.2	-30.7	39.1	0	0	0	114	I171 D173 V176 F193	P122-I171 WeakPolarHBondContact CD-O 3.26Å; P122-I171 HydrophobicContact CG-CB 4.44Å; P122-I171 HydrophobicContact CG-CG2 3.89Å; P122-D173 WeakPolarHBondContact CA-O 3.43Å; P122-D173 WeakPolarHBondContact CD-O 3.47Å; P122-D173 WeakPolarHBondContact CG-O 3.47Å; P122-D173 VanDerWaalsContact N-O 3.13Å; P122-V176 HydrophobicContact CB-CG2 4.05Å; P122-V176 HydrophobicContact CG-CG2 4.07Å; P122-F193 HydrophobicContact CB-CD2 3.65Å; P122-F193 HydrophobicContact CB-CE2 3.94Å; P122-F193 HydrophobicContact CB-CG 4.32Å; P122-F193 HydrophobicContact CG-CB 3.83Å; P122-F193 HydrophobicContact CG-CD1 4.44Å; P122-F193 HydrophobicContact CG-CD2 3.54Å; P122-F193 HydrophobicContact CG-CE2 4.16Å; P122-F193 HydrophobicContact CG-CG 3.69Å
123	Q	97.8	Very high	93.8	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	15%	0.151	C	C	.	.			trans	-127.2	-28.2	-179.3	-70.5	174	71.7	0	0	112.8	V115 E116 F119 L121 Q174 V198 K199 M200	V115-Q123 HydrophobicContact CG2-CB 4.29Å; E116-Q123 VanDerWaalsContact N-OE1 3.16Å; E116-Q123 PolarHBondContact O-NE2 3.39Å; F119-Q123 PolarHBondContact O-NE2 2.84Å; L121-Q123 HydrophobicContact CD1-CG 3.81Å; L121-Q123 PolarHBondContact O-N 3.07Å; Q123-Q174 PolarHBondContact N-O 2.82Å; Q123-V198 CarbonylContact O-C 3.48Å; Q123-V198 WeakPolarHBondContact O-CA 3.43Å; Q123-K199 PolarHBondContact O-N 3.17Å; Q123-M200 PolarHBondContact O-N 2.75Å
124	C	98	Very high	93.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	138	176	-60.4	0	0	0	0	110.1	M111 Q174 I175 V176 M200	M111-C124 HydrophobicContact CB-CB 3.94Å; M111-C124 HydrophobicContact CG-CB 3.92Å; M111-C124 HydrophobicContact SD-CB 4.13Å; C124-Q174 PolarHBondContact N-O 3.07Å; C124-I175 HydrophobicContact CB-CG1 4.22Å; C124-I175 HydrophobicContact CB-CG2 4.48Å; C124-I175 WeakPolarHBondContact O-CA 3.3Å; C124-V176 PolarHBondContact O-N 2.95Å; C124-M200 WeakPolarHBondContact CA-O 3.2Å
125	I	98.2	Very high	93.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.3	176.8	-67.9	177.3	0	0	0	109.3	L127 V176 L183 F193 L195 V198 M200 L201 V202	I125-L127 HydrophobicContact CG2-CD2 4.18Å; I125-L127 HydrophobicContact CG2-CG 4.2Å; I125-V176 CarbonylContact C-O 3.57Å; I125-V176 VanDerWaalsContact CA-O 3.31Å; I125-V176 WeakPolarHBondContact CA-O 3.44Å; I125-V176 HydrophobicContact CG1-CB 4.47Å; I125-L183 HydrophobicContact CB-CD1 4.43Å; I125-L183 HydrophobicContact CD1-CD1 4.08Å; I125-L183 HydrophobicContact CG1-CD1 4.34Å; I125-L183 HydrophobicContact CG2-CD1 3.3Å; I125-F193 HydrophobicContact CD1-CE2 4.07Å; I125-F193 HydrophobicContact CD1-CZ 4.33Å; I125-L195 HydrophobicContact CD1-CD2 3.39Å; I125-V198 HydrophobicContact CB-CG1 4.47Å; I125-V198 HydrophobicContact CD1-CG1 4.07Å; I125-V198 HydrophobicContact CD1-CG2 3.71Å; I125-V198 HydrophobicContact CG1-CG1 4.08Å; I125-V198 HydrophobicContact CG1-CG2 4.17Å; I125-M200 PolarHBondContact N-O 2.93Å; I125-L201 HydrophobicContact CB-CD1 4.03Å; I125-L201 HydrophobicContact CG2-CD1 3.69Å; I125-L201 CarbonylContact O-C 3.58Å; I125-L201 WeakPolarHBondContact O-CA 3.04Å; I125-V202 PolarHBondContact O-N 2.9Å
126	C	98.1	Very high	93.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	117.2	166.8	-175.6	0	0	0	0	110.8	M111 V137 V176 V177 G178 V202	M111-C126 HydrophobicContact CE-CB 4.09Å; M111-C126 HydrophobicContact SD-CB 3.86Å; C126-V137 HydrophobicContact CB-CG1 4.35Å; C126-V176 PolarHBondContact N-O 3.45Å; C126-V177 HydrophobicContact CB-CG1 4.27Å; C126-V177 HydrophobicContact CB-CG2 4.22Å; C126-V177 WeakPolarHBondContact O-CA 3.4Å; C126-G178 PolarHBondContact O-N 3.36Å; C126-V202 CarbonylContact C-O 3.53Å; C126-V202 WeakPolarHBondContact CA-O 3.34Å; C126-V202 HydrophobicContact CB-CB 4.17Å
127	L	97.1	Very high	93.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	129	173.3	-63.9	-179.8	0	0	0	109.7	I125 G178 P180 L183 L201 V202 I203 D204 M209 T219 I222	I125-L127 HydrophobicContact CG2-CD2 4.18Å; I125-L127 HydrophobicContact CG2-CG 4.2Å; L127-G178 WeakPolarHBondContact CA-O 3.43Å; L127-P180 HydrophobicContact CB-CG 4.47Å; L127-P180 HydrophobicContact CD2-CG 4.35Å; L127-L183 HydrophobicContact CD2-CB 4.31Å; L127-L183 HydrophobicContact CD2-CD1 3.74Å; L127-L183 HydrophobicContact CD2-CG 4.45Å; L127-L201 HydrophobicContact CD1-CD1 3.92Å; L127-L201 HydrophobicContact CG-CD1 3.95Å; L127-V202 PolarHBondContact N-O 2.87Å; L127-I203 HydrophobicContact CB-CG1 4.48Å; L127-I203 HydrophobicContact CD1-CG1 4.38Å; L127-D204 PolarHBondContact O-N 2.9Å; L127-M209 HydrophobicContact CB-CE 3.65Å; L127-M209 VanDerWaalsContact O-CE 3.27Å; L127-M209 WeakPolarHBondContact O-CE 3.34Å; L127-T219 HydrophobicContact CD1-CG2 3.72Å; L127-I222 HydrophobicContact CD1-CD1 4.29Å; L127-I222 HydrophobicContact CD2-CD1 4.08Å
128	T	93.7	Very high	93	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.122	C	C	.	.			trans	-128.7	150.6	173.7	70.9	0	0	0	0	110.2	T130 L133 A134 V137 G178 T179 P180 D204 M209	T128-T130 VanDerWaalsContact C-N 3.31Å; T128-T130 PolarHBondContact O-N 3.47Å; T128-T130 PolarHBondContact OG1-O 2.9Å; T128-L133 HydrophobicContact CG2-CD2 4.26Å; T128-L133 HydrophobicContact CG2-CG 4.07Å; T128-A134 WeakPolarHBondContact OG1-CA 3.06Å; T128-A134 VanDerWaalsContact OG1-CB 3.3Å; T128-A134 WeakPolarHBondContact OG1-CB 3.43Å; T128-A134 PolarHBondContact OG1-N 3.01Å; T128-A134 VanDerWaalsContact OG1-N 3.14Å; T128-V137 HydrophobicContact CG2-CB 4.49Å; T128-V137 HydrophobicContact CG2-CG2 3.94Å; T128-G178 PolarHBondContact N-O 3.49Å; T128-G178 PolarHBondContact OG1-O 3.02Å; T128-T179 WeakPolarHBondContact O-CA 3.36Å; T128-P180 WeakPolarHBondContact O-CD 3.2Å; T128-D204 HydrophobicContact CG2-CB 4.34Å; T128-M209 VanDerWaalsContact C-CE 3.47Å
129	P	88.9	Confident	92.9	Very high	11 Å²	11	21.8 Å²	21.8	7%	0.071	11%	0.108	C	C	.	.	S	Bend	trans	-75.7	-16.8	-174.7	28.4	-35.6	0	0	0	114.2	L133 E205 I208 M209 L215	P129-L133 HydrophobicContact CG-CD2 4.34Å; P129-E205 HydrophobicContact CG-CB 3.86Å; P129-I208 HydrophobicContact CB-CB 4.24Å; P129-I208 HydrophobicContact CB-CG2 3.37Å; P129-I208 HydrophobicContact CG-CB 4.09Å; P129-I208 HydrophobicContact CG-CG2 3.56Å; P129-M209 HydrophobicContact CB-CG 4.38Å; P129-L215 HydrophobicContact CB-CD1 4.16Å
130	T	84.6	Confident	92.7	Very high	14 Å²	14	18.6 Å²	18.6	9%	0.086	10%	0.095	C	C	.	.	S	Bend	trans	-138.4	152.8	-175.4	85.7	0	0	0	0	112.1	T128 E132 L133 A134 R356	T128-T130 VanDerWaalsContact C-N 3.31Å; T128-T130 PolarHBondContact O-N 3.47Å; T128-T130 PolarHBondContact OG1-O 2.9Å; T130-E132 WeakPolarHBondContact CB-OE2 3.49Å; T130-E132 PolarHBondContact O-N 3.24Å; T130-E132 PolarHBondContact OG1-OE2 2.8Å; T130-L133 PolarHBondContact O-N 3.44Å; T130-L133 PolarHBondContact OG1-N 2.72Å; T130-A134 PolarHBondContact O-N 2.85Å; T130-A134 VanDerWaalsContact O-N 3.09Å; T130-R356 HydrophobicContact CG2-CB 4.26Å
131	Y	86.7	Confident	92.7	Very high	35 Å²	35	14 Å²	14	14%	0.137	8%	0.075	C	C	.	.	H	α-helix	trans	-50.1	-45.3	174.8	177.6	-79.3	0	0	0	112.3	L133 A134 V135 I157 H330 A334	Y131-L133 PolarHBondContact O-N 2.94Å; Y131-A134 WeakPolarHBondContact O-CB 3.31Å; Y131-A134 PolarHBondContact O-N 3.33Å; Y131-V135 HydrophobicContact CD1-CG2 4.12Å; Y131-V135 HydrophobicContact CE1-CG2 3.67Å; Y131-V135 WeakPolarHBondContact O-CG2 3.36Å; Y131-V135 PolarHBondContact O-N 3.4Å; Y131-I157 HydrophobicContact CD2-CB 3.7Å; Y131-I157 HydrophobicContact CD2-CD1 3.78Å; Y131-I157 HydrophobicContact CD2-CG1 3.92Å; Y131-I157 HydrophobicContact CD2-CG2 4.38Å; Y131-I157 HydrophobicContact CE1-CD1 4.33Å; Y131-I157 HydrophobicContact CE2-CB 3.97Å; Y131-I157 HydrophobicContact CE2-CD1 3.34Å; Y131-I157 HydrophobicContact CE2-CG1 3.63Å; Y131-I157 HydrophobicContact CG-CD1 4.43Å; Y131-H330 HydrophobicContact CD1-CB 4.4Å; Y131-H330 HydrophobicContact CD2-CB 3.74Å; Y131-H330 HydrophobicContact CE2-CB 4.28Å; Y131-H330 HydrophobicContact CG-CB 3.83Å; Y131-A334 HydrophobicContact CD1-CB 4.29Å; Y131-A334 HydrophobicContact CE1-CB 3.76Å
132	E	84	Confident	92.7	Very high	15 Å²	15	15.3 Å²	15.3	7%	0.07	8%	0.08	C	C	.	.	H	α-helix	trans	-69.3	-37.7	-173.5	-53.6	74.3	-171.1	0	0	111.8	T130 Q136 R333 I337	T130-E132 WeakPolarHBondContact CB-OE2 3.49Å; T130-E132 PolarHBondContact O-N 3.24Å; T130-E132 PolarHBondContact OG1-OE2 2.8Å; E132-Q136 WeakPolarHBondContact O-CB 3.44Å; E132-Q136 PolarHBondContact O-N 3.47Å; E132-R333 HydrophobicContact CG-CG 4.31Å; E132-R333 WeakPolarHBondContact OE1-CD 3.4Å; E132-R333 WeakPolarHBondContact OE1-CG 3.43Å; E132-R333 IonicContact OE1-CZ 2.71Å; E132-R333 IonicContact OE1-NE 3.94Å; E132-R333 PolarHBondContact OE1-NE 3.39Å; E132-R333 IonicContact OE1-NH1 3.01Å; E132-R333 PolarHBondContact OE1-NH1 2.82Å; E132-R333 IonicContact OE2-CZ 3.1Å; E132-R333 IonicContact OE2-NE 3.69Å; E132-R333 IonicContact OE2-NH1 2.63Å; E132-R333 PolarHBondContact OE2-NH1 3.1Å; E132-R333 IonicContact OE2-NH2 2.85Å; E132-R333 PolarHBondContact OE2-NH2 3.4Å; E132-I337 HydrophobicContact CB-CD1 4.14Å; E132-I337 HydrophobicContact CG-CD1 3.44Å; E132-I337 VanDerWaalsContact CG-CD1 3.44Å
133	L	87.5	Confident	92.5	Very high	6 Å²	6	20.9 Å²	20.9	3%	0.031	10%	0.104	C	C	.	.	H	α-helix	trans	-70.1	-39.7	175.7	-169.8	61.8	0	0	0	110.8	T128 P129 T130 Y131 V135 Q136 V137 D204 E205	T128-L133 HydrophobicContact CG2-CD2 4.26Å; T128-L133 HydrophobicContact CG2-CG 4.07Å; P129-L133 HydrophobicContact CG-CD2 4.34Å; T130-L133 PolarHBondContact O-N 3.44Å; T130-L133 PolarHBondContact OG1-N 2.72Å; Y131-L133 PolarHBondContact O-N 2.94Å; L133-V135 VanDerWaalsContact C-N 3.35Å; L133-V135 PolarHBondContact O-N 2.71Å; L133-Q136 PolarHBondContact O-N 2.85Å; L133-V137 HydrophobicContact CD1-CG2 4.49Å; L133-V137 HydrophobicContact CG-CG2 4.35Å; L133-V137 WeakPolarHBondContact O-CB 3.41Å; L133-V137 VanDerWaalsContact O-CG2 3.29Å; L133-V137 WeakPolarHBondContact O-CG2 3.44Å; L133-V137 PolarHBondContact O-N 2.78Å; L133-D204 HydrophobicContact CD2-CB 4.44Å; L133-E205 HydrophobicContact CD2-CB 4.32Å; L133-E205 HydrophobicContact CD2-CG 3.53Å
134	A	91.9	Very high	92.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-57.4	-47.3	174	0	0	0	0	0	111.7	T128 T130 Y131 Q136 V137 G138 I157 V177	T128-A134 WeakPolarHBondContact OG1-CA 3.06Å; T128-A134 VanDerWaalsContact OG1-CB 3.3Å; T128-A134 WeakPolarHBondContact OG1-CB 3.43Å; T128-A134 PolarHBondContact OG1-N 3.01Å; T128-A134 VanDerWaalsContact OG1-N 3.14Å; T130-A134 PolarHBondContact O-N 2.85Å; T130-A134 VanDerWaalsContact O-N 3.09Å; Y131-A134 WeakPolarHBondContact O-CB 3.31Å; Y131-A134 PolarHBondContact O-N 3.33Å; A134-Q136 PolarHBondContact O-N 3.41Å; A134-V137 PolarHBondContact O-N 3.19Å; A134-G138 PolarHBondContact O-N 3.2Å; A134-I157 HydrophobicContact CB-CG2 3.47Å; A134-I157 VanDerWaalsContact CB-CG2 3.47Å; A134-V177 HydrophobicContact CB-CG1 4.2Å; A134-V177 WeakPolarHBondContact O-CG1 3.44Å
135	V	89.6	Confident	92.1	Very high	49 Å²	49	21 Å²	21	30%	0.297	11%	0.105	S	C	.	.	H	α-helix	trans	-60.3	-45.5	176.4	173.1	0	0	0	0	111.1	Y131 L133 V137 G138 V139 I157	Y131-V135 HydrophobicContact CD1-CG2 4.12Å; Y131-V135 HydrophobicContact CE1-CG2 3.67Å; Y131-V135 WeakPolarHBondContact O-CG2 3.36Å; Y131-V135 PolarHBondContact O-N 3.4Å; L133-V135 VanDerWaalsContact C-N 3.35Å; L133-V135 PolarHBondContact O-N 2.71Å; V135-V137 PolarHBondContact O-N 3.17Å; V135-G138 PolarHBondContact O-N 3.5Å; V135-V139 HydrophobicContact CG1-CG2 4.43Å; V135-V139 WeakPolarHBondContact O-CB 3.46Å; V135-V139 VanDerWaalsContact O-CG2 3.3Å; V135-V139 WeakPolarHBondContact O-CG2 3.31Å; V135-V139 PolarHBondContact O-N 3.31Å; V135-I157 HydrophobicContact CG2-CD1 3.7Å
136	Q	88.2	Confident	92	Very high	28 Å²	28	24.1 Å²	24.1	13%	0.131	13%	0.131	C	C	.	.	H	α-helix	trans	-61.2	-43.8	178.2	176.6	-175.9	-25.9	0	0	112.6	E132 L133 A134 M140 G357 D359	E132-Q136 WeakPolarHBondContact O-CB 3.44Å; E132-Q136 PolarHBondContact O-N 3.47Å; L133-Q136 PolarHBondContact O-N 2.85Å; A134-Q136 PolarHBondContact O-N 3.41Å; Q136-M140 PolarHBondContact O-N 3.39Å; Q136-M140 VanDerWaalsContact O-N 3.1Å; Q136-G357 PolarHBondContact OE1-O 2.95Å; Q136-D359 VanDerWaalsContact CD-CB 3.41Å; Q136-D359 VanDerWaalsContact NE2-CB 3.3Å; Q136-D359 PolarHBondContact NE2-OD1 2.94Å; Q136-D359 PolarHBondContact NE2-OD2 2.94Å
137	V	93.6	Very high	91.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.5	-49.6	177.9	168	0	0	0	0	110.3	T104 F107 C126 T128 L133 A134 V135 V139 M140 V141 V177	T104-V137 HydrophobicContact CG2-CG2 3.96Å; F107-V137 HydrophobicContact CE2-CB 4.49Å; F107-V137 HydrophobicContact CE2-CG1 3.71Å; F107-V137 HydrophobicContact CE2-CG2 3.97Å; F107-V137 HydrophobicContact CZ-CG1 4.41Å; F107-V137 HydrophobicContact CZ-CG2 3.81Å; C126-V137 HydrophobicContact CB-CG1 4.35Å; T128-V137 HydrophobicContact CG2-CB 4.49Å; T128-V137 HydrophobicContact CG2-CG2 3.94Å; L133-V137 HydrophobicContact CD1-CG2 4.49Å; L133-V137 HydrophobicContact CG-CG2 4.35Å; L133-V137 WeakPolarHBondContact O-CB 3.41Å; L133-V137 VanDerWaalsContact O-CG2 3.29Å; L133-V137 WeakPolarHBondContact O-CG2 3.44Å; L133-V137 PolarHBondContact O-N 2.78Å; A134-V137 PolarHBondContact O-N 3.19Å; V135-V137 PolarHBondContact O-N 3.17Å; V137-V139 PolarHBondContact O-N 3.17Å; V137-M140 WeakPolarHBondContact O-CA 3.01Å; V137-M140 WeakPolarHBondContact O-CB 2.87Å; V137-M140 PolarHBondContact O-N 3.45Å; V137-V141 HydrophobicContact CG1-CG2 4.29Å; V137-V141 WeakPolarHBondContact O-CG2 3.42Å; V137-V141 PolarHBondContact O-N 3.23Å; V137-V177 HydrophobicContact CB-CG1 3.78Å; V137-V177 HydrophobicContact CG1-CG1 3.6Å; V137-V177 HydrophobicContact CG1-CG2 4.12Å
138	G	94.7	Very high	91.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61	-43	-179.4	0	0	0	0	0	112.3	A134 V135 M140 V141 E142 Y155	A134-G138 PolarHBondContact O-N 3.2Å; V135-G138 PolarHBondContact O-N 3.5Å; G138-M140 VanDerWaalsContact C-N 3.25Å; G138-M140 PolarHBondContact O-N 2.91Å; G138-V141 WeakPolarHBondContact O-CB 3.47Å; G138-V141 PolarHBondContact O-N 2.78Å; G138-V141 VanDerWaalsContact O-N 3.09Å; G138-E142 WeakPolarHBondContact O-CG 3.24Å; G138-E142 PolarHBondContact O-N 2.83Å; G138-Y155 WeakPolarHBondContact CA-OH 3.32Å
139	V	92.5	Very high	91.8	Very high	54 Å²	54	35.2 Å²	35.2	33%	0.327	19%	0.187	S	C	.	.	H	α-helix	trans	-60.1	-36.2	174.3	169.4	0	0	0	0	111.6	V135 V137 K143 Y155	V135-V139 HydrophobicContact CG1-CG2 4.43Å; V135-V139 WeakPolarHBondContact O-CB 3.46Å; V135-V139 VanDerWaalsContact O-CG2 3.3Å; V135-V139 WeakPolarHBondContact O-CG2 3.31Å; V135-V139 PolarHBondContact O-N 3.31Å; V137-V139 PolarHBondContact O-N 3.17Å; V139-K143 HydrophobicContact CG1-CD 4.11Å; V139-K143 WeakPolarHBondContact O-CB 3.4Å; V139-K143 WeakPolarHBondContact O-CG 3.37Å; V139-K143 PolarHBondContact O-N 3.13Å; V139-Y155 PolarHBondContact N-OH 3.21Å; V139-Y155 VanDerWaalsContact N-OH 3.15Å
140	M	92.6	Very high	92.1	Very high	24 Å²	24	39.7 Å²	39.7	12%	0.118	21%	0.21	C	C	.	.	H	α-helix	trans	-67.6	-43.9	175	-173.7	63.1	72.2	0	0	111.6	Y69 T104 A108 Q136 V137 G138 K143 I144	Y69-M140 HydrophobicContact CD2-SD 4.41Å; Y69-M140 HydrophobicContact CE2-CE 3.85Å; Y69-M140 HydrophobicContact CE2-SD 3.95Å; T104-M140 HydrophobicContact CG2-CB 4.01Å; T104-M140 HydrophobicContact CG2-CG 4.07Å; A108-M140 HydrophobicContact CB-CG 4.26Å; Q136-M140 PolarHBondContact O-N 3.39Å; Q136-M140 VanDerWaalsContact O-N 3.1Å; V137-M140 WeakPolarHBondContact O-CA 3.01Å; V137-M140 WeakPolarHBondContact O-CB 2.87Å; V137-M140 PolarHBondContact O-N 3.45Å; G138-M140 VanDerWaalsContact C-N 3.25Å; G138-M140 PolarHBondContact O-N 2.91Å; M140-K143 PolarHBondContact O-N 3.1Å; M140-I144 HydrophobicContact CG-CD1 3.87Å; M140-I144 HydrophobicContact CG-CG1 4.49Å; M140-I144 WeakPolarHBondContact O-CG1 3.36Å; M140-I144 PolarHBondContact O-N 3.1Å; M140-I144 HydrophobicContact SD-CD1 3.9Å; M140-I144 HydrophobicContact SD-CG1 4.2Å
141	V	95.9	Very high	92.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.8	-47.3	177.4	174.3	0	0	0	0	110.7	A108 M111 L112 V137 G138 K143 G145 V153 I175	A108-V141 HydrophobicContact CB-CG2 3.84Å; M111-V141 HydrophobicContact CE-CG2 3.6Å; L112-V141 HydrophobicContact CD1-CG1 4.46Å; L112-V141 HydrophobicContact CD2-CG1 3.89Å; L112-V141 HydrophobicContact CG-CG1 4.21Å; V137-V141 HydrophobicContact CG1-CG2 4.29Å; V137-V141 WeakPolarHBondContact O-CG2 3.42Å; V137-V141 PolarHBondContact O-N 3.23Å; G138-V141 WeakPolarHBondContact O-CB 3.47Å; G138-V141 PolarHBondContact O-N 2.78Å; G138-V141 VanDerWaalsContact O-N 3.09Å; V141-K143 VanDerWaalsContact C-N 3.35Å; V141-K143 PolarHBondContact O-N 3.47Å; V141-G145 WeakPolarHBondContact O-CA 3.16Å; V141-G145 PolarHBondContact O-N 2.69Å; V141-V153 HydrophobicContact CG1-CG2 3.8Å; V141-I175 HydrophobicContact CG1-CD1 3.61Å; V141-I175 HydrophobicContact CG1-CG2 4.3Å
142	E	95.1	Very high	93.1	Very high	80 Å²	80	40.6 Å²	40.6	37%	0.374	22%	0.219	S	C	.	.	H	α-helix	trans	-60.7	-41.9	177.1	-71.6	167.1	-177.4	0	0	112.1	G138 G145 A146 V153 Y155	G138-E142 WeakPolarHBondContact O-CG 3.24Å; G138-E142 PolarHBondContact O-N 2.83Å; E142-G145 CarbonylContact O-C 3.57Å; E142-G145 PolarHBondContact O-N 2.99Å; E142-A146 WeakPolarHBondContact O-CA 3.44Å; E142-A146 PolarHBondContact O-N 3.11Å; E142-V153 HydrophobicContact CG-CB 4.13Å; E142-V153 HydrophobicContact CG-CG2 3.92Å; E142-Y155 VanDerWaalsContact OE1-CE2 3.23Å; E142-Y155 WeakPolarHBondContact OE1-CE2 3.17Å; E142-Y155 PolarHBondContact OE1-OH 3.35Å; E142-Y155 PolarHBondContact OE2-OH 3.39Å
143	K	93.2	Very high	93.7	Very high	121 Å²	121	40.8 Å²	40.8	53%	0.526	22%	0.221	S	C	.	.	H	α-helix	trans	-65.3	-49.6	178.8	-78.6	177.2	178	-169.8	0	112.8	V139 M140 V141 G145 A146	V139-K143 HydrophobicContact CG1-CD 4.11Å; V139-K143 WeakPolarHBondContact O-CB 3.4Å; V139-K143 WeakPolarHBondContact O-CG 3.37Å; V139-K143 PolarHBondContact O-N 3.13Å; M140-K143 PolarHBondContact O-N 3.1Å; V141-K143 VanDerWaalsContact C-N 3.35Å; V141-K143 PolarHBondContact O-N 3.47Å; K143-G145 VanDerWaalsContact C-N 3.29Å; K143-A146 WeakPolarHBondContact O-CB 3.18Å; K143-A146 PolarHBondContact O-N 3.05Å
144	I	93.5	Very high	94.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-68.4	-34.2	179	-62.9	172.9	0	0	0	110.2	G65 A105 A108 L109 L112 M140 A146	G65-I144 WeakPolarHBondContact CA-O 3.44Å; A105-I144 HydrophobicContact CB-CD1 4.09Å; A108-I144 HydrophobicContact CB-CD1 3.99Å; L109-I144 HydrophobicContact CD2-CG2 3.6Å; L109-I144 HydrophobicContact CG-CD1 4.48Å; L109-I144 HydrophobicContact CG-CG2 4.33Å; L112-I144 HydrophobicContact CD1-CB 3.7Å; L112-I144 HydrophobicContact CD1-CG2 3.54Å; M140-I144 HydrophobicContact CG-CD1 3.87Å; M140-I144 HydrophobicContact CG-CG1 4.49Å; M140-I144 WeakPolarHBondContact O-CG1 3.36Å; M140-I144 PolarHBondContact O-N 3.1Å; M140-I144 HydrophobicContact SD-CD1 3.9Å; M140-I144 HydrophobicContact SD-CG1 4.2Å; I144-A146 VanDerWaalsContact C-N 3.32Å; I144-A146 PolarHBondContact O-N 3.37Å
145	G	95.2	Very high	94.2	Very high	3 Å²	3	42.7 Å²	42.7	3%	0.031	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	5.8	178.8	0	0	0	0	0	115.2	V141 E142 K143 F147 M148	V141-G145 WeakPolarHBondContact O-CA 3.16Å; V141-G145 PolarHBondContact O-N 2.69Å; E142-G145 CarbonylContact O-C 3.57Å; E142-G145 PolarHBondContact O-N 2.99Å; K143-G145 VanDerWaalsContact C-N 3.29Å; G145-F147 PolarHBondContact O-N 2.82Å; G145-M148 WeakPolarHBondContact O-CB 3.38Å; G145-M148 PolarHBondContact O-N 2.82Å
146	A	94.8	Very high	94.4	Very high	67 Å²	67	40.3 Å²	40.3	55%	0.554	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-22.5	-169.2	0	0	0	0	0	115	E142 K143 I144	E142-A146 WeakPolarHBondContact O-CA 3.44Å; E142-A146 PolarHBondContact O-N 3.11Å; K143-A146 WeakPolarHBondContact O-CB 3.18Å; K143-A146 PolarHBondContact O-N 3.05Å; I144-A146 VanDerWaalsContact C-N 3.32Å; I144-A146 PolarHBondContact O-N 3.37Å
147	F	94.8	Very high	94.4	Very high	78 Å²	78	39.2 Å²	39.2	34%	0.342	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	3.3	177.8	-62.2	-86.5	0	0	0	113.6	P61 E64 N68 G145 D149	P61-F147 HydrophobicContact CB-CB 4.08Å; P61-F147 WeakPolarHBondContact CB-O 2.96Å; E64-F147 VanDerWaalsContact C-CE2 3.49Å; E64-F147 HydrophobicContact CB-CB 4.3Å; E64-F147 HydrophobicContact CB-CD1 4.39Å; E64-F147 HydrophobicContact CB-CD2 3.7Å; E64-F147 HydrophobicContact CB-CE2 3.98Å; E64-F147 HydrophobicContact CB-CG 3.89Å; E64-F147 HydrophobicContact CB-CZ 4.45Å; E64-F147 WeakPolarHBondContact O-CE2 3.49Å; N68-F147 WeakPolarHBondContact ND2-CE2 3.4Å; N68-F147 WeakPolarHBondContact ND2-CZ 3.09Å; G145-F147 PolarHBondContact O-N 2.82Å; F147-D149 PolarHBondContact O-N 2.77Å
148	M	95.6	Very high	93.7	Very high	19 Å²	19	41.7 Å²	41.7	9%	0.094	23%	0.225	C	C	.	.	S	Bend	trans	-85.4	101.7	173.9	-66.3	-174.1	75.4	0	0	109.5	K59 P61 L62 L112 V115 T117 G145 D150 L151	K59-M148 HydrophobicContact CD-CE 4.22Å; P61-M148 HydrophobicContact CB-CG 3.76Å; L62-M148 HydrophobicContact CD2-CG 4.17Å; L62-M148 HydrophobicContact CD2-SD 3.5Å; L62-M148 VanDerWaalsContact CD2-SD 3.5Å; L62-M148 HydrophobicContact CG-SD 4.5Å; L112-M148 HydrophobicContact CB-SD 4.12Å; L112-M148 HydrophobicContact CD2-SD 3.86Å; V115-M148 HydrophobicContact CG1-CE 3.83Å; T117-M148 HydrophobicContact CG2-CB 4.32Å; T117-M148 HydrophobicContact CG2-CE 3.86Å; G145-M148 WeakPolarHBondContact O-CB 3.38Å; G145-M148 PolarHBondContact O-N 2.82Å; M148-D150 PolarHBondContact O-N 3.34Å; M148-L151 HydrophobicContact CB-CB 3.93Å; M148-L151 HydrophobicContact CB-CD2 4.2Å; M148-L151 VanDerWaalsContact O-CB 3.3Å; M148-L151 WeakPolarHBondContact O-CB 3.32Å; M148-L151 PolarHBondContact O-N 3.43Å; M148-L151 HydrophobicContact SD-CD2 4.34Å
149	D	94.8	Very high	92.3	Very high	136 Å²	136	43.8 Å²	43.8	73%	0.727	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.5	139.9	173.5	-63.8	-36.4	0	0	0	110.6	T117 F147 L151	T117-D149 WeakPolarHBondContact CB-O 3.4Å; T117-D149 WeakPolarHBondContact CG2-O 3.45Å; T117-D149 PolarHBondContact OG1-O 2.91Å; F147-D149 PolarHBondContact O-N 2.77Å; D149-L151 PolarHBondContact O-N 3.12Å; D149-L151 VanDerWaalsContact O-N 3.14Å
150	D	95.3	Very high	90.4	Very high	105 Å²	105	45.4 Å²	45.4	56%	0.561	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.1	4.7	177.5	-81.1	-54.4	0	0	0	116.9	K120 M148 Q174	K120-D150 PolarHBondContact NZ-O 2.7Å; K120-D150 IonicContact NZ-OD1 3.97Å; K120-D150 PolarHBondContact NZ-OD1 3.44Å; M148-D150 PolarHBondContact O-N 3.34Å; D150-Q174 PolarHBondContact O-NE2 3.04Å
151	L	97.2	Very high	88.2	Confident	34 Å²	34	52.3 Å²	52.3	18%	0.178	28%	0.275	C	S	.	.			trans	-67.7	133.6	173	-178.3	69.5	0	0	0	110.9	L112 V115 T117 M148 D149 I175	L112-L151 HydrophobicContact CD2-CD1 4.21Å; L112-L151 HydrophobicContact CD2-CD2 3.46Å; L112-L151 VanDerWaalsContact CD2-CD2 3.46Å; L112-L151 HydrophobicContact CD2-CG 4.49Å; V115-L151 HydrophobicContact CG1-CD1 4.05Å; T117-L151 HydrophobicContact CG2-CB 3.88Å; T117-L151 HydrophobicContact CG2-CD1 4.14Å; M148-L151 HydrophobicContact CB-CB 3.93Å; M148-L151 HydrophobicContact CB-CD2 4.2Å; M148-L151 VanDerWaalsContact O-CB 3.3Å; M148-L151 WeakPolarHBondContact O-CB 3.32Å; M148-L151 PolarHBondContact O-N 3.43Å; M148-L151 HydrophobicContact SD-CD2 4.34Å; D149-L151 PolarHBondContact O-N 3.12Å; D149-L151 VanDerWaalsContact O-N 3.14Å; L151-I175 HydrophobicContact CD1-CD1 4.03Å; L151-I175 HydrophobicContact CD1-CG1 4.33Å
152	S	96.2	Very high	86	Confident	34 Å²	34	57.8 Å²	57.8	24%	0.238	31%	0.314	C	S	.	.			trans	-137.1	148.3	167.7	75.9	0	0	0	0	112	D173 Q174 I175	S152-D173 WeakPolarHBondContact CB-OD1 3.38Å; S152-D173 VanDerWaalsContact OG-CA 3.26Å; S152-D173 WeakPolarHBondContact OG-CA 3.16Å; S152-D173 WeakPolarHBondContact OG-CB 3.21Å; S152-D173 PolarHBondContact OG-OD1 3.45Å; S152-Q174 PolarHBondContact O-N 3.34Å; S152-Q174 PolarHBondContact O-OE1 2.86Å; S152-Q174 PolarHBondContact OG-OE1 3.46Å; S152-I175 PolarHBondContact O-N 2.77Å
153	V	96.5	Very high	83.9	Confident	19 Å²	19	55.8 Å²	55.8	12%	0.115	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	124.7	-174.1	-176	0	0	0	0	108.2	V141 E142 Y155 I175 V177	V141-V153 HydrophobicContact CG1-CG2 3.8Å; E142-V153 HydrophobicContact CG-CB 4.13Å; E142-V153 HydrophobicContact CG-CG2 3.92Å; V153-Y155 HydrophobicContact CG1-CE2 4.46Å; V153-I175 CarbonylContact C-O 3.56Å; V153-I175 WeakPolarHBondContact CA-O 3.46Å; V153-I175 HydrophobicContact CG1-CG2 4.49Å; V153-I175 HydrophobicContact CG2-CB 4.34Å; V153-V177 HydrophobicContact CG1-CG2 4.13Å
154	C	94.5	Very high	82	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.02	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	144	174.3	-165.5	0	0	0	0	111.2	S164 I171 D173 I175 V176 V177	C154-S164 PolarHBondContact SG-OG 3.37Å; C154-I171 HydrophobicContact CB-CG2 4.13Å; C154-D173 HydrophobicContact CB-CB 3.67Å; C154-I175 PolarHBondContact N-O 2.91Å; C154-V176 HydrophobicContact CB-CG2 4.41Å; C154-V176 WeakPolarHBondContact O-CA 3.41Å; C154-V177 PolarHBondContact O-N 3.3Å
155	Y	94	Very high	80	Confident	42 Å²	42	52.5 Å²	52.5	17%	0.165	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	106.5	176.6	-64.1	-97.3	0	0	0	110.6	G138 V139 E142 V153 I157 V177 W186	G138-Y155 WeakPolarHBondContact CA-OH 3.32Å; V139-Y155 PolarHBondContact N-OH 3.21Å; V139-Y155 VanDerWaalsContact N-OH 3.15Å; E142-Y155 VanDerWaalsContact OE1-CE2 3.23Å; E142-Y155 WeakPolarHBondContact OE1-CE2 3.17Å; E142-Y155 PolarHBondContact OE1-OH 3.35Å; E142-Y155 PolarHBondContact OE2-OH 3.39Å; V153-Y155 HydrophobicContact CG1-CE2 4.46Å; Y155-I157 VanDerWaalsContact C-N 3.28Å; Y155-I157 HydrophobicContact CD1-CD1 4.41Å; Y155-I157 PolarHBondContact O-N 3Å; Y155-I157 VanDerWaalsContact O-N 3.12Å; Y155-V177 CarbonylContact C-O 3.37Å; Y155-V177 VanDerWaalsContact CA-O 3.28Å; Y155-V177 WeakPolarHBondContact CA-O 3.43Å; Y155-W186 VanDerWaalsContact O-CH2 3.31Å; Y155-W186 WeakPolarHBondContact O-CH2 3.36Å
156	A	93.4	Very high	77.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	69.4	173.8	0	0	0	0	0	110.7	V176 V177 G178 T179 T182 L183 W186	A156-V176 HydrophobicContact CB-CG1 3.72Å; A156-V177 PolarHBondContact N-O 3.36Å; A156-G178 CarbonylContact O-C 3.54Å; A156-G178 WeakPolarHBondContact O-CA 3.39Å; A156-T179 PolarHBondContact O-N 3.15Å; A156-T182 VanDerWaalsContact C-CG2 3.49Å; A156-T182 HydrophobicContact CB-CG2 4.21Å; A156-T182 VanDerWaalsContact O-CB 3.3Å; A156-T182 WeakPolarHBondContact O-CB 3.2Å; A156-L183 HydrophobicContact CB-CD2 3.63Å; A156-L183 HydrophobicContact CB-CG 3.7Å; A156-W186 VanDerWaalsContact CA-CH2 3.48Å; A156-W186 HydrophobicContact CB-CD2 4.2Å; A156-W186 HydrophobicContact CB-CE3 3.7Å; A156-W186 HydrophobicContact CB-CH2 3.88Å; A156-W186 HydrophobicContact CB-CZ2 4.32Å; A156-W186 HydrophobicContact CB-CZ3 3.54Å
