A0A077YWX8_TRITR Loading...

ATP-dependent RNA helicase

RNA helicase.

AlphaFold DB , UniProt , Accession A0A077YWX8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 528 aa.

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(Predicted Aligned Error values between residue pairs)

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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	36.6	Very low	30.3	Very low	237 Å²	237	154.6 Å²	154.6	100%	1.167	85%	0.849	S	S	*	*				0	83.7	0	-64.4	-165.9	-129.5	0	0	106
2	L	28.7	Very low	30.4	Very low	177 Å²	177	158.7 Å²	158.7	93%	0.927	86%	0.858	S	S	*	*				41.5	84.1	82.7	-72.4	172.2	0	0	0	110.8
3	G	30.6	Very low	30.2	Very low	78 Å²	78	162.2 Å²	162.2	80%	0.804	87%	0.865	S	S	*	*			trans	-122.8	96.4	165.4	0	0	0	0	0	107.4
4	C	27.1	Very low	30.3	Very low	130 Å²	130	157.6 Å²	157.6	88%	0.878	86%	0.861	S	S	*	*			trans	-71.2	130.2	165.1	-62.8	0	0	0	0	108.3
5	A	29.9	Very low	30	Very low	81 Å²	81	158.6 Å²	158.6	67%	0.669	87%	0.865	S	S	*	*			trans	-160.1	122.7	162.2	0	0	0	0	0	111.1
6	D	31.9	Very low	29.8	Very low	156 Å²	156	153.1 Å²	153.1	83%	0.834	86%	0.856	S	S	*	*			trans	82.8	106.6	137.8	-55	-23.8	0	0	0	121.8
7	N	39.5	Very low	29.7	Very low	164 Å²	164	150.4 Å²	150.4	88%	0.877	85%	0.85	S	S	*	*			trans	-51.1	146.6	152	-98.4	-19	0	0	0	112.1
8	P	32.1	Very low	29.6	Very low	116 Å²	116	153 Å²	153	75%	0.753	85%	0.854	S	S	*	*				-147.1	143.8	110.3	31.2	-12.1	0	0	0	116.1
9	R	25.7	Very low	29.7	Very low	217 Å²	217	155.2 Å²	155.2	82%	0.819	85%	0.854	S	S	*	*			trans	5.9	136.5	131.6	-63.9	176.4	-172.8	175.8	1.1	115.7
10	E	25.5	Very low	29.6	Very low	160 Å²	160	155.5 Å²	155.5	75%	0.748	85%	0.854	S	S	*	*			cis	-173.7	151.7	47.2	-116.3	144.3	-142.4	0	0	109.7
11	E	26.2	Very low	29.5	Very low	185 Å²	185	155.4 Å²	155.4	86%	0.864	85%	0.851	S	S	*	*			trans	9.3	122.8	153.3	-61.3	172.3	175.9	0	0	120.6
12	E	31.1	Very low	29.1	Very low	203 Å²	203	152.3 Å²	152.3	95%	0.949	84%	0.838	S	S	*	*			trans	-148.4	124.6	143.7	-103.9	-177.8	-177.6	0	0	110.7
13	E	27.8	Very low	29.1	Very low	204 Å²	204	146.7 Å²	146.7	95%	0.953	82%	0.822	S	S	*	*			trans	-76.2	127.6	172.4	-65.4	178.5	141.1	0	0	110.8
14	A	30.9	Very low	29.2	Very low	98 Å²	98	151.9 Å²	151.9	81%	0.81	83%	0.826	S	S	*	*			trans	-161.9	109	154.2	0	0	0	0	0	113
15	N	27	Very low	29.4	Very low	173 Å²	173	154.7 Å²	154.7	93%	0.925	83%	0.826	S	S	*	*			trans	21.3	119.4	141.4	-77.8	-27.2	0	0	0	120.2
16	G	26.1	Very low	29.5	Very low	70 Å²	70	159.2 Å²	159.2	72%	0.722	83%	0.833	S	S	*	*				96.1	100.7	122.2	0	0	0	0	0	118.1
17	S	28.8	Very low	29.4	Very low	107 Å²	107	163 Å²	163	75%	0.748	84%	0.836	S	S	*	*			trans	63.3	97.1	144.7	62.3	0	0	0	0	119.3
18	Q	28.4	Very low	29.2	Very low	198 Å²	198	162.2 Å²	162.2	93%	0.925	83%	0.83	S	S	*	*			trans	-136.3	87.1	142	-80.5	-173.7	-17.5	0	0	109.1	L20	Q18-L20 PolarHBondContact O-N 3.49Å