157	I	88.9	Confident	76.1	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.026	33%	0.327	C	S	.	.	S	Bend	trans	-126.8	152.6	179.7	59.5	-170.2	0	0	0	109.8	Y131 A134 V135 Y155 D159 T179	Y131-I157 HydrophobicContact CD2-CB 3.7Å; Y131-I157 HydrophobicContact CD2-CD1 3.78Å; Y131-I157 HydrophobicContact CD2-CG1 3.92Å; Y131-I157 HydrophobicContact CD2-CG2 4.38Å; Y131-I157 HydrophobicContact CE1-CD1 4.33Å; Y131-I157 HydrophobicContact CE2-CB 3.97Å; Y131-I157 HydrophobicContact CE2-CD1 3.34Å; Y131-I157 HydrophobicContact CE2-CG1 3.63Å; Y131-I157 HydrophobicContact CG-CD1 4.43Å; A134-I157 HydrophobicContact CB-CG2 3.47Å; A134-I157 VanDerWaalsContact CB-CG2 3.47Å; V135-I157 HydrophobicContact CG2-CD1 3.7Å; Y155-I157 VanDerWaalsContact C-N 3.28Å; Y155-I157 HydrophobicContact CD1-CD1 4.41Å; Y155-I157 PolarHBondContact O-N 3Å; Y155-I157 VanDerWaalsContact O-N 3.12Å; I157-D159 PolarHBondContact O-N 2.97Å; I157-T179 HydrophobicContact CG2-CG2 4.46Å
158	P	78.1	Confident	75	Confident	52 Å²	52	67.1 Å²	67.1	34%	0.338	35%	0.353	S	S	.	.			trans	-56.6	128.8	178	-24.5	34.4	0	0	0	111.4	T182	P158-T182 WeakPolarHBondContact CD-OG1 3.16Å
159	D	66.1	Low	74.4	Confident	44 Å²	44	71.5 Å²	71.5	24%	0.235	37%	0.373	C	S	.	.			trans	-73.1	157.9	-173.7	-92.2	9.6	0	0	0	114.4	I157 S163 A165 N166	I157-D159 PolarHBondContact O-N 2.97Å; D159-S163 WeakPolarHBondContact CA-OG 3.16Å; D159-S163 WeakPolarHBondContact OD1-CB 3.38Å; D159-S163 PolarHBondContact OD1-OG 3.44Å; D159-A165 HydrophobicContact CB-CB 4.04Å; D159-A165 WeakPolarHBondContact OD1-CB 3.48Å; D159-A165 PolarHBondContact OD1-N 2.93Å; D159-A165 WeakPolarHBondContact OD2-CA 3.36Å; D159-A165 WeakPolarHBondContact OD2-CB 3.1Å; D159-A165 PolarHBondContact OD2-N 3.23Å; D159-N166 PolarHBondContact OD2-N 2.87Å
160	D	52.9	Low	74.3	Confident	87 Å²	87	69.7 Å²	69.7	47%	0.465	37%	0.369	S	S	.	.			trans	-125	94.2	150.3	-143.9	-13.4	0	0	0	107.4	S162 L331	D160-S162 PolarHBondContact O-N 3.03Å; D160-S162 PolarHBondContact O-OG 3.16Å; D160-L331 HydrophobicContact CB-CD2 4.37Å; D160-L331 WeakPolarHBondContact OD2-CD2 3.23Å
161	E	46.8	Very low	74.2	Confident	170 Å²	170	65.2 Å²	65.2	79%	0.794	35%	0.345	S	S	*	.	S	Bend	trans	38	-10.5	-180	-65.6	-144.2	152.9	0	0	121.9
162	S	48.7	Very low	74.1	Confident	115 Å²	115	67.2 Å²	67.2	80%	0.804	36%	0.358	S	S	*	.	S	Bend	trans	-129.9	-12.5	-162.3	57.7	0	0	0	0	114	D160	D160-S162 PolarHBondContact O-N 3.03Å; D160-S162 PolarHBondContact O-OG 3.16Å
163	S	51.9	Low	74.1	Confident	37 Å²	37	67.2 Å²	67.2	26%	0.259	36%	0.356	S	S	.	.	S	Bend	trans	-85.4	162.4	172	33.1	0	0	0	0	110.8	D159 A165 N166	D159-S163 WeakPolarHBondContact CA-OG 3.16Å; D159-S163 WeakPolarHBondContact OD1-CB 3.38Å; D159-S163 PolarHBondContact OD1-OG 3.44Å; S163-A165 PolarHBondContact O-N 3.33Å; S163-N166 PolarHBondContact O-N 3.38Å
164	S	52.2	Low	74.2	Confident	33 Å²	33	66.3 Å²	66.3	23%	0.231	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-2.2	-172.5	42.4	0	0	0	0	114.4	C154 R167 R192	C154-S164 PolarHBondContact SG-OG 3.37Å; S164-R167 PolarHBondContact O-N 2.77Å; S164-R192 VanDerWaalsContact O-CZ 3.23Å; S164-R192 PolarHBondContact O-NH1 3.4Å; S164-R192 PolarHBondContact O-NH2 2.92Å
165	A	52	Low	74.3	Confident	20 Å²	20	66.1 Å²	66.1	17%	0.165	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-27.8	176.6	0	0	0	0	0	113.5	D159 S163 R167 W186	D159-A165 HydrophobicContact CB-CB 4.04Å; D159-A165 WeakPolarHBondContact OD1-CB 3.48Å; D159-A165 PolarHBondContact OD1-N 2.93Å; D159-A165 WeakPolarHBondContact OD2-CA 3.36Å; D159-A165 WeakPolarHBondContact OD2-CB 3.1Å; D159-A165 PolarHBondContact OD2-N 3.23Å; S163-A165 PolarHBondContact O-N 3.33Å; A165-R167 VanDerWaalsContact C-N 3.31Å; A165-W186 HydrophobicContact CB-CZ2 3.56Å
166	N	50.7	Low	74.5	Confident	101 Å²	101	64.1 Å²	64.1	54%	0.54	34%	0.341	S	S	.	.	S	Bend	trans	-78.9	-16.6	175.3	-97.4	0.6	0	0	0	112.9	D159 S163 K168	D159-N166 PolarHBondContact OD2-N 2.87Å; S163-N166 PolarHBondContact O-N 3.38Å; N166-K168 PolarHBondContact O-N 3.31Å; N166-K168 VanDerWaalsContact O-N 3.16Å
167	R	57.4	Low	74.7	Confident	150 Å²	150	64.1 Å²	64.1	57%	0.566	34%	0.341	S	S	*	.			trans	-72.2	110.9	166.8	-65.7	-171.5	-168.3	174.7	4	107	S164 A165 E169 R192	S164-R167 PolarHBondContact O-N 2.77Å; A165-R167 VanDerWaalsContact C-N 3.31Å; R167-E169 HydrophobicContact CB-CB 4.06Å; R167-E169 HydrophobicContact CB-CG 4.12Å; R167-E169 WeakPolarHBondContact CD-OE2 3.47Å; R167-E169 PolarHBondContact O-N 2.64Å; R167-R192 PolarHBondContact O-NE 2.73Å; R167-R192 PolarHBondContact O-NH1 3.5Å; R167-R192 PolarHBondContact O-NH2 3.15Å
168	K	72.8	Confident	75	Confident	203 Å²	203	63.9 Å²	63.9	88%	0.883	34%	0.34	S	S	*	.			trans	-67.7	7.7	163.9	-65.5	-176.1	179.1	179.8	0	112.6	N166	N166-K168 PolarHBondContact O-N 3.31Å; N166-K168 VanDerWaalsContact O-N 3.16Å
169	E	83	Confident	75.7	Confident	111 Å²	111	62.2 Å²	62.2	52%	0.519	33%	0.329	S	S	.	.	S	Bend	trans	-70.5	146.8	179.1	-62.7	174.9	-175.7	0	0	110.7	R167 I171 R192	R167-E169 HydrophobicContact CB-CB 4.06Å; R167-E169 HydrophobicContact CB-CG 4.12Å; R167-E169 WeakPolarHBondContact CD-OE2 3.47Å; R167-E169 PolarHBondContact O-N 2.64Å; E169-I171 PolarHBondContact O-N 3.33Å; E169-R192 PolarHBondContact O-NE 3.34Å; E169-R192 PolarHBondContact O-NH2 3.37Å
170	P	91.3	Very high	77	Confident	99 Å²	99	60.1 Å²	60.1	64%	0.643	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-55.3	137.7	170.2	-23.9	33.9	0	0	0	111.6	R192	P170-R192 CarbonylContact C-O 3.55Å; P170-R192 WeakPolarHBondContact CA-O 3.45Å
171	I	93.4	Very high	78.9	Confident	10 Å²	10	56.9 Å²	56.9	5%	0.051	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-77.9	123.2	172.7	-61.7	-60.2	0	0	0	108.6	P122 C154 E169 D173 V176 W186 R192 F193	P122-I171 WeakPolarHBondContact CD-O 3.26Å; P122-I171 HydrophobicContact CG-CB 4.44Å; P122-I171 HydrophobicContact CG-CG2 3.89Å; C154-I171 HydrophobicContact CB-CG2 4.13Å; E169-I171 PolarHBondContact O-N 3.33Å; I171-D173 HydrophobicContact CG2-CB 4.13Å; I171-V176 HydrophobicContact CG2-CG2 4.15Å; I171-W186 HydrophobicContact CD1-CE3 4.38Å; I171-W186 HydrophobicContact CD1-CH2 4.29Å; I171-W186 HydrophobicContact CD1-CZ3 3.88Å; I171-W186 HydrophobicContact CG1-CE3 3.99Å; I171-W186 HydrophobicContact CG1-CZ3 3.93Å; I171-R192 VanDerWaalsContact CD1-CZ 3.5Å; I171-R192 HydrophobicContact CG1-CB 4.15Å; I171-R192 PolarHBondContact N-O 3.42Å; I171-F193 HydrophobicContact CB-CB 4.31Å; I171-F193 HydrophobicContact CB-CD1 4.03Å; I171-F193 HydrophobicContact CB-CG 4.44Å; I171-F193 HydrophobicContact CG1-CD1 4.16Å
172	T	94.9	Very high	81.1	Confident	76 Å²	76	49.3 Å²	49.3	47%	0.466	27%	0.27	S	S	.	.			trans	-111.9	-1.7	177.8	56.3	0	0	0	0	112.8	K120 L121	K120-T172 CarbonylContact C-O 3.43Å; K120-T172 WeakPolarHBondContact CA-O 3.06Å; K120-T172 WeakPolarHBondContact O-CB 3.43Å; L121-T172 PolarHBondContact N-O 3.02Å
173	D	96.6	Very high	83.2	Confident	34 Å²	34	43.8 Å²	43.8	18%	0.182	23%	0.232	C	C	.	.			trans	-66.4	140.5	176.1	-57.9	-91.4	0	0	0	112.3	L121 P122 S152 C154 I171	L121-D173 CarbonylContact C-O 3.6Å; P122-D173 WeakPolarHBondContact CA-O 3.43Å; P122-D173 WeakPolarHBondContact CD-O 3.47Å; P122-D173 WeakPolarHBondContact CG-O 3.47Å; P122-D173 VanDerWaalsContact N-O 3.13Å; S152-D173 WeakPolarHBondContact CB-OD1 3.38Å; S152-D173 VanDerWaalsContact OG-CA 3.26Å; S152-D173 WeakPolarHBondContact OG-CA 3.16Å; S152-D173 WeakPolarHBondContact OG-CB 3.21Å; S152-D173 PolarHBondContact OG-OD1 3.45Å; C154-D173 HydrophobicContact CB-CB 3.67Å; I171-D173 HydrophobicContact CG2-CB 4.13Å
174	Q	97.9	Very high	85.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	-80.1	-24.6	-174.8	-52	93.3	-24.8	0	0	113.6	V115 T117 F119 L121 Q123 C124 D150 S152	V115-Q174 HydrophobicContact CG2-CB 3.34Å; V115-Q174 HydrophobicContact CG2-CG 4.18Å; T117-Q174 PolarHBondContact O-NE2 3.09Å; F119-Q174 WeakPolarHBondContact O-CG 3.38Å; L121-Q174 WeakPolarHBondContact O-CA 3.34Å; Q123-Q174 PolarHBondContact N-O 2.82Å; C124-Q174 PolarHBondContact N-O 3.07Å; D150-Q174 PolarHBondContact O-NE2 3.04Å; S152-Q174 PolarHBondContact O-N 3.34Å; S152-Q174 PolarHBondContact O-OE1 2.86Å; S152-Q174 PolarHBondContact OG-OE1 3.46Å
175	I	98.2	Very high	87.1	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	128.3	176.4	-55	-176	0	0	0	109.1	M111 L112 V115 C124 V141 L151 S152 V153 C154 V177	M111-I175 HydrophobicContact CB-CD1 4.27Å; M111-I175 HydrophobicContact CE-CG2 4.49Å; M111-I175 HydrophobicContact SD-CG2 4.19Å; L112-I175 HydrophobicContact CD2-CD1 3.77Å; L112-I175 HydrophobicContact CG-CD1 4.37Å; V115-I175 HydrophobicContact CG1-CD1 4.41Å; V115-I175 HydrophobicContact CG2-CG1 4.29Å; C124-I175 HydrophobicContact CB-CG1 4.22Å; C124-I175 HydrophobicContact CB-CG2 4.48Å; C124-I175 WeakPolarHBondContact O-CA 3.3Å; V141-I175 HydrophobicContact CG1-CD1 3.61Å; V141-I175 HydrophobicContact CG1-CG2 4.3Å; L151-I175 HydrophobicContact CD1-CD1 4.03Å; L151-I175 HydrophobicContact CD1-CG1 4.33Å; S152-I175 PolarHBondContact O-N 2.77Å; V153-I175 CarbonylContact C-O 3.56Å; V153-I175 WeakPolarHBondContact CA-O 3.46Å; V153-I175 HydrophobicContact CG1-CG2 4.49Å; V153-I175 HydrophobicContact CG2-CB 4.34Å; C154-I175 PolarHBondContact N-O 2.91Å; I175-V177 HydrophobicContact CG2-CG2 4.07Å
176	V	97.7	Very high	89.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	121.8	175.2	-171.8	0	0	0	0	109.5	P122 C124 I125 C126 C154 A156 I171 L183 W186	P122-V176 HydrophobicContact CB-CG2 4.05Å; P122-V176 HydrophobicContact CG-CG2 4.07Å; C124-V176 PolarHBondContact O-N 2.95Å; I125-V176 CarbonylContact C-O 3.57Å; I125-V176 VanDerWaalsContact CA-O 3.31Å; I125-V176 WeakPolarHBondContact CA-O 3.44Å; I125-V176 HydrophobicContact CG1-CB 4.47Å; C126-V176 PolarHBondContact N-O 3.45Å; C154-V176 HydrophobicContact CB-CG2 4.41Å; C154-V176 WeakPolarHBondContact O-CA 3.41Å; A156-V176 HydrophobicContact CB-CG1 3.72Å; I171-V176 HydrophobicContact CG2-CG2 4.15Å; V176-L183 HydrophobicContact CG1-CD1 4.5Å; V176-L183 HydrophobicContact CG1-CD2 3.74Å; V176-L183 HydrophobicContact CG1-CG 4.35Å; V176-W186 HydrophobicContact CG1-CZ3 4.3Å
177	V	97.6	Very high	91.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.5	179.2	-176	0	0	0	0	108.8	C126 A134 V137 V153 C154 Y155 A156 I175	C126-V177 HydrophobicContact CB-CG1 4.27Å; C126-V177 HydrophobicContact CB-CG2 4.22Å; C126-V177 WeakPolarHBondContact O-CA 3.4Å; A134-V177 HydrophobicContact CB-CG1 4.2Å; A134-V177 WeakPolarHBondContact O-CG1 3.44Å; V137-V177 HydrophobicContact CB-CG1 3.78Å; V137-V177 HydrophobicContact CG1-CG1 3.6Å; V137-V177 HydrophobicContact CG1-CG2 4.12Å; V153-V177 HydrophobicContact CG1-CG2 4.13Å; C154-V177 PolarHBondContact O-N 3.3Å; Y155-V177 CarbonylContact C-O 3.37Å; Y155-V177 VanDerWaalsContact CA-O 3.28Å; Y155-V177 WeakPolarHBondContact CA-O 3.43Å; A156-V177 PolarHBondContact N-O 3.36Å; I175-V177 HydrophobicContact CG2-CG2 4.07Å
178	G	94.8	Very high	92.8	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	-171	-175.9	0	0	0	0	0	116.2	C126 L127 T128 A156	C126-G178 PolarHBondContact O-N 3.36Å; L127-G178 WeakPolarHBondContact CA-O 3.43Å; T128-G178 PolarHBondContact N-O 3.49Å; T128-G178 PolarHBondContact OG1-O 3.02Å; A156-G178 CarbonylContact O-C 3.54Å; A156-G178 WeakPolarHBondContact O-CA 3.39Å
179	T	92.8	Very high	93.6	Very high	16 Å²	16	34.6 Å²	34.6	10%	0.098	19%	0.191	C	C	.	.			trans	-92.2	147.6	175.9	67.6	0	0	0	0	110.8	T128 A156 I157 G181 T182 L183	T128-T179 WeakPolarHBondContact O-CA 3.36Å; A156-T179 PolarHBondContact O-N 3.15Å; I157-T179 HydrophobicContact CG2-CG2 4.46Å; T179-G181 PolarHBondContact O-N 3.33Å; T179-T182 PolarHBondContact O-N 3.1Å; T179-T182 PolarHBondContact OG1-OG1 2.82Å; T179-L183 PolarHBondContact O-N 3.32Å
180	P	94	Very high	94	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-53.6	-36.5	178.5	-28.9	34.1	0	0	0	114.1	L127 T128 F184 M209 L215 Q218 T219	L127-P180 HydrophobicContact CB-CG 4.47Å; L127-P180 HydrophobicContact CD2-CG 4.35Å; T128-P180 WeakPolarHBondContact O-CD 3.2Å; P180-F184 WeakPolarHBondContact O-CB 3.35Å; P180-F184 PolarHBondContact O-N 3.09Å; P180-M209 HydrophobicContact CG-CE 4.08Å; P180-M209 HydrophobicContact CG-SD 3.97Å; P180-L215 HydrophobicContact CB-CD2 4.34Å; P180-L215 HydrophobicContact CG-CB 4.37Å; P180-L215 HydrophobicContact CG-CD2 4.32Å; P180-Q218 HydrophobicContact CB-CB 3.84Å; P180-T219 WeakPolarHBondContact CG-OG1 3.23Å
181	G	92.2	Very high	94.1	Very high	19 Å²	19	36.5 Å²	36.5	20%	0.196	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-51.7	-179.7	0	0	0	0	0	113.1	T179 F184 Q185 Q218	T179-G181 PolarHBondContact O-N 3.33Å; G181-F184 PolarHBondContact O-N 3.36Å; G181-Q185 PolarHBondContact O-N 2.79Å; G181-Q185 VanDerWaalsContact O-N 3.08Å; G181-Q218 VanDerWaalsContact CA-OE1 3.32Å
182	T	92.4	Very high	94	Very high	11 Å²	11	36.5 Å²	36.5	7%	0.067	19%	0.188	C	C	.	.	H	α-helix	trans	-66.8	-40.8	178.9	-53.2	0	0	0	0	111.4	A156 P158 T179 Q185 W186	A156-T182 VanDerWaalsContact C-CG2 3.49Å; A156-T182 HydrophobicContact CB-CG2 4.21Å; A156-T182 VanDerWaalsContact O-CB 3.3Å; A156-T182 WeakPolarHBondContact O-CB 3.2Å; P158-T182 WeakPolarHBondContact CD-OG1 3.16Å; T179-T182 PolarHBondContact O-N 3.1Å; T179-T182 PolarHBondContact OG1-OG1 2.82Å; T182-Q185 WeakPolarHBondContact O-CB 3.4Å; T182-Q185 PolarHBondContact O-N 3.43Å; T182-W186 HydrophobicContact CG2-CD2 4.33Å; T182-W186 HydrophobicContact CG2-CG 4.5Å; T182-W186 HydrophobicContact CG2-CZ2 4.12Å; T182-W186 PolarHBondContact O-N 3.5Å
183	L	94.4	Very high	94	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.9	-43.3	178.2	-105.8	-156.5	0	0	0	112.6	I125 L127 A156 V176 T179 Q185 W186 T187 F193 I222	I125-L183 HydrophobicContact CB-CD1 4.43Å; I125-L183 HydrophobicContact CD1-CD1 4.08Å; I125-L183 HydrophobicContact CG1-CD1 4.34Å; I125-L183 HydrophobicContact CG2-CD1 3.3Å; L127-L183 HydrophobicContact CD2-CB 4.31Å; L127-L183 HydrophobicContact CD2-CD1 3.74Å; L127-L183 HydrophobicContact CD2-CG 4.45Å; A156-L183 HydrophobicContact CB-CD2 3.63Å; A156-L183 HydrophobicContact CB-CG 3.7Å; V176-L183 HydrophobicContact CG1-CD1 4.5Å; V176-L183 HydrophobicContact CG1-CD2 3.74Å; V176-L183 HydrophobicContact CG1-CG 4.35Å; T179-L183 PolarHBondContact O-N 3.32Å; L183-Q185 VanDerWaalsContact C-N 3.28Å; L183-Q185 PolarHBondContact O-N 3.26Å; L183-W186 HydrophobicContact CD2-CE3 4.19Å; L183-W186 PolarHBondContact O-N 2.96Å; L183-T187 WeakPolarHBondContact O-CG2 3.33Å; L183-T187 PolarHBondContact O-N 2.84Å; L183-T187 PolarHBondContact O-OG1 3.45Å; L183-T187 VanDerWaalsContact O-OG1 3.05Å; L183-F193 HydrophobicContact CD2-CE1 3.66Å; L183-F193 HydrophobicContact CD2-CZ 3.46Å; L183-F193 VanDerWaalsContact CD2-CZ 3.46Å; L183-I222 HydrophobicContact CB-CD1 3.87Å
184	F	93.5	Very high	93.8	Very high	55 Å²	55	37.4 Å²	37.4	24%	0.241	19%	0.189	C	C	.	.	H	α-helix	trans	-58.8	-41.3	175	177.3	-100.5	0	0	0	111.6	P180 G181 T187 S188 Q218 A221 I222	P180-F184 WeakPolarHBondContact O-CB 3.35Å; P180-F184 PolarHBondContact O-N 3.09Å; G181-F184 PolarHBondContact O-N 3.36Å; F184-T187 PolarHBondContact O-OG1 2.74Å; F184-S188 WeakPolarHBondContact CE2-OG 3.33Å; F184-S188 VanDerWaalsContact O-CB 3.22Å; F184-S188 WeakPolarHBondContact O-CB 3.42Å; F184-S188 PolarHBondContact O-N 2.92Å; F184-S188 PolarHBondContact O-OG 3.43Å; F184-Q218 HydrophobicContact CB-CB 4.42Å; F184-Q218 HydrophobicContact CB-CG 4.49Å; F184-A221 HydrophobicContact CD2-CB 3.83Å; F184-A221 HydrophobicContact CE2-CB 3.63Å; F184-I222 HydrophobicContact CB-CD1 4.29Å; F184-I222 HydrophobicContact CB-CG1 4.36Å
185	Q	92.4	Very high	93.7	Very high	81 Å²	81	37.7 Å²	37.7	38%	0.379	19%	0.191	S	C	.	.	I	π-helix	trans	-60.3	-49.2	174.2	-174.5	177.5	-26.2	0	0	111.3	G181 T182 L183 T187 Q189 E190	G181-Q185 PolarHBondContact O-N 2.79Å; G181-Q185 VanDerWaalsContact O-N 3.08Å; T182-Q185 WeakPolarHBondContact O-CB 3.4Å; T182-Q185 PolarHBondContact O-N 3.43Å; L183-Q185 VanDerWaalsContact C-N 3.28Å; L183-Q185 PolarHBondContact O-N 3.26Å; Q185-T187 PolarHBondContact O-N 2.66Å; Q185-Q189 WeakPolarHBondContact O-CB 3.27Å; Q185-Q189 PolarHBondContact O-N 3Å; Q185-E190 HydrophobicContact CG-CG 4.26Å; Q185-E190 PolarHBondContact NE2-OE1 3.41Å; Q185-E190 PolarHBondContact O-N 3.25Å
186	W	93.4	Very high	93.6	Very high	2 Å²	2	39 Å²	39	1%	0.008	20%	0.201	C	C	.	.	I	π-helix	trans	-62.1	-40.4	-179.4	-73.2	7.5	0	0	0	112.9	Y155 A156 A165 I171 V176 T182 L183 K191 R192 F193	Y155-W186 VanDerWaalsContact O-CH2 3.31Å; Y155-W186 WeakPolarHBondContact O-CH2 3.36Å; A156-W186 VanDerWaalsContact CA-CH2 3.48Å; A156-W186 HydrophobicContact CB-CD2 4.2Å; A156-W186 HydrophobicContact CB-CE3 3.7Å; A156-W186 HydrophobicContact CB-CH2 3.88Å; A156-W186 HydrophobicContact CB-CZ2 4.32Å; A156-W186 HydrophobicContact CB-CZ3 3.54Å; A165-W186 HydrophobicContact CB-CZ2 3.56Å; I171-W186 HydrophobicContact CD1-CE3 4.38Å; I171-W186 HydrophobicContact CD1-CH2 4.29Å; I171-W186 HydrophobicContact CD1-CZ3 3.88Å; I171-W186 HydrophobicContact CG1-CE3 3.99Å; I171-W186 HydrophobicContact CG1-CZ3 3.93Å; V176-W186 HydrophobicContact CG1-CZ3 4.3Å; T182-W186 HydrophobicContact CG2-CD2 4.33Å; T182-W186 HydrophobicContact CG2-CG 4.5Å; T182-W186 HydrophobicContact CG2-CZ2 4.12Å; T182-W186 PolarHBondContact O-N 3.5Å; L183-W186 HydrophobicContact CD2-CE3 4.19Å; L183-W186 PolarHBondContact O-N 2.96Å; W186-K191 CarbonylContact O-C 3.54Å; W186-K191 WeakPolarHBondContact O-CA 3.16Å; W186-K191 PolarHBondContact O-N 3.17Å; W186-R192 HydrophobicContact CB-CB 4.34Å; W186-R192 HydrophobicContact CB-CG 4.41Å; W186-R192 HydrophobicContact CG-CG 4.49Å; W186-R192 VanDerWaalsContact CZ2-NH1 3.28Å; W186-R192 PolarHBondContact O-N 2.91Å; W186-F193 HydrophobicContact CB-CE1 4.16Å; W186-F193 HydrophobicContact CE3-CE1 4.17Å
187	T	94	Very high	93.4	Very high	19 Å²	19	43 Å²	43	12%	0.117	22%	0.223	C	C	.	.	I	π-helix	trans	-84	-41.2	-176.6	57.3	0	0	0	0	112.7	L183 F184 Q185 F193 L195	L183-T187 WeakPolarHBondContact O-CG2 3.33Å; L183-T187 PolarHBondContact O-N 2.84Å; L183-T187 PolarHBondContact O-OG1 3.45Å; L183-T187 VanDerWaalsContact O-OG1 3.05Å; F184-T187 PolarHBondContact O-OG1 2.74Å; Q185-T187 PolarHBondContact O-N 2.66Å; T187-F193 HydrophobicContact CG2-CD1 4.43Å; T187-F193 HydrophobicContact CG2-CD2 4.46Å; T187-F193 HydrophobicContact CG2-CE1 3.75Å; T187-F193 HydrophobicContact CG2-CE2 3.82Å; T187-F193 HydrophobicContact CG2-CZ 3.41Å; T187-F193 VanDerWaalsContact CG2-CZ 3.41Å; T187-L195 HydrophobicContact CG2-CD1 4.25Å; T187-L195 HydrophobicContact CG2-CD2 3.92Å; T187-L195 HydrophobicContact CG2-CG 3.96Å
188	S	91.7	Very high	93.4	Very high	61 Å²	61	43.1 Å²	43.1	43%	0.427	22%	0.223	S	C	.	.	I	π-helix	trans	-98.2	-32.7	-168.8	-56.8	0	0	0	0	114	F184	F184-S188 WeakPolarHBondContact CE2-OG 3.33Å; F184-S188 VanDerWaalsContact O-CB 3.22Å; F184-S188 WeakPolarHBondContact O-CB 3.42Å; F184-S188 PolarHBondContact O-N 2.92Å; F184-S188 PolarHBondContact O-OG 3.43Å
189	Q	90.2	Very high	93.4	Very high	133 Å²	133	45.8 Å²	45.8	62%	0.621	24%	0.235	S	C	*	.	I	π-helix	trans	-103	-49.9	-175.6	-59.2	179.6	7.6	0	0	111.6	Q185	Q185-Q189 WeakPolarHBondContact O-CB 3.27Å; Q185-Q189 PolarHBondContact O-N 3Å
190	E	91.4	Very high	93.6	Very high	80 Å²	80	45 Å²	45	37%	0.374	23%	0.231	S	C	.	.	S	Bend	trans	-89.7	-19.9	-175.7	-63.9	175.6	-176.4	0	0	113.2	Q185 R192	Q185-E190 HydrophobicContact CG-CG 4.26Å; Q185-E190 PolarHBondContact NE2-OE1 3.41Å; Q185-E190 PolarHBondContact O-N 3.25Å; E190-R192 VanDerWaalsContact C-N 3.27Å; E190-R192 HydrophobicContact CB-CG 3.73Å; E190-R192 PolarHBondContact O-N 3.09Å; E190-R192 WeakPolarHBondContact OE2-CD 3.46Å
191	K	92.3	Very high	93.7	Very high	170 Å²	170	45.1 Å²	45.1	74%	0.739	23%	0.231	S	C	*	.			trans	52.8	42.5	-179.3	-57.2	-177.9	179.6	-178.2	0	113	W186 F193	W186-K191 CarbonylContact O-C 3.54Å; W186-K191 WeakPolarHBondContact O-CA 3.16Å; W186-K191 PolarHBondContact O-N 3.17Å; K191-F193 PolarHBondContact O-N 2.95Å
192	R	92.5	Very high	94	Very high	9 Å²	9	44.2 Å²	44.2	3%	0.034	22%	0.221	C	C	.	.			trans	-68.4	-24.5	-178.8	-62.2	-167.2	60.7	-173	1.3	113.3	S164 R167 E169 P170 I171 W186 E190	S164-R192 VanDerWaalsContact O-CZ 3.23Å; S164-R192 PolarHBondContact O-NH1 3.4Å; S164-R192 PolarHBondContact O-NH2 2.92Å; R167-R192 PolarHBondContact O-NE 2.73Å; R167-R192 PolarHBondContact O-NH1 3.5Å; R167-R192 PolarHBondContact O-NH2 3.15Å; E169-R192 PolarHBondContact O-NE 3.34Å; E169-R192 PolarHBondContact O-NH2 3.37Å; P170-R192 CarbonylContact C-O 3.55Å; P170-R192 WeakPolarHBondContact CA-O 3.45Å; I171-R192 VanDerWaalsContact CD1-CZ 3.5Å; I171-R192 HydrophobicContact CG1-CB 4.15Å; I171-R192 PolarHBondContact N-O 3.42Å; W186-R192 HydrophobicContact CB-CB 4.34Å; W186-R192 HydrophobicContact CB-CG 4.41Å; W186-R192 HydrophobicContact CG-CG 4.49Å; W186-R192 VanDerWaalsContact CZ2-NH1 3.28Å; W186-R192 PolarHBondContact O-N 2.91Å; E190-R192 VanDerWaalsContact C-N 3.27Å; E190-R192 HydrophobicContact CB-CG 3.73Å; E190-R192 PolarHBondContact O-N 3.09Å; E190-R192 WeakPolarHBondContact OE2-CD 3.46Å
193	F	94.4	Very high	94.1	Very high	20 Å²	20	43.7 Å²	43.7	9%	0.088	22%	0.218	C	C	.	.	S	Bend	trans	-160.3	162.3	171	67.2	-80.4	0	0	0	109.7	P122 I125 I171 L183 W186 T187 K191 L195	P122-F193 HydrophobicContact CB-CD2 3.65Å; P122-F193 HydrophobicContact CB-CE2 3.94Å; P122-F193 HydrophobicContact CB-CG 4.32Å; P122-F193 HydrophobicContact CG-CB 3.83Å; P122-F193 HydrophobicContact CG-CD1 4.44Å; P122-F193 HydrophobicContact CG-CD2 3.54Å; P122-F193 HydrophobicContact CG-CE2 4.16Å; P122-F193 HydrophobicContact CG-CG 3.69Å; I125-F193 HydrophobicContact CD1-CE2 4.07Å; I125-F193 HydrophobicContact CD1-CZ 4.33Å; I171-F193 HydrophobicContact CB-CB 4.31Å; I171-F193 HydrophobicContact CB-CD1 4.03Å; I171-F193 HydrophobicContact CB-CG 4.44Å; I171-F193 HydrophobicContact CG1-CD1 4.16Å; L183-F193 HydrophobicContact CD2-CE1 3.66Å; L183-F193 HydrophobicContact CD2-CZ 3.46Å; L183-F193 VanDerWaalsContact CD2-CZ 3.46Å; W186-F193 HydrophobicContact CB-CE1 4.16Å; W186-F193 HydrophobicContact CE3-CE1 4.17Å; T187-F193 HydrophobicContact CG2-CD1 4.43Å; T187-F193 HydrophobicContact CG2-CD2 4.46Å; T187-F193 HydrophobicContact CG2-CE1 3.75Å; T187-F193 HydrophobicContact CG2-CE2 3.82Å; T187-F193 HydrophobicContact CG2-CZ 3.41Å; T187-F193 VanDerWaalsContact CG2-CZ 3.41Å; K191-F193 PolarHBondContact O-N 2.95Å; F193-L195 HydrophobicContact CE2-CD2 3.89Å
194	D	92.2	Very high	94.1	Very high	109 Å²	109	43.9 Å²	43.9	58%	0.583	22%	0.219	S	C	*	.			trans	-98.9	144.8	176.5	-176.1	11.7	0	0	0	111	A196	D194-A196 VanDerWaalsContact C-N 3.29Å; D194-A196 PolarHBondContact OD1-N 3.06Å; D194-A196 VanDerWaalsContact OD1-N 3.11Å; D194-A196 WeakPolarHBondContact OD2-CB 3.43Å
195	L	96.4	Very high	93.9	Very high	7 Å²	7	41.7 Å²	41.7	4%	0.037	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-79.8	-9.6	176.7	-68.7	176.8	0	0	0	113	I125 T187 F193 N197 V198 I222 A225 L226	I125-L195 HydrophobicContact CD1-CD2 3.39Å; T187-L195 HydrophobicContact CG2-CD1 4.25Å; T187-L195 HydrophobicContact CG2-CD2 3.92Å; T187-L195 HydrophobicContact CG2-CG 3.96Å; F193-L195 HydrophobicContact CE2-CD2 3.89Å; L195-N197 PolarHBondContact O-N 2.8Å; L195-N197 VanDerWaalsContact O-N 3.13Å; L195-V198 HydrophobicContact CD2-CG2 3.96Å; L195-V198 WeakPolarHBondContact O-CB 3.33Å; L195-V198 PolarHBondContact O-N 3.37Å; L195-V198 VanDerWaalsContact O-N 3.1Å; L195-I222 HydrophobicContact CD1-CG2 4.28Å; L195-A225 HydrophobicContact CD1-CB 3.65Å; L195-L226 HydrophobicContact CB-CD2 4.13Å; L195-L226 HydrophobicContact CD2-CD2 4.13Å
196	A	95.3	Very high	93.8	Very high	27 Å²	27	37.9 Å²	37.9	22%	0.223	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-57.9	-26.8	-177.9	0	0	0	0	0	114.8	D194 Q227	D194-A196 VanDerWaalsContact C-N 3.29Å; D194-A196 PolarHBondContact OD1-N 3.06Å; D194-A196 VanDerWaalsContact OD1-N 3.11Å; D194-A196 WeakPolarHBondContact OD2-CB 3.43Å; A196-Q227 WeakPolarHBondContact O-CG 3.47Å; A196-Q227 PolarHBondContact O-NE2 3.35Å; A196-Q227 VanDerWaalsContact O-NE2 3.11Å; A196-Q227 PolarHBondContact O-OE1 3.02Å
197	N	94.7	Very high	93.5	Very high	85 Å²	85	38 Å²	38	46%	0.455	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-99.9	2.2	-179.1	-66.9	-73.2	0	0	0	113.9	L121 L195 K199	L121-N197 HydrophobicContact CD1-CB 3.33Å; L195-N197 PolarHBondContact O-N 2.8Å; L195-N197 VanDerWaalsContact O-N 3.13Å; N197-K199 PolarHBondContact O-N 3.08Å
198	V	97	Very high	93	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	19%	0.187	C	C	.	.			trans	-73.5	117.1	-179.7	179.2	0	0	0	0	109	Q123 I125 L195 M200 L226 C230	Q123-V198 CarbonylContact O-C 3.48Å; Q123-V198 WeakPolarHBondContact O-CA 3.43Å; I125-V198 HydrophobicContact CB-CG1 4.47Å; I125-V198 HydrophobicContact CD1-CG1 4.07Å; I125-V198 HydrophobicContact CD1-CG2 3.71Å; I125-V198 HydrophobicContact CG1-CG1 4.08Å; I125-V198 HydrophobicContact CG1-CG2 4.17Å; L195-V198 HydrophobicContact CD2-CG2 3.96Å; L195-V198 WeakPolarHBondContact O-CB 3.33Å; L195-V198 PolarHBondContact O-N 3.37Å; L195-V198 VanDerWaalsContact O-N 3.1Å; V198-M200 WeakPolarHBondContact CG1-O 3.24Å; V198-L226 HydrophobicContact CB-CD2 3.6Å; V198-L226 HydrophobicContact CG1-CD2 3.64Å; V198-L226 HydrophobicContact CG2-CD2 4.23Å; V198-C230 WeakPolarHBondContact O-CB 3.4Å
199	K	95	Very high	92.7	Very high	57 Å²	57	34.2 Å²	34.2	25%	0.248	17%	0.167	C	C	.	.			trans	-92.1	-22.6	-179.3	-62.1	172.3	-177.2	165.9	0	112.4	K114 E116 Q123 N197 Q231	K114-K199 HydrophobicContact CG-CB 4.06Å; E116-K199 IonicContact OE1-NZ 2.76Å; E116-K199 PolarHBondContact OE1-NZ 3.25Å; Q123-K199 PolarHBondContact O-N 3.17Å; N197-K199 PolarHBondContact O-N 3.08Å; K199-Q231 PolarHBondContact O-N 3.2Å
200	M	95.9	Very high	92.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	133	-178.6	-174.7	173.9	-77.4	0	0	112.4	C110 M111 K114 Q123 C124 I125 V198 V202 Q231 L233	C110-M200 HydrophobicContact CB-CE 4.11Å; C110-M200 HydrophobicContact CB-SD 3.82Å; M111-M200 HydrophobicContact CG-SD 3.91Å; K114-M200 HydrophobicContact CB-CE 4.25Å; K114-M200 HydrophobicContact CD-CE 4.42Å; K114-M200 HydrophobicContact CG-CE 4.39Å; Q123-M200 PolarHBondContact O-N 2.75Å; C124-M200 WeakPolarHBondContact CA-O 3.2Å; I125-M200 PolarHBondContact N-O 2.93Å; V198-M200 WeakPolarHBondContact CG1-O 3.24Å; M200-V202 HydrophobicContact CG-CG2 4.23Å; M200-V202 HydrophobicContact SD-CG2 4.25Å; M200-Q231 CarbonylContact C-O 3.55Å; M200-Q231 VanDerWaalsContact CA-O 3.25Å; M200-Q231 WeakPolarHBondContact CA-O 3.3Å; M200-Q231 HydrophobicContact CE-CG 4.44Å; M200-L233 HydrophobicContact CE-CD1 4.09Å; M200-L233 HydrophobicContact SD-CD1 3.9Å
201	L	97.2	Very high	91.6	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	125.2	167.5	175.2	66.9	0	0	0	109.4	I125 L127 I203 L226 Q231 K232 L233	I125-L201 HydrophobicContact CB-CD1 4.03Å; I125-L201 HydrophobicContact CG2-CD1 3.69Å; I125-L201 CarbonylContact O-C 3.58Å; I125-L201 WeakPolarHBondContact O-CA 3.04Å; L127-L201 HydrophobicContact CD1-CD1 3.92Å; L127-L201 HydrophobicContact CG-CD1 3.95Å; L201-I203 HydrophobicContact CD2-CD1 4.28Å; L201-I203 HydrophobicContact CD2-CG1 4.32Å; L201-I203 HydrophobicContact CG-CG1 4.3Å; L201-L226 HydrophobicContact CB-CD1 3.78Å; L201-L226 HydrophobicContact CD2-CD1 3.63Å; L201-L226 HydrophobicContact CG-CD1 4.18Å; L201-Q231 PolarHBondContact N-O 3.14Å; L201-K232 HydrophobicContact CB-CG 4.32Å; L201-K232 CarbonylContact O-C 3.54Å; L201-K232 VanDerWaalsContact O-CA 3.31Å; L201-K232 WeakPolarHBondContact O-CA 3.39Å; L201-L233 PolarHBondContact O-N 3.2Å
202	V	97.2	Very high	90.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	134.7	170.1	-179.1	0	0	0	0	108.9	F107 M111 I125 C126 L127 M200 L233 F235	F107-V202 HydrophobicContact CB-CG1 3.89Å; F107-V202 HydrophobicContact CB-CG2 4.28Å; F107-V202 HydrophobicContact CD1-CG1 4.16Å; F107-V202 HydrophobicContact CD2-CG1 3.93Å; F107-V202 HydrophobicContact CE2-CG1 4.46Å; F107-V202 HydrophobicContact CG-CG1 3.77Å; M111-V202 HydrophobicContact CG-CG2 3.87Å; M111-V202 HydrophobicContact SD-CG2 3.95Å; I125-V202 PolarHBondContact O-N 2.9Å; C126-V202 CarbonylContact C-O 3.53Å; C126-V202 WeakPolarHBondContact CA-O 3.34Å; C126-V202 HydrophobicContact CB-CB 4.17Å; L127-V202 PolarHBondContact N-O 2.87Å; M200-V202 HydrophobicContact CG-CG2 4.23Å; M200-V202 HydrophobicContact SD-CG2 4.25Å; V202-L233 CarbonylContact C-O 3.58Å; V202-L233 WeakPolarHBondContact CA-O 3.17Å; V202-L233 HydrophobicContact CG2-CB 4.37Å; V202-L233 HydrophobicContact CG2-CD1 4.35Å; V202-F235 HydrophobicContact CG1-CD2 4.07Å; V202-F235 HydrophobicContact CG1-CE2 4.2Å
203	I	96	Very high	89.5	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	109.3	171.1	-60.5	174.5	0	0	0	107.4	L127 L201 A206 M209 T219 L233 L234 F235 F246 V250	L127-I203 HydrophobicContact CB-CG1 4.48Å; L127-I203 HydrophobicContact CD1-CG1 4.38Å; L201-I203 HydrophobicContact CD2-CD1 4.28Å; L201-I203 HydrophobicContact CD2-CG1 4.32Å; L201-I203 HydrophobicContact CG-CG1 4.3Å; I203-A206 HydrophobicContact CG2-CB 4.08Å; I203-M209 HydrophobicContact CG2-CE 3.97Å; I203-M209 HydrophobicContact CG2-CG 4.31Å; I203-M209 HydrophobicContact CG2-SD 3.69Å; I203-T219 HydrophobicContact CD1-CG2 3.61Å; I203-T219 HydrophobicContact CG1-CG2 4.29Å; I203-L233 PolarHBondContact N-O 3.11Å; I203-L234 HydrophobicContact CB-CG 4.42Å; I203-F235 PolarHBondContact O-N 3.31Å; I203-F246 HydrophobicContact CD1-CE1 4.32Å; I203-F246 HydrophobicContact CD1-CZ 4.46Å; I203-F246 HydrophobicContact CG2-CE1 4.37Å; I203-V250 HydrophobicContact CD1-CB 4.41Å; I203-V250 HydrophobicContact CD1-CG1 3.64Å; I203-V250 HydrophobicContact CD1-CG2 4.01Å
204	D	93.8	Very high	88.7	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.016	18%	0.183	C	C	.	.			trans	-92.5	150.3	175.3	-162.1	14.6	0	0	0	111.4	F107 L127 T128 L133 A206	F107-D204 HydrophobicContact CE1-CB 4.1Å; F107-D204 HydrophobicContact CZ-CB 4.1Å; F107-D204 WeakPolarHBondContact CZ-OD2 3.29Å; L127-D204 PolarHBondContact O-N 2.9Å; T128-D204 HydrophobicContact CG2-CB 4.34Å; L133-D204 HydrophobicContact CD2-CB 4.44Å; D204-A206 PolarHBondContact O-N 3.5Å
205	E	89.1	Confident	88.1	Confident	10 Å²	10	31.9 Å²	31.9	5%	0.047	16%	0.16	C	C	.	.	S	Bend	trans	49.7	50.5	-179.2	-61.3	-81.4	-142.6	0	0	112.8	P129 L133 D207 I208 M209 F235 T237 H384	P129-E205 HydrophobicContact CG-CB 3.86Å; L133-E205 HydrophobicContact CD2-CB 4.32Å; L133-E205 HydrophobicContact CD2-CG 3.53Å; E205-D207 VanDerWaalsContact C-N 3.25Å; E205-D207 PolarHBondContact O-N 3.14Å; E205-I208 HydrophobicContact CB-CB 4.16Å; E205-I208 HydrophobicContact CB-CD1 3.91Å; E205-I208 HydrophobicContact CB-CG1 4.3Å; E205-I208 HydrophobicContact CG-CD1 4.19Å; E205-I208 WeakPolarHBondContact O-CA 3.49Å; E205-I208 VanDerWaalsContact O-CB 3.28Å; E205-I208 WeakPolarHBondContact O-CB 3.36Å; E205-I208 PolarHBondContact O-N 3.14Å; E205-M209 PolarHBondContact O-N 3.41Å; E205-M209 VanDerWaalsContact O-N 3.15Å; E205-F235 PolarHBondContact N-O 3.46Å; E205-F235 VanDerWaalsContact N-O 3.15Å; E205-T237 PolarHBondContact OE2-OG1 3.17Å; E205-H384 IonicContact OE1-CE1 2.73Å; E205-H384 IonicContact OE2-CE1 3.39Å; E205-H384 PolarHBondContact OE2-CE1 2.89Å; E205-H384 VanDerWaalsContact OE2-CE1 3.26Å
206	A	90.8	Very high	87.4	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.9	-30.3	-173	0	0	0	0	0	114.1	I203 D204 I208 M209 V210 L234 F235 T243 F246	I203-A206 HydrophobicContact CG2-CB 4.08Å; D204-A206 PolarHBondContact O-N 3.5Å; A206-I208 PolarHBondContact O-N 2.88Å; A206-M209 WeakPolarHBondContact O-CB 3.29Å; A206-M209 PolarHBondContact O-N 2.71Å; A206-M209 VanDerWaalsContact O-N 3.17Å; A206-V210 VanDerWaalsContact O-CG2 3.28Å; A206-V210 WeakPolarHBondContact O-CG2 3.47Å; A206-V210 PolarHBondContact O-N 2.63Å; A206-V210 VanDerWaalsContact O-N 3.09Å; A206-L234 HydrophobicContact CB-CD1 3.93Å; A206-L234 HydrophobicContact CB-CD2 3.4Å; A206-L234 HydrophobicContact CB-CG 3.57Å; A206-F235 PolarHBondContact N-O 2.71Å; A206-T243 HydrophobicContact CB-CG2 4.48Å; A206-F246 HydrophobicContact CB-CD1 4.5Å; A206-F246 HydrophobicContact CB-CE1 4.32Å
207	D	86.5	Confident	87	Confident	5 Å²	5	34 Å²	34	3%	0.027	18%	0.175	C	C	.	.	H	α-helix	trans	-58.1	-38.7	171.4	46.5	-37.1	0	0	0	111.9	E205 D211 S236 T237 T238 S380 H384	E205-D207 VanDerWaalsContact C-N 3.25Å; E205-D207 PolarHBondContact O-N 3.14Å; D207-D211 PolarHBondContact O-N 3.35Å; D207-S236 WeakPolarHBondContact CB-OG 3.45Å; D207-S236 PolarHBondContact N-OG 2.86Å; D207-S236 PolarHBondContact OD1-OG 3.09Å; D207-T237 PolarHBondContact OD1-N 3.35Å; D207-T238 WeakPolarHBondContact CB-OG1 3.45Å; D207-T238 PolarHBondContact OD2-N 3.37Å; D207-T238 PolarHBondContact OD2-OG1 3.2Å; D207-S380 PolarHBondContact OD2-OG 2.99Å; D207-H384 IonicContact OD2-CD2 3.55Å; D207-H384 IonicContact OD2-CE1 2.82Å; D207-H384 IonicContact OD2-NE2 2.74Å; D207-H384 PolarHBondContact OD2-NE2 3.18Å
208	I	83.7	Confident	86.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-71.1	-39.6	175.7	-66.4	174.1	0	0	0	111	P129 E205 A206 V210 D211 L212 R356	P129-I208 HydrophobicContact CB-CB 4.24Å; P129-I208 HydrophobicContact CB-CG2 3.37Å; P129-I208 HydrophobicContact CG-CB 4.09Å; P129-I208 HydrophobicContact CG-CG2 3.56Å; E205-I208 HydrophobicContact CB-CB 4.16Å; E205-I208 HydrophobicContact CB-CD1 3.91Å; E205-I208 HydrophobicContact CB-CG1 4.3Å; E205-I208 HydrophobicContact CG-CD1 4.19Å; E205-I208 WeakPolarHBondContact O-CA 3.49Å; E205-I208 VanDerWaalsContact O-CB 3.28Å; E205-I208 WeakPolarHBondContact O-CB 3.36Å; E205-I208 PolarHBondContact O-N 3.14Å; A206-I208 PolarHBondContact O-N 2.88Å; I208-V210 PolarHBondContact O-N 3.38Å; I208-D211 PolarHBondContact O-N 2.92Å; I208-L212 HydrophobicContact CG2-CD1 4.37Å; I208-L212 PolarHBondContact O-N 3.05Å; I208-R356 HydrophobicContact CD1-CB 4Å; I208-R356 HydrophobicContact CD1-CG 3.62Å; I208-R356 HydrophobicContact CG1-CG 4.43Å
209	M	85.4	Confident	86.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.6	-37.3	177.4	-67	-138.7	177.3	0	0	112.3	L127 T128 P129 P180 I203 E205 A206 L212 T219 F246	L127-M209 HydrophobicContact CB-CE 3.65Å; L127-M209 VanDerWaalsContact O-CE 3.27Å; L127-M209 WeakPolarHBondContact O-CE 3.34Å; T128-M209 VanDerWaalsContact C-CE 3.47Å; P129-M209 HydrophobicContact CB-CG 4.38Å; P180-M209 HydrophobicContact CG-CE 4.08Å; P180-M209 HydrophobicContact CG-SD 3.97Å; I203-M209 HydrophobicContact CG2-CE 3.97Å; I203-M209 HydrophobicContact CG2-CG 4.31Å; I203-M209 HydrophobicContact CG2-SD 3.69Å; E205-M209 PolarHBondContact O-N 3.41Å; E205-M209 VanDerWaalsContact O-N 3.15Å; A206-M209 WeakPolarHBondContact O-CB 3.29Å; A206-M209 PolarHBondContact O-N 2.71Å; A206-M209 VanDerWaalsContact O-N 3.17Å; M209-L212 PolarHBondContact O-N 3.42Å; M209-T219 HydrophobicContact SD-CG2 4.5Å; M209-F246 HydrophobicContact CB-CZ 4.41Å
210	V	83.5	Confident	86.6	Confident	33 Å²	33	31 Å²	31	20%	0.2	16%	0.158	C	C	.	.	H	α-helix	trans	-73.9	-33	-178.3	179.5	0	0	0	0	112.9	A206 I208 L212 K242 F246	A206-V210 VanDerWaalsContact O-CG2 3.28Å; A206-V210 WeakPolarHBondContact O-CG2 3.47Å; A206-V210 PolarHBondContact O-N 2.63Å; A206-V210 VanDerWaalsContact O-N 3.09Å; I208-V210 PolarHBondContact O-N 3.38Å; V210-L212 PolarHBondContact O-N 3.47Å; V210-K242 HydrophobicContact CG1-CB 3.66Å; V210-K242 HydrophobicContact CG1-CD 4.48Å; V210-F246 HydrophobicContact CG2-CB 3.24Å; V210-F246 HydrophobicContact CG2-CD1 3.7Å; V210-F246 HydrophobicContact CG2-CD2 3.58Å; V210-F246 HydrophobicContact CG2-CE1 4.43Å; V210-F246 HydrophobicContact CG2-CE2 4.34Å; V210-F246 HydrophobicContact CG2-CG 3.22Å
211	D	73.8	Confident	86.5	Confident	67 Å²	67	32.6 Å²	32.6	36%	0.358	17%	0.172	S	C	.	.	H	α-helix	trans	-66.5	-27.6	176.8	-76.4	-20.5	0	0	0	112.5	D207 I208 R356	D207-D211 PolarHBondContact O-N 3.35Å; I208-D211 PolarHBondContact O-N 2.92Å; D211-R356 IonicContact OD2-NH2 2.79Å; D211-R356 PolarHBondContact OD2-NH2 3.42Å
212	L	71.1	Confident	86.4	Confident	50 Å²	50	32.6 Å²	32.6	26%	0.262	17%	0.172	S	C	.	.	S	Bend	trans	-99	93.4	-178.1	-62.4	175.8	0	0	0	109.8	I208 M209 V210 S214 L215 G216 M353	I208-L212 HydrophobicContact CG2-CD1 4.37Å; I208-L212 PolarHBondContact O-N 3.05Å; M209-L212 PolarHBondContact O-N 3.42Å; V210-L212 PolarHBondContact O-N 3.47Å; L212-S214 VanDerWaalsContact C-N 3.26Å; L212-S214 PolarHBondContact O-N 2.85Å; L212-L215 HydrophobicContact CB-CB 4.18Å; L212-L215 HydrophobicContact CB-CD1 3.82Å; L212-L215 HydrophobicContact CB-CG 3.84Å; L212-L215 HydrophobicContact CD1-CD1 3.49Å; L212-L215 VanDerWaalsContact CD1-CD1 3.49Å; L212-L215 HydrophobicContact CD1-CG 4.34Å; L212-L215 HydrophobicContact CG-CD1 4.29Å; L212-L215 WeakPolarHBondContact O-CB 3.1Å; L212-L215 PolarHBondContact O-N 3.47Å; L212-G216 PolarHBondContact O-N 3.1Å; L212-M353 HydrophobicContact CD2-CE 4.48Å
213	R	70.2	Confident	86.3	Confident	232 Å²	232	33.1 Å²	33.1	88%	0.875	18%	0.175	S	C	*	.	H	α-helix	trans	-45.1	-43.2	-171.5	-72.2	-170.7	179.3	-159.7	0.6	114.9	S217	R213-S217 PolarHBondContact O-N 2.92Å; R213-S217 PolarHBondContact O-OG 3.33Å
214	S	77.5	Confident	86.2	Confident	70 Å²	70	38.1 Å²	38.1	49%	0.49	20%	0.202	S	C	.	.	H	α-helix	trans	-65	-42.4	180	50.6	0	0	0	0	112.5	L212 G216 S217 Q218	L212-S214 VanDerWaalsContact C-N 3.26Å; L212-S214 PolarHBondContact O-N 2.85Å; S214-G216 PolarHBondContact O-N 3.47Å; S214-S217 PolarHBondContact O-N 3.04Å; S214-S217 PolarHBondContact O-OG 2.74Å; S214-Q218 VanDerWaalsContact O-CG 3.31Å; S214-Q218 WeakPolarHBondContact O-CG 3.3Å; S214-Q218 PolarHBondContact O-N 3.23Å; S214-Q218 PolarHBondContact O-OE1 3.15Å
215	L	79.6	Confident	86.2	Confident	20 Å²	20	40.8 Å²	40.8	11%	0.105	22%	0.224	C	C	.	.	H	α-helix	trans	-65.2	-40.4	-178.7	-59.7	-170	0	0	0	111.4	P129 P180 L212 Q218 T219	P129-L215 HydrophobicContact CB-CD1 4.16Å; P180-L215 HydrophobicContact CB-CD2 4.34Å; P180-L215 HydrophobicContact CG-CB 4.37Å; P180-L215 HydrophobicContact CG-CD2 4.32Å; L212-L215 HydrophobicContact CB-CB 4.18Å; L212-L215 HydrophobicContact CB-CD1 3.82Å; L212-L215 HydrophobicContact CB-CG 3.84Å; L212-L215 HydrophobicContact CD1-CD1 3.49Å; L212-L215 VanDerWaalsContact CD1-CD1 3.49Å; L212-L215 HydrophobicContact CD1-CG 4.34Å; L212-L215 HydrophobicContact CG-CD1 4.29Å; L212-L215 WeakPolarHBondContact O-CB 3.1Å; L212-L215 PolarHBondContact O-N 3.47Å; L215-Q218 PolarHBondContact O-N 3.28Å; L215-T219 VanDerWaalsContact O-CB 3.3Å; L215-T219 WeakPolarHBondContact O-CB 3.49Å; L215-T219 PolarHBondContact O-N 3.31Å; L215-T219 PolarHBondContact O-OG1 3.15Å
216	G	82.4	Confident	86.5	Confident	7 Å²	7	41.2 Å²	41.2	7%	0.072	23%	0.227	C	C	.	.	H	α-helix	trans	-58.5	-49.8	175.5	0	0	0	0	0	112.2	L212 S214 Q218 T219 F220	L212-G216 PolarHBondContact O-N 3.1Å; S214-G216 PolarHBondContact O-N 3.47Å; G216-Q218 PolarHBondContact O-N 3.01Å; G216-T219 PolarHBondContact O-N 3.29Å; G216-F220 WeakPolarHBondContact O-CD2 3.32Å; G216-F220 VanDerWaalsContact O-CG 3.32Å; G216-F220 WeakPolarHBondContact O-CG 3.12Å; G216-F220 PolarHBondContact O-N 3.4Å
217	S	87.5	Confident	86.7	Confident	71 Å²	71	45.9 Å²	45.9	50%	0.497	25%	0.248	S	C	.	.	H	α-helix	trans	-63.1	-40.1	178.3	55.2	0	0	0	0	113.7	R213 S214 F220 A221	R213-S217 PolarHBondContact O-N 2.92Å; R213-S217 PolarHBondContact O-OG 3.33Å; S214-S217 PolarHBondContact O-N 3.04Å; S214-S217 PolarHBondContact O-OG 2.74Å; S217-F220 PolarHBondContact O-N 3.35Å; S217-A221 PolarHBondContact O-N 3.17Å
218	Q	91.4	Very high	86.9	Confident	49 Å²	49	50.6 Å²	50.6	23%	0.229	29%	0.288	C	S	.	.	H	α-helix	trans	-68.9	-39.2	178	-71.6	166.5	-25.4	0	0	111.4	P180 G181 F184 S214 L215 G216 F220 A221 I222	P180-Q218 HydrophobicContact CB-CB 3.84Å; G181-Q218 VanDerWaalsContact CA-OE1 3.32Å; F184-Q218 HydrophobicContact CB-CB 4.42Å; F184-Q218 HydrophobicContact CB-CG 4.49Å; S214-Q218 VanDerWaalsContact O-CG 3.31Å; S214-Q218 WeakPolarHBondContact O-CG 3.3Å; S214-Q218 PolarHBondContact O-N 3.23Å; S214-Q218 PolarHBondContact O-OE1 3.15Å; L215-Q218 PolarHBondContact O-N 3.28Å; G216-Q218 PolarHBondContact O-N 3.01Å; Q218-F220 VanDerWaalsContact C-N 3.34Å; Q218-F220 PolarHBondContact O-N 3.49Å; Q218-A221 PolarHBondContact O-N 2.94Å; Q218-I222 WeakPolarHBondContact O-CG1 3.36Å; Q218-I222 PolarHBondContact O-N 3.25Å
219	T	93.4	Very high	87.3	Confident	0 Å²	0	55 Å²	55	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.1	-41.6	175.9	-56.6	0	0	0	0	111.3	L127 P180 I203 M209 L215 G216 I222 T223 F246	L127-T219 HydrophobicContact CD1-CG2 3.72Å; P180-T219 WeakPolarHBondContact CG-OG1 3.23Å; I203-T219 HydrophobicContact CD1-CG2 3.61Å; I203-T219 HydrophobicContact CG1-CG2 4.29Å; M209-T219 HydrophobicContact SD-CG2 4.5Å; L215-T219 VanDerWaalsContact O-CB 3.3Å; L215-T219 WeakPolarHBondContact O-CB 3.49Å; L215-T219 PolarHBondContact O-N 3.31Å; L215-T219 PolarHBondContact O-OG1 3.15Å; G216-T219 PolarHBondContact O-N 3.29Å; T219-I222 PolarHBondContact O-N 2.72Å; T219-T223 WeakPolarHBondContact O-CB 3.24Å; T219-T223 PolarHBondContact O-N 3.17Å; T219-T223 PolarHBondContact O-OG1 3.24Å; T219-F246 HydrophobicContact CG2-CE2 4.39Å; T219-F246 HydrophobicContact CG2-CZ 3.73Å
220	F	93.5	Very high	87.7	Confident	31 Å²	31	55 Å²	55	14%	0.136	32%	0.319	C	S	.	.	H	α-helix	trans	-62.7	-44.4	173.4	-64	-41.1	0	0	0	112.1	G216 S217 Q218 I222 T223 D224 F246 R249 V250	G216-F220 WeakPolarHBondContact O-CD2 3.32Å; G216-F220 VanDerWaalsContact O-CG 3.32Å; G216-F220 WeakPolarHBondContact O-CG 3.12Å; G216-F220 PolarHBondContact O-N 3.4Å; S217-F220 PolarHBondContact O-N 3.35Å; Q218-F220 VanDerWaalsContact C-N 3.34Å; Q218-F220 PolarHBondContact O-N 3.49Å; F220-I222 VanDerWaalsContact C-N 3.31Å; F220-I222 PolarHBondContact O-N 3.45Å; F220-T223 PolarHBondContact O-N 3.34Å; F220-T223 VanDerWaalsContact O-N 3.09Å; F220-D224 WeakPolarHBondContact O-CB 3.28Å; F220-D224 PolarHBondContact O-N 3.45Å; F220-F246 HydrophobicContact CD1-CE2 4.25Å; F220-F246 AromaticContact CE1-CD2 3.5Å; F220-F246 HydrophobicContact CE1-CD2 3.5Å; F220-F246 VanDerWaalsContact CE1-CD2 3.5Å; F220-F246 AromaticContact CE1-CE2 3.6Å; F220-F246 HydrophobicContact CE1-CE2 3.6Å; F220-F246 HydrophobicContact CE1-CG 4.25Å; F220-F246 HydrophobicContact CE1-CZ 4.44Å; F220-F246 HydrophobicContact CE2-CD2 4.13Å; F220-F246 HydrophobicContact CE2-CE2 4.36Å; F220-F246 AromaticContact CZ-CD2 3.26Å; F220-F246 HydrophobicContact CZ-CD2 3.26Å; F220-F246 AromaticContact CZ-CE2 3.69Å; F220-F246 HydrophobicContact CZ-CE2 3.69Å; F220-F246 HydrophobicContact CZ-CG 4.16Å; F220-R249 HydrophobicContact CD1-CB 4.39Å; F220-R249 HydrophobicContact CD1-CG 3.82Å; F220-R249 HydrophobicContact CE1-CB 3.75Å; F220-R249 VanDerWaalsContact CE1-CD 3.5Å; F220-R249 HydrophobicContact CE1-CG 3.67Å; F220-R249 VanDerWaalsContact CG-CZ 3.43Å; F220-R249 HydrophobicContact CZ-CB 4.22Å; F220-R249 HydrophobicContact CZ-CG 4.26Å; F220-V250 HydrophobicContact CD1-CG2 4.15Å; F220-V250 HydrophobicContact CE1-CG2 3.97Å
221	A	93	Very high	88.2	Confident	34 Å²	34	53.6 Å²	53.6	28%	0.281	31%	0.31	S	S	.	.	H	α-helix	trans	-60.8	-39.2	178.4	0	0	0	0	0	112.9	F184 S217 Q218 A225	F184-A221 HydrophobicContact CD2-CB 3.83Å; F184-A221 HydrophobicContact CE2-CB 3.63Å; S217-A221 PolarHBondContact O-N 3.17Å; Q218-A221 PolarHBondContact O-N 2.94Å; A221-A225 PolarHBondContact O-N 3.02Å
222	I	94.9	Very high	89.2	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-65.7	-44.9	173.1	-65.7	164.5	0	0	0	110.2	L127 L183 F184 L195 Q218 T219 F220 A225 L226	L127-I222 HydrophobicContact CD1-CD1 4.29Å; L127-I222 HydrophobicContact CD2-CD1 4.08Å; L183-I222 HydrophobicContact CB-CD1 3.87Å; F184-I222 HydrophobicContact CB-CD1 4.29Å; F184-I222 HydrophobicContact CB-CG1 4.36Å; L195-I222 HydrophobicContact CD1-CG2 4.28Å; Q218-I222 WeakPolarHBondContact O-CG1 3.36Å; Q218-I222 PolarHBondContact O-N 3.25Å; T219-I222 PolarHBondContact O-N 2.72Å; F220-I222 VanDerWaalsContact C-N 3.31Å; F220-I222 PolarHBondContact O-N 3.45Å; I222-A225 PolarHBondContact O-N 3.48Å; I222-L226 PolarHBondContact O-N 3.46Å
223	T	94.7	Very high	90.4	Very high	12 Å²	12	49.2 Å²	49.2	7%	0.074	29%	0.286	C	S	.	.	H	α-helix	trans	-63.7	-43.6	-178.6	-54.4	0	0	0	0	112.1	T219 F220 A225 L226 K232 V250	T219-T223 WeakPolarHBondContact O-CB 3.24Å; T219-T223 PolarHBondContact O-N 3.17Å; T219-T223 PolarHBondContact O-OG1 3.24Å; F220-T223 PolarHBondContact O-N 3.34Å; F220-T223 VanDerWaalsContact O-N 3.09Å; T223-A225 PolarHBondContact O-N 3.05Å; T223-L226 WeakPolarHBondContact O-CB 3.32Å; T223-L226 PolarHBondContact O-N 3.03Å; T223-L226 VanDerWaalsContact O-N 3.17Å; T223-K232 HydrophobicContact CG2-CD 4.13Å; T223-V250 HydrophobicContact CG2-CG1 4.01Å
224	D	94	Very high	91.5	Very high	106 Å²	106	38.2 Å²	38.2	57%	0.567	24%	0.244	S	C	*	.	H	α-helix	trans	-65.5	-20.6	-179.5	-66.5	-19.9	0	0	0	111.8	F220 R249	F220-D224 WeakPolarHBondContact O-CB 3.28Å; F220-D224 PolarHBondContact O-N 3.45Å; D224-R249 IonicContact OD2-NH2 3.23Å; D224-R249 PolarHBondContact OD2-NH2 3.44Å; D224-R249 VanDerWaalsContact OD2-NH2 3.1Å
225	A	94.9	Very high	92.3	Very high	58 Å²	58	34.9 Å²	34.9	48%	0.479	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-6.4	178.1	0	0	0	0	0	114.3	L195 A221 I222 T223	L195-A225 HydrophobicContact CD1-CB 3.65Å; A221-A225 PolarHBondContact O-N 3.02Å; I222-A225 PolarHBondContact O-N 3.48Å; T223-A225 PolarHBondContact O-N 3.05Å
226	L	95.4	Very high	92.8	Very high	20 Å²	20	34 Å²	34	11%	0.105	22%	0.216	C	C	.	.	S	Bend	trans	-77	154.2	176.7	-70.1	168.4	0	0	0	111.6	L195 V198 L201 I222 T223 C230	L195-L226 HydrophobicContact CB-CD2 4.13Å; L195-L226 HydrophobicContact CD2-CD2 4.13Å; V198-L226 HydrophobicContact CB-CD2 3.6Å; V198-L226 HydrophobicContact CG1-CD2 3.64Å; V198-L226 HydrophobicContact CG2-CD2 4.23Å; L201-L226 HydrophobicContact CB-CD1 3.78Å; L201-L226 HydrophobicContact CD2-CD1 3.63Å; L201-L226 HydrophobicContact CG-CD1 4.18Å; I222-L226 PolarHBondContact O-N 3.46Å; T223-L226 WeakPolarHBondContact O-CB 3.32Å; T223-L226 PolarHBondContact O-N 3.03Å; T223-L226 VanDerWaalsContact O-N 3.17Å; L226-C230 HydrophobicContact CB-CB 4.12Å
227	Q	94.4	Very high	92.9	Very high	97 Å²	97	33.8 Å²	33.8	45%	0.453	21%	0.214	S	C	.	.			trans	-64.2	148.3	168.8	-65.6	-166.1	-23.2	0	0	111.3	A196 S229 C230	A196-Q227 WeakPolarHBondContact O-CG 3.47Å; A196-Q227 PolarHBondContact O-NE2 3.35Å; A196-Q227 VanDerWaalsContact O-NE2 3.11Å; A196-Q227 PolarHBondContact O-OE1 3.02Å; Q227-S229 PolarHBondContact O-N 3.42Å; Q227-S229 VanDerWaalsContact O-N 3.13Å; Q227-S229 PolarHBondContact OE1-OG 3.46Å; Q227-C230 WeakPolarHBondContact O-CB 3.44Å; Q227-C230 PolarHBondContact O-N 3.4Å
228	A	91.3	Very high	92.6	Very high	105 Å²	105	31 Å²	31	87%	0.868	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.2	177.6	0	0	0	0	0	113.3	C230	A228-C230 VanDerWaalsContact C-N 3.26Å; A228-C230 PolarHBondContact O-N 3.34Å
229	S	90.9	Very high	92.1	Very high	91 Å²	91	30.2 Å²	30.2	64%	0.636	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-11.6	175.7	52.3	0	0	0	0	114.2	Q227 Q231	Q227-S229 PolarHBondContact O-N 3.42Å; Q227-S229 VanDerWaalsContact O-N 3.13Å; Q227-S229 PolarHBondContact OE1-OG 3.46Å; S229-Q231 PolarHBondContact O-N 3.48Å
230	C	94.2	Very high	91.6	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.007	21%	0.209	C	C	.	.			trans	-69.9	120.5	179.9	-177.9	0	0	0	0	110.6	V198 L226 Q227 A228 K232	V198-C230 WeakPolarHBondContact O-CB 3.4Å; L226-C230 HydrophobicContact CB-CB 4.12Å; Q227-C230 WeakPolarHBondContact O-CB 3.44Å; Q227-C230 PolarHBondContact O-N 3.4Å; A228-C230 VanDerWaalsContact C-N 3.26Å; A228-C230 PolarHBondContact O-N 3.34Å; C230-K232 PolarHBondContact O-NZ 3.43Å
231	Q	94.5	Very high	91.2	Very high	3 Å²	3	38.3 Å²	38.3	1%	0.014	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	134.2	176.1	-176.3	177.3	17.3	0	0	110.2	A91 K199 M200 L201 S229 L233	A91-Q231 PolarHBondContact O-NE2 3.1Å; K199-Q231 PolarHBondContact O-N 3.2Å; M200-Q231 CarbonylContact C-O 3.55Å; M200-Q231 VanDerWaalsContact CA-O 3.25Å; M200-Q231 WeakPolarHBondContact CA-O 3.3Å; M200-Q231 HydrophobicContact CE-CG 4.44Å; L201-Q231 PolarHBondContact N-O 3.14Å; S229-Q231 PolarHBondContact O-N 3.48Å; Q231-L233 HydrophobicContact CG-CD2 4.11Å
232	K	95.1	Very high	90.9	Very high	25 Å²	25	43 Å²	43	11%	0.109	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.3	-174.7	-62.2	167.1	-142.2	65.9	0	110.6	D92 M93 L201 T223 C230 V250 T251	D92-K232 CarbonylContact C-O 3.54Å; D92-K232 WeakPolarHBondContact CA-O 3.39Å; D92-K232 HydrophobicContact CB-CB 4.45Å; D92-K232 WeakPolarHBondContact CB-O 3.44Å; D92-K232 PolarHBondContact OD1-N 3Å; D92-K232 IonicContact OD1-NZ 2.65Å; D92-K232 IonicContact OD2-NZ 3.07Å; D92-K232 PolarHBondContact OD2-NZ 2.83Å; M93-K232 PolarHBondContact N-O 2.82Å; L201-K232 HydrophobicContact CB-CG 4.32Å; L201-K232 CarbonylContact O-C 3.54Å; L201-K232 VanDerWaalsContact O-CA 3.31Å; L201-K232 WeakPolarHBondContact O-CA 3.39Å; T223-K232 HydrophobicContact CG2-CD 4.13Å; C230-K232 PolarHBondContact O-NZ 3.43Å; K232-V250 HydrophobicContact CD-CG1 4.1Å; K232-V250 WeakPolarHBondContact CD-O 3.28Å; K232-T251 HydrophobicContact CB-CG2 3.47Å; K232-T251 VanDerWaalsContact CB-CG2 3.47Å; K232-T251 HydrophobicContact CD-CG2 4.23Å
233	L	95	Very high	90.5	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.8	178.7	-48	-176.8	0	0	0	109.3	I85 M93 C110 M200 L201 V202 I203 Q231 F235	I85-L233 HydrophobicContact CD1-CD1 4.32Å; M93-L233 HydrophobicContact CB-CD2 3.84Å; M93-L233 HydrophobicContact CE-CD1 4.39Å; M93-L233 HydrophobicContact CE-CD2 3.31Å; M93-L233 HydrophobicContact CG-CD2 4.03Å; M93-L233 HydrophobicContact SD-CD2 4.23Å; C110-L233 HydrophobicContact CB-CD1 3.81Å; M200-L233 HydrophobicContact CE-CD1 4.09Å; M200-L233 HydrophobicContact SD-CD1 3.9Å; L201-L233 PolarHBondContact O-N 3.2Å; V202-L233 CarbonylContact C-O 3.58Å; V202-L233 WeakPolarHBondContact CA-O 3.17Å; V202-L233 HydrophobicContact CG2-CB 4.37Å; V202-L233 HydrophobicContact CG2-CD1 4.35Å; I203-L233 PolarHBondContact N-O 3.11Å; Q231-L233 HydrophobicContact CG-CD2 4.11Å; L233-F235 HydrophobicContact CB-CD2 4.42Å; L233-F235 HydrophobicContact CB-CE2 3.7Å; L233-F235 HydrophobicContact CD1-CE2 4.46Å
234	L	94.8	Very high	90.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.3	-179.7	-173.7	153	0	0	0	109.7	M93 I94 V95 I203 A206 F246 A247	M93-L234 PolarHBondContact O-N 2.87Å; I94-L234 CarbonylContact C-O 3.59Å; I94-L234 WeakPolarHBondContact CA-O 3.22Å; I94-L234 HydrophobicContact CG1-CB 4.34Å; I94-L234 HydrophobicContact CG2-CD2 4.09Å; V95-L234 PolarHBondContact N-O 2.81Å; I203-L234 HydrophobicContact CB-CG 4.42Å; A206-L234 HydrophobicContact CB-CD1 3.93Å; A206-L234 HydrophobicContact CB-CD2 3.4Å; A206-L234 HydrophobicContact CB-CG 3.57Å; L234-F246 HydrophobicContact CD1-CD1 3.93Å; L234-F246 HydrophobicContact CD1-CE1 3.9Å; L234-A247 HydrophobicContact CD1-CB 3.65Å; L234-A247 HydrophobicContact CD2-CB 4.27Å
235	F	93.8	Very high	89.9	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	136.5	179.6	-69.1	-95.3	0	0	0	110.1	V81 V95 K103 F107 V202 I203 E205 A206 L233	V81-F235 HydrophobicContact CG1-CZ 4.41Å; V81-F235 HydrophobicContact CG2-CE1 4.01Å; V81-F235 HydrophobicContact CG2-CZ 4.17Å; V95-F235 HydrophobicContact CB-CD1 3.59Å; V95-F235 HydrophobicContact CB-CE1 3.62Å; V95-F235 HydrophobicContact CB-CG 4.34Å; V95-F235 HydrophobicContact CB-CZ 4.38Å; V95-F235 HydrophobicContact CG1-CD1 3.91Å; V95-F235 HydrophobicContact CG1-CE1 3.83Å; V95-F235 HydrophobicContact CG2-CD1 4.16Å; V95-F235 HydrophobicContact CG2-CE1 3.71Å; V95-F235 HydrophobicContact CG2-CZ 4.03Å; V95-F235 WeakPolarHBondContact O-CA 3.19Å; K103-F235 HydrophobicContact CB-CD1 4.22Å; K103-F235 HydrophobicContact CD-CB 4.2Å; K103-F235 HydrophobicContact CD-CD1 3.94Å; K103-F235 HydrophobicContact CG-CD1 4.17Å; F107-F235 HydrophobicContact CB-CD2 4.28Å; F107-F235 HydrophobicContact CB-CE2 3.54Å; F107-F235 HydrophobicContact CB-CZ 3.77Å; F107-F235 HydrophobicContact CD1-CD1 4.31Å; F107-F235 AromaticContact CD1-CD2 3.8Å; F107-F235 HydrophobicContact CD1-CD2 3.8Å; F107-F235 HydrophobicContact CD1-CE1 4.37Å; F107-F235 AromaticContact CD1-CE2 3.87Å; F107-F235 HydrophobicContact CD1-CE2 3.87Å; F107-F235 HydrophobicContact CD1-CG 4.04Å; F107-F235 HydrophobicContact CD1-CZ 4.17Å; F107-F235 HydrophobicContact CG-CD2 4.42Å; F107-F235 HydrophobicContact CG-CE2 4.14Å; F107-F235 HydrophobicContact CG-CZ 4.49Å; V202-F235 HydrophobicContact CG1-CD2 4.07Å; V202-F235 HydrophobicContact CG1-CE2 4.2Å; I203-F235 PolarHBondContact O-N 3.31Å; E205-F235 PolarHBondContact N-O 3.46Å; E205-F235 VanDerWaalsContact N-O 3.15Å; A206-F235 PolarHBondContact N-O 2.71Å; L233-F235 HydrophobicContact CB-CD2 4.42Å; L233-F235 HydrophobicContact CB-CE2 3.7Å; L233-F235 HydrophobicContact CD1-CE2 4.46Å
236	S	90.2	Very high	89.8	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.007	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	148.2	176.7	-176.8	0	0	0	0	111.7	V95 Q96 S97 D207 T238	V95-S236 PolarHBondContact O-N 2.92Å; Q96-S236 VanDerWaalsContact CA-O 3.31Å; Q96-S236 WeakPolarHBondContact CA-O 2.99Å; S97-S236 PolarHBondContact N-O 2.76Å; S97-S236 VanDerWaalsContact N-O 3.1Å; D207-S236 WeakPolarHBondContact CB-OG 3.45Å; D207-S236 PolarHBondContact N-OG 2.86Å; D207-S236 PolarHBondContact OD1-OG 3.09Å; S236-T238 PolarHBondContact OG-N 2.91Å; S236-T238 PolarHBondContact OG-O 3.39Å
237	T	83.6	Confident	89.6	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.018	24%	0.242	C	C	.	.	S	Bend	trans	-78.9	-30.7	170.9	-60.1	0	0	0	0	111.4	S97 E205 D207 I383 H384	S97-T237 WeakPolarHBondContact O-CA 3.28Å; E205-T237 PolarHBondContact OE2-OG1 3.17Å; D207-T237 PolarHBondContact OD1-N 3.35Å; T237-I383 HydrophobicContact CG2-CG2 3.92Å; T237-H384 WeakPolarHBondContact CB-CE1 3.33Å; T237-H384 PolarHBondContact OG1-CE1 3.15Å
238	T	80.9	Confident	89.3	Confident	12 Å²	12	40.1 Å²	40.1	7%	0.074	24%	0.242	C	C	.	.			trans	-132	127.9	-176.1	62.8	0	0	0	0	113.1	D207 S236 T243 S380	D207-T238 WeakPolarHBondContact CB-OG1 3.45Å; D207-T238 PolarHBondContact OD2-N 3.37Å; D207-T238 PolarHBondContact OD2-OG1 3.2Å; S236-T238 PolarHBondContact OG-N 2.91Å; S236-T238 PolarHBondContact OG-O 3.39Å; T238-T243 PolarHBondContact O-OG1 3.37Å; T238-S380 PolarHBondContact OG1-OG 3.38Å; T238-S380 VanDerWaalsContact OG1-OG 3.11Å
239	I	81.5	Confident	89.3	Confident	33 Å²	33	41.4 Å²	41.4	17%	0.169	23%	0.225	C	C	.	.			trans	-96.3	106.6	171.7	-62.6	-174.7	0	0	0	108.6	I94 Q96 V244 R258	I94-I239 HydrophobicContact CG2-CD1 4.43Å; Q96-I239 HydrophobicContact CB-CD1 3.73Å; Q96-I239 HydrophobicContact CB-CG1 4.05Å; Q96-I239 HydrophobicContact CG-CD1 4.16Å; Q96-I239 HydrophobicContact CG-CG1 4Å; I239-V244 HydrophobicContact CG2-CG2 3.43Å; I239-V244 VanDerWaalsContact CG2-CG2 3.43Å; I239-R258 HydrophobicContact CD1-CG 4.01Å