19	F	29.7	Very low	29	Very low	195 Å²	195	165.1 Å²	165.1	86%	0.855	83%	0.834	S	S	*	*			trans	-65.5	124.1	159.5	-85.6	-93.5	0	0	0	107.7	I21	F19-I21 PolarHBondContact O-N 3.15Å; F19-I21 VanDerWaalsContact O-N 3.1Å
20	L	28.3	Very low	29.4	Very low	161 Å²	161	159 Å²	159	84%	0.843	83%	0.829	S	S	*	*			trans	-61.9	108.4	179.5	-145.4	96.7	0	0	0	109.2	Q18 L22	Q18-L20 PolarHBondContact O-N 3.49Å; L20-L22 PolarHBondContact O-N 3.34Å
21	I	28.7	Very low	29.7	Very low	154 Å²	154	157.1 Å²	157.1	79%	0.79	83%	0.828	S	S	*	*			trans	-72.3	100.1	173.7	-61.6	174.3	0	0	0	106.9	F19 G23	F19-I21 PolarHBondContact O-N 3.15Å; F19-I21 VanDerWaalsContact O-N 3.1Å; I21-G23 PolarHBondContact O-N 3.34Å
22	L	27.1	Very low	29.8	Very low	172 Å²	172	153.6 Å²	153.6	90%	0.901	82%	0.821	S	S	*	*	S	Bend	trans	-63.4	94.8	168.3	-85.8	154.1	0	0	0	108.7	L20	L20-L22 PolarHBondContact O-N 3.34Å
23	G	29.4	Very low	30.2	Very low	58 Å²	58	151.3 Å²	151.3	60%	0.598	82%	0.815	S	S	*	*			trans	171.7	18.6	178.4	0	0	0	0	0	115.4	I21 E25	I21-G23 PolarHBondContact O-N 3.34Å; G23-E25 PolarHBondContact O-N 3.35Å; G23-E25 VanDerWaalsContact O-N 3.16Å
24	E	31.8	Very low	30.5	Very low	188 Å²	188	146.7 Å²	146.7	88%	0.879	80%	0.803	S	S	*	*			trans	-68.7	115.2	165	-78.5	-170.1	163.8	0	0	108.3	E26	E24-E26 VanDerWaalsContact C-N 3.25Å; E24-E26 PolarHBondContact O-N 3.09Å
25	E	32.8	Very low	30.9	Very low	188 Å²	188	149.9 Å²	149.9	88%	0.879	81%	0.805	S	S	*	*			trans	-56.5	81.2	-179.3	-61.9	177.2	157.4	0	0	110.9	G23 R27	G23-E25 PolarHBondContact O-N 3.35Å; G23-E25 VanDerWaalsContact O-N 3.16Å; E25-R27 VanDerWaalsContact C-N 3.28Å; E25-R27 PolarHBondContact O-N 3.42Å
26	E	31.1	Very low	32.1	Very low	176 Å²	176	146.1 Å²	146.1	82%	0.822	79%	0.789	S	S	*	*			trans	-59.2	104.2	152.9	-77	-167.6	165.8	0	0	105.5	E24 I28	E24-E26 VanDerWaalsContact C-N 3.25Å; E24-E26 PolarHBondContact O-N 3.09Å; E26-I28 PolarHBondContact O-N 2.65Å
27	R	29.5	Very low	33.6	Very low	235 Å²	235	149.2 Å²	149.2	89%	0.887	79%	0.787	S	S	*	*			trans	-48.4	92.8	169.1	-75.7	177.7	176.2	177.7	-0.5	107.4	E25 Q29	E25-R27 VanDerWaalsContact C-N 3.28Å; E25-R27 PolarHBondContact O-N 3.42Å; R27-Q29 VanDerWaalsContact C-N 3.28Å; R27-Q29 PolarHBondContact O-N 3.14Å
28	I	35.1	Very low	35.3	Very low	149 Å²	149	147.7 Å²	147.7	76%	0.764	77%	0.773	S	S	*	*			trans	-56.9	103.5	170.2	-61.7	174.1	0	0	0	103.3	E26 A30	E26-I28 PolarHBondContact O-N 2.65Å; I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 3Å
29	Q	27.2	Very low	37.3	Very low	177 Å²	177	139.7 Å²	139.7	83%	0.827	74%	0.739	S	S	*	*			trans	-50.7	109.4	168.6	-78.9	179.7	-8.5	0	0	104.4	R27 V31	R27-Q29 VanDerWaalsContact C-N 3.28Å; R27-Q29 PolarHBondContact O-N 3.14Å; Q29-V31 VanDerWaalsContact C-N 3.3Å; Q29-V31 PolarHBondContact O-N 3.39Å