240	T	82.6	Confident	89.3	Confident	62 Å²	62	37.3 Å²	37.3	38%	0.38	20%	0.195	S	C	.	.			trans	-109.2	166.9	170	69.8	0	0	0	0	110	K242 T243 V244	T240-K242 PolarHBondContact O-N 3.44Å; T240-K242 VanDerWaalsContact O-N 3.17Å; T240-K242 PolarHBondContact OG1-N 3.05Å; T240-T243 PolarHBondContact N-OG1 2.71Å; T240-T243 CarbonylContact O-C 3.55Å; T240-T243 WeakPolarHBondContact O-CA 3.35Å; T240-T243 WeakPolarHBondContact O-CB 3.38Å; T240-T243 PolarHBondContact O-N 2.86Å; T240-T243 PolarHBondContact OG1-N 3.46Å; T240-T243 PolarHBondContact OG1-OG1 3.45Å; T240-V244 WeakPolarHBondContact O-CG2 3.3Å; T240-V244 PolarHBondContact O-N 3.26Å
241	D	85.8	Confident	89.1	Confident	139 Å²	139	37.2 Å²	37.2	74%	0.743	20%	0.195	S	C	*	.	H	α-helix	trans	-55.5	-35.1	175.1	-61.7	-21.2	0	0	0	112.4	V244 T245	D241-V244 PolarHBondContact O-N 3.04Å; D241-T245 WeakPolarHBondContact O-CB 3.45Å; D241-T245 PolarHBondContact O-N 3.43Å; D241-T245 PolarHBondContact O-OG1 2.89Å
242	K	86.6	Confident	88.6	Confident	133 Å²	133	41.3 Å²	41.3	58%	0.578	22%	0.222	S	C	*	.	H	α-helix	trans	-65.8	-45.8	174.2	-63.5	-175.9	178.6	175.2	0	111.4	V210 T240 V244 T245 F246	V210-K242 HydrophobicContact CG1-CB 3.66Å; V210-K242 HydrophobicContact CG1-CD 4.48Å; T240-K242 PolarHBondContact O-N 3.44Å; T240-K242 VanDerWaalsContact O-N 3.17Å; T240-K242 PolarHBondContact OG1-N 3.05Å; K242-V244 VanDerWaalsContact C-N 3.34Å; K242-V244 PolarHBondContact O-N 3.1Å; K242-T245 PolarHBondContact O-N 2.99Å; K242-F246 WeakPolarHBondContact O-CB 3.47Å; K242-F246 PolarHBondContact O-N 3.26Å
243	T	86.9	Confident	88.3	Confident	5 Å²	5	47.1 Å²	47.1	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-61.9	-41.6	175.8	-41.9	0	0	0	0	111	A206 T238 T240 F246 A247	A206-T243 HydrophobicContact CB-CG2 4.48Å; T238-T243 PolarHBondContact O-OG1 3.37Å; T240-T243 PolarHBondContact N-OG1 2.71Å; T240-T243 CarbonylContact O-C 3.55Å; T240-T243 WeakPolarHBondContact O-CA 3.35Å; T240-T243 WeakPolarHBondContact O-CB 3.38Å; T240-T243 PolarHBondContact O-N 2.86Å; T240-T243 PolarHBondContact OG1-N 3.46Å; T240-T243 PolarHBondContact OG1-OG1 3.45Å; T243-F246 PolarHBondContact O-N 3.41Å; T243-A247 WeakPolarHBondContact O-CB 3.35Å; T243-A247 PolarHBondContact O-N 2.85Å
244	V	86.7	Confident	88	Confident	55 Å²	55	48.7 Å²	48.7	33%	0.333	27%	0.265	S	S	.	.	H	α-helix	trans	-63	-46.1	176.8	173.3	0	0	0	0	111.1	I239 T240 D241 K242 A247 S248	I239-V244 HydrophobicContact CG2-CG2 3.43Å; I239-V244 VanDerWaalsContact CG2-CG2 3.43Å; T240-V244 WeakPolarHBondContact O-CG2 3.3Å; T240-V244 PolarHBondContact O-N 3.26Å; D241-V244 PolarHBondContact O-N 3.04Å; K242-V244 VanDerWaalsContact C-N 3.34Å; K242-V244 PolarHBondContact O-N 3.1Å; V244-A247 PolarHBondContact O-N 3.29Å; V244-S248 WeakPolarHBondContact O-CB 3.11Å; V244-S248 PolarHBondContact O-N 3.17Å; V244-S248 PolarHBondContact O-OG 3.39Å
245	T	89.1	Confident	87.9	Confident	101 Å²	101	52.3 Å²	52.3	62%	0.62	28%	0.283	S	S	*	.	H	α-helix	trans	-61.5	-46	178.4	-57.4	0	0	0	0	110.9	D241 K242 S248 R249	D241-T245 WeakPolarHBondContact O-CB 3.45Å; D241-T245 PolarHBondContact O-N 3.43Å; D241-T245 PolarHBondContact O-OG1 2.89Å; K242-T245 PolarHBondContact O-N 2.99Å; T245-S248 PolarHBondContact O-N 3.31Å; T245-R249 PolarHBondContact O-N 3.43Å
246	F	91.5	Very high	87.7	Confident	7 Å²	7	55.3 Å²	55.3	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-49.7	175.9	176.7	-94.4	0	0	0	111.7	I203 A206 M209 V210 T219 F220 L234 K242 T243 S248 R249 V250	I203-F246 HydrophobicContact CD1-CE1 4.32Å; I203-F246 HydrophobicContact CD1-CZ 4.46Å; I203-F246 HydrophobicContact CG2-CE1 4.37Å; A206-F246 HydrophobicContact CB-CD1 4.5Å; A206-F246 HydrophobicContact CB-CE1 4.32Å; M209-F246 HydrophobicContact CB-CZ 4.41Å; V210-F246 HydrophobicContact CG2-CB 3.24Å; V210-F246 HydrophobicContact CG2-CD1 3.7Å; V210-F246 HydrophobicContact CG2-CD2 3.58Å; V210-F246 HydrophobicContact CG2-CE1 4.43Å; V210-F246 HydrophobicContact CG2-CE2 4.34Å; V210-F246 HydrophobicContact CG2-CG 3.22Å; T219-F246 HydrophobicContact CG2-CE2 4.39Å; T219-F246 HydrophobicContact CG2-CZ 3.73Å; F220-F246 HydrophobicContact CD1-CE2 4.25Å; F220-F246 AromaticContact CE1-CD2 3.5Å; F220-F246 HydrophobicContact CE1-CD2 3.5Å; F220-F246 VanDerWaalsContact CE1-CD2 3.5Å; F220-F246 AromaticContact CE1-CE2 3.6Å; F220-F246 HydrophobicContact CE1-CE2 3.6Å; F220-F246 HydrophobicContact CE1-CG 4.25Å; F220-F246 HydrophobicContact CE1-CZ 4.44Å; F220-F246 HydrophobicContact CE2-CD2 4.13Å; F220-F246 HydrophobicContact CE2-CE2 4.36Å; F220-F246 AromaticContact CZ-CD2 3.26Å; F220-F246 HydrophobicContact CZ-CD2 3.26Å; F220-F246 AromaticContact CZ-CE2 3.69Å; F220-F246 HydrophobicContact CZ-CE2 3.69Å; F220-F246 HydrophobicContact CZ-CG 4.16Å; L234-F246 HydrophobicContact CD1-CD1 3.93Å; L234-F246 HydrophobicContact CD1-CE1 3.9Å; K242-F246 WeakPolarHBondContact O-CB 3.47Å; K242-F246 PolarHBondContact O-N 3.26Å; T243-F246 PolarHBondContact O-N 3.41Å; F246-S248 VanDerWaalsContact C-N 3.31Å; F246-S248 PolarHBondContact O-N 3.06Å; F246-R249 PolarHBondContact O-N 3.27Å; F246-R249 VanDerWaalsContact O-N 3.15Å; F246-V250 HydrophobicContact CD1-CG2 4.39Å; F246-V250 HydrophobicContact CE1-CG2 4Å; F246-V250 HydrophobicContact CZ-CG2 4.09Å; F246-V250 PolarHBondContact O-N 2.93Å; F246-V250 VanDerWaalsContact O-N 3.17Å
247	A	91.7	Very high	87.6	Confident	1 Å²	1	57 Å²	57	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-63.4	-37.7	-178.9	0	0	0	0	0	112	I94 L234 T243 V244 R249 V250 T251	I94-A247 HydrophobicContact CD1-CB 3.44Å; I94-A247 VanDerWaalsContact CD1-CB 3.44Å; I94-A247 HydrophobicContact CG1-CB 4.05Å; L234-A247 HydrophobicContact CD1-CB 3.65Å; L234-A247 HydrophobicContact CD2-CB 4.27Å; T243-A247 WeakPolarHBondContact O-CB 3.35Å; T243-A247 PolarHBondContact O-N 2.85Å; V244-A247 PolarHBondContact O-N 3.29Å; A247-R249 VanDerWaalsContact C-N 3.26Å; A247-R249 PolarHBondContact O-N 3.08Å; A247-V250 PolarHBondContact O-N 3.5Å; A247-T251 PolarHBondContact O-N 2.92Å; A247-T251 PolarHBondContact O-OG1 3.18Å
248	S	89.2	Confident	87.6	Confident	65 Å²	65	64 Å²	64	46%	0.455	34%	0.336	S	S	.	.	H	α-helix	trans	-64.8	-29.4	177.2	-55	0	0	0	0	112.8	V244 T245 F246 P252	V244-S248 WeakPolarHBondContact O-CB 3.11Å; V244-S248 PolarHBondContact O-N 3.17Å; V244-S248 PolarHBondContact O-OG 3.39Å; T245-S248 PolarHBondContact O-N 3.31Å; F246-S248 VanDerWaalsContact C-N 3.31Å; F246-S248 PolarHBondContact O-N 3.06Å; S248-P252 WeakPolarHBondContact O-CA 3.3Å
249	R	90.7	Very high	87.4	Confident	132 Å²	132	65.3 Å²	65.3	50%	0.498	34%	0.342	S	S	.	.	H	α-helix	trans	-76.1	-36.4	174.1	178.7	170.5	172.3	-171.6	1.7	112.2	F220 D224 T245 F246 A247	F220-R249 HydrophobicContact CD1-CB 4.39Å; F220-R249 HydrophobicContact CD1-CG 3.82Å; F220-R249 HydrophobicContact CE1-CB 3.75Å; F220-R249 VanDerWaalsContact CE1-CD 3.5Å; F220-R249 HydrophobicContact CE1-CG 3.67Å; F220-R249 VanDerWaalsContact CG-CZ 3.43Å; F220-R249 HydrophobicContact CZ-CB 4.22Å; F220-R249 HydrophobicContact CZ-CG 4.26Å; D224-R249 IonicContact OD2-NH2 3.23Å; D224-R249 PolarHBondContact OD2-NH2 3.44Å; D224-R249 VanDerWaalsContact OD2-NH2 3.1Å; T245-R249 PolarHBondContact O-N 3.43Å; F246-R249 PolarHBondContact O-N 3.27Å; F246-R249 VanDerWaalsContact O-N 3.15Å; A247-R249 VanDerWaalsContact C-N 3.26Å; A247-R249 PolarHBondContact O-N 3.08Å
250	V	91.5	Very high	86.9	Confident	4 Å²	4	70.8 Å²	70.8	2%	0.024	36%	0.361	C	S	.	.	H	α-helix	trans	-75.7	-47.8	178.7	178.3	0	0	0	0	110.9	I203 F220 T223 K232 F246 A247	I203-V250 HydrophobicContact CD1-CB 4.41Å; I203-V250 HydrophobicContact CD1-CG1 3.64Å; I203-V250 HydrophobicContact CD1-CG2 4.01Å; F220-V250 HydrophobicContact CD1-CG2 4.15Å; F220-V250 HydrophobicContact CE1-CG2 3.97Å; T223-V250 HydrophobicContact CG2-CG1 4.01Å; K232-V250 HydrophobicContact CD-CG1 4.1Å; K232-V250 WeakPolarHBondContact CD-O 3.28Å; F246-V250 HydrophobicContact CD1-CG2 4.39Å; F246-V250 HydrophobicContact CE1-CG2 4Å; F246-V250 HydrophobicContact CZ-CG2 4.09Å; F246-V250 PolarHBondContact O-N 2.93Å; F246-V250 VanDerWaalsContact O-N 3.17Å; A247-V250 PolarHBondContact O-N 3.5Å
251	T	89.2	Confident	86.1	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	37%	0.373	C	S	.	.			trans	-127	92.9	-172.9	60.5	0	0	0	0	108.6	D92 K232 A247 N253 P254	D92-T251 HydrophobicContact CB-CG2 3.96Å; K232-T251 HydrophobicContact CB-CG2 3.47Å; K232-T251 VanDerWaalsContact CB-CG2 3.47Å; K232-T251 HydrophobicContact CD-CG2 4.23Å; A247-T251 PolarHBondContact O-N 2.92Å; A247-T251 PolarHBondContact O-OG1 3.18Å; T251-N253 PolarHBondContact O-N 2.94Å; T251-P254 VanDerWaalsContact O-CD 3.29Å; T251-P254 WeakPolarHBondContact O-CD 3.18Å
252	P	84	Confident	85.2	Confident	89 Å²	89	71.1 Å²	71.1	58%	0.578	36%	0.36	S	S	*	.	S	Bend	trans	-69.1	-31.6	-172.2	23.3	-32.4	0	0	0	113.8	S248	S248-P252 WeakPolarHBondContact O-CA 3.3Å
253	N	88	Confident	84.2	Confident	147 Å²	147	66.2 Å²	66.2	79%	0.786	34%	0.339	S	S	*	.	S	Bend	trans	-131	64.9	-179.3	-65.4	-41	0	0	0	112.1	T251	T251-N253 PolarHBondContact O-N 2.94Å
254	P	90.5	Very high	83.2	Confident	34 Å²	34	67.1 Å²	67.1	22%	0.221	34%	0.344	C	S	.	.			trans	-87.9	153	-174.2	33.4	-27.5	0	0	0	112.1	D92 I94 T251 V256	D92-P254 HydrophobicContact CB-CB 4.32Å; D92-P254 CarbonylContact O-C 3.48Å; D92-P254 VanDerWaalsContact O-CA 3.29Å; D92-P254 WeakPolarHBondContact O-CA 3.31Å; I94-P254 HydrophobicContact CD1-CB 4.11Å; I94-P254 HydrophobicContact CD1-CG 3.44Å; I94-P254 VanDerWaalsContact CD1-CG 3.44Å; I94-P254 HydrophobicContact CG1-CB 3.94Å; I94-P254 HydrophobicContact CG1-CG 3.86Å; T251-P254 VanDerWaalsContact O-CD 3.29Å; T251-P254 WeakPolarHBondContact O-CD 3.18Å; P254-V256 HydrophobicContact CG-CG2 4.2Å
255	I	90.9	Very high	82.4	Confident	75 Å²	75	66.2 Å²	66.2	39%	0.385	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	126.9	157.3	-63.8	174.3	0	0	0	107.6	V84 A91 D92 M93 I94 I257	V84-I255 HydrophobicContact CG1-CD1 3.83Å; V84-I255 HydrophobicContact CG2-CD1 4.3Å; A91-I255 HydrophobicContact CB-CD1 3.71Å; A91-I255 HydrophobicContact CB-CG1 4.12Å; D92-I255 PolarHBondContact O-N 3.44Å; M93-I255 CarbonylContact C-O 3.59Å; M93-I255 VanDerWaalsContact CA-O 3.28Å; M93-I255 WeakPolarHBondContact CA-O 3.4Å; M93-I255 HydrophobicContact CG-CB 4.3Å; I94-I255 PolarHBondContact N-O 2.82Å; I255-I257 HydrophobicContact CG2-CG1 4.47Å
256	V	90	Very high	81.7	Confident	64 Å²	64	61.7 Å²	61.7	39%	0.388	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	112.6	-178.7	-169.6	0	0	0	0	109.9	I94 P254 R258	I94-V256 HydrophobicContact CB-CG1 4.33Å; I94-V256 HydrophobicContact CB-CG2 4.44Å; I94-V256 HydrophobicContact CD1-CG2 4.44Å; I94-V256 HydrophobicContact CG2-CG1 4.38Å; I94-V256 CarbonylContact O-C 3.26Å; I94-V256 WeakPolarHBondContact O-CA 3.48Å; P254-V256 HydrophobicContact CG-CG2 4.2Å; V256-R258 HydrophobicContact CG1-CG 3.67Å
257	I	87.9	Confident	80.9	Confident	36 Å²	36	67.3 Å²	67.3	19%	0.185	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	112.2	172.3	-61.9	167.7	0	0	0	107.3	A80 V81 I94 V95 Q96 I255	A80-I257 HydrophobicContact CB-CD1 3.93Å; A80-I257 HydrophobicContact CB-CG2 4.23Å; V81-I257 HydrophobicContact CG2-CD1 4.46Å; I94-I257 PolarHBondContact O-N 2.96Å; V95-I257 HydrophobicContact CG1-CB 4.37Å; V95-I257 HydrophobicContact CG1-CG2 4.39Å; V95-I257 HydrophobicContact CG2-CB 4.45Å; V95-I257 HydrophobicContact CG2-CD1 4.21Å; Q96-I257 PolarHBondContact N-O 2.93Å; I255-I257 HydrophobicContact CG2-CG1 4.47Å
258	R	84.7	Confident	80.3	Confident	149 Å²	149	67.2 Å²	67.2	56%	0.562	33%	0.327	S	S	*	.			trans	-115.3	142.3	176.9	-59.6	-166.6	176.4	167.6	-0.6	111	I239 V256	I239-R258 HydrophobicContact CD1-CG 4.01Å; V256-R258 HydrophobicContact CG1-CG 3.67Å
259	L	76.9	Confident	80.2	Confident	40 Å²	40	64.2 Å²	64.2	21%	0.209	31%	0.305	C	S	.	.			trans	-68.6	144.7	162.7	-66.9	-179.3	0	0	0	109	E263 M264	L259-E263 HydrophobicContact CB-CB 4.2Å; L259-E263 HydrophobicContact CD2-CB 4.36Å; L259-M264 HydrophobicContact CB-CG 4.39Å
260	R	71	Confident	80.1	Confident	149 Å²	149	60.4 Å²	60.4	56%	0.562	29%	0.293	S	S	*	.			trans	-67.8	154	166.7	-62.1	179.7	-72.5	163.5	2.9	109.3	D262 E263 M264	R260-D262 WeakPolarHBondContact CB-OD1 3.23Å; R260-D262 PolarHBondContact O-N 3.24Å; R260-E263 HydrophobicContact CB-CG 4.2Å; R260-E263 IonicContact CZ-OE1 3.64Å; R260-E263 PolarHBondContact N-OE2 3.33Å; R260-E263 VanDerWaalsContact N-OE2 3.1Å; R260-E263 IonicContact NE-OE1 3.75Å; R260-E263 PolarHBondContact NE-OE1 2.89Å; R260-E263 IonicContact NE-OE2 3.2Å; R260-E263 IonicContact NH2-OE1 3.2Å; R260-E263 PolarHBondContact NH2-OE1 3.07Å; R260-E263 WeakPolarHBondContact O-CA 3.44Å; R260-E263 WeakPolarHBondContact O-CB 3.29Å; R260-E263 PolarHBondContact O-N 3.23Å; R260-M264 PolarHBondContact O-N 3.45Å
261	D	65.7	Low	80.1	Confident	120 Å²	120	61 Å²	61	64%	0.642	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-58.3	-34.6	-176.4	-72.4	-29.2	0	0	0	112.2	E263 M264	D261-E263 VanDerWaalsContact C-N 3.32Å; D261-E263 PolarHBondContact O-N 3.42Å; D261-M264 WeakPolarHBondContact O-CB 3.47Å; D261-M264 PolarHBondContact O-N 3.47Å
262	D	65.8	Low	80.4	Confident	87 Å²	87	61.2 Å²	61.2	47%	0.465	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-70.4	-25.5	175.1	62.9	-46.6	0	0	0	113.3	R260 M264	R260-D262 WeakPolarHBondContact CB-OD1 3.23Å; R260-D262 PolarHBondContact O-N 3.24Å; D262-M264 VanDerWaalsContact C-N 3.35Å
263	E	66.7	Low	80.9	Confident	30 Å²	30	58.5 Å²	58.5	14%	0.14	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-83.6	-11.1	175.4	-65.1	175.1	157.8	0	0	112.8	Q46 R76 L259 R260 D261 Y265	Q46-E263 PolarHBondContact NE2-O 3.27Å; R76-E263 IonicContact NH1-OE1 3.41Å; R76-E263 PolarHBondContact NH1-OE1 3.27Å; L259-E263 HydrophobicContact CB-CB 4.2Å; L259-E263 HydrophobicContact CD2-CB 4.36Å; R260-E263 HydrophobicContact CB-CG 4.2Å; R260-E263 IonicContact CZ-OE1 3.64Å; R260-E263 PolarHBondContact N-OE2 3.33Å; R260-E263 VanDerWaalsContact N-OE2 3.1Å; R260-E263 IonicContact NE-OE1 3.75Å; R260-E263 PolarHBondContact NE-OE1 2.89Å; R260-E263 IonicContact NE-OE2 3.2Å; R260-E263 IonicContact NH2-OE1 3.2Å; R260-E263 PolarHBondContact NH2-OE1 3.07Å; R260-E263 WeakPolarHBondContact O-CA 3.44Å; R260-E263 WeakPolarHBondContact O-CB 3.29Å; R260-E263 PolarHBondContact O-N 3.23Å; D261-E263 VanDerWaalsContact C-N 3.32Å; D261-E263 PolarHBondContact O-N 3.42Å; E263-Y265 PolarHBondContact O-N 3.09Å
264	M	64.8	Low	81.2	Confident	25 Å²	25	51.7 Å²	51.7	12%	0.123	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-71.4	-19.5	170.7	-63.6	-164	71.8	0	0	112.2	L259 R260 D261 D262 L266 F418	L259-M264 HydrophobicContact CB-CG 4.39Å; R260-M264 PolarHBondContact O-N 3.45Å; D261-M264 WeakPolarHBondContact O-CB 3.47Å; D261-M264 PolarHBondContact O-N 3.47Å; D262-M264 VanDerWaalsContact C-N 3.35Å; M264-L266 PolarHBondContact O-N 3.14Å; M264-F418 HydrophobicContact CE-CE1 4.23Å
265	Y	69.8	Low	81.5	Confident	36 Å²	36	55.2 Å²	55.2	14%	0.141	25%	0.252	C	S	.	.	S	Bend	trans	-72.1	123	176	178.9	-112.4	0	0	0	110.7	Q46 E263 R267 K420	Q46-Y265 PolarHBondContact NE2-O 3.22Å; Q46-Y265 VanDerWaalsContact NE2-O 3.12Å; E263-Y265 PolarHBondContact O-N 3.09Å; Y265-R267 HydrophobicContact CD1-CB 4.38Å; Y265-R267 HydrophobicContact CD1-CG 3.6Å; Y265-R267 HydrophobicContact CE1-CB 4.18Å; Y265-R267 HydrophobicContact CE1-CG 3.77Å; Y265-R267 PolarHBondContact O-N 2.82Å; Y265-R267 VanDerWaalsContact O-N 3.17Å; Y265-K420 HydrophobicContact CD2-CB 3.81Å; Y265-K420 HydrophobicContact CD2-CD 4.34Å; Y265-K420 HydrophobicContact CE1-CD 3.79Å; Y265-K420 HydrophobicContact CE2-CB 3.65Å; Y265-K420 HydrophobicContact CE2-CD 3.51Å; Y265-K420 HydrophobicContact CE2-CG 4.18Å; Y265-K420 WeakPolarHBondContact OH-CD 3.25Å; Y265-K420 PolarHBondContact OH-NZ 2.99Å
266	L	74.3	Confident	81.7	Confident	6 Å²	6	52 Å²	52	3%	0.031	24%	0.237	C	C	.	.			trans	-82.5	88.7	176.2	-62.9	171.7	0	0	0	108.7	H98 M264 N268 I269 I386	H98-L266 HydrophobicContact CB-CD2 3.82Å; M264-L266 PolarHBondContact O-N 3.14Å; L266-N268 PolarHBondContact O-N 3.48Å; L266-I269 HydrophobicContact CB-CB 4.15Å; L266-I269 HydrophobicContact CB-CD1 3.73Å; L266-I269 HydrophobicContact CB-CG1 3.85Å; L266-I269 HydrophobicContact CD1-CD1 3.54Å; L266-I269 HydrophobicContact CG-CD1 4.18Å; L266-I269 PolarHBondContact O-N 2.97Å; L266-I269 VanDerWaalsContact O-N 3.08Å; L266-I386 HydrophobicContact CD1-CD1 4.2Å; L266-I386 HydrophobicContact CD1-CG1 4.07Å
267	R	75.6	Confident	81.8	Confident	124 Å²	124	58.6 Å²	58.6	47%	0.468	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-39.8	-174	-70	-177.4	-179.2	-159.3	-0.5	113.2	Y265 I269	Y265-R267 HydrophobicContact CD1-CB 4.38Å; Y265-R267 HydrophobicContact CD1-CG 3.6Å; Y265-R267 HydrophobicContact CE1-CB 4.18Å; Y265-R267 HydrophobicContact CE1-CG 3.77Å; Y265-R267 PolarHBondContact O-N 2.82Å; Y265-R267 VanDerWaalsContact O-N 3.17Å; R267-I269 PolarHBondContact O-N 3.41Å; R267-I269 VanDerWaalsContact O-N 3.14Å
268	N	80.1	Confident	82	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	14.1	-174.3	-49.7	21.3	0	0	0	111.4	L266 G393 N395 S396	L266-N268 PolarHBondContact O-N 3.48Å; N268-G393 WeakPolarHBondContact ND2-CA 3.32Å; N268-G393 PolarHBondContact ND2-O 2.82Å; N268-N395 CarbonylContact O-C 3.52Å; N268-N395 VanDerWaalsContact O-CA 3.24Å; N268-N395 WeakPolarHBondContact O-CA 3.11Å; N268-S396 PolarHBondContact O-N 3.12Å
269	I	85.6	Confident	82.3	Confident	1 Å²	1	57 Å²	57	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	106.5	174.4	-51.7	-173.2	0	0	0	108.4	L266 R267 Q271 I386 G389 S396 A398	L266-I269 HydrophobicContact CB-CB 4.15Å; L266-I269 HydrophobicContact CB-CD1 3.73Å; L266-I269 HydrophobicContact CB-CG1 3.85Å; L266-I269 HydrophobicContact CD1-CD1 3.54Å; L266-I269 HydrophobicContact CG-CD1 4.18Å; L266-I269 PolarHBondContact O-N 2.97Å; L266-I269 VanDerWaalsContact O-N 3.08Å; R267-I269 PolarHBondContact O-N 3.41Å; R267-I269 VanDerWaalsContact O-N 3.14Å; I269-Q271 HydrophobicContact CG2-CG 4.08Å; I269-Q271 PolarHBondContact O-N 3.3Å; I269-I386 VanDerWaalsContact CD1-O 3.23Å; I269-I386 WeakPolarHBondContact CD1-O 2.95Å; I269-I386 HydrophobicContact CG2-CB 4.4Å; I269-G389 WeakPolarHBondContact CD1-O 3.22Å; I269-S396 CarbonylContact C-O 2.91Å; I269-S396 WeakPolarHBondContact CA-O 3.31Å; I269-A398 HydrophobicContact CG2-CB 3.84Å
270	H	88.9	Confident	83	Confident	52 Å²	52	59.4 Å²	59.4	24%	0.241	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	110.3	172.1	-56.8	-84.5	0	0	0	108.7	F272 S396 I397 A398 L436	H270-F272 HydrophobicContact CB-CD2 4.38Å; H270-F272 HydrophobicContact CB-CE2 3.54Å; H270-F272 HydrophobicContact CB-CZ 4.16Å; H270-S396 PolarHBondContact N-O 2.86Å; H270-I397 HydrophobicContact CB-CG1 4.48Å; H270-I397 WeakPolarHBondContact O-CA 3.47Å; H270-A398 PolarHBondContact O-N 3.07Å; H270-L436 HydrophobicContact CB-CD1 4.2Å
271	Q	92.1	Very high	84.2	Confident	17 Å²	17	54.2 Å²	54.2	8%	0.079	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	121.3	-174.1	-69.2	169.1	63.7	0	0	110	I269 Y382 I386 A398 P422 Q423	I269-Q271 HydrophobicContact CG2-CG 4.08Å; I269-Q271 PolarHBondContact O-N 3.3Å; Q271-Y382 PolarHBondContact OE1-OH 2.86Å; Q271-I386 VanDerWaalsContact CD-CD1 3.46Å; Q271-I386 HydrophobicContact CG-CD1 4.01Å; Q271-A398 HydrophobicContact CG-CB 4.29Å; Q271-P422 HydrophobicContact CB-CB 4.12Å; Q271-P422 HydrophobicContact CB-CG 4.26Å; Q271-P422 CarbonylContact O-C 3.57Å; Q271-P422 WeakPolarHBondContact O-CA 3.33Å; Q271-Q423 PolarHBondContact O-N 3.33Å
272	F	94.2	Very high	85.6	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	154.8	178.3	-61.2	-81.6	0	0	0	111.2	H270 I397 A398 L399 T400 Q423 I425 L433 L436	H270-F272 HydrophobicContact CB-CD2 4.38Å; H270-F272 HydrophobicContact CB-CE2 3.54Å; H270-F272 HydrophobicContact CB-CZ 4.16Å; F272-I397 HydrophobicContact CD2-CG2 4.28Å; F272-A398 PolarHBondContact N-O 2.93Å; F272-L399 HydrophobicContact CB-CD1 3.71Å; F272-L399 CarbonylContact O-C 3.53Å; F272-L399 WeakPolarHBondContact O-CA 3.44Å; F272-T400 PolarHBondContact O-N 2.93Å; F272-Q423 CarbonylContact C-O 3.48Å; F272-Q423 WeakPolarHBondContact CA-O 3.27Å; F272-Q423 HydrophobicContact CD1-CB 3.9Å; F272-Q423 HydrophobicContact CE1-CB 4.09Å; F272-I425 HydrophobicContact CB-CB 4.48Å; F272-I425 HydrophobicContact CB-CG2 3.81Å; F272-I425 HydrophobicContact CD1-CB 4.05Å; F272-I425 HydrophobicContact CD1-CD1 4.41Å; F272-I425 HydrophobicContact CD1-CG2 4.27Å; F272-I425 HydrophobicContact CG-CG2 4.27Å; F272-L433 HydrophobicContact CD1-CD2 4.22Å; F272-L433 HydrophobicContact CD2-CD2 3.47Å; F272-L433 VanDerWaalsContact CD2-CD2 3.47Å; F272-L433 HydrophobicContact CE1-CD2 4.02Å; F272-L433 HydrophobicContact CE2-CD2 3.2Å; F272-L433 HydrophobicContact CG-CD2 3.97Å; F272-L433 HydrophobicContact CZ-CD2 3.52Å; F272-L436 HydrophobicContact CE2-CD1 3.78Å; F272-L436 HydrophobicContact CZ-CD1 3.56Å
273	Y	95.5	Very high	87	Confident	33 Å²	33	44.8 Å²	44.8	13%	0.129	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	151.9	163.4	78.1	-83.2	0	0	0	110.8	Q275 T400 V402 M408 I411 P422 Q423 L424 I425	Y273-Q275 HydrophobicContact CE2-CG 4.36Å; Y273-T400 CarbonylContact C-O 3.55Å; Y273-T400 WeakPolarHBondContact CA-O 3.38Å; Y273-T400 WeakPolarHBondContact CB-O 3.4Å; Y273-V402 HydrophobicContact CD2-CG2 4.16Å; Y273-M408 HydrophobicContact CE2-CE 3.93Å; Y273-M408 HydrophobicContact CE2-SD 3.94Å; Y273-I411 HydrophobicContact CD2-CG2 4.41Å; Y273-I411 HydrophobicContact CG-CG1 4.36Å; Y273-I411 HydrophobicContact CG-CG2 4.45Å; Y273-P422 HydrophobicContact CD1-CB 4.06Å; Y273-P422 VanDerWaalsContact CD1-O 3.28Å; Y273-P422 WeakPolarHBondContact CD1-O 3.27Å; Y273-P422 VanDerWaalsContact CE1-O 3.28Å; Y273-P422 WeakPolarHBondContact CE1-O 3.35Å; Y273-Q423 PolarHBondContact N-O 2.87Å; Y273-L424 HydrophobicContact CD2-CD1 4.04Å; Y273-L424 HydrophobicContact CE1-CB 3.78Å; Y273-L424 VanDerWaalsContact CE1-N 3.34Å; Y273-L424 HydrophobicContact CE2-CB 4.27Å; Y273-L424 HydrophobicContact CE2-CD1 3.51Å; Y273-L424 HydrophobicContact CE2-CG 4.42Å; Y273-L424 WeakPolarHBondContact O-CA 3.24Å; Y273-I425 PolarHBondContact O-N 3.45Å
274	M	95.3	Very high	88.3	Confident	3 Å²	3	48 Å²	48	2%	0.015	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	134.8	179.4	-178.7	175.9	-65.8	0	0	109.4	L285 L399 T400 F401 V402 I425 A427 L430	M274-L285 HydrophobicContact CG-CD1 4.37Å; M274-L285 HydrophobicContact SD-CB 4.41Å; M274-L285 HydrophobicContact SD-CD1 3.37Å; M274-L285 WeakPolarHBondContact SD-CD1 3.37Å; M274-L285 HydrophobicContact SD-CD2 3.69Å; M274-L285 HydrophobicContact SD-CG 4Å; M274-L399 HydrophobicContact CB-CD1 4.19Å; M274-T400 PolarHBondContact N-O 2.95Å; M274-F401 HydrophobicContact CB-CD1 4.02Å; M274-F401 HydrophobicContact CB-CE1 4.24Å; M274-F401 HydrophobicContact CG-CD1 4.47Å; M274-F401 WeakPolarHBondContact O-CA 3.35Å; M274-F401 HydrophobicContact SD-CE1 4.04Å; M274-V402 PolarHBondContact O-N 3.08Å; M274-I425 HydrophobicContact CB-CG2 4.37Å; M274-I425 HydrophobicContact CE-CG2 3.8Å; M274-I425 WeakPolarHBondContact CE-O 3.26Å; M274-I425 WeakPolarHBondContact CG-O 3.45Å; M274-A427 HydrophobicContact SD-CB 4.39Å; M274-L430 HydrophobicContact CE-CD1 4.28Å; M274-L430 HydrophobicContact CE-CD2 3.53Å; M274-L430 HydrophobicContact CE-CG 3.8Å
275	Q	95.5	Very high	89.7	Confident	108 Å²	108	47.5 Å²	47.5	51%	0.505	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	132.1	175.6	-63.7	-175.7	42.5	0	0	109.3	Y273 V402 M408 L424	Y273-Q275 HydrophobicContact CE2-CG 4.36Å; Q275-V402 CarbonylContact C-O 3.56Å; Q275-V402 VanDerWaalsContact CA-O 3.31Å; Q275-V402 WeakPolarHBondContact CA-O 3.35Å; Q275-M408 HydrophobicContact CG-CE 3.48Å; Q275-M408 VanDerWaalsContact CG-CE 3.48Å; Q275-L424 HydrophobicContact CG-CD1 4.32Å
276	C	94.8	Very high	90.8	Very high	9 Å²	9	45.8 Å²	45.8	6%	0.061	21%	0.211	C	C	.	.			trans	-127.4	146.7	178.5	-56.6	0	0	0	0	109.6	E281 K282 L285 F401 V402 D403	C276-E281 HydrophobicContact CB-CG 4.34Å; C276-K282 HydrophobicContact CB-CG 3.67Å; C276-L285 VanDerWaalsContact SG-CD1 3.55Å; C276-F401 WeakPolarHBondContact SG-CD1 3.44Å; C276-V402 PolarHBondContact N-O 3.09Å; C276-D403 VanDerWaalsContact O-CA 3.27Å; C276-D403 WeakPolarHBondContact O-CA 3.2Å
277	R	92.9	Very high	91.7	Very high	201 Å²	201	46 Å²	46	76%	0.758	21%	0.213	S	C	*	.	S	Bend	trans	-78.5	-34.1	179.7	-64.1	172.2	-71.4	170	-2.9	112.3	E281	R277-E281 VanDerWaalsContact CB-OE2 3.24Å; R277-E281 WeakPolarHBondContact CB-OE2 3.47Å; R277-E281 VanDerWaalsContact CG-OE2 3.27Å; R277-E281 WeakPolarHBondContact CG-OE2 3.44Å; R277-E281 IonicContact CZ-OE1 3.26Å; R277-E281 IonicContact CZ-OE2 3.89Å; R277-E281 PolarHBondContact N-OE2 2.81Å; R277-E281 IonicContact NE-OE1 3.94Å; R277-E281 PolarHBondContact NE-OE1 2.93Å; R277-E281 VanDerWaalsContact NE-OE1 3.12Å; R277-E281 IonicContact NE-OE2 3.69Å; R277-E281 PolarHBondContact NE-OE2 3.06Å; R277-E281 IonicContact NH2-OE1 3.12Å; R277-E281 PolarHBondContact NH2-OE1 3.49Å; R277-E281 IonicContact NH2-OE2 2.78Å
278	N	91.6	Very high	92.5	Very high	75 Å²	75	44.8 Å²	44.8	40%	0.401	21%	0.209	S	C	.	.	S	Bend	trans	-161.7	177.2	-176	58.4	45.8	0	0	0	111.5	D280 E281 K282	N278-D280 VanDerWaalsContact C-N 3.3Å; N278-D280 PolarHBondContact O-N 3.2Å; N278-D280 PolarHBondContact OD1-N 2.73Å; N278-E281 PolarHBondContact O-N 3.4Å; N278-E281 PolarHBondContact OD1-N 3.25Å; N278-K282 PolarHBondContact O-N 3.08Å
279	D	90.8	Very high	93.1	Very high	77 Å²	77	44.8 Å²	44.8	41%	0.412	21%	0.209	S	C	.	.	H	α-helix	trans	-65.9	-26.6	179.3	-82.3	-17.6	0	0	0	114	K282 F283 Y367	D279-K282 PolarHBondContact O-N 2.74Å; D279-F283 PolarHBondContact O-N 2.98Å; D279-Y367 PolarHBondContact O-OH 3.23Å
280	D	92.8	Very high	93.2	Very high	91 Å²	91	44.8 Å²	44.8	49%	0.487	21%	0.209	S	C	.	.	H	α-helix	trans	-71.4	-40.7	178.1	-69.1	-35.7	0	0	0	110.8	N278 F283 D284 K313	N278-D280 VanDerWaalsContact C-N 3.3Å; N278-D280 PolarHBondContact O-N 3.2Å; N278-D280 PolarHBondContact OD1-N 2.73Å; D280-F283 WeakPolarHBondContact O-CB 3.48Å; D280-F283 PolarHBondContact O-N 3.38Å; D280-D284 PolarHBondContact O-N 3.22Å; D280-K313 IonicContact OD1-NZ 2.73Å; D280-K313 PolarHBondContact OD1-NZ 3.03Å
281	E	94.6	Very high	93.3	Very high	40 Å²	40	47.2 Å²	47.2	19%	0.187	22%	0.224	C	C	.	.	H	α-helix	trans	-64	-41.8	172.4	-177.7	162.4	-120	0	0	111.7	C276 R277 N278 F283 D284 L285	C276-E281 HydrophobicContact CB-CG 4.34Å; R277-E281 VanDerWaalsContact CB-OE2 3.24Å; R277-E281 WeakPolarHBondContact CB-OE2 3.47Å; R277-E281 VanDerWaalsContact CG-OE2 3.27Å; R277-E281 WeakPolarHBondContact CG-OE2 3.44Å; R277-E281 IonicContact CZ-OE1 3.26Å; R277-E281 IonicContact CZ-OE2 3.89Å; R277-E281 PolarHBondContact N-OE2 2.81Å; R277-E281 IonicContact NE-OE1 3.94Å; R277-E281 PolarHBondContact NE-OE1 2.93Å; R277-E281 VanDerWaalsContact NE-OE1 3.12Å; R277-E281 IonicContact NE-OE2 3.69Å; R277-E281 PolarHBondContact NE-OE2 3.06Å; R277-E281 IonicContact NH2-OE1 3.12Å; R277-E281 PolarHBondContact NH2-OE1 3.49Å; R277-E281 IonicContact NH2-OE2 2.78Å; N278-E281 PolarHBondContact O-N 3.4Å; N278-E281 PolarHBondContact OD1-N 3.25Å; E281-F283 VanDerWaalsContact C-N 3.26Å; E281-F283 PolarHBondContact O-N 3.44Å; E281-D284 PolarHBondContact O-N 3.03Å; E281-L285 HydrophobicContact CG-CD1 3.72Å; E281-L285 HydrophobicContact CG-CG 4.38Å; E281-L285 WeakPolarHBondContact O-CB 3.29Å; E281-L285 WeakPolarHBondContact O-CD1 3.47Å; E281-L285 WeakPolarHBondContact O-CG 3.48Å; E281-L285 PolarHBondContact O-N 3.31Å
282	K	95.4	Very high	93.1	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56.9	-41.7	172.9	-71.8	-176.8	176.3	178.3	0	111.8	C276 N278 D279 T286 Y367 F401 D403 E407	C276-K282 HydrophobicContact CB-CG 3.67Å; N278-K282 PolarHBondContact O-N 3.08Å; D279-K282 PolarHBondContact O-N 2.74Å; K282-T286 WeakPolarHBondContact O-CB 3.37Å; K282-T286 PolarHBondContact O-N 3.37Å; K282-T286 PolarHBondContact O-OG1 2.95Å; K282-Y367 HydrophobicContact CB-CD2 4.46Å; K282-Y367 HydrophobicContact CB-CE1 3.97Å; K282-Y367 HydrophobicContact CB-CE2 3.76Å; K282-Y367 HydrophobicContact CD-CD1 4.06Å; K282-Y367 HydrophobicContact CD-CE1 3.78Å; K282-Y367 PolarHBondContact NZ-O 2.92Å; K282-F401 HydrophobicContact CB-CD2 4.17Å; K282-F401 HydrophobicContact CB-CG 4.45Å; K282-F401 HydrophobicContact CD-CB 3.92Å; K282-F401 HydrophobicContact CD-CG 4.45Å; K282-F401 HydrophobicContact CG-CB 3.87Å; K282-F401 HydrophobicContact CG-CD2 4.15Å; K282-F401 HydrophobicContact CG-CG 4Å; K282-D403 WeakPolarHBondContact CE-OD2 3.42Å; K282-D403 IonicContact NZ-OD2 3Å; K282-D403 PolarHBondContact NZ-OD2 2.83Å; K282-E407 IonicContact NZ-OE2 3.9Å
283	F	95.4	Very high	92.7	Very high	8 Å²	8	49.1 Å²	49.1	4%	0.035	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-52.3	177	166.8	-99.5	0	0	0	111.7	D279 D280 E281 L285 T286 A287 L310 K313 M314 F317 Y367	D279-F283 PolarHBondContact O-N 2.98Å; D280-F283 WeakPolarHBondContact O-CB 3.48Å; D280-F283 PolarHBondContact O-N 3.38Å; E281-F283 VanDerWaalsContact C-N 3.26Å; E281-F283 PolarHBondContact O-N 3.44Å; F283-L285 VanDerWaalsContact C-N 3.29Å; F283-L285 PolarHBondContact O-N 2.89Å; F283-T286 WeakPolarHBondContact O-CB 3.31Å; F283-T286 PolarHBondContact O-N 3.47Å; F283-T286 VanDerWaalsContact O-N 3.09Å; F283-A287 PolarHBondContact O-N 2.72Å; F283-L310 HydrophobicContact CD2-CD1 3.8Å; F283-K313 HydrophobicContact CD2-CB 3.8Å; F283-K313 HydrophobicContact CD2-CD 4.02Å; F283-K313 HydrophobicContact CE2-CB 3.38Å; F283-K313 HydrophobicContact CE2-CD 4.35Å; F283-K313 HydrophobicContact CE2-CG 4.49Å; F283-K313 HydrophobicContact CG-CD 4.1Å; F283-K313 HydrophobicContact CZ-CB 3.87Å; F283-M314 HydrophobicContact CD2-CG 4.46Å; F283-M314 HydrophobicContact CD2-SD 4.06Å; F283-M314 HydrophobicContact CE2-CG 3.99Å; F283-M314 HydrophobicContact CE2-SD 3.55Å; F283-M314 VanDerWaalsContact CE2-SD 3.55Å; F283-M314 HydrophobicContact CZ-SD 4.44Å; F283-F317 HydrophobicContact CE1-CD2 4.08Å; F283-F317 HydrophobicContact CE1-CE1 4.45Å; F283-F317 AromaticContact CE1-CE2 3.67Å; F283-F317 HydrophobicContact CE1-CE2 3.67Å; F283-F317 AromaticContact CE1-CZ 3.88Å; F283-F317 HydrophobicContact CE1-CZ 3.88Å; F283-F317 AromaticContact CZ-CD2 3.51Å; F283-F317 HydrophobicContact CZ-CD2 3.51Å; F283-F317 AromaticContact CZ-CE2 3.59Å; F283-F317 HydrophobicContact CZ-CE2 3.59Å; F283-F317 HydrophobicContact CZ-CG 4.02Å; F283-F317 HydrophobicContact CZ-CZ 4.16Å; F283-Y367 PolarHBondContact N-OH 3.15Å
284	D	94.1	Very high	92.1	Very high	98 Å²	98	50.6 Å²	50.6	52%	0.524	25%	0.248	S	C	.	.	H	α-helix	trans	-58.3	-43.5	-178.7	-71.7	-20	0	0	0	111.6	D280 E281 A287 R288	D280-D284 PolarHBondContact O-N 3.22Å; E281-D284 PolarHBondContact O-N 3.03Å; D284-A287 PolarHBondContact O-N 3.42Å; D284-R288 WeakPolarHBondContact O-CB 3.28Å; D284-R288 PolarHBondContact O-N 3.38Å
285	L	94	Very high	91.6	Very high	14 Å²	14	52.8 Å²	52.8	7%	0.073	27%	0.271	C	S	.	.	H	α-helix	trans	-67.1	-38.6	177.1	-66	164.2	0	0	0	112.1	M274 C276 E281 F283 R288 L289 F401 A427 L430	M274-L285 HydrophobicContact CG-CD1 4.37Å; M274-L285 HydrophobicContact SD-CB 4.41Å; M274-L285 HydrophobicContact SD-CD1 3.37Å; M274-L285 WeakPolarHBondContact SD-CD1 3.37Å; M274-L285 HydrophobicContact SD-CD2 3.69Å; M274-L285 HydrophobicContact SD-CG 4Å; C276-L285 VanDerWaalsContact SG-CD1 3.55Å; E281-L285 HydrophobicContact CG-CD1 3.72Å; E281-L285 HydrophobicContact CG-CG 4.38Å; E281-L285 WeakPolarHBondContact O-CB 3.29Å; E281-L285 WeakPolarHBondContact O-CD1 3.47Å; E281-L285 WeakPolarHBondContact O-CG 3.48Å; E281-L285 PolarHBondContact O-N 3.31Å; F283-L285 VanDerWaalsContact C-N 3.29Å; F283-L285 PolarHBondContact O-N 2.89Å; L285-R288 PolarHBondContact O-N 3.3Å; L285-L289 VanDerWaalsContact O-CB 3.28Å; L285-L289 WeakPolarHBondContact O-CB 3.28Å; L285-L289 PolarHBondContact O-N 3.37Å; L285-F401 HydrophobicContact CB-CE1 3.77Å; L285-F401 HydrophobicContact CB-CZ 3.73Å; L285-F401 HydrophobicContact CD1-CE1 4.04Å; L285-A427 HydrophobicContact CD2-CB 3.66Å; L285-L430 HydrophobicContact CD2-CD1 3.73Å
286	T	94	Very high	91.4	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.8	-48.8	173.9	-59	0	0	0	0	110.7	K282 F283 R288 L289 C290 I299 M314 F401	K282-T286 WeakPolarHBondContact O-CB 3.37Å; K282-T286 PolarHBondContact O-N 3.37Å; K282-T286 PolarHBondContact O-OG1 2.95Å; F283-T286 WeakPolarHBondContact O-CB 3.31Å; F283-T286 PolarHBondContact O-N 3.47Å; F283-T286 VanDerWaalsContact O-N 3.09Å; T286-R288 PolarHBondContact O-N 3.02Å; T286-L289 PolarHBondContact O-N 2.78Å; T286-C290 VanDerWaalsContact O-CB 3.32Å; T286-C290 WeakPolarHBondContact O-CB 3.44Å; T286-C290 PolarHBondContact O-N 3.47Å; T286-C290 PolarHBondContact O-SG 3.35Å; T286-I299 HydrophobicContact CG2-CD1 3.66Å; T286-I299 HydrophobicContact CG2-CG1 4.39Å; T286-M314 HydrophobicContact CG2-CE 4.27Å; T286-M314 HydrophobicContact CG2-SD 4.37Å; T286-F401 VanDerWaalsContact OG1-CE2 3.23Å; T286-F401 WeakPolarHBondContact OG1-CE2 3.32Å
287	A	93.2	Very high	91.3	Very high	10 Å²	10	48.7 Å²	48.7	8%	0.083	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-44.7	179.1	0	0	0	0	0	111.6	F283 D284 C290 N291 M314	F283-A287 PolarHBondContact O-N 2.72Å; D284-A287 PolarHBondContact O-N 3.42Å; A287-C290 PolarHBondContact O-N 3.12Å; A287-N291 PolarHBondContact O-N 2.97Å; A287-N291 PolarHBondContact O-ND2 3.34Å; A287-M314 HydrophobicContact CB-CE 4.49Å; A287-M314 HydrophobicContact CB-SD 4.14Å
288	R	92.5	Very high	91.4	Very high	99 Å²	99	39.2 Å²	39.2	37%	0.374	22%	0.216	S	C	.	.	H	α-helix	trans	-61.2	-49	176.1	-175.5	172.1	175.4	-156	-7.4	112.2	D284 L285 T286 C290 N291 L292 A427 L430	D284-R288 WeakPolarHBondContact O-CB 3.28Å; D284-R288 PolarHBondContact O-N 3.38Å; L285-R288 PolarHBondContact O-N 3.3Å; T286-R288 PolarHBondContact O-N 3.02Å; R288-C290 VanDerWaalsContact C-N 3.33Å; R288-C290 PolarHBondContact O-N 3.37Å; R288-N291 PolarHBondContact O-N 3.46Å; R288-N291 VanDerWaalsContact O-N 3.08Å; R288-L292 HydrophobicContact CG-CD1 3.9Å; R288-L292 HydrophobicContact CG-CG 4.47Å; R288-L292 WeakPolarHBondContact O-CG 3.28Å; R288-L292 PolarHBondContact O-N 2.9Å; R288-A427 PolarHBondContact NH1-O 3.33Å; R288-L430 HydrophobicContact CB-CD1 4.49Å; R288-L430 HydrophobicContact CG-CD1 4.21Å
289	L	91.3	Very high	91.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.1	-47	176.5	-175.4	78	0	0	0	111.1	L285 T286 N291 L292 I293 M363 V365 L399 L430 L433	L285-L289 VanDerWaalsContact O-CB 3.28Å; L285-L289 WeakPolarHBondContact O-CB 3.28Å; L285-L289 PolarHBondContact O-N 3.37Å; T286-L289 PolarHBondContact O-N 2.78Å; L289-N291 PolarHBondContact O-N 3.34Å; L289-L292 PolarHBondContact O-N 3.05Å; L289-I293 HydrophobicContact CD1-CD1 3.43Å; L289-I293 VanDerWaalsContact CD1-CD1 3.43Å; L289-I293 HydrophobicContact CD1-CG1 4.36Å; L289-I293 HydrophobicContact CG-CD1 3.97Å; L289-I293 PolarHBondContact O-N 3.49Å; L289-M363 HydrophobicContact CD1-SD 4.4Å; L289-M363 HydrophobicContact CD2-CE 3.91Å; L289-M363 HydrophobicContact CD2-SD 3.66Å; L289-M363 HydrophobicContact CG-CE 4.16Å; L289-M363 HydrophobicContact CG-SD 3.79Å; L289-V365 HydrophobicContact CD2-CG2 3.55Å; L289-L399 HydrophobicContact CD1-CD2 4.35Å; L289-L399 HydrophobicContact CD2-CB 4.22Å; L289-L399 HydrophobicContact CD2-CD2 3.77Å; L289-L430 HydrophobicContact CD1-CD2 4.03Å; L289-L433 HydrophobicContact CD1-CD1 3.71Å
290	C	89.4	Confident	91.9	Very high	1 Å²	1	32 Å²	32	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-25.1	177.9	-68.5	0	0	0	0	112.3	T286 A287 R288 M314 R346 L347	T286-C290 VanDerWaalsContact O-CB 3.32Å; T286-C290 WeakPolarHBondContact O-CB 3.44Å; T286-C290 PolarHBondContact O-N 3.47Å; T286-C290 PolarHBondContact O-SG 3.35Å; A287-C290 PolarHBondContact O-N 3.12Å; R288-C290 VanDerWaalsContact C-N 3.33Å; R288-C290 PolarHBondContact O-N 3.37Å; C290-M314 HydrophobicContact CB-CE 4.26Å; C290-R346 PolarHBondContact O-NE 3.15Å; C290-R346 PolarHBondContact O-NH1 3.41Å; C290-R346 VanDerWaalsContact O-NH1 3.16Å; C290-R346 PolarHBondContact O-NH2 3.33Å; C290-L347 HydrophobicContact CB-CD1 4.3Å; C290-L347 HydrophobicContact CB-CD2 4.29Å; C290-L347 VanDerWaalsContact SG-CD2 3.56Å
291	N	89.4	Confident	92	Very high	103 Å²	103	27.6 Å²	27.6	55%	0.551	15%	0.154	S	C	*	.	H	α-helix	trans	-83.4	-35.9	174.7	-75.4	-30.3	0	0	0	112.7	A287 R288 L289 H319	A287-N291 PolarHBondContact O-N 2.97Å; A287-N291 PolarHBondContact O-ND2 3.34Å; R288-N291 PolarHBondContact O-N 3.46Å; R288-N291 VanDerWaalsContact O-N 3.08Å; L289-N291 PolarHBondContact O-N 3.34Å; N291-H319 PolarHBondContact OD1-CE1 3.29Å; N291-H319 VanDerWaalsContact OD1-CE1 3.22Å
292	L	88.9	Confident	91.8	Very high	54 Å²	54	29.1 Å²	29.1	28%	0.283	16%	0.162	S	C	.	.	H	α-helix	trans	-73.4	-40.7	-178.4	-71.1	169.8	0	0	0	113.2	R288 L289 L430	R288-L292 HydrophobicContact CG-CD1 3.9Å; R288-L292 HydrophobicContact CG-CG 4.47Å; R288-L292 WeakPolarHBondContact O-CG 3.28Å; R288-L292 PolarHBondContact O-N 2.9Å; L289-L292 PolarHBondContact O-N 3.05Å; L292-L430 HydrophobicContact CD1-CB 3.95Å
293	I	84.8	Confident	91.7	Very high	8 Å²	8	32.5 Å²	32.5	4%	0.041	18%	0.183	C	C	.	.	S	Bend	trans	-95.4	116.9	-175.6	-62.8	170.7	0	0	0	109	L289 R346 M363 I397 L433	L289-I293 HydrophobicContact CD1-CD1 3.43Å; L289-I293 VanDerWaalsContact CD1-CD1 3.43Å; L289-I293 HydrophobicContact CD1-CG1 4.36Å; L289-I293 HydrophobicContact CG-CD1 3.97Å; L289-I293 PolarHBondContact O-N 3.49Å; I293-R346 PolarHBondContact O-NH2 2.68Å; I293-M363 HydrophobicContact CB-SD 3.9Å; I293-M363 HydrophobicContact CD1-SD 3.41Å; I293-M363 WeakPolarHBondContact CD1-SD 3.32Å; I293-M363 HydrophobicContact CG1-SD 4.23Å; I293-M363 HydrophobicContact CG2-SD 3.9Å; I293-I397 HydrophobicContact CD1-CD1 3.51Å; I293-I397 HydrophobicContact CG1-CD1 4.41Å; I293-L433 HydrophobicContact CD1-CB 4.25Å
294	P	83	Confident	91.5	Very high	63 Å²	63	35.6 Å²	35.6	41%	0.409	20%	0.196	S	C	.	.			trans	-71.5	162.9	176.8	32.1	-35.7	0	0	0	111	L441	P294-L441 HydrophobicContact CG-CD1 3.29Å; P294-L441 HydrophobicContact CG-CD2 4Å; P294-L441 HydrophobicContact CG-CG 4.29Å
295	G	86.1	Confident	91.6	Very high	49 Å²	49	40.6 Å²	40.6	51%	0.505	21%	0.208	S	C	.	.	S	Bend	trans	91.7	-164.6	-178.1	0	0	0	0	0	113.4	R346	G295-R346 WeakPolarHBondContact O-CG 3.16Å; G295-R346 PolarHBondContact O-NE 3.4Å
296	Q	91.4	Very high	91.6	Very high	30 Å²	30	41 Å²	41	14%	0.14	21%	0.211	C	C	.	.			trans	-95.2	145.9	-175.1	-61.7	-172.6	-84.2	0	0	111.7	F340 Y345 R346 V362 M363	Q296-F340 HydrophobicContact CB-CE2 4.04Å; Q296-F340 HydrophobicContact CB-CZ 3.85Å; Q296-F340 HydrophobicContact CG-CE2 4.39Å; Q296-F340 VanDerWaalsContact NE2-CD2 3.31Å; Q296-F340 VanDerWaalsContact NE2-CE2 3.33Å; Q296-F340 PolarHBondContact NE2-O 3.3Å; Q296-Y345 PolarHBondContact NE2-O 2.96Å; Q296-R346 CarbonylContact C-O 3.55Å; Q296-R346 VanDerWaalsContact CA-O 3.25Å; Q296-R346 WeakPolarHBondContact CA-O 3.42Å; Q296-V362 HydrophobicContact CB-CG1 3.94Å; Q296-V362 WeakPolarHBondContact O-CB 3.2Å; Q296-M363 PolarHBondContact O-N 3.07Å; Q296-M363 VanDerWaalsContact O-N 3.1Å
297	G	92.5	Very high	91.6	Very high	1 Å²	1	41 Å²	41	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	145.7	179.8	0	0	0	0	0	112.2	R346 L347 L348 M363	G297-R346 PolarHBondContact N-O 3.07Å; G297-L347 WeakPolarHBondContact O-CA 3.31Å; G297-L348 PolarHBondContact O-N 2.91Å; G297-M363 CarbonylContact C-O 3.52Å; G297-M363 WeakPolarHBondContact CA-O 3.13Å
298	M	94.4	Very high	91.8	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.2	172.6	-168.7	177.8	-151.6	0	0	109.9	F300 L348 T350 I358 V362 M363 V365 R388	M298-F300 HydrophobicContact CB-CE2 4.31Å; M298-F300 HydrophobicContact CE-CE1 4.49Å; M298-F300 HydrophobicContact CE-CZ 4.1Å; M298-F300 HydrophobicContact CG-CD2 4.41Å; M298-F300 HydrophobicContact CG-CE2 3.77Å; M298-F300 HydrophobicContact CG-CZ 4Å; M298-F300 HydrophobicContact SD-CE1 4.36Å; M298-F300 HydrophobicContact SD-CE2 3.74Å; M298-F300 HydrophobicContact SD-CZ 3.45Å; M298-F300 WeakPolarHBondContact SD-CZ 3.5Å; M298-L348 CarbonylContact C-O 3.59Å; M298-L348 VanDerWaalsContact CA-O 3.32Å; M298-L348 WeakPolarHBondContact CA-O 3.45Å; M298-L348 HydrophobicContact CE-CD2 3.59Å; M298-L348 HydrophobicContact CE-CG 4.23Å; M298-T350 HydrophobicContact CE-CG2 3.48Å; M298-T350 VanDerWaalsContact CE-CG2 3.48Å; M298-T350 HydrophobicContact CG-CG2 4.32Å; M298-I358 HydrophobicContact CE-CB 4.27Å; M298-I358 HydrophobicContact CE-CD1 3.64Å; M298-I358 HydrophobicContact CE-CG1 4.48Å; M298-I358 HydrophobicContact CE-CG2 4.26Å; M298-V362 HydrophobicContact CB-CB 4.46Å; M298-V362 HydrophobicContact CB-CG2 3.68Å; M298-M363 PolarHBondContact N-O 3.47Å; M298-V365 PolarHBondContact O-N 2.88Å; M298-R388 HydrophobicContact SD-CG 4.26Å
299	I	95.8	Very high	91.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	124.4	-175.8	-52.3	163.8	0	0	0	109.2	T286 L310 L347 L348 I349 T350 V365 Y367	T286-I299 HydrophobicContact CG2-CD1 3.66Å; T286-I299 HydrophobicContact CG2-CG1 4.39Å; I299-L310 HydrophobicContact CG2-CD2 3.66Å; I299-L347 HydrophobicContact CD1-CD1 4.23Å; I299-L348 PolarHBondContact N-O 2.98Å; I299-I349 HydrophobicContact CB-CG1 4.2Å; I299-I349 HydrophobicContact CD1-CG1 4.12Å; I299-I349 CarbonylContact O-C 3.55Å; I299-I349 WeakPolarHBondContact O-CA 3.48Å; I299-T350 PolarHBondContact O-N 3.34Å; I299-V365 CarbonylContact C-O 3.59Å; I299-V365 WeakPolarHBondContact CA-O 3.38Å; I299-V365 HydrophobicContact CB-CB 4.43Å; I299-V365 HydrophobicContact CG1-CB 4.09Å; I299-V365 HydrophobicContact CG1-CG2 4.43Å; I299-V365 HydrophobicContact CG2-CB 4.22Å; I299-V365 HydrophobicContact CG2-CG1 4.26Å; I299-Y367 HydrophobicContact CG2-CD2 4.27Å; I299-Y367 HydrophobicContact CG2-CG 4.49Å
300	F	96.1	Very high	92.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	117.4	-176.3	-72.2	-88.9	0	0	0	111.9	M298 T350 S355 V364 V365 Y367 H368 R385	M298-F300 HydrophobicContact CB-CE2 4.31Å; M298-F300 HydrophobicContact CE-CE1 4.49Å; M298-F300 HydrophobicContact CE-CZ 4.1Å; M298-F300 HydrophobicContact CG-CD2 4.41Å; M298-F300 HydrophobicContact CG-CE2 3.77Å; M298-F300 HydrophobicContact CG-CZ 4Å; M298-F300 HydrophobicContact SD-CE1 4.36Å; M298-F300 HydrophobicContact SD-CE2 3.74Å; M298-F300 HydrophobicContact SD-CZ 3.45Å; M298-F300 WeakPolarHBondContact SD-CZ 3.5Å; F300-T350 HydrophobicContact CD1-CG2 3.79Å; F300-T350 HydrophobicContact CE1-CG2 3.72Å; F300-T350 HydrophobicContact CZ-CG2 4.35Å; F300-S355 WeakPolarHBondContact CE1-OG 3.47Å; F300-V364 HydrophobicContact CD2-CG1 3.93Å; F300-V364 HydrophobicContact CE2-CG1 3.84Å; F300-V365 PolarHBondContact N-O 3.36Å; F300-Y367 WeakPolarHBondContact O-CB 3.42Å; F300-Y367 PolarHBondContact O-N 2.96Å; F300-H368 PolarHBondContact O-N 3.44Å; F300-R385 HydrophobicContact CD1-CG 3.65Å; F300-R385 HydrophobicContact CD2-CB 4.13Å; F300-R385 HydrophobicContact CD2-CG 4.01Å; F300-R385 HydrophobicContact CE1-CB 4.29Å; F300-R385 HydrophobicContact CE1-CG 3.53Å; F300-R385 HydrophobicContact CE2-CB 3.86Å; F300-R385 HydrophobicContact CE2-CG 3.95Å; F300-R385 HydrophobicContact CG-CB 4.48Å; F300-R385 HydrophobicContact CG-CG 3.87Å; F300-R385 HydrophobicContact CZ-CB 3.94Å; F300-R385 HydrophobicContact CZ-CG 3.7Å
301	C	95.2	Very high	92.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.225	C	C	.	.			trans	-105.7	151.4	174.1	-61.1	0	0	0	0	111.2	A307 T350	C301-A307 HydrophobicContact CB-CB 4.04Å; C301-T350 PolarHBondContact N-O 2.96Å
302	M	91.8	Very high	92.9	Very high	71 Å²	71	43.2 Å²	43.2	35%	0.35	23%	0.227	S	C	.	.	S	Bend	trans	-69.8	-42.6	176.5	-172.7	67.4	77.5	0	0	111.7	H368 V369 L371	M302-H368 HydrophobicContact CB-CB 3.96Å; M302-H368 PolarHBondContact N-ND1 2.95Å; M302-V369 WeakPolarHBondContact CE-O 3.36Å; M302-L371 HydrophobicContact CE-CB 4.01Å; M302-L371 HydrophobicContact CE-CG 4.4Å
303	T	91.8	Very high	93.3	Very high	72 Å²	72	43.7 Å²	43.7	44%	0.442	23%	0.227	S	C	.	.	S	Bend	trans	-121.3	154.5	-172.9	70.1	0	0	0	0	111.9	R305 S306 A307	T303-R305 VanDerWaalsContact C-N 3.27Å; T303-R305 PolarHBondContact O-N 3.48Å; T303-S306 PolarHBondContact O-N 2.91Å; T303-S306 WeakPolarHBondContact OG1-CB 3.22Å; T303-S306 PolarHBondContact OG1-N 3.46Å; T303-S306 VanDerWaalsContact OG1-N 3.1Å; T303-A307 PolarHBondContact O-N 3.02Å
304	K	92.5	Very high	93.8	Very high	73 Å²	73	43.3 Å²	43.3	32%	0.317	23%	0.225	S	C	.	.	H	α-helix	trans	-59.5	-40.1	173.5	-53.9	-175.2	-171.1	-179.3	0	111.6	S306 A307 N308 T325 E327	K304-S306 PolarHBondContact O-N 3.44Å; K304-A307 WeakPolarHBondContact O-CB 3.43Å; K304-A307 PolarHBondContact O-N 3.22Å; K304-N308 PolarHBondContact O-N 3.35Å; K304-T325 HydrophobicContact CB-CG2 4.23Å; K304-T325 HydrophobicContact CG-CG2 4.31Å; K304-E327 HydrophobicContact CD-CG 4.26Å; K304-E327 VanDerWaalsContact CD-OE1 3.26Å; K304-E327 WeakPolarHBondContact CD-OE1 3.12Å; K304-E327 IonicContact NZ-OE1 3.37Å
305	R	94.6	Very high	94.5	Very high	203 Å²	203	45.9 Å²	45.9	77%	0.766	23%	0.227	S	C	*	.	H	α-helix	trans	-58.3	-49.7	176.8	-177.3	178.2	178.1	173.3	-0.3	111.3	T303 A307 N308 V309	T303-R305 VanDerWaalsContact C-N 3.27Å; T303-R305 PolarHBondContact O-N 3.48Å; R305-A307 VanDerWaalsContact C-N 3.34Å; R305-A307 PolarHBondContact O-N 3.26Å; R305-N308 PolarHBondContact O-N 3.28Å; R305-V309 WeakPolarHBondContact O-CG2 3.28Å; R305-V309 PolarHBondContact O-N 3.46Å
306	S	94.4	Very high	94.9	Very high	21 Å²	21	48 Å²	48	15%	0.147	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-41.4	177.2	171	0	0	0	0	111.9	T303 K304 N308 V309 L310 H368	T303-S306 PolarHBondContact O-N 2.91Å; T303-S306 WeakPolarHBondContact OG1-CB 3.22Å; T303-S306 PolarHBondContact OG1-N 3.46Å; T303-S306 VanDerWaalsContact OG1-N 3.1Å; K304-S306 PolarHBondContact O-N 3.44Å; S306-N308 PolarHBondContact O-N 2.87Å; S306-V309 PolarHBondContact O-N 3.19Å; S306-L310 WeakPolarHBondContact O-CB 3.41Å; S306-L310 PolarHBondContact O-N 2.89Å; S306-H368 PolarHBondContact OG-CE1 3.05Å
307	A	95.7	Very high	95	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-58.8	-45	175.6	0	0	0	0	0	112.5	C301 T303 K304 R305 A311 T325 I349	C301-A307 HydrophobicContact CB-CB 4.04Å; T303-A307 PolarHBondContact O-N 3.02Å; K304-A307 WeakPolarHBondContact O-CB 3.43Å; K304-A307 PolarHBondContact O-N 3.22Å; R305-A307 VanDerWaalsContact C-N 3.34Å; R305-A307 PolarHBondContact O-N 3.26Å; A307-A311 WeakPolarHBondContact O-CB 3.45Å; A307-A311 PolarHBondContact O-N 3.48Å; A307-T325 HydrophobicContact CB-CG2 4.04Å; A307-I349 HydrophobicContact CB-CG2 3.75Å
308	N	95.6	Very high	95	Very high	60 Å²	60	56 Å²	56	32%	0.321	29%	0.286	S	S	.	.	H	α-helix	trans	-67.8	-45.5	179.9	-70.1	-19.3	0	0	0	112.1	K304 R305 S306 L310 A311 E312	K304-N308 PolarHBondContact O-N 3.35Å; R305-N308 PolarHBondContact O-N 3.28Å; S306-N308 PolarHBondContact O-N 2.87Å; N308-L310 PolarHBondContact O-N 2.89Å; N308-A311 WeakPolarHBondContact O-CB 3.38Å; N308-A311 PolarHBondContact O-N 2.73Å; N308-E312 PolarHBondContact O-N 2.96Å
309	V	96.1	Very high	95	Very high	66 Å²	66	56.6 Å²	56.6	40%	0.4	29%	0.289	S	S	.	.	H	α-helix	trans	-60.3	-45.6	177.1	171.3	0	0	0	0	111	R305 S306 A311 E312 K313	R305-V309 WeakPolarHBondContact O-CG2 3.28Å; R305-V309 PolarHBondContact O-N 3.46Å; S306-V309 PolarHBondContact O-N 3.19Å; V309-A311 VanDerWaalsContact C-N 3.3Å; V309-A311 PolarHBondContact O-N 3.32Å; V309-E312 PolarHBondContact O-N 3.45Å; V309-K313 PolarHBondContact O-N 2.85Å; V309-K313 VanDerWaalsContact O-N 3.09Å
310	L	96.9	Very high	95	Very high	3 Å²	3	61.8 Å²	61.8	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-62.6	-40	177	-178.7	60.4	0	0	0	111.4	F283 I299 S306 N308 K313 M314 I349 Y367	F283-L310 HydrophobicContact CD2-CD1 3.8Å; I299-L310 HydrophobicContact CG2-CD2 3.66Å; S306-L310 WeakPolarHBondContact O-CB 3.41Å; S306-L310 PolarHBondContact O-N 2.89Å; N308-L310 PolarHBondContact O-N 2.89Å; L310-K313 PolarHBondContact O-N 2.83Å; L310-M314 HydrophobicContact CD1-CG 3.91Å; L310-M314 HydrophobicContact CG-CG 4.19Å; L310-M314 WeakPolarHBondContact O-CB 3.34Å; L310-M314 WeakPolarHBondContact O-CG 3.32Å; L310-M314 PolarHBondContact O-N 3.12Å; L310-I349 HydrophobicContact CB-CD1 4.18Å; L310-I349 HydrophobicContact CD2-CD1 4.04Å; L310-I349 HydrophobicContact CD2-CG2 4.41Å; L310-I349 HydrophobicContact CG-CD1 3.79Å; L310-Y367 HydrophobicContact CD1-CD2 4.31Å; L310-Y367 HydrophobicContact CD1-CE2 3.68Å; L310-Y367 HydrophobicContact CD2-CD2 3.59Å; L310-Y367 HydrophobicContact CD2-CE2 3.8Å; L310-Y367 HydrophobicContact CD2-CG 4.13Å; L310-Y367 HydrophobicContact CG-CE2 4.36Å
311	A	97	Very high	95	Very high	1 Å²	1	62 Å²	62	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-64	-42.5	178.5	0	0	0	0	0	112.8	A307 N308 V309 R315 V321 V323 I349	A307-A311 WeakPolarHBondContact O-CB 3.45Å; A307-A311 PolarHBondContact O-N 3.48Å; N308-A311 WeakPolarHBondContact O-CB 3.38Å; N308-A311 PolarHBondContact O-N 2.73Å; V309-A311 VanDerWaalsContact C-N 3.3Å; V309-A311 PolarHBondContact O-N 3.32Å; A311-R315 WeakPolarHBondContact O-CB 3.42Å; A311-R315 WeakPolarHBondContact O-CG 3.14Å; A311-R315 PolarHBondContact O-N 3.3Å; A311-V321 HydrophobicContact CB-CG1 3.99Å; A311-V323 HydrophobicContact CB-CG2 3.28Å; A311-I349 HydrophobicContact CB-CD1 3.81Å
312	E	96.8	Very high	95	Very high	130 Å²	130	62.2 Å²	62.2	61%	0.607	32%	0.319	S	S	*	.	H	α-helix	trans	-61.5	-49.6	175.7	-73	176.5	174.6	0	0	111.3	N308 V309 M314 R315 S316	N308-E312 PolarHBondContact O-N 2.96Å; V309-E312 PolarHBondContact O-N 3.45Å; E312-M314 PolarHBondContact O-N 2.91Å; E312-R315 PolarHBondContact O-N 3.43Å; E312-S316 PolarHBondContact O-N 2.72Å
313	K	96.4	Very high	95.2	Very high	64 Å²	64	59.1 Å²	59.1	28%	0.278	30%	0.304	S	S	.	.	H	α-helix	trans	-59.8	-47.9	176.5	-69.1	-173.9	172.8	-171.4	0	111.9	D280 F283 V309 L310 R315 S316 F317	D280-K313 IonicContact OD1-NZ 2.73Å; D280-K313 PolarHBondContact OD1-NZ 3.03Å; F283-K313 HydrophobicContact CD2-CB 3.8Å; F283-K313 HydrophobicContact CD2-CD 4.02Å; F283-K313 HydrophobicContact CE2-CB 3.38Å; F283-K313 HydrophobicContact CE2-CD 4.35Å; F283-K313 HydrophobicContact CE2-CG 4.49Å; F283-K313 HydrophobicContact CG-CD 4.1Å; F283-K313 HydrophobicContact CZ-CB 3.87Å; V309-K313 PolarHBondContact O-N 2.85Å; V309-K313 VanDerWaalsContact O-N 3.09Å; L310-K313 PolarHBondContact O-N 2.83Å; K313-R315 VanDerWaalsContact C-N 3.31Å; K313-R315 PolarHBondContact O-N 3.41Å; K313-S316 PolarHBondContact O-N 2.91Å; K313-S316 PolarHBondContact O-OG 2.91Å; K313-F317 VanDerWaalsContact O-CD2 3.32Å; K313-F317 WeakPolarHBondContact O-CD2 3.18Å; K313-F317 PolarHBondContact O-N 3.23Å
314	M	96.6	Very high	95.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-37	-179.3	-71.5	-64.4	-72.9	0	0	112	F283 T286 A287 C290 L310 E312 F317 H319 V321 L347	F283-M314 HydrophobicContact CD2-CG 4.46Å; F283-M314 HydrophobicContact CD2-SD 4.06Å; F283-M314 HydrophobicContact CE2-CG 3.99Å; F283-M314 HydrophobicContact CE2-SD 3.55Å; F283-M314 VanDerWaalsContact CE2-SD 3.55Å; F283-M314 HydrophobicContact CZ-SD 4.44Å; T286-M314 HydrophobicContact CG2-CE 4.27Å; T286-M314 HydrophobicContact CG2-SD 4.37Å; A287-M314 HydrophobicContact CB-CE 4.49Å; A287-M314 HydrophobicContact CB-SD 4.14Å; C290-M314 HydrophobicContact CB-CE 4.26Å; L310-M314 HydrophobicContact CD1-CG 3.91Å; L310-M314 HydrophobicContact CG-CG 4.19Å; L310-M314 WeakPolarHBondContact O-CB 3.34Å; L310-M314 WeakPolarHBondContact O-CG 3.32Å; L310-M314 PolarHBondContact O-N 3.12Å; E312-M314 PolarHBondContact O-N 2.91Å; M314-F317 PolarHBondContact O-N 2.74Å; M314-H319 HydrophobicContact CB-CB 4.37Å; M314-H319 HydrophobicContact CE-CB 4.27Å; M314-H319 VanDerWaalsContact CE-CD2 3.48Å; M314-H319 WeakPolarHBondContact CE-CD2 3.01Å; M314-H319 WeakPolarHBondContact O-CB 3.06Å; M314-H319 PolarHBondContact O-CD2 3.22Å; M314-H319 PolarHBondContact O-N 2.47Å; M314-V321 HydrophobicContact CB-CG2 3.62Å; M314-L347 HydrophobicContact CE-CD1 3.25Å
315	R	97	Very high	95.2	Very high	117 Å²	117	52.4 Å²	52.4	44%	0.442	27%	0.269	S	S	.	.	H	α-helix	trans	-66.8	-39.1	174.7	-73.4	171.2	-171.8	140	0.1	112.4	A311 E312 K313 F317 G318 V321	A311-R315 WeakPolarHBondContact O-CB 3.42Å; A311-R315 WeakPolarHBondContact O-CG 3.14Å; A311-R315 PolarHBondContact O-N 3.3Å; E312-R315 PolarHBondContact O-N 3.43Å; K313-R315 VanDerWaalsContact C-N 3.31Å; K313-R315 PolarHBondContact O-N 3.41Å; R315-F317 PolarHBondContact O-N 2.79Å; R315-G318 PolarHBondContact O-N 3.36Å; R315-V321 HydrophobicContact CG-CB 3.98Å; R315-V321 HydrophobicContact CG-CG2 4.24Å; R315-V321 PolarHBondContact NE-O 3.45Å; R315-V321 PolarHBondContact NH2-O 3.34Å
316	S	95.1	Very high	94.7	Very high	93 Å²	93	45.2 Å²	45.2	65%	0.65	25%	0.253	S	S	*	.	H	α-helix	trans	-65.7	-22.1	177.8	72	0	0	0	0	112.9	E312 K313 G318	E312-S316 PolarHBondContact O-N 2.72Å; K313-S316 PolarHBondContact O-N 2.91Å; K313-S316 PolarHBondContact O-OG 2.91Å; S316-G318 VanDerWaalsContact C-N 3.32Å
317	F	92.7	Very high	94.3	Very high	134 Å²	134	50.2 Å²	50.2	59%	0.588	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	11	171.3	-79.1	-106.5	0	0	0	113.5	F283 K313 M314 R315	F283-F317 HydrophobicContact CE1-CD2 4.08Å; F283-F317 HydrophobicContact CE1-CE1 4.45Å; F283-F317 AromaticContact CE1-CE2 3.67Å; F283-F317 HydrophobicContact CE1-CE2 3.67Å; F283-F317 AromaticContact CE1-CZ 3.88Å; F283-F317 HydrophobicContact CE1-CZ 3.88Å; F283-F317 AromaticContact CZ-CD2 3.51Å; F283-F317 HydrophobicContact CZ-CD2 3.51Å; F283-F317 AromaticContact CZ-CE2 3.59Å; F283-F317 HydrophobicContact CZ-CE2 3.59Å; F283-F317 HydrophobicContact CZ-CG 4.02Å; F283-F317 HydrophobicContact CZ-CZ 4.16Å; K313-F317 VanDerWaalsContact O-CD2 3.32Å; K313-F317 WeakPolarHBondContact O-CD2 3.18Å; K313-F317 PolarHBondContact O-N 3.23Å; M314-F317 PolarHBondContact O-N 2.74Å; R315-F317 PolarHBondContact O-N 2.79Å
318	G	93.4	Very high	93.8	Very high	65 Å²	65	51.6 Å²	51.6	67%	0.67	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	6.8	172.8	0	0	0	0	0	115.5	R315 S316	R315-G318 PolarHBondContact O-N 3.36Å; S316-G318 VanDerWaalsContact C-N 3.32Å