30	A	35	Very low	39.4	Very low	88 Å²	88	137.6 Å²	137.6	73%	0.727	73%	0.732	S	S	*	*			trans	-53.3	102.3	-176.6	0	0	0	0	0	106.6	I28 P32	I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 3Å; A30-P32 WeakPolarHBondContact O-CD 3.32Å
31	V	31	Very low	41.8	Very low	120 Å²	120	132.5 Å²	132.5	73%	0.727	70%	0.701	S	S	*	*			trans	-55.8	113.7	173.3	177.8	0	0	0	0	103.2	Q29 L33	Q29-V31 VanDerWaalsContact C-N 3.3Å; Q29-V31 PolarHBondContact O-N 3.39Å; V31-L33 PolarHBondContact O-N 2.83Å
32	P	29	Very low	44.1	Very low	111 Å²	111	125.5 Å²	125.5	72%	0.721	67%	0.665	S	S	*	*			trans	-60	115	-176	-13.3	24.1	0	0	0	105.4	A30 P34	A30-P32 WeakPolarHBondContact O-CD 3.32Å; P32-P34 VanDerWaalsContact O-N 3.1Å
33	L	38.9	Very low	46.3	Very low	155 Å²	155	120.6 Å²	120.6	81%	0.812	65%	0.65	S	S	*	*			trans	-45.7	125.8	172.1	-78.5	160.6	0	0	0	106	V31 L35	V31-L33 PolarHBondContact O-N 2.83Å; L33-L35 PolarHBondContact O-N 3.07Å
34	P	34.1	Very low	48.8	Very low	108 Å²	108	122.8 Å²	122.8	70%	0.701	65%	0.648	S	S	*	*			trans	-51.8	122.4	-177.4	1.1	-4.1	0	0	0	106.2	P32 T36	P32-P34 VanDerWaalsContact O-N 3.1Å; P34-T36 PolarHBondContact O-N 3.33Å
35	L	39.2	Very low	51.2	Low	164 Å²	164	114.8 Å²	114.8	86%	0.859	61%	0.613	S	S	*	*			trans	-54.4	98.2	175.2	-76.4	165	0	0	0	105.5	L33 I37	L33-L35 PolarHBondContact O-N 3.07Å; L35-I37 PolarHBondContact O-N 3.28Å
36	T	52.6	Low	53.8	Low	95 Å²	95	108.8 Å²	108.8	58%	0.583	59%	0.589	S	S	*	*			trans	-64.7	97.1	173.2	30.3	0	0	0	0	104.6	P34 V38	P34-T36 PolarHBondContact O-N 3.33Å; T36-V38 VanDerWaalsContact C-N 3.33Å; T36-V38 PolarHBondContact O-N 3.22Å
37	I	57	Low	56.3	Low	134 Å²	134	105.9 Å²	105.9	69%	0.687	58%	0.578	S	S	*	*			trans	-61.5	102.7	177.2	-63.8	171.4	0	0	0	105.3	L35 P39	L35-I37 PolarHBondContact O-N 3.28Å; I37-P39 WeakPolarHBondContact O-CD 3.48Å
38	V	65.6	Low	58.8	Low	75 Å²	75	94.8 Å²	94.8	46%	0.455	54%	0.536	S	S	.	.			trans	-69	123.9	175.6	177.7	0	0	0	0	106.5	T36 V42	T36-V38 VanDerWaalsContact C-N 3.33Å; T36-V38 PolarHBondContact O-N 3.22Å; V38-V42 HydrophobicContact CG1-CB 3.55Å; V38-V42 HydrophobicContact CG1-CG1 3.47Å; V38-V42 VanDerWaalsContact CG1-CG1 3.47Å
39	P	69.3	Low	60.9	Low	31 Å²	31	89.7 Å²	89.7	20%	0.201	51%	0.514	C	S	.	.			trans	-55.8	144.2	178.8	-25.7	33.9	0	0	0	111.4	I37 W41 V42 A43 I312	I37-P39 WeakPolarHBondContact O-CD 3.48Å; P39-W41 HydrophobicContact CB-CG 4.43Å; P39-W41 PolarHBondContact O-N 3.24Å; P39-W41 VanDerWaalsContact O-N 3.13Å; P39-V42 HydrophobicContact CB-CG2 4.18Å; P39-V42 HydrophobicContact CG-CG2 4.29Å; P39-V42 WeakPolarHBondContact O-CA 3.44Å; P39-V42 WeakPolarHBondContact O-CB 3.2Å; P39-V42 PolarHBondContact O-N 2.88Å; P39-A43 PolarHBondContact O-N 3.36Å; P39-A43 VanDerWaalsContact O-N 3.13Å; P39-I312 HydrophobicContact CG-CG2 4.39Å