319	H	94.2	Very high	93.4	Very high	16 Å²	16	52.4 Å²	52.4	7%	0.074	29%	0.288	C	S	.	.			trans	-77.7	137.5	177.1	-61.9	-84.2	0	0	0	112	N291 M314 V321 L347	N291-H319 PolarHBondContact OD1-CE1 3.29Å; N291-H319 VanDerWaalsContact OD1-CE1 3.22Å; M314-H319 HydrophobicContact CB-CB 4.37Å; M314-H319 HydrophobicContact CE-CB 4.27Å; M314-H319 VanDerWaalsContact CE-CD2 3.48Å; M314-H319 WeakPolarHBondContact CE-CD2 3.01Å; M314-H319 WeakPolarHBondContact O-CB 3.06Å; M314-H319 PolarHBondContact O-CD2 3.22Å; M314-H319 PolarHBondContact O-N 2.47Å; H319-V321 HydrophobicContact CB-CG2 3.9Å; H319-V321 PolarHBondContact O-N 2.66Å; H319-L347 HydrophobicContact CB-CD1 4.03Å
320	L	95.4	Very high	92.6	Very high	109 Å²	109	53.4 Å²	53.4	57%	0.571	29%	0.288	S	S	*	.			trans	-77.9	101.7	170.9	-62.7	178.8	0	0	0	110.3	Y345 R346 L347	L320-Y345 HydrophobicContact CB-CD1 4.45Å; L320-R346 PolarHBondContact O-N 2.69Å; L320-L347 PolarHBondContact O-N 3.28Å
321	V	96.8	Very high	91.8	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.018	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.2	-171.6	-179.4	0	0	0	0	112.2	A311 M314 R315 H319 V323 Y345 L347 I349	A311-V321 HydrophobicContact CB-CG1 3.99Å; M314-V321 HydrophobicContact CB-CG2 3.62Å; R315-V321 HydrophobicContact CG-CB 3.98Å; R315-V321 HydrophobicContact CG-CG2 4.24Å; R315-V321 PolarHBondContact NE-O 3.45Å; R315-V321 PolarHBondContact NH2-O 3.34Å; H319-V321 HydrophobicContact CB-CG2 3.9Å; H319-V321 PolarHBondContact O-N 2.66Å; V321-V323 HydrophobicContact CG1-CG2 4.33Å; V321-Y345 VanDerWaalsContact C-CD1 3.48Å; V321-L347 HydrophobicContact CG2-CB 4.15Å; V321-L347 HydrophobicContact CG2-CD1 4.12Å; V321-I349 HydrophobicContact CG1-CD1 3.5Å; V321-I349 VanDerWaalsContact CG1-CD1 3.5Å; V321-I349 HydrophobicContact CG1-CG1 3.83Å
322	N	95.2	Very high	91.4	Very high	6 Å²	6	60.8 Å²	60.8	3%	0.032	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	154.1	165	-149.7	-10.4	0	0	0	110.8	R336 Y345 L347 L348 I349	N322-R336 WeakPolarHBondContact ND2-CA 3.3Å; N322-R336 VanDerWaalsContact ND2-CB 3.33Å; N322-R336 WeakPolarHBondContact ND2-CB 3.38Å; N322-R336 PolarHBondContact ND2-O 2.96Å; N322-R336 VanDerWaalsContact OD1-CD 3.28Å; N322-R336 WeakPolarHBondContact OD1-CD 3.46Å; N322-R336 WeakPolarHBondContact OD1-CG 2.99Å; N322-Y345 HydrophobicContact CB-CD1 3.97Å; N322-Y345 HydrophobicContact CB-CD2 3.84Å; N322-Y345 HydrophobicContact CB-CE1 4.45Å; N322-Y345 HydrophobicContact CB-CE2 4.33Å; N322-Y345 HydrophobicContact CB-CG 3.64Å; N322-L347 PolarHBondContact N-O 2.95Å; N322-L348 HydrophobicContact CB-CD1 4.13Å; N322-I349 PolarHBondContact O-N 3.01Å
323	V	95.3	Very high	90.9	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.03	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	132.2	-179.7	-178.8	0	0	0	0	109.7	A311 V321 T325 R336 I349	A311-V323 HydrophobicContact CB-CG2 3.28Å; V321-V323 HydrophobicContact CG1-CG2 4.33Å; V323-T325 HydrophobicContact CG1-CG2 3.86Å; V323-R336 VanDerWaalsContact O-CD 3.25Å; V323-R336 WeakPolarHBondContact O-CD 3.43Å; V323-R336 PolarHBondContact O-NH1 2.8Å; V323-I349 CarbonylContact C-O 3.59Å; V323-I349 VanDerWaalsContact CA-O 3.31Å; V323-I349 WeakPolarHBondContact CA-O 3.15Å; V323-I349 HydrophobicContact CG2-CB 4.4Å
324	I	92.9	Very high	90.2	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	110	174.4	-70	176.5	0	0	0	109.5	L328 R333 R336 I337 L348 I349 T350 C354 I358	I324-L328 HydrophobicContact CB-CD1 4.34Å; I324-L328 HydrophobicContact CG1-CD1 4.16Å; I324-L328 HydrophobicContact CG2-CD1 4.43Å; I324-R333 HydrophobicContact CD1-CG 4.37Å; I324-R333 HydrophobicContact CG2-CG 3.77Å; I324-R336 HydrophobicContact CD1-CB 3.96Å; I324-R336 HydrophobicContact CG1-CB 3.93Å; I324-I337 HydrophobicContact CD1-CD1 4.16Å; I324-I337 HydrophobicContact CD1-CG1 3.43Å; I324-I337 VanDerWaalsContact CD1-CG1 3.43Å; I324-L348 HydrophobicContact CB-CD1 4.07Å; I324-L348 HydrophobicContact CD1-CD1 3.63Å; I324-L348 HydrophobicContact CD1-CD2 4.13Å; I324-L348 HydrophobicContact CG1-CD1 3.67Å; I324-I349 PolarHBondContact N-O 2.79Å; I324-T350 VanDerWaalsContact O-CA 3.26Å; I324-T350 WeakPolarHBondContact O-CA 3.41Å; I324-T350 WeakPolarHBondContact O-CB 3.45Å; I324-T350 PolarHBondContact O-OG1 3.3Å; I324-C354 HydrophobicContact CG2-CB 3.56Å; I324-I358 HydrophobicContact CD1-CD1 4.22Å
325	T	90.8	Very high	89.9	Confident	4 Å²	4	59.3 Å²	59.3	3%	0.025	32%	0.319	C	S	.	.			trans	-130.9	169.5	177.5	60.6	0	0	0	0	109.6	K304 A307 V323 E327 L328 T351	K304-T325 HydrophobicContact CB-CG2 4.23Å; K304-T325 HydrophobicContact CG-CG2 4.31Å; A307-T325 HydrophobicContact CB-CG2 4.04Å; V323-T325 HydrophobicContact CG1-CG2 3.86Å; T325-E327 PolarHBondContact O-N 2.95Å; T325-L328 PolarHBondContact O-N 3.05Å; T325-T351 HydrophobicContact CG2-CG2 4.42Å
326	A	85.1	Confident	89.6	Confident	53 Å²	53	57.3 Å²	57.3	44%	0.438	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	9.6	-174.4	0	0	0	0	0	114.6	C354	A326-C354 VanDerWaalsContact CA-SG 3.55Å; A326-C354 PolarHBondContact N-SG 2.82Å
327	E	85.5	Confident	89.3	Confident	126 Å²	126	53.5 Å²	53.5	59%	0.589	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-18.1	170.4	-81.1	154.2	-153.9	0	0	112.5	K304 T325	K304-E327 HydrophobicContact CD-CG 4.26Å; K304-E327 VanDerWaalsContact CD-OE1 3.26Å; K304-E327 WeakPolarHBondContact CD-OE1 3.12Å; K304-E327 IonicContact NZ-OE1 3.37Å; T325-E327 PolarHBondContact O-N 2.95Å
328	L	86	Confident	89.1	Confident	29 Å²	29	54 Å²	54	15%	0.152	28%	0.282	C	S	.	.	S	Bend	trans	-75.8	142.9	-179.4	-58.5	178.2	0	0	0	111.4	I324 T325 E332 R333 R336	I324-L328 HydrophobicContact CB-CD1 4.34Å; I324-L328 HydrophobicContact CG1-CD1 4.16Å; I324-L328 HydrophobicContact CG2-CD1 4.43Å; T325-L328 PolarHBondContact O-N 3.05Å; L328-E332 WeakPolarHBondContact CA-OE2 3.41Å; L328-E332 HydrophobicContact CB-CB 4.07Å; L328-E332 HydrophobicContact CD2-CB 4.27Å; L328-R333 HydrophobicContact CB-CB 4.41Å; L328-R336 VanDerWaalsContact CD2-NH1 3.27Å
329	T	86.4	Confident	89.1	Confident	76 Å²	76	51.8 Å²	51.8	47%	0.466	26%	0.255	S	S	.	.			trans	-65.5	161.7	165.6	74.8	0	0	0	0	110.2	L331 E332 R333	T329-L331 PolarHBondContact O-N 3.16Å; T329-E332 PolarHBondContact N-OE2 2.95Å; T329-E332 PolarHBondContact O-N 3.21Å; T329-E332 VanDerWaalsContact OG1-CG 3.32Å; T329-E332 WeakPolarHBondContact OG1-CG 3.13Å; T329-E332 PolarHBondContact OG1-N 3.16Å; T329-E332 VanDerWaalsContact OG1-N 3.16Å; T329-R333 WeakPolarHBondContact O-CB 3.38Å; T329-R333 PolarHBondContact O-N 3.29Å
330	H	80	Confident	89	Confident	87 Å²	87	51 Å²	51	40%	0.403	25%	0.251	S	S	.	.	H	α-helix	trans	-57.3	-38.8	175.7	-67.7	-57.1	0	0	0	112.2	Y131 R333 A334	Y131-H330 HydrophobicContact CD1-CB 4.4Å; Y131-H330 HydrophobicContact CD2-CB 3.74Å; Y131-H330 HydrophobicContact CE2-CB 4.28Å; Y131-H330 HydrophobicContact CG-CB 3.83Å; H330-R333 PolarHBondContact O-N 3.39Å; H330-A334 WeakPolarHBondContact O-CB 3.46Å; H330-A334 PolarHBondContact O-N 3.38Å
331	L	78.8	Confident	88.7	Confident	76 Å²	76	51.9 Å²	51.9	40%	0.398	25%	0.247	S	C	.	.	H	α-helix	trans	-67.5	-45.7	177.3	-174.6	70.4	0	0	0	111.9	D160 T329 R333 A334 K335	D160-L331 HydrophobicContact CB-CD2 4.37Å; D160-L331 WeakPolarHBondContact OD2-CD2 3.23Å; T329-L331 PolarHBondContact O-N 3.16Å; L331-R333 VanDerWaalsContact C-N 3.27Å; L331-R333 PolarHBondContact O-N 3.14Å; L331-A334 PolarHBondContact O-N 2.83Å; L331-K335 WeakPolarHBondContact O-CB 3.3Å; L331-K335 PolarHBondContact O-N 2.88Å
332	E	88.6	Confident	88.4	Confident	84 Å²	84	57.4 Å²	57.4	39%	0.393	27%	0.272	S	S	.	.	H	α-helix	trans	-60	-42.2	177.4	-73.3	178.1	137.4	0	0	111.2	L328 T329 K335 R336	L328-E332 WeakPolarHBondContact CA-OE2 3.41Å; L328-E332 HydrophobicContact CB-CB 4.07Å; L328-E332 HydrophobicContact CD2-CB 4.27Å; T329-E332 PolarHBondContact N-OE2 2.95Å; T329-E332 PolarHBondContact O-N 3.21Å; T329-E332 VanDerWaalsContact OG1-CG 3.32Å; T329-E332 WeakPolarHBondContact OG1-CG 3.13Å; T329-E332 PolarHBondContact OG1-N 3.16Å; T329-E332 VanDerWaalsContact OG1-N 3.16Å; E332-K335 PolarHBondContact O-N 2.69Å; E332-R336 WeakPolarHBondContact O-CB 3.42Å; E332-R336 VanDerWaalsContact O-CG 3.29Å; E332-R336 WeakPolarHBondContact O-CG 3.29Å; E332-R336 PolarHBondContact O-N 3.21Å
333	R	87.8	Confident	88.3	Confident	20 Å²	20	65 Å²	65	8%	0.075	31%	0.305	C	S	.	.	H	α-helix	trans	-63.1	-47.4	175.6	-174.9	163.1	168.4	-127.6	-6.3	111.2	E132 I324 L328 T329 H330 L331 K335 R336 I337 C354 R356	E132-R333 HydrophobicContact CG-CG 4.31Å; E132-R333 WeakPolarHBondContact OE1-CD 3.4Å; E132-R333 WeakPolarHBondContact OE1-CG 3.43Å; E132-R333 IonicContact OE1-CZ 2.71Å; E132-R333 IonicContact OE1-NE 3.94Å; E132-R333 PolarHBondContact OE1-NE 3.39Å; E132-R333 IonicContact OE1-NH1 3.01Å; E132-R333 PolarHBondContact OE1-NH1 2.82Å; E132-R333 IonicContact OE2-CZ 3.1Å; E132-R333 IonicContact OE2-NE 3.69Å; E132-R333 IonicContact OE2-NH1 2.63Å; E132-R333 PolarHBondContact OE2-NH1 3.1Å; E132-R333 IonicContact OE2-NH2 2.85Å; E132-R333 PolarHBondContact OE2-NH2 3.4Å; I324-R333 HydrophobicContact CD1-CG 4.37Å; I324-R333 HydrophobicContact CG2-CG 3.77Å; L328-R333 HydrophobicContact CB-CB 4.41Å; T329-R333 WeakPolarHBondContact O-CB 3.38Å; T329-R333 PolarHBondContact O-N 3.29Å; H330-R333 PolarHBondContact O-N 3.39Å; L331-R333 VanDerWaalsContact C-N 3.27Å; L331-R333 PolarHBondContact O-N 3.14Å; R333-K335 PolarHBondContact O-N 3.16Å; R333-R336 PolarHBondContact O-N 3.42Å; R333-I337 HydrophobicContact CG-CD1 3.89Å; R333-I337 VanDerWaalsContact O-CG1 3.3Å; R333-I337 WeakPolarHBondContact O-CG1 3.5Å; R333-I337 PolarHBondContact O-N 2.92Å; R333-C354 PolarHBondContact NE-O 2.74Å; R333-C354 PolarHBondContact NH2-O 2.92Å; R333-R356 PolarHBondContact NH2-O 2.87Å
334	A	81.9	Confident	88.2	Confident	19 Å²	19	72.3 Å²	72.3	16%	0.157	33%	0.332	C	S	.	.	H	α-helix	trans	-60.4	-43.7	177	0	0	0	0	0	112.4	Y131 H330 L331 I337 R338	Y131-A334 HydrophobicContact CD1-CB 4.29Å; Y131-A334 HydrophobicContact CE1-CB 3.76Å; H330-A334 WeakPolarHBondContact O-CB 3.46Å; H330-A334 PolarHBondContact O-N 3.38Å; L331-A334 PolarHBondContact O-N 2.83Å; A334-I337 PolarHBondContact O-N 2.63Å; A334-R338 WeakPolarHBondContact O-CB 3.47Å; A334-R338 PolarHBondContact O-N 3.44Å
335	K	88.4	Confident	88.3	Confident	124 Å²	124	76 Å²	76	54%	0.539	35%	0.347	S	S	.	.	H	α-helix	trans	-59.9	-47.6	174.6	-179.4	-179.4	176.7	-178.3	0	111.2	L331 E332 R333 I337 R338 D339	L331-K335 WeakPolarHBondContact O-CB 3.3Å; L331-K335 PolarHBondContact O-N 2.88Å; E332-K335 PolarHBondContact O-N 2.69Å; R333-K335 PolarHBondContact O-N 3.16Å; K335-I337 VanDerWaalsContact C-N 3.35Å; K335-I337 PolarHBondContact O-N 3.11Å; K335-R338 WeakPolarHBondContact O-CB 3.43Å; K335-R338 PolarHBondContact O-N 3.17Å; K335-D339 PolarHBondContact O-N 3.05Å
336	R	91.4	Very high	88.4	Confident	74 Å²	74	79.3 Å²	79.3	28%	0.279	36%	0.359	S	S	.	.	H	α-helix	trans	-64.1	-38.2	179.6	-75.4	-175.9	-171.3	-175.2	7.1	112.6	N322 V323 I324 L328 E332 R333 D339 F340	N322-R336 WeakPolarHBondContact ND2-CA 3.3Å; N322-R336 VanDerWaalsContact ND2-CB 3.33Å; N322-R336 WeakPolarHBondContact ND2-CB 3.38Å; N322-R336 PolarHBondContact ND2-O 2.96Å; N322-R336 VanDerWaalsContact OD1-CD 3.28Å; N322-R336 WeakPolarHBondContact OD1-CD 3.46Å; N322-R336 WeakPolarHBondContact OD1-CG 2.99Å; V323-R336 VanDerWaalsContact O-CD 3.25Å; V323-R336 WeakPolarHBondContact O-CD 3.43Å; V323-R336 PolarHBondContact O-NH1 2.8Å; I324-R336 HydrophobicContact CD1-CB 3.96Å; I324-R336 HydrophobicContact CG1-CB 3.93Å; L328-R336 VanDerWaalsContact CD2-NH1 3.27Å; E332-R336 WeakPolarHBondContact O-CB 3.42Å; E332-R336 VanDerWaalsContact O-CG 3.29Å; E332-R336 WeakPolarHBondContact O-CG 3.29Å; E332-R336 PolarHBondContact O-N 3.21Å; R333-R336 PolarHBondContact O-N 3.42Å; R336-D339 PolarHBondContact O-N 3.31Å; R336-F340 WeakPolarHBondContact O-CB 3.25Å; R336-F340 PolarHBondContact O-N 3.17Å
337	I	88.4	Confident	88.9	Confident	14 Å²	14	76.9 Å²	76.9	7%	0.072	34%	0.338	C	S	.	.	H	α-helix	trans	-65.6	-41.7	173.8	-68.7	163.6	0	0	0	110.7	E132 I324 R333 A334 K335 F340 R341 I358 I360	E132-I337 HydrophobicContact CB-CD1 4.14Å; E132-I337 HydrophobicContact CG-CD1 3.44Å; E132-I337 VanDerWaalsContact CG-CD1 3.44Å; I324-I337 HydrophobicContact CD1-CD1 4.16Å; I324-I337 HydrophobicContact CD1-CG1 3.43Å; I324-I337 VanDerWaalsContact CD1-CG1 3.43Å; R333-I337 HydrophobicContact CG-CD1 3.89Å; R333-I337 VanDerWaalsContact O-CG1 3.3Å; R333-I337 WeakPolarHBondContact O-CG1 3.5Å; R333-I337 PolarHBondContact O-N 2.92Å; A334-I337 PolarHBondContact O-N 2.63Å; K335-I337 VanDerWaalsContact C-N 3.35Å; K335-I337 PolarHBondContact O-N 3.11Å; I337-F340 PolarHBondContact O-N 3.41Å; I337-R341 WeakPolarHBondContact O-CB 3.38Å; I337-R341 PolarHBondContact O-N 3.45Å; I337-I358 HydrophobicContact CD1-CD1 3.88Å; I337-I358 HydrophobicContact CD1-CG1 3.77Å; I337-I358 HydrophobicContact CG1-CD1 3.91Å; I337-I358 HydrophobicContact CG1-CG1 4.12Å; I337-I360 HydrophobicContact CG2-CD1 4.14Å
338	R	88.4	Confident	89.4	Confident	145 Å²	145	70.9 Å²	70.9	55%	0.547	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-48	175.9	-170	-166.1	-56.8	165.9	1.7	111.5	A334 K335 F340 R341 H342	A334-R338 WeakPolarHBondContact O-CB 3.47Å; A334-R338 PolarHBondContact O-N 3.44Å; K335-R338 WeakPolarHBondContact O-CB 3.43Å; K335-R338 PolarHBondContact O-N 3.17Å; R338-F340 VanDerWaalsContact C-N 3.29Å; R338-F340 PolarHBondContact O-N 3.34Å; R338-R341 WeakPolarHBondContact O-CB 3.4Å; R338-R341 PolarHBondContact O-N 3.34Å; R338-R341 VanDerWaalsContact O-N 3.17Å; R338-H342 PolarHBondContact O-CD2 3.08Å; R338-H342 PolarHBondContact O-N 3.15Å
339	D	93.5	Very high	89.9	Confident	17 Å²	17	69.5 Å²	69.5	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-61.2	-39.8	177.2	-72.2	-33.2	0	0	0	111.4	K335 R336 H342 K343 R344 Y345	K335-D339 PolarHBondContact O-N 3.05Å; R336-D339 PolarHBondContact O-N 3.31Å; D339-H342 PolarHBondContact O-N 2.98Å; D339-K343 PolarHBondContact O-N 3.49Å; D339-R344 HydrophobicContact CB-CB 4.31Å; D339-R344 VanDerWaalsContact O-CB 3.32Å; D339-R344 WeakPolarHBondContact O-CB 3.38Å; D339-R344 PolarHBondContact O-N 2.83Å; D339-R344 VanDerWaalsContact OD1-CD 3.28Å; D339-R344 WeakPolarHBondContact OD1-CD 3.33Å; D339-R344 IonicContact OD1-CZ 2.86Å; D339-R344 IonicContact OD1-NE 3.88Å; D339-R344 IonicContact OD1-NH1 3.77Å; D339-R344 PolarHBondContact OD1-NH1 2.57Å; D339-Y345 HydrophobicContact CB-CD2 4Å; D339-Y345 HydrophobicContact CB-CE2 3.87Å
340	F	92.3	Very high	90.3	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.9	-47.3	172.7	-172.2	-119.2	0	0	0	111.1	Q296 R336 I337 R338 H342 K343 Y345 L348 I360 V362	Q296-F340 HydrophobicContact CB-CE2 4.04Å; Q296-F340 HydrophobicContact CB-CZ 3.85Å; Q296-F340 HydrophobicContact CG-CE2 4.39Å; Q296-F340 VanDerWaalsContact NE2-CD2 3.31Å; Q296-F340 VanDerWaalsContact NE2-CE2 3.33Å; Q296-F340 PolarHBondContact NE2-O 3.3Å; R336-F340 WeakPolarHBondContact O-CB 3.25Å; R336-F340 PolarHBondContact O-N 3.17Å; I337-F340 PolarHBondContact O-N 3.41Å; R338-F340 VanDerWaalsContact C-N 3.29Å; R338-F340 PolarHBondContact O-N 3.34Å; F340-H342 PolarHBondContact O-N 2.96Å; F340-K343 PolarHBondContact O-N 3.33Å; F340-Y345 WeakPolarHBondContact CD2-O 3.29Å; F340-L348 HydrophobicContact CD1-CB 4Å; F340-L348 HydrophobicContact CD1-CD2 3.78Å; F340-L348 HydrophobicContact CD2-CB 3.84Å; F340-L348 HydrophobicContact CE1-CB 3.81Å; F340-L348 HydrophobicContact CE1-CD2 3.99Å; F340-L348 HydrophobicContact CE2-CB 3.62Å; F340-L348 HydrophobicContact CG-CB 4.03Å; F340-L348 HydrophobicContact CG-CD2 4.28Å; F340-L348 HydrophobicContact CZ-CB 3.61Å; F340-I360 HydrophobicContact CD1-CD1 3.58Å; F340-I360 HydrophobicContact CD1-CG2 4.44Å; F340-I360 HydrophobicContact CE1-CD1 4.25Å; F340-I360 HydrophobicContact CE1-CG2 4.19Å; F340-V362 HydrophobicContact CE1-CG1 3.8Å; F340-V362 HydrophobicContact CZ-CG1 3.81Å
341	R	88.8	Confident	90.8	Very high	127 Å²	127	62.3 Å²	62.3	48%	0.479	27%	0.265	S	S	.	.	H	α-helix	trans	-57.1	-35.8	176.3	-176	176.5	-76.8	173.4	-5.3	113.1	I337 R338 K343 D359 I360	I337-R341 WeakPolarHBondContact O-CB 3.38Å; I337-R341 PolarHBondContact O-N 3.45Å; R338-R341 WeakPolarHBondContact O-CB 3.4Å; R338-R341 PolarHBondContact O-N 3.34Å; R338-R341 VanDerWaalsContact O-N 3.17Å; R341-K343 PolarHBondContact O-N 2.9Å; R341-D359 PolarHBondContact NH2-O 3.46Å; R341-I360 HydrophobicContact CB-CD1 3.84Å; R341-I360 HydrophobicContact CB-CG1 4.42Å
342	H	91.1	Very high	90.9	Very high	120 Å²	120	60.1 Å²	60.1	56%	0.556	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	16.7	175.8	-65.1	-58.1	0	0	0	114.1	R338 D339 F340 R344	R338-H342 PolarHBondContact O-CD2 3.08Å; R338-H342 PolarHBondContact O-N 3.15Å; D339-H342 PolarHBondContact O-N 2.98Å; F340-H342 PolarHBondContact O-N 2.96Å; H342-R344 HydrophobicContact CB-CG 4.47Å; H342-R344 PolarHBondContact O-N 3.14Å; H342-R344 VanDerWaalsContact O-N 3.08Å
343	K	92.1	Very high	90.2	Very high	165 Å²	165	61.5 Å²	61.5	72%	0.717	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	22.2	177.3	-55.8	179.7	-180	178.1	0	114.2	D339 F340 R341 Y345	D339-K343 PolarHBondContact O-N 3.49Å; F340-K343 PolarHBondContact O-N 3.33Å; R341-K343 PolarHBondContact O-N 2.9Å; K343-Y345 PolarHBondContact O-N 2.85Å
344	R	94.1	Very high	89.4	Confident	159 Å²	159	60.9 Å²	60.9	60%	0.6	26%	0.26	S	S	*	.	S	Bend	trans	-68.5	-24.1	173.7	-64.5	-178.3	170.2	-172.1	-9.8	112.3	D339 H342	D339-R344 HydrophobicContact CB-CB 4.31Å; D339-R344 VanDerWaalsContact O-CB 3.32Å; D339-R344 WeakPolarHBondContact O-CB 3.38Å; D339-R344 PolarHBondContact O-N 2.83Å; D339-R344 VanDerWaalsContact OD1-CD 3.28Å; D339-R344 WeakPolarHBondContact OD1-CD 3.33Å; D339-R344 IonicContact OD1-CZ 2.86Å; D339-R344 IonicContact OD1-NE 3.88Å; D339-R344 IonicContact OD1-NH1 3.77Å; D339-R344 PolarHBondContact OD1-NH1 2.57Å; H342-R344 HydrophobicContact CB-CG 4.47Å; H342-R344 PolarHBondContact O-N 3.14Å; H342-R344 VanDerWaalsContact O-N 3.08Å
345	Y	95.1	Very high	88.8	Confident	77 Å²	77	60.2 Å²	60.2	30%	0.302	25%	0.254	S	S	.	.			trans	-126.2	136.4	174.6	-62.4	-85.2	0	0	0	109.5	Q296 L320 V321 N322 D339 F340 K343	Q296-Y345 PolarHBondContact NE2-O 2.96Å; L320-Y345 HydrophobicContact CB-CD1 4.45Å; V321-Y345 VanDerWaalsContact C-CD1 3.48Å; N322-Y345 HydrophobicContact CB-CD1 3.97Å; N322-Y345 HydrophobicContact CB-CD2 3.84Å; N322-Y345 HydrophobicContact CB-CE1 4.45Å; N322-Y345 HydrophobicContact CB-CE2 4.33Å; N322-Y345 HydrophobicContact CB-CG 3.64Å; D339-Y345 HydrophobicContact CB-CD2 4Å; D339-Y345 HydrophobicContact CB-CE2 3.87Å; F340-Y345 WeakPolarHBondContact CD2-O 3.29Å; K343-Y345 PolarHBondContact O-N 2.85Å
346	R	93.2	Very high	88.1	Confident	74 Å²	74	55.3 Å²	55.3	28%	0.279	23%	0.232	S	C	.	.	S	Bend	trans	-76.6	-37.9	175.5	-173.3	178.1	-174.5	176	6.3	111	C290 I293 G295 Q296 G297 L320	C290-R346 PolarHBondContact O-NE 3.15Å; C290-R346 PolarHBondContact O-NH1 3.41Å; C290-R346 VanDerWaalsContact O-NH1 3.16Å; C290-R346 PolarHBondContact O-NH2 3.33Å; I293-R346 PolarHBondContact O-NH2 2.68Å; G295-R346 WeakPolarHBondContact O-CG 3.16Å; G295-R346 PolarHBondContact O-NE 3.4Å; Q296-R346 CarbonylContact C-O 3.55Å; Q296-R346 VanDerWaalsContact CA-O 3.25Å; Q296-R346 WeakPolarHBondContact CA-O 3.42Å; G297-R346 PolarHBondContact N-O 3.07Å; L320-R346 PolarHBondContact O-N 2.69Å
347	L	95.5	Very high	86.8	Confident	2 Å²	2	52 Å²	52	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	138	-173.8	-58.1	178.1	0	0	0	111.3	C290 G297 I299 M314 H319 L320 V321 N322	C290-L347 HydrophobicContact CB-CD1 4.3Å; C290-L347 HydrophobicContact CB-CD2 4.29Å; C290-L347 VanDerWaalsContact SG-CD2 3.56Å; G297-L347 WeakPolarHBondContact O-CA 3.31Å; I299-L347 HydrophobicContact CD1-CD1 4.23Å; M314-L347 HydrophobicContact CE-CD1 3.25Å; H319-L347 HydrophobicContact CB-CD1 4.03Å; L320-L347 PolarHBondContact O-N 3.28Å; V321-L347 HydrophobicContact CG2-CB 4.15Å; V321-L347 HydrophobicContact CG2-CD1 4.12Å; N322-L347 PolarHBondContact N-O 2.95Å
348	L	95.3	Very high	86.2	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	111.9	168.6	175.6	60.9	0	0	0	109.7	G297 M298 I299 N322 I324 F340 I358	G297-L348 PolarHBondContact O-N 2.91Å; M298-L348 CarbonylContact C-O 3.59Å; M298-L348 VanDerWaalsContact CA-O 3.32Å; M298-L348 WeakPolarHBondContact CA-O 3.45Å; M298-L348 HydrophobicContact CE-CD2 3.59Å; M298-L348 HydrophobicContact CE-CG 4.23Å; I299-L348 PolarHBondContact N-O 2.98Å; N322-L348 HydrophobicContact CB-CD1 4.13Å; I324-L348 HydrophobicContact CB-CD1 4.07Å; I324-L348 HydrophobicContact CD1-CD1 3.63Å; I324-L348 HydrophobicContact CD1-CD2 4.13Å; I324-L348 HydrophobicContact CG1-CD1 3.67Å; F340-L348 HydrophobicContact CD1-CB 4Å; F340-L348 HydrophobicContact CD1-CD2 3.78Å; F340-L348 HydrophobicContact CD2-CB 3.84Å; F340-L348 HydrophobicContact CE1-CB 3.81Å; F340-L348 HydrophobicContact CE1-CD2 3.99Å; F340-L348 HydrophobicContact CE2-CB 3.62Å; F340-L348 HydrophobicContact CG-CB 4.03Å; F340-L348 HydrophobicContact CG-CD2 4.28Å; F340-L348 HydrophobicContact CZ-CB 3.61Å; L348-I358 HydrophobicContact CD2-CD1 3.9Å
349	I	96.4	Very high	85.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.5	174.3	-56.6	175.9	0	0	0	108.9	I299 A307 L310 A311 V321 N322 V323 I324	I299-I349 HydrophobicContact CB-CG1 4.2Å; I299-I349 HydrophobicContact CD1-CG1 4.12Å; I299-I349 CarbonylContact O-C 3.55Å; I299-I349 WeakPolarHBondContact O-CA 3.48Å; A307-I349 HydrophobicContact CB-CG2 3.75Å; L310-I349 HydrophobicContact CB-CD1 4.18Å; L310-I349 HydrophobicContact CD2-CD1 4.04Å; L310-I349 HydrophobicContact CD2-CG2 4.41Å; L310-I349 HydrophobicContact CG-CD1 3.79Å; A311-I349 HydrophobicContact CB-CD1 3.81Å; V321-I349 HydrophobicContact CG1-CD1 3.5Å; V321-I349 VanDerWaalsContact CG1-CD1 3.5Å; V321-I349 HydrophobicContact CG1-CG1 3.83Å; N322-I349 PolarHBondContact O-N 3.01Å; V323-I349 CarbonylContact C-O 3.59Å; V323-I349 VanDerWaalsContact CA-O 3.31Å; V323-I349 WeakPolarHBondContact CA-O 3.15Å; V323-I349 HydrophobicContact CG2-CB 4.4Å; I324-I349 PolarHBondContact N-O 2.79Å
350	T	95	Very high	84.9	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	174.1	-176.5	-163.1	0	0	0	0	113.7	M298 I299 F300 C301 I324	M298-T350 HydrophobicContact CE-CG2 3.48Å; M298-T350 VanDerWaalsContact CE-CG2 3.48Å; M298-T350 HydrophobicContact CG-CG2 4.32Å; I299-T350 PolarHBondContact O-N 3.34Å; F300-T350 HydrophobicContact CD1-CG2 3.79Å; F300-T350 HydrophobicContact CE1-CG2 3.72Å; F300-T350 HydrophobicContact CZ-CG2 4.35Å; C301-T350 PolarHBondContact N-O 2.96Å; I324-T350 VanDerWaalsContact O-CA 3.26Å; I324-T350 WeakPolarHBondContact O-CA 3.41Å; I324-T350 WeakPolarHBondContact O-CB 3.45Å; I324-T350 PolarHBondContact O-OG1 3.3Å
351	T	91.3	Very high	84.4	Confident	12 Å²	12	50.3 Å²	50.3	7%	0.074	23%	0.227	C	C	.	.			trans	-110	165.4	168.8	64.2	0	0	0	0	110.5	T325 M353 C354 S355	T325-T351 HydrophobicContact CG2-CG2 4.42Å; T351-M353 PolarHBondContact O-N 3.24Å; T351-C354 PolarHBondContact O-N 3.18Å; T351-S355 PolarHBondContact O-N 3.2Å
352	N	81.3	Confident	84.4	Confident	30 Å²	30	44.7 Å²	44.7	16%	0.16	21%	0.207	C	C	.	.	H	α-helix	trans	-48.1	-54.3	-178.1	-80.9	-11.6	0	0	0	113.5	C354 S355 S381 R385	N352-C354 VanDerWaalsContact C-N 3.25Å; N352-C354 PolarHBondContact O-N 3.18Å; N352-S355 PolarHBondContact O-N 3.01Å; N352-S355 PolarHBondContact O-OG 2.87Å; N352-S381 PolarHBondContact ND2-OG 2.86Å; N352-R385 VanDerWaalsContact CG-NH2 3.34Å; N352-R385 PolarHBondContact ND2-NH2 2.9Å; N352-R385 PolarHBondContact OD1-NE 3.23Å; N352-R385 PolarHBondContact OD1-NH2 3.24Å
353	M	72.2	Confident	84.4	Confident	113 Å²	113	39.7 Å²	39.7	56%	0.557	18%	0.184	S	C	*	.	H	α-helix	trans	-59.3	-38.2	-174.4	-69.8	-176.9	59.9	0	0	112.6	L212 T351	L212-M353 HydrophobicContact CD2-CE 4.48Å; T351-M353 PolarHBondContact O-N 3.24Å
354	C	71.3	Confident	84.5	Confident	6 Å²	6	31.9 Å²	31.9	4%	0.041	15%	0.15	C	C	.	.	H	α-helix	trans	-92.6	-1.9	-171.3	-48.9	0	0	0	0	113.6	I324 A326 R333 T351 N352	I324-C354 HydrophobicContact CG2-CB 3.56Å; A326-C354 VanDerWaalsContact CA-SG 3.55Å; A326-C354 PolarHBondContact N-SG 2.82Å; R333-C354 PolarHBondContact NE-O 2.74Å; R333-C354 PolarHBondContact NH2-O 2.92Å; T351-C354 PolarHBondContact O-N 3.18Å; N352-C354 VanDerWaalsContact C-N 3.25Å; N352-C354 PolarHBondContact O-N 3.18Å
355	S	70	Confident	84.5	Confident	5 Å²	5	24.3 Å²	24.3	4%	0.035	12%	0.122	C	C	.	.	H	α-helix	trans	-90.2	-21.1	174.7	71.5	0	0	0	0	114.5	F300 T351 N352 G357 I358	F300-S355 WeakPolarHBondContact CE1-OG 3.47Å; T351-S355 PolarHBondContact O-N 3.2Å; N352-S355 PolarHBondContact O-N 3.01Å; N352-S355 PolarHBondContact O-OG 2.87Å; S355-G357 PolarHBondContact O-N 2.69Å; S355-I358 WeakPolarHBondContact O-CB 3.48Å; S355-I358 WeakPolarHBondContact O-CG1 3.44Å; S355-I358 PolarHBondContact O-N 2.82Å; S355-I358 VanDerWaalsContact O-N 3.12Å
356	R	72.7	Confident	84.6	Confident	22 Å²	22	20.6 Å²	20.6	8%	0.083	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	132.8	-179	-68.5	173.6	168.4	-178.4	-8.1	109	T130 I208 D211 R333	T130-R356 HydrophobicContact CG2-CB 4.26Å; I208-R356 HydrophobicContact CD1-CB 4Å; I208-R356 HydrophobicContact CD1-CG 3.62Å; I208-R356 HydrophobicContact CG1-CG 4.43Å; D211-R356 IonicContact OD2-NH2 2.79Å; D211-R356 PolarHBondContact OD2-NH2 3.42Å; R333-R356 PolarHBondContact NH2-O 2.87Å
357	G	65.4	Low	84.7	Confident	5 Å²	5	17.5 Å²	17.5	5%	0.052	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	-0.5	-175.8	0	0	0	0	0	116.3	Q136 S355 D359	Q136-G357 PolarHBondContact OE1-O 2.95Å; S355-G357 PolarHBondContact O-N 2.69Å; G357-D359 PolarHBondContact O-N 2.9Å
358	I	75.9	Confident	84.7	Confident	2 Å²	2	18.6 Å²	18.6	1%	0.01	10%	0.101	C	C	.	.			trans	-80.9	107.7	177.9	-60.8	-176.6	0	0	0	110.4	M298 I324 I337 L348 S355 I360 R388	M298-I358 HydrophobicContact CE-CB 4.27Å; M298-I358 HydrophobicContact CE-CD1 3.64Å; M298-I358 HydrophobicContact CE-CG1 4.48Å; M298-I358 HydrophobicContact CE-CG2 4.26Å; I324-I358 HydrophobicContact CD1-CD1 4.22Å; I337-I358 HydrophobicContact CD1-CD1 3.88Å; I337-I358 HydrophobicContact CD1-CG1 3.77Å; I337-I358 HydrophobicContact CG1-CD1 3.91Å; I337-I358 HydrophobicContact CG1-CG1 4.12Å; L348-I358 HydrophobicContact CD2-CD1 3.9Å; S355-I358 WeakPolarHBondContact O-CB 3.48Å; S355-I358 WeakPolarHBondContact O-CG1 3.44Å; S355-I358 PolarHBondContact O-N 2.82Å; S355-I358 VanDerWaalsContact O-N 3.12Å; I358-I360 HydrophobicContact CG2-CB 4.5Å; I358-I360 HydrophobicContact CG2-CD1 4.07Å; I358-I360 HydrophobicContact CG2-CG1 4.26Å; I358-R388 WeakPolarHBondContact O-CD 3.39Å; I358-R388 PolarHBondContact O-NH1 3Å
359	D	75.3	Confident	84.7	Confident	54 Å²	54	18.6 Å²	18.6	29%	0.289	10%	0.101	S	C	.	.			trans	-105.7	73.5	-173.6	-156.7	71.2	0	0	0	111.4	Q136 R341 G357 R391	Q136-D359 VanDerWaalsContact CD-CB 3.41Å; Q136-D359 VanDerWaalsContact NE2-CB 3.3Å; Q136-D359 PolarHBondContact NE2-OD1 2.94Å; Q136-D359 PolarHBondContact NE2-OD2 2.94Å; R341-D359 PolarHBondContact NH2-O 3.46Å; G357-D359 PolarHBondContact O-N 2.9Å; D359-R391 VanDerWaalsContact C-NH1 3.33Å; D359-R391 IonicContact OD1-CZ 3.14Å; D359-R391 IonicContact OD1-NH1 3.16Å; D359-R391 PolarHBondContact OD1-NH1 3.26Å; D359-R391 IonicContact OD1-NH2 3.75Å; D359-R391 PolarHBondContact OD1-NH2 3.32Å; D359-R391 IonicContact OD2-NH1 3.3Å; D359-R391 PolarHBondContact OD2-NH1 3.22Å; D359-R391 VanDerWaalsContact OD2-NH1 3.08Å
360	I	79.1	Confident	84.5	Confident	10 Å²	10	18.6 Å²	18.6	5%	0.051	10%	0.101	C	C	.	.			trans	-139.6	118.2	-178.1	-57.9	169.5	0	0	0	107.7	I337 F340 R341 I358 V362	I337-I360 HydrophobicContact CG2-CD1 4.14Å; F340-I360 HydrophobicContact CD1-CD1 3.58Å; F340-I360 HydrophobicContact CD1-CG2 4.44Å; F340-I360 HydrophobicContact CE1-CD1 4.25Å; F340-I360 HydrophobicContact CE1-CG2 4.19Å; R341-I360 HydrophobicContact CB-CD1 3.84Å; R341-I360 HydrophobicContact CB-CG1 4.42Å; I358-I360 HydrophobicContact CG2-CB 4.5Å; I358-I360 HydrophobicContact CG2-CD1 4.07Å; I358-I360 HydrophobicContact CG2-CG1 4.26Å; I360-V362 HydrophobicContact CG2-CG1 3.96Å; I360-V362 PolarHBondContact O-N 3.39Å
361	P	82.3	Confident	84.4	Confident	74 Å²	74	19.8 Å²	19.8	48%	0.481	11%	0.107	S	C	.	.			trans	-60.3	120.6	175.1	-22.3	33.3	0	0	0	111.5	R388	P361-R388 WeakPolarHBondContact CA-O 3.34Å
362	V	88.2	Confident	84.2	Confident	9 Å²	9	23.2 Å²	23.2	6%	0.055	12%	0.121	C	C	.	.			trans	-148.1	161	-175.4	-66.4	0	0	0	0	111.7	Q296 M298 F340 I360 V364 R388 G389 S396	Q296-V362 HydrophobicContact CB-CG1 3.94Å; Q296-V362 WeakPolarHBondContact O-CB 3.2Å; M298-V362 HydrophobicContact CB-CB 4.46Å; M298-V362 HydrophobicContact CB-CG2 3.68Å; F340-V362 HydrophobicContact CE1-CG1 3.8Å; F340-V362 HydrophobicContact CZ-CG1 3.81Å; I360-V362 HydrophobicContact CG2-CG1 3.96Å; I360-V362 PolarHBondContact O-N 3.39Å; V362-V364 HydrophobicContact CG2-CG2 4.35Å; V362-R388 HydrophobicContact CG2-CB 3.98Å; V362-R388 PolarHBondContact N-O 3.2Å; V362-G389 VanDerWaalsContact O-CA 3.29Å; V362-G389 WeakPolarHBondContact O-CA 3.32Å; V362-S396 PolarHBondContact O-OG 2.89Å
363	M	91.2	Very high	84.4	Confident	15 Å²	15	28.6 Å²	28.6	7%	0.074	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	140.8	159	176.7	-171.5	67.8	0	0	109.5	L289 I293 Q296 G297 M298 V365 I397	L289-M363 HydrophobicContact CD1-SD 4.4Å; L289-M363 HydrophobicContact CD2-CE 3.91Å; L289-M363 HydrophobicContact CD2-SD 3.66Å; L289-M363 HydrophobicContact CG-CE 4.16Å; L289-M363 HydrophobicContact CG-SD 3.79Å; I293-M363 HydrophobicContact CB-SD 3.9Å; I293-M363 HydrophobicContact CD1-SD 3.41Å; I293-M363 WeakPolarHBondContact CD1-SD 3.32Å; I293-M363 HydrophobicContact CG1-SD 4.23Å; I293-M363 HydrophobicContact CG2-SD 3.9Å; Q296-M363 PolarHBondContact O-N 3.07Å; Q296-M363 VanDerWaalsContact O-N 3.1Å; G297-M363 CarbonylContact C-O 3.52Å; G297-M363 WeakPolarHBondContact CA-O 3.13Å; M298-M363 PolarHBondContact N-O 3.47Å; M363-V365 HydrophobicContact CE-CG2 4Å; M363-I397 HydrophobicContact CG-CB 4.34Å
364	V	93	Very high	85.1	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.3	-178.6	176.9	0	0	0	0	110.6	F300 V362 R385 I386 R388 I397 A398 L399	F300-V364 HydrophobicContact CD2-CG1 3.93Å; F300-V364 HydrophobicContact CE2-CG1 3.84Å; V362-V364 HydrophobicContact CG2-CG2 4.35Å; V364-R385 HydrophobicContact CG1-CB 4.4Å; V364-R385 VanDerWaalsContact CG2-O 3.28Å; V364-R385 WeakPolarHBondContact CG2-O 3.44Å; V364-I386 HydrophobicContact CG1-CG2 4.48Å; V364-R388 HydrophobicContact CG2-CB 4.08Å; V364-I397 PolarHBondContact N-O 3.4Å; V364-A398 HydrophobicContact CB-CB 4.35Å; V364-A398 CarbonylContact O-C 3.57Å; V364-A398 WeakPolarHBondContact O-CA 3.4Å; V364-L399 PolarHBondContact O-N 3.47Å
365	V	95.5	Very high	85.8	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	112.1	171.8	-177.1	0	0	0	0	108.9	L289 M298 I299 F300 M363 Y367 L399 F401	L289-V365 HydrophobicContact CD2-CG2 3.55Å; M298-V365 PolarHBondContact O-N 2.88Å; I299-V365 CarbonylContact C-O 3.59Å; I299-V365 WeakPolarHBondContact CA-O 3.38Å; I299-V365 HydrophobicContact CB-CB 4.43Å; I299-V365 HydrophobicContact CG1-CB 4.09Å; I299-V365 HydrophobicContact CG1-CG2 4.43Å; I299-V365 HydrophobicContact CG2-CB 4.22Å; I299-V365 HydrophobicContact CG2-CG1 4.26Å; F300-V365 PolarHBondContact N-O 3.36Å; M363-V365 HydrophobicContact CE-CG2 4Å; V365-Y367 PolarHBondContact O-N 2.92Å; V365-L399 CarbonylContact C-O 3.44Å; V365-L399 WeakPolarHBondContact CA-O 3.22Å; V365-F401 HydrophobicContact CG1-CD2 4.21Å; V365-F401 HydrophobicContact CG1-CE2 3.67Å; V365-F401 HydrophobicContact CG1-CZ 4.47Å
366	N	96.2	Very high	86.8	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	90.7	167.4	-67.8	-49.6	0	0	0	108.4	H368 R385 L399 T400 F401	N366-H368 PolarHBondContact O-N 3.44Å; N366-R385 WeakPolarHBondContact OD1-CD 2.89Å; N366-R385 PolarHBondContact OD1-NH1 2.86Å; N366-L399 PolarHBondContact N-O 3.49Å; N366-T400 HydrophobicContact CB-CG2 3.74Å; N366-T400 PolarHBondContact ND2-OG1 2.91Å; N366-F401 PolarHBondContact O-N 3.39Å
367	Y	96.8	Very high	87.7	Confident	8 Å²	8	30.3 Å²	30.3	3%	0.031	19%	0.191	C	C	.	.	S	Bend	trans	-62.6	-32.7	176.7	-162.3	-79.7	0	0	0	111.5	D279 K282 F283 I299 F300 L310 V365 F401	D279-Y367 PolarHBondContact O-OH 3.23Å; K282-Y367 HydrophobicContact CB-CD2 4.46Å; K282-Y367 HydrophobicContact CB-CE1 3.97Å; K282-Y367 HydrophobicContact CB-CE2 3.76Å; K282-Y367 HydrophobicContact CD-CD1 4.06Å; K282-Y367 HydrophobicContact CD-CE1 3.78Å; K282-Y367 PolarHBondContact NZ-O 2.92Å; F283-Y367 PolarHBondContact N-OH 3.15Å; I299-Y367 HydrophobicContact CG2-CD2 4.27Å; I299-Y367 HydrophobicContact CG2-CG 4.49Å; F300-Y367 WeakPolarHBondContact O-CB 3.42Å; F300-Y367 PolarHBondContact O-N 2.96Å; L310-Y367 HydrophobicContact CD1-CD2 4.31Å; L310-Y367 HydrophobicContact CD1-CE2 3.68Å; L310-Y367 HydrophobicContact CD2-CD2 3.59Å; L310-Y367 HydrophobicContact CD2-CE2 3.8Å; L310-Y367 HydrophobicContact CD2-CG 4.13Å; L310-Y367 HydrophobicContact CG-CE2 4.36Å; V365-Y367 PolarHBondContact O-N 2.92Å; Y367-F401 HydrophobicContact CD2-CD2 4.37Å
368	H	94.9	Very high	88.8	Confident	26 Å²	26	30.7 Å²	30.7	12%	0.12	19%	0.192	C	C	.	.	S	Bend	trans	-124.5	142.1	167.9	-60.3	83.8	0	0	0	109.9	F300 M302 S306 N366 R385	F300-H368 PolarHBondContact O-N 3.44Å; M302-H368 HydrophobicContact CB-CB 3.96Å; M302-H368 PolarHBondContact N-ND1 2.95Å; S306-H368 PolarHBondContact OG-CE1 3.05Å; N366-H368 PolarHBondContact O-N 3.44Å; H368-R385 PolarHBondContact O-NH1 3.5Å
369	V	94.6	Very high	89.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.205	C	C	.	.			trans	-60.4	134.1	171.5	-176.8	0	0	0	0	109.1	M302 L371 T400 F401 V402 E407 A410 I414	M302-V369 WeakPolarHBondContact CE-O 3.36Å; V369-L371 HydrophobicContact CG1-CD2 4.05Å; V369-L371 HydrophobicContact CG1-CG 4.45Å; V369-L371 PolarHBondContact O-N 3.25Å; V369-L371 VanDerWaalsContact O-N 3.14Å; V369-T400 HydrophobicContact CG2-CG2 3.81Å; V369-F401 WeakPolarHBondContact CG2-O 3.32Å; V369-V402 HydrophobicContact CG2-CG2 4.04Å; V369-E407 HydrophobicContact CB-CB 4.31Å; V369-E407 HydrophobicContact CB-CG 4.06Å; V369-E407 HydrophobicContact CG2-CB 3.74Å; V369-E407 HydrophobicContact CG2-CG 3.89Å; V369-A410 HydrophobicContact CG1-CB 3.96Å; V369-I414 HydrophobicContact CG1-CD1 4.38Å
370	P	92.4	Very high	89.7	Confident	0 Å²	0	32 Å²	32	0%	0	20%	0.197	C	C	.	.			trans	-67.9	113.1	175.5	26.4	-31.7	0	0	0	110.1	D378 Y382 I414	P370-D378 HydrophobicContact CB-CB 4.25Å; P370-D378 PolarHBondContact O-N 3Å; P370-Y382 HydrophobicContact CG-CD2 3.86Å; P370-Y382 HydrophobicContact CG-CG 4.28Å; P370-I414 HydrophobicContact CG-CD1 4.46Å
371	L	92.2	Very high	90	Very high	24 Å²	24	31.8 Å²	31.8	13%	0.126	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-126.1	147	178.5	-57.7	177.9	0	0	0	109.7	M302 V369 S376 E407 A410	M302-L371 HydrophobicContact CE-CB 4.01Å; M302-L371 HydrophobicContact CE-CG 4.4Å; V369-L371 HydrophobicContact CG1-CD2 4.05Å; V369-L371 HydrophobicContact CG1-CG 4.45Å; V369-L371 PolarHBondContact O-N 3.25Å; V369-L371 VanDerWaalsContact O-N 3.14Å; L371-S376 CarbonylContact C-O 3.56Å; L371-S376 WeakPolarHBondContact CA-O 3.42Å; L371-E407 HydrophobicContact CD1-CG 4.35Å; L371-A410 HydrophobicContact CD2-CB 3.49Å; L371-A410 VanDerWaalsContact CD2-CB 3.49Å
372	F	88.4	Confident	90.4	Very high	85 Å²	85	28.2 Å²	28.2	37%	0.373	17%	0.173	S	C	.	.			trans	-68.3	162.5	164	-69.7	-66.8	0	0	0	110.7	A374 G375 S376 P377 D378	F372-A374 PolarHBondContact O-N 2.93Å; F372-A374 VanDerWaalsContact O-N 3.09Å; F372-G375 WeakPolarHBondContact O-CA 3.37Å; F372-G375 PolarHBondContact O-N 3.46Å; F372-S376 WeakPolarHBondContact CD2-OG 3.36Å; F372-S376 PolarHBondContact N-O 2.83Å; F372-P377 WeakPolarHBondContact CD2-O 3.45Å; F372-P377 VanDerWaalsContact CE2-O 3.29Å; F372-P377 WeakPolarHBondContact CE2-O 3.28Å; F372-D378 HydrophobicContact CD1-CB 4.4Å; F372-D378 HydrophobicContact CD2-CB 4.1Å; F372-D378 HydrophobicContact CE1-CB 4.2Å; F372-D378 HydrophobicContact CE2-CB 3.92Å; F372-D378 HydrophobicContact CG-CB 4.35Å; F372-D378 HydrophobicContact CZ-CB 3.96Å
373	P	84.6	Confident	90.2	Very high	143 Å²	143	28.3 Å²	28.3	93%	0.929	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-30.6	175.5	-28.1	35.9	0	0	0	114.2	G375	P373-G375 PolarHBondContact O-N 3.47Å
374	A	87.2	Confident	89.7	Confident	91 Å²	91	28 Å²	28	75%	0.752	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-4.9	175.2	0	0	0	0	0	114	F372 S376	F372-A374 PolarHBondContact O-N 2.93Å; F372-A374 VanDerWaalsContact O-N 3.09Å; A374-S376 VanDerWaalsContact C-N 3.35Å
375	G	86.5	Confident	89.5	Confident	14 Å²	14	28 Å²	28	14%	0.144	17%	0.172	C	C	.	.	S	Bend	trans	84.3	1.8	-178.5	0	0	0	0	0	115	F372 P373	F372-G375 WeakPolarHBondContact O-CA 3.37Å; F372-G375 PolarHBondContact O-N 3.46Å; P373-G375 PolarHBondContact O-N 3.47Å
376	S	90.9	Very high	89.2	Confident	54 Å²	54	28 Å²	28	38%	0.378	17%	0.172	S	C	.	.			trans	-74.4	153.9	172.6	52.4	0	0	0	0	111.4	L371 F372 A374 D378	L371-S376 CarbonylContact C-O 3.56Å; L371-S376 WeakPolarHBondContact CA-O 3.42Å; F372-S376 WeakPolarHBondContact CD2-OG 3.36Å; F372-S376 PolarHBondContact N-O 2.83Å; A374-S376 VanDerWaalsContact C-N 3.35Å; S376-D378 PolarHBondContact O-N 3.24Å
377	P	91	Very high	88.5	Confident	23 Å²	23	28.1 Å²	28.1	15%	0.149	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-66.5	133.5	-177.8	-17.4	31.7	0	0	0	111.9	F372 F379 A410 I414	F372-P377 WeakPolarHBondContact CD2-O 3.45Å; F372-P377 VanDerWaalsContact CE2-O 3.29Å; F372-P377 WeakPolarHBondContact CE2-O 3.28Å; P377-F379 HydrophobicContact CB-CD1 4.46Å; P377-F379 HydrophobicContact CB-CE1 3.99Å; P377-F379 HydrophobicContact CB-CE2 4.31Å; P377-F379 HydrophobicContact CB-CZ 3.91Å; P377-F379 HydrophobicContact CG-CZ 4.2Å; P377-F379 PolarHBondContact O-N 3.39Å; P377-A410 HydrophobicContact CB-CB 4.09Å; P377-A410 HydrophobicContact CG-CB 3.8Å; P377-I414 HydrophobicContact CB-CG1 4.28Å
378	D	89.2	Confident	87.6	Confident	13 Å²	13	28 Å²	28	7%	0.07	17%	0.172	C	C	.	.			trans	-95.4	86.2	171.9	-177.4	-5.7	0	0	0	109.9	P370 F372 S376 S380 S381 Y382	P370-D378 HydrophobicContact CB-CB 4.25Å; P370-D378 PolarHBondContact O-N 3Å; F372-D378 HydrophobicContact CD1-CB 4.4Å; F372-D378 HydrophobicContact CD2-CB 4.1Å; F372-D378 HydrophobicContact CE1-CB 4.2Å; F372-D378 HydrophobicContact CE2-CB 3.92Å; F372-D378 HydrophobicContact CG-CB 4.35Å; F372-D378 HydrophobicContact CZ-CB 3.96Å; S376-D378 PolarHBondContact O-N 3.24Å; D378-S380 VanDerWaalsContact C-N 3.29Å; D378-S380 PolarHBondContact O-N 3.18Å; D378-S380 PolarHBondContact OD1-N 3.03Å; D378-S381 VanDerWaalsContact CG-OG 3.24Å; D378-S381 PolarHBondContact O-N 2.91Å; D378-S381 PolarHBondContact OD1-N 2.98Å; D378-S381 WeakPolarHBondContact OD2-CB 3.36Å; D378-S381 PolarHBondContact OD2-OG 3.16Å; D378-Y382 PolarHBondContact O-N 2.65Å
379	F	87	Confident	86.6	Confident	67 Å²	67	26.9 Å²	26.9	29%	0.294	17%	0.168	S	C	.	.	H	α-helix	trans	-60.1	-37.3	-179	-57.4	-72	0	0	0	113	P377 Y382 I383 I414 R417 F418	P377-F379 HydrophobicContact CB-CD1 4.46Å; P377-F379 HydrophobicContact CB-CE1 3.99Å; P377-F379 HydrophobicContact CB-CE2 4.31Å; P377-F379 HydrophobicContact CB-CZ 3.91Å; P377-F379 HydrophobicContact CG-CZ 4.2Å; P377-F379 PolarHBondContact O-N 3.39Å; F379-Y382 PolarHBondContact O-N 3.44Å; F379-I383 PolarHBondContact O-N 3.23Å; F379-I414 HydrophobicContact CD1-CB 4.4Å; F379-I414 HydrophobicContact CD1-CG1 3.77Å; F379-I414 HydrophobicContact CE1-CG1 3.99Å; F379-R417 HydrophobicContact CD1-CB 3.88Å; F379-R417 HydrophobicContact CD1-CG 3.97Å; F379-R417 HydrophobicContact CE1-CB 3.85Å; F379-R417 HydrophobicContact CE1-CG 4.29Å; F379-R417 HydrophobicContact CG-CG 4.28Å; F379-F418 HydrophobicContact CB-CE2 4.09Å; F379-F418 HydrophobicContact CB-CZ 3.87Å; F379-F418 HydrophobicContact CD1-CE2 4.23Å
380	S	82	Confident	85.3	Confident	15 Å²	15	27.1 Å²	27.1	11%	0.105	17%	0.17	C	C	.	.	H	α-helix	trans	-67.7	-52.2	-178.3	-179	0	0	0	0	109.6	D207 T238 D378 Y382 I383 H384	D207-S380 PolarHBondContact OD2-OG 2.99Å; T238-S380 PolarHBondContact OG1-OG 3.38Å; T238-S380 VanDerWaalsContact OG1-OG 3.11Å; D378-S380 VanDerWaalsContact C-N 3.29Å; D378-S380 PolarHBondContact O-N 3.18Å; D378-S380 PolarHBondContact OD1-N 3.03Å; S380-Y382 VanDerWaalsContact C-N 3.26Å; S380-Y382 PolarHBondContact O-N 2.79Å; S380-I383 PolarHBondContact O-N 3.31Å; S380-H384 WeakPolarHBondContact O-CB 3.41Å; S380-H384 PolarHBondContact O-CD2 3.22Å; S380-H384 PolarHBondContact O-N 3.49Å; S380-H384 PolarHBondContact OG-CD2 3.04Å; S380-H384 VanDerWaalsContact OG-CD2 3.31Å
381	S	86.7	Confident	84.1	Confident	6 Å²	6	27.6 Å²	27.6	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-56.1	-42.4	175.2	-72	0	0	0	0	111.7	N352 D378 I383 H384 R385	N352-S381 PolarHBondContact ND2-OG 2.86Å; D378-S381 VanDerWaalsContact CG-OG 3.24Å; D378-S381 PolarHBondContact O-N 2.91Å; D378-S381 PolarHBondContact OD1-N 2.98Å; D378-S381 WeakPolarHBondContact OD2-CB 3.36Å; D378-S381 PolarHBondContact OD2-OG 3.16Å; S381-I383 PolarHBondContact O-N 2.8Å; S381-H384 PolarHBondContact O-N 3.24Å; S381-R385 WeakPolarHBondContact O-CB 3.38Å; S381-R385 WeakPolarHBondContact O-CG 3.33Å; S381-R385 PolarHBondContact O-N 3.49Å
382	Y	89.6	Confident	82.8	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-55.2	-53.7	178.4	-174.2	-96.1	0	0	0	112.8	Q271 P370 D378 F379 S380 H384 R385 I386 I411 I414 F418 P422	Q271-Y382 PolarHBondContact OE1-OH 2.86Å; P370-Y382 HydrophobicContact CG-CD2 3.86Å; P370-Y382 HydrophobicContact CG-CG 4.28Å; D378-Y382 PolarHBondContact O-N 2.65Å; F379-Y382 PolarHBondContact O-N 3.44Å; S380-Y382 VanDerWaalsContact C-N 3.26Å; S380-Y382 PolarHBondContact O-N 2.79Å; Y382-H384 VanDerWaalsContact C-N 3.33Å; Y382-H384 PolarHBondContact O-N 2.94Å; Y382-R385 PolarHBondContact O-N 3.4Å; Y382-I386 HydrophobicContact CD1-CD1 4.22Å; Y382-I386 HydrophobicContact CE1-CD1 3.73Å; Y382-I386 HydrophobicContact CE1-CG1 4.41Å; Y382-I386 HydrophobicContact CE1-CG2 4.11Å; Y382-I386 HydrophobicContact CE2-CG2 4.26Å; Y382-I386 PolarHBondContact O-N 3.02Å; Y382-I411 HydrophobicContact CE2-CD1 3.82Å; Y382-I414 HydrophobicContact CD1-CG2 3.3Å; Y382-I414 HydrophobicContact CD2-CD1 3.83Å; Y382-I414 HydrophobicContact CD2-CG2 4.12Å; Y382-I414 HydrophobicContact CE1-CG2 3.4Å; Y382-I414 HydrophobicContact CE2-CD1 4.45Å; Y382-I414 HydrophobicContact CE2-CG2 4.21Å; Y382-I414 HydrophobicContact CG-CD1 3.95Å; Y382-I414 HydrophobicContact CG-CG1 4.48Å; Y382-I414 HydrophobicContact CG-CG2 3.67Å; Y382-F418 HydrophobicContact CD1-CE2 4.47Å; Y382-P422 VanDerWaalsContact OH-CG 3.28Å; Y382-P422 WeakPolarHBondContact OH-CG 3.34Å
383	I	84.7	Confident	81.7	Confident	11 Å²	11	28 Å²	28	6%	0.056	18%	0.176	C	C	.	.	H	α-helix	trans	-62	-41.4	179.2	-71.4	-62.5	0	0	0	111.8	T237 F379 S380 S381 R385 I386 G387 F418	T237-I383 HydrophobicContact CG2-CG2 3.92Å; F379-I383 PolarHBondContact O-N 3.23Å; S380-I383 PolarHBondContact O-N 3.31Å; S381-I383 PolarHBondContact O-N 2.8Å; I383-R385 VanDerWaalsContact C-N 3.3Å; I383-R385 PolarHBondContact O-N 3.09Å; I383-I386 HydrophobicContact CD1-CD1 4.14Å; I383-I386 PolarHBondContact O-N 2.92Å; I383-G387 PolarHBondContact O-N 3.36Å; I383-F418 HydrophobicContact CB-CZ 4.39Å; I383-F418 HydrophobicContact CD1-CD1 3.85Å; I383-F418 HydrophobicContact CD1-CD2 3.8Å; I383-F418 HydrophobicContact CD1-CE1 3.84Å; I383-F418 HydrophobicContact CD1-CE2 3.79Å; I383-F418 HydrophobicContact CD1-CG 3.84Å; I383-F418 HydrophobicContact CD1-CZ 3.81Å; I383-F418 HydrophobicContact CG1-CD1 3.97Å; I383-F418 HydrophobicContact CG1-CD2 4.03Å; I383-F418 HydrophobicContact CG1-CE1 3.41Å; I383-F418 VanDerWaalsContact CG1-CE1 3.41Å; I383-F418 HydrophobicContact CG1-CE2 3.47Å; I383-F418 VanDerWaalsContact CG1-CE2 3.47Å; I383-F418 HydrophobicContact CG1-CG 4.27Å; I383-F418 HydrophobicContact CG1-CZ 3.12Å
384	H	81.1	Confident	81.1	Confident	8 Å²	8	24.1 Å²	24.1	4%	0.037	15%	0.147	C	C	.	.	H	α-helix	trans	-63.1	-35.6	177.2	-84.2	-69.3	0	0	0	113.5	E205 D207 T237 S380 S381 Y382 R388	E205-H384 IonicContact OE1-CE1 2.73Å; E205-H384 IonicContact OE2-CE1 3.39Å; E205-H384 PolarHBondContact OE2-CE1 2.89Å; E205-H384 VanDerWaalsContact OE2-CE1 3.26Å; D207-H384 IonicContact OD2-CD2 3.55Å; D207-H384 IonicContact OD2-CE1 2.82Å; D207-H384 IonicContact OD2-NE2 2.74Å; D207-H384 PolarHBondContact OD2-NE2 3.18Å; T237-H384 WeakPolarHBondContact CB-CE1 3.33Å; T237-H384 PolarHBondContact OG1-CE1 3.15Å; S380-H384 WeakPolarHBondContact O-CB 3.41Å; S380-H384 PolarHBondContact O-CD2 3.22Å; S380-H384 PolarHBondContact O-N 3.49Å; S380-H384 PolarHBondContact OG-CD2 3.04Å; S380-H384 VanDerWaalsContact OG-CD2 3.31Å; S381-H384 PolarHBondContact O-N 3.24Å; Y382-H384 VanDerWaalsContact C-N 3.33Å; Y382-H384 PolarHBondContact O-N 2.94Å; H384-R388 PolarHBondContact O-NE 2.87Å; H384-R388 VanDerWaalsContact O-NE 3.07Å
385	R	89	Confident	80.8	Confident	1 Å²	1	21.1 Å²	21.1	0%	0.004	12%	0.119	C	C	.	.	H	α-helix	trans	-69.9	-53.6	176.4	-71.5	-176	-173.1	-176.4	0.2	110.5	F300 N352 V364 N366 H368 S381 Y382 I383 G387 R388	F300-R385 HydrophobicContact CD1-CG 3.65Å; F300-R385 HydrophobicContact CD2-CB 4.13Å; F300-R385 HydrophobicContact CD2-CG 4.01Å; F300-R385 HydrophobicContact CE1-CB 4.29Å; F300-R385 HydrophobicContact CE1-CG 3.53Å; F300-R385 HydrophobicContact CE2-CB 3.86Å; F300-R385 HydrophobicContact CE2-CG 3.95Å; F300-R385 HydrophobicContact CG-CB 4.48Å; F300-R385 HydrophobicContact CG-CG 3.87Å; F300-R385 HydrophobicContact CZ-CB 3.94Å; F300-R385 HydrophobicContact CZ-CG 3.7Å; N352-R385 VanDerWaalsContact CG-NH2 3.34Å; N352-R385 PolarHBondContact ND2-NH2 2.9Å; N352-R385 PolarHBondContact OD1-NE 3.23Å; N352-R385 PolarHBondContact OD1-NH2 3.24Å; V364-R385 HydrophobicContact CG1-CB 4.4Å; V364-R385 VanDerWaalsContact CG2-O 3.28Å; V364-R385 WeakPolarHBondContact CG2-O 3.44Å; N366-R385 WeakPolarHBondContact OD1-CD 2.89Å; N366-R385 PolarHBondContact OD1-NH1 2.86Å; H368-R385 PolarHBondContact O-NH1 3.5Å; S381-R385 WeakPolarHBondContact O-CB 3.38Å; S381-R385 WeakPolarHBondContact O-CG 3.33Å; S381-R385 PolarHBondContact O-N 3.49Å; Y382-R385 PolarHBondContact O-N 3.4Å; I383-R385 VanDerWaalsContact C-N 3.3Å; I383-R385 PolarHBondContact O-N 3.09Å; R385-G387 VanDerWaalsContact C-N 3.34Å; R385-G387 PolarHBondContact O-N 3.02Å; R385-R388 WeakPolarHBondContact O-CB 3.29Å; R385-R388 VanDerWaalsContact O-CG 3.22Å; R385-R388 WeakPolarHBondContact O-CG 3.39Å; R385-R388 PolarHBondContact O-N 2.9Å
386	I	87.6	Confident	80.8	Confident	0 Å²	0	21 Å²	21	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-68.8	-34.7	-175.2	68.9	166.2	0	0	0	111.5	L266 I269 Q271 V364 Y382 I383 R388 G389 A398	L266-I386 HydrophobicContact CD1-CD1 4.2Å; L266-I386 HydrophobicContact CD1-CG1 4.07Å; I269-I386 VanDerWaalsContact CD1-O 3.23Å; I269-I386 WeakPolarHBondContact CD1-O 2.95Å; I269-I386 HydrophobicContact CG2-CB 4.4Å; Q271-I386 VanDerWaalsContact CD-CD1 3.46Å; Q271-I386 HydrophobicContact CG-CD1 4.01Å; V364-I386 HydrophobicContact CG1-CG2 4.48Å; Y382-I386 HydrophobicContact CD1-CD1 4.22Å; Y382-I386 HydrophobicContact CE1-CD1 3.73Å; Y382-I386 HydrophobicContact CE1-CG1 4.41Å; Y382-I386 HydrophobicContact CE1-CG2 4.11Å; Y382-I386 HydrophobicContact CE2-CG2 4.26Å; Y382-I386 PolarHBondContact O-N 3.02Å; I383-I386 HydrophobicContact CD1-CD1 4.14Å; I383-I386 PolarHBondContact O-N 2.92Å; I386-R388 PolarHBondContact O-N 3.39Å; I386-G389 PolarHBondContact O-N 2.67Å; I386-A398 HydrophobicContact CB-CB 3.86Å; I386-A398 HydrophobicContact CG2-CB 3.5Å; I386-A398 VanDerWaalsContact CG2-CB 3.5Å
387	G	81.6	Confident	80.8	Confident	2 Å²	2	18.4 Å²	18.4	2%	0.021	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	5.2	176.6	0	0	0	0	0	115.7	I383 R385 G389 R391	I383-G387 PolarHBondContact O-N 3.36Å; R385-G387 VanDerWaalsContact C-N 3.34Å; R385-G387 PolarHBondContact O-N 3.02Å; G387-G389 VanDerWaalsContact C-N 3.33Å; G387-G389 CarbonylContact C-O 3.53Å; G387-R391 PolarHBondContact O-NE 2.88Å
388	R	79.3	Confident	80.8	Confident	4 Å²	4	17.3 Å²	17.3	2%	0.015	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-27.2	164	-55.3	-65.9	151.8	-168.9	-6.1	111.1	M298 I358 P361 V362 V364 H384 R385 I386	M298-R388 HydrophobicContact SD-CG 4.26Å; I358-R388 WeakPolarHBondContact O-CD 3.39Å; I358-R388 PolarHBondContact O-NH1 3Å; P361-R388 WeakPolarHBondContact CA-O 3.34Å; V362-R388 HydrophobicContact CG2-CB 3.98Å; V362-R388 PolarHBondContact N-O 3.2Å; V364-R388 HydrophobicContact CG2-CB 4.08Å; H384-R388 PolarHBondContact O-NE 2.87Å; H384-R388 VanDerWaalsContact O-NE 3.07Å; R385-R388 WeakPolarHBondContact O-CB 3.29Å; R385-R388 VanDerWaalsContact O-CG 3.22Å; R385-R388 WeakPolarHBondContact O-CG 3.39Å; R385-R388 PolarHBondContact O-N 2.9Å; I386-R388 PolarHBondContact O-N 3.39Å
389	G	74	Confident	81.1	Confident	3 Å²	3	16.7 Å²	16.7	3%	0.031	9%	0.087	C	C	.	.	S	Bend	trans	-87	-179.8	163.8	0	0	0	0	0	112.2	I269 V362 I386 G387 R391 S396	I269-G389 WeakPolarHBondContact CD1-O 3.22Å; V362-G389 VanDerWaalsContact O-CA 3.29Å; V362-G389 WeakPolarHBondContact O-CA 3.32Å; I386-G389 PolarHBondContact O-N 2.67Å; G387-G389 VanDerWaalsContact C-N 3.33Å; G387-G389 CarbonylContact C-O 3.53Å; G389-R391 PolarHBondContact O-N 2.89Å; G389-S396 WeakPolarHBondContact CA-OG 3.28Å
390	G	66.2	Low	81.5	Confident	5 Å²	5	13.5 Å²	13.5	5%	0.052	7%	0.073	C	C	.	.	S	Bend	trans	79.6	14.3	163.7	0	0	0	0	0	116.4	L394 S396	G390-L394 CarbonylContact C-O 3.51Å; G390-L394 VanDerWaalsContact C-O 3.26Å; G390-L394 WeakPolarHBondContact CA-O 3.38Å; G390-S396 VanDerWaalsContact N-CB 3.31Å
391	R	68.1	Low	82.3	Confident	10 Å²	10	12.8 Å²	12.8	4%	0.038	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-89.8	137.1	-163.7	-67.1	176.4	168.9	-156.6	-12.7	112.1	D359 G387 G389 G393 L394	D359-R391 VanDerWaalsContact C-NH1 3.33Å; D359-R391 IonicContact OD1-CZ 3.14Å; D359-R391 IonicContact OD1-NH1 3.16Å; D359-R391 PolarHBondContact OD1-NH1 3.26Å; D359-R391 IonicContact OD1-NH2 3.75Å; D359-R391 PolarHBondContact OD1-NH2 3.32Å; D359-R391 IonicContact OD2-NH1 3.3Å; D359-R391 PolarHBondContact OD2-NH1 3.22Å; D359-R391 VanDerWaalsContact OD2-NH1 3.08Å; G387-R391 PolarHBondContact O-NE 2.88Å; G389-R391 PolarHBondContact O-N 2.89Å; R391-G393 VanDerWaalsContact C-N 3.27Å; R391-G393 PolarHBondContact O-N 2.94Å; R391-L394 PolarHBondContact O-N 3.16Å
392	F	63.2	Low	82.7	Confident	107 Å²	107	12.7 Å²	12.7	47%	0.469	7%	0.067	S	C	.	.	G	3₁₀ helix	trans	51.2	42.5	179.3	-63.5	-76.7	0	0	0	113.7	L71	L71-F392 HydrophobicContact CD2-CE1 4.49Å
393	G	66.2	Low	82.8	Confident	11 Å²	11	15.3 Å²	15.3	11%	0.113	8%	0.081	C	C	.	.	G	3₁₀ helix	trans	96.4	-22	177.3	0	0	0	0	0	114.8	N44 N268 R391	N44-G393 WeakPolarHBondContact OD1-CA 3.44Å; N268-G393 WeakPolarHBondContact ND2-CA 3.32Å; N268-G393 PolarHBondContact ND2-O 2.82Å; R391-G393 VanDerWaalsContact C-N 3.27Å; R391-G393 PolarHBondContact O-N 2.94Å
394	L	71.9	Confident	83.2	Confident	62 Å²	62	18.1 Å²	18.1	33%	0.325	10%	0.096	S	C	.	.			trans	-68.7	136.3	-176	-61.7	175.4	0	0	0	111.8	G390 R391 D440	G390-L394 CarbonylContact C-O 3.51Å; G390-L394 VanDerWaalsContact C-O 3.26Å; G390-L394 WeakPolarHBondContact CA-O 3.38Å; R391-L394 PolarHBondContact O-N 3.16Å; L394-D440 HydrophobicContact CD2-CB 4.3Å
395	N	81	Confident	83.8	Confident	28 Å²	28	25.2 Å²	25.2	15%	0.15	13%	0.129	C	C	.	.			trans	-72.5	146.6	174.2	-60.8	-62.9	0	0	0	111.2	N268 D440	N268-N395 CarbonylContact O-C 3.52Å; N268-N395 VanDerWaalsContact O-CA 3.24Å; N268-N395 WeakPolarHBondContact O-CA 3.11Å; N395-D440 WeakPolarHBondContact CA-OD2 3.34Å; N395-D440 WeakPolarHBondContact CB-OD2 3.45Å; N395-D440 PolarHBondContact N-OD2 3.32Å; N395-D440 PolarHBondContact ND2-OD2 3Å
396	S	86.3	Confident	84	Confident	10 Å²	10	32 Å²	32	7%	0.07	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	164	171.6	-175.2	0	0	0	0	111.3	N268 I269 H270 V362 G389 G390	N268-S396 PolarHBondContact O-N 3.12Å; I269-S396 CarbonylContact C-O 2.91Å; I269-S396 WeakPolarHBondContact CA-O 3.31Å; H270-S396 PolarHBondContact N-O 2.86Å; V362-S396 PolarHBondContact O-OG 2.89Å; G389-S396 WeakPolarHBondContact CA-OG 3.28Å; G390-S396 VanDerWaalsContact N-CB 3.31Å
397	I	90.3	Very high	84.3	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	134.2	176	-69.1	163.2	0	0	0	109.3	H270 F272 I293 M363 V364 L433 V437	H270-I397 HydrophobicContact CB-CG1 4.48Å; H270-I397 WeakPolarHBondContact O-CA 3.47Å; F272-I397 HydrophobicContact CD2-CG2 4.28Å; I293-I397 HydrophobicContact CD1-CD1 3.51Å; I293-I397 HydrophobicContact CG1-CD1 4.41Å; M363-I397 HydrophobicContact CG-CB 4.34Å; V364-I397 PolarHBondContact N-O 3.4Å; I397-L433 HydrophobicContact CD1-CB 3.86Å; I397-L433 VanDerWaalsContact CD1-O 3.23Å; I397-L433 WeakPolarHBondContact CD1-O 3.19Å; I397-L433 HydrophobicContact CG2-CD1 4.48Å; I397-V437 HydrophobicContact CD1-CG2 3.32Å; I397-V437 HydrophobicContact CG1-CG2 3.59Å
398	A	92.4	Very high	84.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	110.5	165.3	0	0	0	0	0	109.4	I269 H270 Q271 F272 V364 I386	I269-A398 HydrophobicContact CG2-CB 3.84Å; H270-A398 PolarHBondContact O-N 3.07Å; Q271-A398 HydrophobicContact CG-CB 4.29Å; F272-A398 PolarHBondContact N-O 2.93Å; V364-A398 HydrophobicContact CB-CB 4.35Å; V364-A398 CarbonylContact O-C 3.57Å; V364-A398 WeakPolarHBondContact O-CA 3.4Å; I386-A398 HydrophobicContact CB-CB 3.86Å; I386-A398 HydrophobicContact CG2-CB 3.5Å; I386-A398 VanDerWaalsContact CG2-CB 3.5Å
399	L	94.8	Very high	85.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.5	174	-176	65.9	0	0	0	110.2	F272 M274 L289 V364 V365 N366 F401 I425 L430	F272-L399 HydrophobicContact CB-CD1 3.71Å; F272-L399 CarbonylContact O-C 3.53Å; F272-L399 WeakPolarHBondContact O-CA 3.44Å; M274-L399 HydrophobicContact CB-CD1 4.19Å; L289-L399 HydrophobicContact CD1-CD2 4.35Å; L289-L399 HydrophobicContact CD2-CB 4.22Å; L289-L399 HydrophobicContact CD2-CD2 3.77Å; V364-L399 PolarHBondContact O-N 3.47Å; V365-L399 CarbonylContact C-O 3.44Å; V365-L399 WeakPolarHBondContact CA-O 3.22Å; N366-L399 PolarHBondContact N-O 3.49Å; L399-F401 HydrophobicContact CD2-CD1 4.5Å; L399-F401 HydrophobicContact CD2-CE1 3.64Å; L399-F401 HydrophobicContact CD2-CZ 3.69Å; L399-F401 HydrophobicContact CG-CE1 4.27Å; L399-F401 HydrophobicContact CG-CZ 4.5Å; L399-I425 HydrophobicContact CD1-CG2 3.8Å; L399-L430 HydrophobicContact CD2-CD2 4.41Å