40	E	74.8	Confident	63	Low	151 Å²	151	83.2 Å²	83.2	71%	0.706	48%	0.482	S	S	*	.	H	α-helix	trans	-52.9	-40.2	-175.5	-172.7	-171.3	166.3	0	0	112.9	V42 A43 N44	E40-V42 VanDerWaalsContact C-N 3.26Å; E40-V42 PolarHBondContact O-N 3.25Å; E40-A43 WeakPolarHBondContact O-CB 3.47Å; E40-A43 PolarHBondContact O-N 2.89Å; E40-A43 VanDerWaalsContact O-N 3.16Å; E40-N44 WeakPolarHBondContact O-CB 3.37Å; E40-N44 PolarHBondContact O-N 3.35Å; E40-N44 PolarHBondContact O-ND2 3.37Å
41	W	78	Confident	64.7	Low	54 Å²	54	85.2 Å²	85.2	21%	0.205	47%	0.471	C	S	.	.	H	α-helix	trans	-66.7	-25.9	178.9	68.5	-95.2	0	0	0	113.6	P39 C109 I312 P321 L323	P39-W41 HydrophobicContact CB-CG 4.43Å; P39-W41 PolarHBondContact O-N 3.24Å; P39-W41 VanDerWaalsContact O-N 3.13Å; W41-C109 HydrophobicContact CH2-CB 4.49Å; W41-C109 HydrophobicContact CZ3-CB 4Å; W41-I312 HydrophobicContact CH2-CD1 3.74Å; W41-I312 HydrophobicContact CH2-CG1 3.9Å; W41-I312 HydrophobicContact CH2-CG2 4.45Å; W41-I312 HydrophobicContact CZ2-CB 4.29Å; W41-I312 HydrophobicContact CZ2-CD1 3.74Å; W41-I312 HydrophobicContact CZ2-CG1 3.84Å; W41-I312 HydrophobicContact CZ2-CG2 3.55Å; W41-P321 HydrophobicContact CB-CG 4.27Å; W41-P321 HydrophobicContact CD2-CB 3.93Å; W41-P321 HydrophobicContact CD2-CG 3.48Å; W41-P321 VanDerWaalsContact CD2-CG 3.48Å; W41-P321 HydrophobicContact CE3-CB 3.86Å; W41-P321 HydrophobicContact CE3-CG 3.96Å; W41-P321 HydrophobicContact CG-CB 4.46Å; W41-P321 HydrophobicContact CG-CG 3.62Å; W41-P321 HydrophobicContact CH2-CB 4.35Å; W41-P321 HydrophobicContact CZ2-CB 4.38Å; W41-P321 HydrophobicContact CZ2-CG 4.13Å; W41-P321 HydrophobicContact CZ3-CB 4.08Å; W41-P321 HydrophobicContact CZ3-CG 4.48Å; W41-L323 HydrophobicContact CE3-CB 3.94Å; W41-L323 HydrophobicContact CZ3-CB 3.81Å; W41-L323 HydrophobicContact CZ3-CD2 4.34Å; W41-L323 HydrophobicContact CZ3-CG 4.45Å
42	V	77.2	Confident	66.6	Low	6 Å²	6	80.7 Å²	80.7	4%	0.036	44%	0.442	C	S	.	.	H	α-helix	trans	-77	-39.3	173.2	179.3	0	0	0	0	109.9	V38 P39 E40 N44 S45 I312 L323	V38-V42 HydrophobicContact CG1-CB 3.55Å; V38-V42 HydrophobicContact CG1-CG1 3.47Å; V38-V42 VanDerWaalsContact CG1-CG1 3.47Å; P39-V42 HydrophobicContact CB-CG2 4.18Å; P39-V42 HydrophobicContact CG-CG2 4.29Å; P39-V42 WeakPolarHBondContact O-CA 3.44Å; P39-V42 WeakPolarHBondContact O-CB 3.2Å; P39-V42 PolarHBondContact O-N 2.88Å; E40-V42 VanDerWaalsContact C-N 3.26Å; E40-V42 PolarHBondContact O-N 3.25Å; V42-N44 VanDerWaalsContact C-N 3.3Å; V42-S45 WeakPolarHBondContact O-CB 3.44Å; V42-S45 PolarHBondContact O-N 3.26Å; V42-I312 HydrophobicContact CG2-CD1 3.74Å; V42-L323 HydrophobicContact CB-CD2 4.4Å; V42-L323 HydrophobicContact CG1-CD2 3.92Å
43	A	74.1	Confident	68.6	Low	69 Å²	69	81.2 Å²	81.2	57%	0.57	44%	0.439	S	S	*	.	H	α-helix	trans	-62	-40.8	173.5	0	0	0	0	0	111.2	P39 E40 S45	P39-A43 PolarHBondContact O-N 3.36Å; P39-A43 VanDerWaalsContact O-N 3.13Å; E40-A43 WeakPolarHBondContact O-CB 3.47Å; E40-A43 PolarHBondContact O-N 2.89Å; E40-A43 VanDerWaalsContact O-N 3.16Å; A43-S45 PolarHBondContact O-N 2.91Å; A43-S45 VanDerWaalsContact O-N 3.16Å