400	T	96.3	Very high	86.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120.7	176.6	-54.7	0	0	0	0	111.3	F272 Y273 M274 N366 V369 I411	F272-T400 PolarHBondContact O-N 2.93Å; Y273-T400 CarbonylContact C-O 3.55Å; Y273-T400 WeakPolarHBondContact CA-O 3.38Å; Y273-T400 WeakPolarHBondContact CB-O 3.4Å; M274-T400 PolarHBondContact N-O 2.95Å; N366-T400 HydrophobicContact CB-CG2 3.74Å; N366-T400 PolarHBondContact ND2-OG1 2.91Å; V369-T400 HydrophobicContact CG2-CG2 3.81Å; T400-I411 HydrophobicContact CG2-CD1 3.98Å
401	F	97.3	Very high	87.8	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	140.9	172.3	-61.6	-55.3	0	0	0	110.8	M274 C276 K282 L285 T286 V365 N366 Y367 V369 L399	M274-F401 HydrophobicContact CB-CD1 4.02Å; M274-F401 HydrophobicContact CB-CE1 4.24Å; M274-F401 HydrophobicContact CG-CD1 4.47Å; M274-F401 WeakPolarHBondContact O-CA 3.35Å; M274-F401 HydrophobicContact SD-CE1 4.04Å; C276-F401 WeakPolarHBondContact SG-CD1 3.44Å; K282-F401 HydrophobicContact CB-CD2 4.17Å; K282-F401 HydrophobicContact CB-CG 4.45Å; K282-F401 HydrophobicContact CD-CB 3.92Å; K282-F401 HydrophobicContact CD-CG 4.45Å; K282-F401 HydrophobicContact CG-CB 3.87Å; K282-F401 HydrophobicContact CG-CD2 4.15Å; K282-F401 HydrophobicContact CG-CG 4Å; L285-F401 HydrophobicContact CB-CE1 3.77Å; L285-F401 HydrophobicContact CB-CZ 3.73Å; L285-F401 HydrophobicContact CD1-CE1 4.04Å; T286-F401 VanDerWaalsContact OG1-CE2 3.23Å; T286-F401 WeakPolarHBondContact OG1-CE2 3.32Å; V365-F401 HydrophobicContact CG1-CD2 4.21Å; V365-F401 HydrophobicContact CG1-CE2 3.67Å; V365-F401 HydrophobicContact CG1-CZ 4.47Å; N366-F401 PolarHBondContact O-N 3.39Å; Y367-F401 HydrophobicContact CD2-CD2 4.37Å; V369-F401 WeakPolarHBondContact CG2-O 3.32Å; L399-F401 HydrophobicContact CD2-CD1 4.5Å; L399-F401 HydrophobicContact CD2-CE1 3.64Å; L399-F401 HydrophobicContact CD2-CZ 3.69Å; L399-F401 HydrophobicContact CG-CE1 4.27Å; L399-F401 HydrophobicContact CG-CZ 4.5Å
402	V	95.9	Very high	88.9	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.018	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	120.6	-179	174.9	0	0	0	0	107.7	Y273 M274 Q275 C276 V369 E407 M408 I411	Y273-V402 HydrophobicContact CD2-CG2 4.16Å; M274-V402 PolarHBondContact O-N 3.08Å; Q275-V402 CarbonylContact C-O 3.56Å; Q275-V402 VanDerWaalsContact CA-O 3.31Å; Q275-V402 WeakPolarHBondContact CA-O 3.35Å; C276-V402 PolarHBondContact N-O 3.09Å; V369-V402 HydrophobicContact CG2-CG2 4.04Å; V402-E407 WeakPolarHBondContact CA-OE2 3.37Å; V402-E407 HydrophobicContact CG1-CB 3.8Å; V402-M408 HydrophobicContact CG1-CB 3.98Å; V402-M408 HydrophobicContact CG1-CE 3.89Å; V402-I411 HydrophobicContact CG2-CB 4.34Å; V402-I411 HydrophobicContact CG2-CG2 4.01Å
403	D	92.7	Very high	90.3	Very high	55 Å²	55	40.7 Å²	40.7	29%	0.294	19%	0.192	S	C	.	.			trans	-114.7	-4.2	-177.5	64.7	25.8	0	0	0	115.8	C276 K282 E407	C276-D403 VanDerWaalsContact O-CA 3.27Å; C276-D403 WeakPolarHBondContact O-CA 3.2Å; K282-D403 WeakPolarHBondContact CE-OD2 3.42Å; K282-D403 IonicContact NZ-OD2 3Å; K282-D403 PolarHBondContact NZ-OD2 2.83Å; D403-E407 PolarHBondContact N-OE2 2.9Å
404	N	93	Very high	91.3	Very high	70 Å²	70	40.2 Å²	40.2	37%	0.374	19%	0.187	S	C	.	.	S	Bend	trans	-152.1	167	-178.6	67	65.6	0	0	0	112.8	R406 E407 M408	N404-R406 PolarHBondContact O-N 3.22Å; N404-R406 WeakPolarHBondContact OD1-CA 3.23Å; N404-R406 VanDerWaalsContact OD1-CB 3.22Å; N404-R406 WeakPolarHBondContact OD1-CB 3.38Å; N404-R406 PolarHBondContact OD1-N 3.3Å; N404-E407 PolarHBondContact O-N 2.73Å; N404-E407 PolarHBondContact OD1-N 3.01Å; N404-M408 PolarHBondContact O-N 3.21Å
405	E	92.5	Very high	92	Very high	157 Å²	157	37.3 Å²	37.3	73%	0.734	17%	0.172	S	C	*	.	H	α-helix	trans	-62.5	-27.6	-178.3	-65.4	-172.7	163.3	0	0	114.2	R409	E405-R409 WeakPolarHBondContact O-CG 3.31Å; E405-R409 PolarHBondContact O-N 3.08Å; E405-R409 PolarHBondContact O-NE 3.4Å
406	R	92.9	Very high	92.2	Very high	144 Å²	144	44 Å²	44	54%	0.543	20%	0.195	S	C	.	.	H	α-helix	trans	-70.6	-46.7	176.9	-176.1	-171.5	-62.1	-171.1	-1.1	109.9	N404 M408 R409 A410	N404-R406 PolarHBondContact O-N 3.22Å; N404-R406 WeakPolarHBondContact OD1-CA 3.23Å; N404-R406 VanDerWaalsContact OD1-CB 3.22Å; N404-R406 WeakPolarHBondContact OD1-CB 3.38Å; N404-R406 PolarHBondContact OD1-N 3.3Å; R406-M408 VanDerWaalsContact C-N 3.31Å; R406-M408 PolarHBondContact O-N 3.27Å; R406-R409 PolarHBondContact O-N 2.7Å; R406-A410 WeakPolarHBondContact O-CB 3.37Å; R406-A410 PolarHBondContact O-N 3.18Å
407	E	94.4	Very high	92.1	Very high	10 Å²	10	50.2 Å²	50.2	5%	0.047	22%	0.217	C	C	.	.	H	α-helix	trans	-62.1	-38.8	174	-73	-165.8	157.3	0	0	111.7	K282 V369 L371 V402 D403 N404 A410 I411	K282-E407 IonicContact NZ-OE2 3.9Å; V369-E407 HydrophobicContact CB-CB 4.31Å; V369-E407 HydrophobicContact CB-CG 4.06Å; V369-E407 HydrophobicContact CG2-CB 3.74Å; V369-E407 HydrophobicContact CG2-CG 3.89Å; L371-E407 HydrophobicContact CD1-CG 4.35Å; V402-E407 WeakPolarHBondContact CA-OE2 3.37Å; V402-E407 HydrophobicContact CG1-CB 3.8Å; D403-E407 PolarHBondContact N-OE2 2.9Å; N404-E407 PolarHBondContact O-N 2.73Å; N404-E407 PolarHBondContact OD1-N 3.01Å; E407-A410 WeakPolarHBondContact O-CB 3.32Å; E407-A410 PolarHBondContact O-N 3.41Å; E407-A410 VanDerWaalsContact O-N 3.15Å; E407-I411 PolarHBondContact O-N 3.11Å
408	M	94.2	Very high	91.5	Very high	30 Å²	30	50.9 Å²	50.9	15%	0.148	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-47.8	174.4	-175.5	58.8	70.8	0	0	112	Y273 Q275 V402 N404 R406 A410 I411 Q412	Y273-M408 HydrophobicContact CE2-CE 3.93Å; Y273-M408 HydrophobicContact CE2-SD 3.94Å; Q275-M408 HydrophobicContact CG-CE 3.48Å; Q275-M408 VanDerWaalsContact CG-CE 3.48Å; V402-M408 HydrophobicContact CG1-CB 3.98Å; V402-M408 HydrophobicContact CG1-CE 3.89Å; N404-M408 PolarHBondContact O-N 3.21Å; R406-M408 VanDerWaalsContact C-N 3.31Å; R406-M408 PolarHBondContact O-N 3.27Å; M408-A410 PolarHBondContact O-N 2.62Å; M408-I411 VanDerWaalsContact O-CG2 3.31Å; M408-I411 WeakPolarHBondContact O-CG2 3.26Å; M408-I411 PolarHBondContact O-N 3.1Å; M408-I411 HydrophobicContact SD-CG2 4.23Å; M408-Q412 VanDerWaalsContact O-CG 3.29Å; M408-Q412 WeakPolarHBondContact O-CG 3.32Å; M408-Q412 PolarHBondContact O-N 3.25Å; M408-Q412 VanDerWaalsContact O-N 3.15Å
409	R	93.4	Very high	90.5	Very high	153 Å²	153	54.3 Å²	54.3	58%	0.577	26%	0.256	S	S	*	.	H	α-helix	trans	-62.7	-34.1	175.2	-76.4	-176.3	-73.1	178	-7.6	112	E405 R406 S413	E405-R409 WeakPolarHBondContact O-CG 3.31Å; E405-R409 PolarHBondContact O-N 3.08Å; E405-R409 PolarHBondContact O-NE 3.4Å; R406-R409 PolarHBondContact O-N 2.7Å; R409-S413 WeakPolarHBondContact O-CB 3.38Å; R409-S413 PolarHBondContact O-N 3Å; R409-S413 PolarHBondContact O-OG 2.78Å
410	A	93.9	Very high	89.7	Confident	3 Å²	3	58.6 Å²	58.6	3%	0.025	27%	0.274	C	S	.	.	H	α-helix	trans	-69.1	-47.8	178.6	0	0	0	0	0	112.5	V369 L371 P377 R406 E407 M408 Q412 S413 I414	V369-A410 HydrophobicContact CG1-CB 3.96Å; L371-A410 HydrophobicContact CD2-CB 3.49Å; L371-A410 VanDerWaalsContact CD2-CB 3.49Å; P377-A410 HydrophobicContact CB-CB 4.09Å; P377-A410 HydrophobicContact CG-CB 3.8Å; R406-A410 WeakPolarHBondContact O-CB 3.37Å; R406-A410 PolarHBondContact O-N 3.18Å; E407-A410 WeakPolarHBondContact O-CB 3.32Å; E407-A410 PolarHBondContact O-N 3.41Å; E407-A410 VanDerWaalsContact O-N 3.15Å; M408-A410 PolarHBondContact O-N 2.62Å; A410-Q412 VanDerWaalsContact C-N 3.32Å; A410-Q412 PolarHBondContact O-N 3.31Å; A410-S413 WeakPolarHBondContact O-CB 3.48Å; A410-S413 PolarHBondContact O-N 3.42Å; A410-S413 VanDerWaalsContact O-N 3.12Å; A410-I414 WeakPolarHBondContact O-CG1 3.28Å; A410-I414 PolarHBondContact O-N 3.01Å
411	I	93.2	Very high	88.9	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-64.3	-37.8	179.1	-162.5	61.2	0	0	0	111.9	Y273 Y382 T400 V402 E407 M408 S413 I414 G415 P422	Y273-I411 HydrophobicContact CD2-CG2 4.41Å; Y273-I411 HydrophobicContact CG-CG1 4.36Å; Y273-I411 HydrophobicContact CG-CG2 4.45Å; Y382-I411 HydrophobicContact CE2-CD1 3.82Å; T400-I411 HydrophobicContact CG2-CD1 3.98Å; V402-I411 HydrophobicContact CG2-CB 4.34Å; V402-I411 HydrophobicContact CG2-CG2 4.01Å; E407-I411 PolarHBondContact O-N 3.11Å; M408-I411 VanDerWaalsContact O-CG2 3.31Å; M408-I411 WeakPolarHBondContact O-CG2 3.26Å; M408-I411 PolarHBondContact O-N 3.1Å; M408-I411 HydrophobicContact SD-CG2 4.23Å; I411-S413 VanDerWaalsContact C-N 3.34Å; I411-S413 PolarHBondContact O-N 2.94Å; I411-I414 HydrophobicContact CD1-CD1 4.34Å; I411-I414 WeakPolarHBondContact O-CB 3.42Å; I411-I414 PolarHBondContact O-N 3.02Å; I411-G415 PolarHBondContact O-N 3.47Å; I411-P422 HydrophobicContact CD1-CB 4.49Å; I411-P422 HydrophobicContact CD1-CG 3.84Å; I411-P422 HydrophobicContact CG1-CB 4.38Å; I411-P422 HydrophobicContact CG1-CG 4.05Å
412	Q	91.7	Very high	88.6	Confident	85 Å²	85	62.8 Å²	62.8	40%	0.397	30%	0.301	S	S	.	.	H	α-helix	trans	-64.5	-38.6	173.4	-70	176.1	-0.2	0	0	112.1	M408 A410 G415 R416	M408-Q412 VanDerWaalsContact O-CG 3.29Å; M408-Q412 WeakPolarHBondContact O-CG 3.32Å; M408-Q412 PolarHBondContact O-N 3.25Å; M408-Q412 VanDerWaalsContact O-N 3.15Å; A410-Q412 VanDerWaalsContact C-N 3.32Å; A410-Q412 PolarHBondContact O-N 3.31Å; Q412-G415 PolarHBondContact O-N 3.5Å; Q412-R416 PolarHBondContact O-N 3.01Å
413	S	92	Very high	88.4	Confident	30 Å²	30	66.1 Å²	66.1	21%	0.21	32%	0.317	C	S	.	.	H	α-helix	trans	-67.2	-40	176.6	-60.2	0	0	0	0	111.7	R409 A410 I411 G415 R416 R417	R409-S413 WeakPolarHBondContact O-CB 3.38Å; R409-S413 PolarHBondContact O-N 3Å; R409-S413 PolarHBondContact O-OG 2.78Å; A410-S413 WeakPolarHBondContact O-CB 3.48Å; A410-S413 PolarHBondContact O-N 3.42Å; A410-S413 VanDerWaalsContact O-N 3.12Å; I411-S413 VanDerWaalsContact C-N 3.34Å; I411-S413 PolarHBondContact O-N 2.94Å; S413-G415 VanDerWaalsContact C-N 3.32Å; S413-R416 PolarHBondContact O-N 3.19Å; S413-R416 PolarHBondContact OG-NH2 2.93Å; S413-R417 PolarHBondContact O-N 3.49Å
414	I	88.2	Confident	88.5	Confident	1 Å²	1	67 Å²	67	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-58	-47.8	173.1	-73.1	164.9	0	0	0	109.7	V369 P370 P377 F379 Y382 A410 I411 R416 R417 F418	V369-I414 HydrophobicContact CG1-CD1 4.38Å; P370-I414 HydrophobicContact CG-CD1 4.46Å; P377-I414 HydrophobicContact CB-CG1 4.28Å; F379-I414 HydrophobicContact CD1-CB 4.4Å; F379-I414 HydrophobicContact CD1-CG1 3.77Å; F379-I414 HydrophobicContact CE1-CG1 3.99Å; Y382-I414 HydrophobicContact CD1-CG2 3.3Å; Y382-I414 HydrophobicContact CD2-CD1 3.83Å; Y382-I414 HydrophobicContact CD2-CG2 4.12Å; Y382-I414 HydrophobicContact CE1-CG2 3.4Å; Y382-I414 HydrophobicContact CE2-CD1 4.45Å; Y382-I414 HydrophobicContact CE2-CG2 4.21Å; Y382-I414 HydrophobicContact CG-CD1 3.95Å; Y382-I414 HydrophobicContact CG-CG1 4.48Å; Y382-I414 HydrophobicContact CG-CG2 3.67Å; A410-I414 WeakPolarHBondContact O-CG1 3.28Å; A410-I414 PolarHBondContact O-N 3.01Å; I411-I414 HydrophobicContact CD1-CD1 4.34Å; I411-I414 WeakPolarHBondContact O-CB 3.42Å; I411-I414 PolarHBondContact O-N 3.02Å; I414-R416 PolarHBondContact O-N 3.45Å; I414-R417 PolarHBondContact O-N 2.83Å; I414-R417 VanDerWaalsContact O-N 3.14Å; I414-F418 HydrophobicContact CG2-CD2 3.96Å; I414-F418 HydrophobicContact CG2-CE2 4.13Å; I414-F418 VanDerWaalsContact O-CD2 3.24Å; I414-F418 WeakPolarHBondContact O-CD2 3.45Å; I414-F418 PolarHBondContact O-N 2.95Å
415	G	85	Confident	88.5	Confident	1 Å²	1	64 Å²	64	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-57.9	-45.1	176.8	0	0	0	0	0	114.2	I411 Q412 S413 R417 G419 K420 P421	I411-G415 PolarHBondContact O-N 3.47Å; Q412-G415 PolarHBondContact O-N 3.5Å; S413-G415 VanDerWaalsContact C-N 3.32Å; G415-R417 VanDerWaalsContact C-N 3.32Å; G415-R417 PolarHBondContact O-N 3.3Å; G415-G419 PolarHBondContact O-N 3.46Å; G415-K420 PolarHBondContact O-N 3.34Å; G415-P421 VanDerWaalsContact CA-CA 3.47Å
416	R	85.5	Confident	88.5	Confident	168 Å²	168	61.1 Å²	61.1	63%	0.634	29%	0.292	S	S	*	.	H	α-helix	trans	-63	-37.4	175.3	-73.6	-172.7	-67.1	-93.1	0.4	112.6	Q412 S413 I414	Q412-R416 PolarHBondContact O-N 3.01Å; S413-R416 PolarHBondContact O-N 3.19Å; S413-R416 PolarHBondContact OG-NH2 2.93Å; I414-R416 PolarHBondContact O-N 3.45Å
417	R	83.5	Confident	88.2	Confident	141 Å²	141	55.3 Å²	55.3	53%	0.532	28%	0.275	S	S	.	.	H	α-helix	trans	-67.8	-36.6	-177.8	179.7	57.4	176	146.4	-1.5	112.7	F379 S413 I414 G415	F379-R417 HydrophobicContact CD1-CB 3.88Å; F379-R417 HydrophobicContact CD1-CG 3.97Å; F379-R417 HydrophobicContact CE1-CB 3.85Å; F379-R417 HydrophobicContact CE1-CG 4.29Å; F379-R417 HydrophobicContact CG-CG 4.28Å; S413-R417 PolarHBondContact O-N 3.49Å; I414-R417 PolarHBondContact O-N 2.83Å; I414-R417 VanDerWaalsContact O-N 3.14Å; G415-R417 VanDerWaalsContact C-N 3.32Å; G415-R417 PolarHBondContact O-N 3.3Å
418	F	78.2	Confident	87.9	Confident	15 Å²	15	61.3 Å²	61.3	7%	0.066	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	13.1	-174.6	-59.7	-63.7	0	0	0	114.1	M264 F379 Y382 I383 I414 K420	M264-F418 HydrophobicContact CE-CE1 4.23Å; F379-F418 HydrophobicContact CB-CE2 4.09Å; F379-F418 HydrophobicContact CB-CZ 3.87Å; F379-F418 HydrophobicContact CD1-CE2 4.23Å; Y382-F418 HydrophobicContact CD1-CE2 4.47Å; I383-F418 HydrophobicContact CB-CZ 4.39Å; I383-F418 HydrophobicContact CD1-CD1 3.85Å; I383-F418 HydrophobicContact CD1-CD2 3.8Å; I383-F418 HydrophobicContact CD1-CE1 3.84Å; I383-F418 HydrophobicContact CD1-CE2 3.79Å; I383-F418 HydrophobicContact CD1-CG 3.84Å; I383-F418 HydrophobicContact CD1-CZ 3.81Å; I383-F418 HydrophobicContact CG1-CD1 3.97Å; I383-F418 HydrophobicContact CG1-CD2 4.03Å; I383-F418 HydrophobicContact CG1-CE1 3.41Å; I383-F418 VanDerWaalsContact CG1-CE1 3.41Å; I383-F418 HydrophobicContact CG1-CE2 3.47Å; I383-F418 VanDerWaalsContact CG1-CE2 3.47Å; I383-F418 HydrophobicContact CG1-CG 4.27Å; I383-F418 HydrophobicContact CG1-CZ 3.12Å; I414-F418 HydrophobicContact CG2-CD2 3.96Å; I414-F418 HydrophobicContact CG2-CE2 4.13Å; I414-F418 VanDerWaalsContact O-CD2 3.24Å; I414-F418 WeakPolarHBondContact O-CD2 3.45Å; I414-F418 PolarHBondContact O-N 2.95Å; F418-K420 PolarHBondContact O-N 3.45Å; F418-K420 VanDerWaalsContact O-N 3.09Å
419	G	71.9	Confident	87.6	Confident	72 Å²	72	63.7 Å²	63.7	74%	0.742	32%	0.316	S	S	*	.	S	Bend	trans	78.6	-17	171.5	0	0	0	0	0	116.2	G415	G415-G419 PolarHBondContact O-N 3.46Å
420	K	77.4	Confident	87.3	Confident	90 Å²	90	56.4 Å²	56.4	39%	0.391	29%	0.289	S	S	.	.	S	Bend	trans	-136.6	114.1	174.3	-159.1	-174.7	-172.5	173.3	0	110.9	Y265 G415 F418	Y265-K420 HydrophobicContact CD2-CB 3.81Å; Y265-K420 HydrophobicContact CD2-CD 4.34Å; Y265-K420 HydrophobicContact CE1-CD 3.79Å; Y265-K420 HydrophobicContact CE2-CB 3.65Å; Y265-K420 HydrophobicContact CE2-CD 3.51Å; Y265-K420 HydrophobicContact CE2-CG 4.18Å; Y265-K420 WeakPolarHBondContact OH-CD 3.25Å; Y265-K420 PolarHBondContact OH-NZ 2.99Å; G415-K420 PolarHBondContact O-N 3.34Å; F418-K420 PolarHBondContact O-N 3.45Å; F418-K420 VanDerWaalsContact O-N 3.09Å
421	P	81	Confident	86.9	Confident	81 Å²	81	59.4 Å²	59.4	53%	0.526	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-68.9	143.6	178.6	28.2	-33	0	0	0	111.8	G415 Q423	G415-P421 VanDerWaalsContact CA-CA 3.47Å; P421-Q423 PolarHBondContact O-N 3.47Å
422	P	90	Very high	86.5	Confident	7 Å²	7	60.5 Å²	60.5	5%	0.045	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-53.3	138.4	166.4	-25.5	36.3	0	0	0	110.1	Q271 Y273 Y382 I411	Q271-P422 HydrophobicContact CB-CB 4.12Å; Q271-P422 HydrophobicContact CB-CG 4.26Å; Q271-P422 CarbonylContact O-C 3.57Å; Q271-P422 WeakPolarHBondContact O-CA 3.33Å; Y273-P422 HydrophobicContact CD1-CB 4.06Å; Y273-P422 VanDerWaalsContact CD1-O 3.28Å; Y273-P422 WeakPolarHBondContact CD1-O 3.27Å; Y273-P422 VanDerWaalsContact CE1-O 3.28Å; Y273-P422 WeakPolarHBondContact CE1-O 3.35Å; Y382-P422 VanDerWaalsContact OH-CG 3.28Å; Y382-P422 WeakPolarHBondContact OH-CG 3.34Å; I411-P422 HydrophobicContact CD1-CB 4.49Å; I411-P422 HydrophobicContact CD1-CG 3.84Å; I411-P422 HydrophobicContact CG1-CB 4.38Å; I411-P422 HydrophobicContact CG1-CG 4.05Å
423	Q	92.4	Very high	86.1	Confident	73 Å²	73	56.5 Å²	56.5	34%	0.341	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	139	-178.7	-66.5	179.8	-10.9	0	0	110.4	Q271 F272 Y273 P421 I425	Q271-Q423 PolarHBondContact O-N 3.33Å; F272-Q423 CarbonylContact C-O 3.48Å; F272-Q423 WeakPolarHBondContact CA-O 3.27Å; F272-Q423 HydrophobicContact CD1-CB 3.9Å; F272-Q423 HydrophobicContact CE1-CB 4.09Å; Y273-Q423 PolarHBondContact N-O 2.87Å; P421-Q423 PolarHBondContact O-N 3.47Å; Q423-I425 PolarHBondContact O-N 3.5Å
424	L	93.4	Very high	85.5	Confident	74 Å²	74	55.3 Å²	55.3	39%	0.387	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	132.3	171.2	179	61.3	0	0	0	108.8	Y273 Q275	Y273-L424 HydrophobicContact CD2-CD1 4.04Å; Y273-L424 HydrophobicContact CE1-CB 3.78Å; Y273-L424 VanDerWaalsContact CE1-N 3.34Å; Y273-L424 HydrophobicContact CE2-CB 4.27Å; Y273-L424 HydrophobicContact CE2-CD1 3.51Å; Y273-L424 HydrophobicContact CE2-CG 4.42Å; Y273-L424 WeakPolarHBondContact O-CA 3.24Å; Q275-L424 HydrophobicContact CG-CD1 4.32Å
425	I	93.6	Very high	85.2	Confident	7 Å²	7	60.8 Å²	60.8	4%	0.036	32%	0.315	C	S	.	.			trans	-127.8	132	169.7	-168.7	168.2	0	0	0	110.2	F272 Y273 M274 L399 Q423 N429 L433	F272-I425 HydrophobicContact CB-CB 4.48Å; F272-I425 HydrophobicContact CB-CG2 3.81Å; F272-I425 HydrophobicContact CD1-CB 4.05Å; F272-I425 HydrophobicContact CD1-CD1 4.41Å; F272-I425 HydrophobicContact CD1-CG2 4.27Å; F272-I425 HydrophobicContact CG-CG2 4.27Å; Y273-I425 PolarHBondContact O-N 3.45Å; M274-I425 HydrophobicContact CB-CG2 4.37Å; M274-I425 HydrophobicContact CE-CG2 3.8Å; M274-I425 WeakPolarHBondContact CE-O 3.26Å; M274-I425 WeakPolarHBondContact CG-O 3.45Å; L399-I425 HydrophobicContact CD1-CG2 3.8Å; Q423-I425 PolarHBondContact O-N 3.5Å; I425-N429 HydrophobicContact CD1-CB 4.26Å; I425-N429 HydrophobicContact CG1-CB 3.92Å; I425-L433 HydrophobicContact CD1-CD1 3.89Å; I425-L433 HydrophobicContact CD1-CD2 3.42Å; I425-L433 VanDerWaalsContact CD1-CD2 3.42Å; I425-L433 HydrophobicContact CD1-CG 3.48Å; I425-L433 VanDerWaalsContact CD1-CG 3.48Å
426	E	91.6	Very high	84.9	Confident	96 Å²	96	62.7 Å²	62.7	45%	0.449	33%	0.325	S	S	.	.			trans	-83.5	153.7	174.3	-58.2	-58.4	155.2	0	0	110.9	E428 N429	E426-E428 WeakPolarHBondContact CB-OE2 3.38Å; E426-E428 PolarHBondContact O-N 2.99Å; E426-N429 PolarHBondContact O-N 2.98Å
427	A	87.9	Confident	84.3	Confident	23 Å²	23	55.7 Å²	55.7	19%	0.19	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-59.9	-31	-174.8	0	0	0	0	0	113.3	M274 L285 R288 N429 L430	M274-A427 HydrophobicContact SD-CB 4.39Å; L285-A427 HydrophobicContact CD2-CB 3.66Å; R288-A427 PolarHBondContact NH1-O 3.33Å; A427-N429 PolarHBondContact O-N 3.07Å; A427-L430 WeakPolarHBondContact O-CG 3.34Å; A427-L430 PolarHBondContact O-N 3.36Å
428	E	87.6	Confident	83.5	Confident	136 Å²	136	55.4 Å²	55.4	64%	0.636	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-64.6	-31.5	177.9	-62.2	71.4	-153.1	0	0	111.4	E426	E426-E428 WeakPolarHBondContact CB-OE2 3.38Å; E426-E428 PolarHBondContact O-N 2.99Å
429	N	88.5	Confident	82.5	Confident	80 Å²	80	58.4 Å²	58.4	43%	0.428	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-90.3	2.6	-174.1	-65	-34.5	0	0	0	113.6	I425 E426 A427 T431 A432	I425-N429 HydrophobicContact CD1-CB 4.26Å; I425-N429 HydrophobicContact CG1-CB 3.92Å; E426-N429 PolarHBondContact O-N 2.98Å; A427-N429 PolarHBondContact O-N 3.07Å; N429-T431 PolarHBondContact O-N 3.27Å; N429-A432 VanDerWaalsContact O-CB 3.3Å; N429-A432 WeakPolarHBondContact O-CB 3.34Å; N429-A432 PolarHBondContact O-N 2.93Å
430	L	86.2	Confident	81.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-53.5	-31.7	178.9	-80.9	176.6	0	0	0	113.6	M274 L285 R288 L289 L292 L399 A427 A432 L433	M274-L430 HydrophobicContact CE-CD1 4.28Å; M274-L430 HydrophobicContact CE-CD2 3.53Å; M274-L430 HydrophobicContact CE-CG 3.8Å; L285-L430 HydrophobicContact CD2-CD1 3.73Å; R288-L430 HydrophobicContact CB-CD1 4.49Å; R288-L430 HydrophobicContact CG-CD1 4.21Å; L289-L430 HydrophobicContact CD1-CD2 4.03Å; L292-L430 HydrophobicContact CD1-CB 3.95Å; L399-L430 HydrophobicContact CD2-CD2 4.41Å; A427-L430 WeakPolarHBondContact O-CG 3.34Å; A427-L430 PolarHBondContact O-N 3.36Å; L430-A432 VanDerWaalsContact C-N 3.26Å; L430-A432 PolarHBondContact O-N 3.35Å; L430-L433 HydrophobicContact CD2-CD1 3.84Å; L430-L433 VanDerWaalsContact O-CB 3.29Å; L430-L433 WeakPolarHBondContact O-CB 3.35Å; L430-L433 PolarHBondContact O-N 3.06Å
431	T	85.2	Confident	80.5	Confident	66 Å²	66	55.7 Å²	55.7	41%	0.405	29%	0.293	S	S	.	.	H	α-helix	trans	-64.3	-31.8	178.6	-47.8	0	0	0	0	112.2	N429 L433 A434	N429-T431 PolarHBondContact O-N 3.27Å; T431-L433 PolarHBondContact O-N 2.99Å; T431-A434 WeakPolarHBondContact O-CB 3.32Å; T431-A434 PolarHBondContact O-N 2.73Å; T431-A434 VanDerWaalsContact O-N 3.14Å
432	A	85.4	Confident	78.4	Confident	25 Å²	25	60.1 Å²	60.1	21%	0.207	31%	0.307	C	S	.	.	H	α-helix	trans	-65.1	-26.4	178	0	0	0	0	0	112.2	I33 N429 L430 A434 E435	I33-A432 HydrophobicContact CD1-CB 3.6Å; N429-A432 VanDerWaalsContact O-CB 3.3Å; N429-A432 WeakPolarHBondContact O-CB 3.34Å; N429-A432 PolarHBondContact O-N 2.93Å; L430-A432 VanDerWaalsContact C-N 3.26Å; L430-A432 PolarHBondContact O-N 3.35Å; A432-A434 VanDerWaalsContact C-N 3.28Å; A432-A434 PolarHBondContact O-N 3.12Å; A432-E435 WeakPolarHBondContact O-CB 3.22Å; A432-E435 PolarHBondContact O-N 2.94Å; A432-E435 VanDerWaalsContact O-N 3.16Å
433	L	84.4	Confident	75.9	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.6	-38	174.4	-64.1	-173.6	0	0	0	112	F272 L289 I293 I397 I425 L430 T431 E435 L436	F272-L433 HydrophobicContact CD1-CD2 4.22Å; F272-L433 HydrophobicContact CD2-CD2 3.47Å; F272-L433 VanDerWaalsContact CD2-CD2 3.47Å; F272-L433 HydrophobicContact CE1-CD2 4.02Å; F272-L433 HydrophobicContact CE2-CD2 3.2Å; F272-L433 HydrophobicContact CG-CD2 3.97Å; F272-L433 HydrophobicContact CZ-CD2 3.52Å; L289-L433 HydrophobicContact CD1-CD1 3.71Å; I293-L433 HydrophobicContact CD1-CB 4.25Å; I397-L433 HydrophobicContact CD1-CB 3.86Å; I397-L433 VanDerWaalsContact CD1-O 3.23Å; I397-L433 WeakPolarHBondContact CD1-O 3.19Å; I397-L433 HydrophobicContact CG2-CD1 4.48Å; I425-L433 HydrophobicContact CD1-CD1 3.89Å; I425-L433 HydrophobicContact CD1-CD2 3.42Å; I425-L433 VanDerWaalsContact CD1-CD2 3.42Å; I425-L433 HydrophobicContact CD1-CG 3.48Å; I425-L433 VanDerWaalsContact CD1-CG 3.48Å; L430-L433 HydrophobicContact CD2-CD1 3.84Å; L430-L433 VanDerWaalsContact O-CB 3.29Å; L430-L433 WeakPolarHBondContact O-CB 3.35Å; L430-L433 PolarHBondContact O-N 3.06Å; T431-L433 PolarHBondContact O-N 2.99Å; L433-E435 PolarHBondContact O-N 3.3Å; L433-E435 VanDerWaalsContact O-N 3.16Å; L433-L436 HydrophobicContact CD2-CD1 4.22Å; L433-L436 PolarHBondContact O-N 3Å; L433-L436 VanDerWaalsContact O-N 3.15Å
434	A	79.4	Confident	73	Confident	6 Å²	6	70.2 Å²	70.2	5%	0.05	37%	0.367	C	S	.	.	H	α-helix	trans	-61.1	-27.7	179	0	0	0	0	0	112.1	T431 A432 R438	T431-A434 WeakPolarHBondContact O-CB 3.32Å; T431-A434 PolarHBondContact O-N 2.73Å; T431-A434 VanDerWaalsContact O-N 3.14Å; A432-A434 VanDerWaalsContact C-N 3.28Å; A432-A434 PolarHBondContact O-N 3.12Å; A434-R438 WeakPolarHBondContact O-CG 3.39Å; A434-R438 PolarHBondContact O-N 3.38Å
435	E	80.9	Confident	72	Confident	116 Å²	116	70.1 Å²	70.1	54%	0.542	37%	0.366	S	S	.	.	H	α-helix	trans	-73.3	-28.9	-179.7	-54.7	-168.3	147.7	0	0	112.9	A432 L433 V437 R438	A432-E435 WeakPolarHBondContact O-CB 3.22Å; A432-E435 PolarHBondContact O-N 2.94Å; A432-E435 VanDerWaalsContact O-N 3.16Å; L433-E435 PolarHBondContact O-N 3.3Å; L433-E435 VanDerWaalsContact O-N 3.16Å; E435-V437 VanDerWaalsContact C-N 3.28Å; E435-V437 PolarHBondContact O-N 3.09Å; E435-R438 IonicContact OE1-NH1 2.62Å
436	L	78.9	Confident	70.9	Confident	40 Å²	40	73.4 Å²	73.4	21%	0.209	38%	0.383	C	S	.	.	H	α-helix	trans	-69.4	-24.5	179.4	-64.1	172.7	0	0	0	113.2	H270 F272 L433	H270-L436 HydrophobicContact CB-CD1 4.2Å; F272-L436 HydrophobicContact CE2-CD1 3.78Å; F272-L436 HydrophobicContact CZ-CD1 3.56Å; L433-L436 HydrophobicContact CD2-CD1 4.22Å; L433-L436 PolarHBondContact O-N 3Å; L433-L436 VanDerWaalsContact O-N 3.15Å
437	V	74	Confident	69.7	Low	21 Å²	21	72.1 Å²	72.1	13%	0.127	38%	0.379	C	S	.	.	H	α-helix	trans	-107.7	-10.4	-176.3	-171.6	0	0	0	0	112.3	I397 E435 D440 L441	I397-V437 HydrophobicContact CD1-CG2 3.32Å; I397-V437 HydrophobicContact CG1-CG2 3.59Å; E435-V437 VanDerWaalsContact C-N 3.28Å; E435-V437 PolarHBondContact O-N 3.09Å; V437-D440 PolarHBondContact O-N 3.43Å; V437-L441 HydrophobicContact CG1-CD1 4.4Å; V437-L441 WeakPolarHBondContact O-CD1 3.32Å
438	R	65.3	Low	68.6	Low	136 Å²	136	75 Å²	75	51%	0.513	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-53.5	-38.3	176.5	-90.5	176.3	-170.5	163.7	3.8	115.3	A434 E435 D440 L441	A434-R438 WeakPolarHBondContact O-CG 3.39Å; A434-R438 PolarHBondContact O-N 3.38Å; E435-R438 IonicContact OE1-NH1 2.62Å; R438-D440 VanDerWaalsContact C-N 3.31Å; R438-D440 PolarHBondContact O-N 2.98Å; R438-L441 PolarHBondContact O-N 3.25Å
439	P	58.1	Low	67.5	Low	78 Å²	78	71.2 Å²	71.2	51%	0.506	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-59.4	-39	-177.3	-25.3	34.9	0	0	0	113.4	L441 Q442	P439-L441 VanDerWaalsContact C-N 3.33Å; P439-L441 PolarHBondContact O-N 2.86Å; P439-Q442 PolarHBondContact O-N 3.2Å
440	D	57.6	Low	66	Low	30 Å²	30	70.6 Å²	70.6	16%	0.16	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-83.7	-11.3	-173.9	-58.4	-29	0	0	0	113.8	L394 N395 V437 R438 Q442 T443	L394-D440 HydrophobicContact CD2-CB 4.3Å; N395-D440 WeakPolarHBondContact CA-OD2 3.34Å; N395-D440 WeakPolarHBondContact CB-OD2 3.45Å; N395-D440 PolarHBondContact N-OD2 3.32Å; N395-D440 PolarHBondContact ND2-OD2 3Å; V437-D440 PolarHBondContact O-N 3.43Å; R438-D440 VanDerWaalsContact C-N 3.31Å; R438-D440 PolarHBondContact O-N 2.98Å; D440-Q442 VanDerWaalsContact C-N 3.31Å; D440-T443 PolarHBondContact O-OG1 3.17Å
441	L	48.8	Very low	64.6	Low	75 Å²	75	75.6 Å²	75.6	39%	0.393	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-81.9	-12.5	176.5	-71	158	0	0	0	112.4	P294 V437 R438 P439	P294-L441 HydrophobicContact CG-CD1 3.29Å; P294-L441 HydrophobicContact CG-CD2 4Å; P294-L441 HydrophobicContact CG-CG 4.29Å; V437-L441 HydrophobicContact CG1-CD1 4.4Å; V437-L441 WeakPolarHBondContact O-CD1 3.32Å; R438-L441 PolarHBondContact O-N 3.25Å; P439-L441 VanDerWaalsContact C-N 3.33Å; P439-L441 PolarHBondContact O-N 2.86Å
442	Q	36.7	Very low	63	Low	174 Å²	174	76.4 Å²	76.4	81%	0.813	40%	0.397	S	S	*	.	S	Bend	trans	-88.5	-9.1	174.8	-63.7	-171.8	-2.5	0	0	112.7	P439 D440	P439-Q442 PolarHBondContact O-N 3.2Å; D440-Q442 VanDerWaalsContact C-N 3.31Å
443	T	37.5	Very low	61.2	Low	108 Å²	108	80.7 Å²	80.7	66%	0.663	41%	0.413	S	S	*	.			trans	-112.9	7.8	-173.5	44.9	0	0	0	0	115.1	D440	D440-T443 PolarHBondContact O-OG1 3.17Å
444	N	32.6	Very low	59.1	Low	184 Å²	184	88 Å²	88	98%	0.984	45%	0.451	S	S	*	.			trans	-121.5	0	169.4	-76.7	-62.2	0	0	0	110.2

Retrieved 444 of 444 residues in 129.5 ms (Link to these results)

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