44	N	80.9	Confident	70.2	Confident	105 Å²	105	81.5 Å²	81.5	56%	0.561	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	32.1	178.5	-67.7	-29	0	0	0	113.6	E40 V42	E40-N44 WeakPolarHBondContact O-CB 3.37Å; E40-N44 PolarHBondContact O-N 3.35Å; E40-N44 PolarHBondContact O-ND2 3.37Å; V42-N44 VanDerWaalsContact C-N 3.3Å
45	S	82.8	Confident	72.1	Confident	20 Å²	20	78.9 Å²	78.9	14%	0.14	41%	0.414	C	S	.	.			trans	-66.9	141.6	178.9	67.8	0	0	0	0	112.8	V42 A43 I47 L323	V42-S45 WeakPolarHBondContact O-CB 3.44Å; V42-S45 PolarHBondContact O-N 3.26Å; A43-S45 PolarHBondContact O-N 2.91Å; A43-S45 VanDerWaalsContact O-N 3.16Å; S45-I47 PolarHBondContact O-N 3.41Å; S45-L323 CarbonylContact C-O 3.48Å; S45-L323 WeakPolarHBondContact CA-O 3.33Å
46	T	86.7	Confident	74	Confident	62 Å²	62	72.4 Å²	72.4	38%	0.38	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	115.5	170.2	-55.1	0	0	0	0	109.3	L323 F324 R325	T46-L323 PolarHBondContact N-O 3.06Å; T46-F324 HydrophobicContact CG2-CD1 4.05Å; T46-F324 HydrophobicContact CG2-CE1 4.23Å; T46-R325 PolarHBondContact O-N 3.16Å
47	I	83.8	Confident	75.4	Confident	114 Å²	114	68.4 Å²	68.4	59%	0.585	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	119.6	-179.6	-59.1	173.3	0	0	0	109.5	S45 R325 K327	S45-I47 PolarHBondContact O-N 3.41Å; I47-R325 CarbonylContact C-O 3.57Å; I47-R325 WeakPolarHBondContact CA-O 3.33Å; I47-K327 HydrophobicContact CG2-CB 3.79Å; I47-K327 HydrophobicContact CG2-CD 4.5Å; I47-K327 HydrophobicContact CG2-CG 4.06Å
48	V	82.3	Confident	76.6	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.018	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	143.1	-179.2	-177.1	0	0	0	0	110.8	P84 I85 E88 F324 R325 S326 K327	V48-P84 HydrophobicContact CG1-CB 3.96Å; V48-P84 WeakPolarHBondContact CG1-O 3.36Å; V48-I85 HydrophobicContact CB-CD1 4.03Å; V48-I85 HydrophobicContact CG1-CB 4.44Å; V48-I85 HydrophobicContact CG1-CD1 4.17Å; V48-I85 HydrophobicContact CG2-CD1 3.79Å; V48-E88 HydrophobicContact CB-CG 4.45Å; V48-E88 HydrophobicContact CG1-CB 4.32Å; V48-E88 HydrophobicContact CG1-CG 3.84Å; V48-E88 HydrophobicContact CG2-CB 3.88Å; V48-E88 HydrophobicContact CG2-CG 3.93Å; V48-F324 HydrophobicContact CG2-CD1 4.42Å; V48-R325 PolarHBondContact N-O 3Å; V48-S326 WeakPolarHBondContact O-CA 2.92Å; V48-K327 PolarHBondContact O-N 3.29Å
49	S	79.6	Confident	77.4	Confident	41 Å²	41	60.5 Å²	60.5	29%	0.287	32%	0.317	S	S	.	.			trans	-63.7	154.9	176	-170.3	0	0	0	0	112.9	R51 D55 P84	S49-R51 PolarHBondContact OG-N 2.9Å; S49-D55 WeakPolarHBondContact CB-OD2 3.3Å; S49-D55 PolarHBondContact OG-OD2 3.3Å; S49-P84 VanDerWaalsContact O-CB 3.28Å; S49-P84 WeakPolarHBondContact O-CB 3.4Å
50	R	71.6	Confident	77.9	Confident	41 Å²	41	65.4 Å²	65.4	16%	0.155	34%	0.337	C	S	.	.			trans	-102.5	-11	175.4	-158.4	-171.4	-67	169.1	1.6	113	I52 K327 T341 F342	R50-I52 VanDerWaalsContact C-N 3.28Å; R50-I52 PolarHBondContact O-N 2.98Å; R50-K327 PolarHBondContact NH2-O 3.24Å; R50-T341 VanDerWaalsContact CZ-CG2 3.45Å; R50-F342 WeakPolarHBondContact CD-O 3.35Å; R50-F342 PolarHBondContact NE-O 3.08Å; R50-F342 PolarHBondContact NH1-O 2.95Å
51	R	70.2	Confident	78.1	Confident	131 Å²	131	64.6 Å²	64.6	49%	0.494	33%	0.333	S	S	.	.			trans	-77.9	80.4	-170.3	-58.8	171.8	172.8	175.6	-0.9	110.2	S49 N53 K54 D55	S49-R51 PolarHBondContact OG-N 2.9Å; R51-N53 VanDerWaalsContact C-N 3.26Å; R51-N53 PolarHBondContact O-N 2.9Å; R51-K54 HydrophobicContact CB-CB 4.03Å; R51-K54 PolarHBondContact O-N 3.3Å; R51-D55 WeakPolarHBondContact CB-OD2 3.48Å; R51-D55 WeakPolarHBondContact O-CB 3.47Å; R51-D55 PolarHBondContact O-N 3.04Å
52	I	71.3	Confident	78	Confident	24 Å²	24	62.8 Å²	62.8	12%	0.123	33%	0.327	C	S	.	.	H	α-helix	trans	-51.9	-47.8	-178.9	-65.8	170	0	0	0	110.1	R50 K54 S56 F83	R50-I52 VanDerWaalsContact C-N 3.28Å; R50-I52 PolarHBondContact O-N 2.98Å; I52-K54 VanDerWaalsContact C-N 3.27Å; I52-K54 PolarHBondContact O-N 3.29Å; I52-S56 WeakPolarHBondContact O-CB 3.34Å; I52-S56 PolarHBondContact O-N 3.46Å; I52-S56 PolarHBondContact O-OG 2.98Å; I52-F83 HydrophobicContact CG2-CD1 3.51Å; I52-F83 HydrophobicContact CG2-CE1 3.56Å; I52-F83 HydrophobicContact CG2-CG 4.22Å; I52-F83 HydrophobicContact CG2-CZ 4.3Å
53	N	71.3	Confident	77.9	Confident	123 Å²	123	65 Å²	65	66%	0.658	35%	0.346	S	S	*	.	H	α-helix	trans	-71	-19.8	-175.6	-58	-2.5	0	0	0	114.2	R51	R51-N53 VanDerWaalsContact C-N 3.26Å; R51-N53 PolarHBondContact O-N 2.9Å
54	K	71.1	Confident	78.1	Confident	161 Å²	161	66.7 Å²	66.7	70%	0.7	36%	0.36	S	S	*	.	H	α-helix	trans	-106.1	-35.7	-175.6	-66.8	-170.6	174	-172.5	0	113.6	R51 I52	R51-K54 HydrophobicContact CB-CB 4.03Å; R51-K54 PolarHBondContact O-N 3.3Å; I52-K54 VanDerWaalsContact C-N 3.27Å; I52-K54 PolarHBondContact O-N 3.29Å
55	D	75.1	Confident	78.1	Confident	53 Å²	53	64.8 Å²	64.8	28%	0.283	35%	0.349	S	S	.	.	H	α-helix	trans	-112.3	6	-168.1	-54.5	-19.4	0	0	0	112.1	S49 R51 P84	S49-D55 WeakPolarHBondContact CB-OD2 3.3Å; S49-D55 PolarHBondContact OG-OD2 3.3Å; R51-D55 WeakPolarHBondContact CB-OD2 3.48Å; R51-D55 WeakPolarHBondContact O-CB 3.47Å; R51-D55 PolarHBondContact O-N 3.04Å; D55-P84 HydrophobicContact CB-CG 4.01Å
56	S	78.7	Confident	78.3	Confident	27 Å²	27	64 Å²	64	19%	0.189	34%	0.344	C	S	.	.			trans	-74.1	153.5	169.3	-61.7	0	0	0	0	111	I52 L82	I52-S56 WeakPolarHBondContact O-CB 3.34Å; I52-S56 PolarHBondContact O-N 3.46Å; I52-S56 PolarHBondContact O-OG 2.98Å; S56-L82 VanDerWaalsContact CA-O 3.25Å; S56-L82 WeakPolarHBondContact CA-O 3.27Å; S56-L82 WeakPolarHBondContact CB-O 3.37Å; S56-L82 PolarHBondContact OG-O 2.98Å
57	V	81.4	Confident	78.2	Confident	12 Å²	12	62.2 Å²	62.2	7%	0.073	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	143.4	-174.5	160.2	0	0	0	0	110	E61 M62 V81 L82 K87	V57-E61 HydrophobicContact CG1-CB 3.69Å; V57-E61 HydrophobicContact CG1-CG 4.2Å; V57-E61 VanDerWaalsContact CG1-OE2 3.28Å; V57-E61 WeakPolarHBondContact CG1-OE2 3.31Å; V57-M62 HydrophobicContact CG1-CG 4.47Å; V57-V81 CarbonylContact O-C 3.53Å; V57-V81 WeakPolarHBondContact O-CA 3.38Å; V57-L82 PolarHBondContact N-O 3.42Å; V57-L82 VanDerWaalsContact N-O 3.08Å; V57-L82 PolarHBondContact O-N 3.32Å; V57-K87 HydrophobicContact CB-CD 4.22Å; V57-K87 HydrophobicContact CB-CG 4.32Å; V57-K87 HydrophobicContact CG2-CD 3.5Å; V57-K87 HydrophobicContact CG2-CG 4.09Å
58	S	83.2	Confident	78.4	Confident	39 Å²	39	60.6 Å²	60.6	27%	0.273	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	141.9	174.2	177.8	0	0	0	0	110.3	E60 E61	S58-E60 PolarHBondContact O-N 3.21Å; S58-E60 VanDerWaalsContact O-N 3.14Å; S58-E60 PolarHBondContact OG-N 3.12Å; S58-E61 PolarHBondContact O-N 2.92Å
59	L	81.6	Confident	78.7	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.016	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-58.6	-26.1	175.1	-176.2	63.6	0	0	0	112.3	M62 A63 V71 L74 K75 T80 L82	L59-M62 PolarHBondContact O-N 3.24Å; L59-M62 VanDerWaalsContact O-N 3.14Å; L59-A63 PolarHBondContact O-N 3.49Å; L59-V71 HydrophobicContact CD2-CG1 4.01Å; L59-V71 HydrophobicContact CG-CG1 4.14Å; L59-L74 HydrophobicContact CD1-CB 4.46Å; L59-L74 HydrophobicContact CD1-CD1 3.77Å; L59-L74 HydrophobicContact CD2-CB 3.82Å; L59-K75 HydrophobicContact CD2-CG 3.71Å; L59-T80 WeakPolarHBondContact CB-O 3.49Å; L59-T80 PolarHBondContact N-O 2.99Å; L59-L82 HydrophobicContact CD1-CD1 4.38Å; L59-L82 HydrophobicContact CD1-CD2 4.38Å; L59-L82 HydrophobicContact CD1-CG 4.35Å
60	E	79.2	Confident	79.1	Confident	135 Å²	135	60.5 Å²	60.5	63%	0.631	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-66.1	-36.2	179.7	-64	175.4	168.5	0	0	112.7	S58 M62 A63	S58-E60 PolarHBondContact O-N 3.21Å; S58-E60 VanDerWaalsContact O-N 3.14Å; S58-E60 PolarHBondContact OG-N 3.12Å; E60-M62 PolarHBondContact O-N 3.4Å; E60-A63 VanDerWaalsContact O-CB 3.26Å; E60-A63 WeakPolarHBondContact O-CB 3.36Å; E60-A63 PolarHBondContact O-N 3.22Å; E60-A63 VanDerWaalsContact O-N 3.1Å
61	E	79.3	Confident	79.9	Confident	134 Å²	134	59.2 Å²	59.2	63%	0.626	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-63.9	-23.1	175.3	-67.3	173.4	-134.9	0	0	111.7	V57 S58	V57-E61 HydrophobicContact CG1-CB 3.69Å; V57-E61 HydrophobicContact CG1-CG 4.2Å; V57-E61 VanDerWaalsContact CG1-OE2 3.28Å; V57-E61 WeakPolarHBondContact CG1-OE2 3.31Å; S58-E61 PolarHBondContact O-N 2.92Å
62	M	77.4	Confident	80.8	Confident	16 Å²	16	58.1 Å²	58.1	8%	0.079	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-94.8	-4.6	179.3	-69.2	-80.1	-74.4	0	0	113.3	V57 L59 E60 A64 L65 L66 L82 I90 P91	V57-M62 HydrophobicContact CG1-CG 4.47Å; L59-M62 PolarHBondContact O-N 3.24Å; L59-M62 VanDerWaalsContact O-N 3.14Å; E60-M62 PolarHBondContact O-N 3.4Å; M62-A64 PolarHBondContact O-N 3.23Å; M62-L65 HydrophobicContact CE-CD2 4.32Å; M62-L65 PolarHBondContact O-N 3.46Å; M62-L66 PolarHBondContact O-N 2.87Å; M62-L82 HydrophobicContact CB-CD1 4.3Å; M62-L82 HydrophobicContact CE-CD1 3.88Å; M62-L82 HydrophobicContact CG-CD1 3.81Å; M62-I90 HydrophobicContact CE-CB 4.42Å; M62-I90 HydrophobicContact CE-CG2 4.23Å; M62-P91 HydrophobicContact CE-CG 3.43Å; M62-P91 VanDerWaalsContact CE-CG 3.43Å; M62-P91 HydrophobicContact SD-CG 3.83Å
63	A	74	Confident	81.6	Confident	51 Å²	51	57 Å²	57	42%	0.421	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-21	178.8	0	0	0	0	0	113	L59 E60 L65 L66 V71	L59-A63 PolarHBondContact O-N 3.49Å; E60-A63 VanDerWaalsContact O-CB 3.26Å; E60-A63 WeakPolarHBondContact O-CB 3.36Å; E60-A63 PolarHBondContact O-N 3.22Å; E60-A63 VanDerWaalsContact O-N 3.1Å; A63-L65 VanDerWaalsContact C-N 3.31Å; A63-L66 VanDerWaalsContact O-O 3.05Å; A63-V71 HydrophobicContact CB-CG2 4.47Å
64	A	78.5	Confident	82.5	Confident	105 Å²	105	51.2 Å²	51.2	87%	0.868	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-27.6	173	0	0	0	0	0	112.8	M62	M62-A64 PolarHBondContact O-N 3.23Å
65	L	81.9	Confident	83.3	Confident	65 Å²	65	48.7 Å²	48.7	34%	0.34	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-37.9	-176.9	-173.2	67.6	0	0	0	112.4	M62 A63 P91 V94	M62-L65 HydrophobicContact CE-CD2 4.32Å; M62-L65 PolarHBondContact O-N 3.46Å; A63-L65 VanDerWaalsContact C-N 3.31Å; L65-P91 HydrophobicContact CD2-CB 3.41Å; L65-P91 VanDerWaalsContact CD2-CB 3.41Å; L65-P91 HydrophobicContact CD2-CG 3.75Å; L65-V94 HydrophobicContact CD1-CG1 3.94Å; L65-V94 HydrophobicContact CG-CG1 4.19Å
66	L	85.7	Confident	83.9	Confident	3 Å²	3	49 Å²	49	2%	0.016	29%	0.289	C	S	.	.	S	Bend	trans	-97.5	130.4	-179	-64.8	177.4	0	0	0	110.3	M62 A63 V71 L74 I90 V94 V124	M62-L66 PolarHBondContact O-N 2.87Å; A63-L66 VanDerWaalsContact O-O 3.05Å; L66-V71 HydrophobicContact CB-CG2 3.94Å; L66-L74 HydrophobicContact CD1-CD1 4.38Å; L66-I90 HydrophobicContact CD1-CG2 4.46Å; L66-I90 HydrophobicContact CD2-CG2 4.17Å; L66-V94 HydrophobicContact CD2-CG2 4.42Å; L66-V124 HydrophobicContact CD1-CG1 3.95Å; L66-V124 HydrophobicContact CD2-CG1 3.92Å
67	P	85.7	Confident	84	Confident	26 Å²	26	49.4 Å²	49.4	17%	0.169	29%	0.292	C	S	.	.			trans	-56.7	153.4	173.5	-28.7	36.9	0	0	0	114.6	D69 I70 V71 H128 R131	P67-D69 WeakPolarHBondContact CB-OD1 3.47Å; P67-D69 PolarHBondContact O-N 2.78Å; P67-I70 HydrophobicContact CG-CD1 4.43Å; P67-I70 PolarHBondContact O-N 2.84Å; P67-I70 VanDerWaalsContact O-N 3.11Å; P67-V71 PolarHBondContact O-N 3.12Å; P67-V71 VanDerWaalsContact O-N 3.13Å; P67-H128 VanDerWaalsContact CD-CE1 3.42Å; P67-H128 WeakPolarHBondContact CD-CE1 3.47Å; P67-H128 WeakPolarHBondContact CD-ND1 3.49Å; P67-R131 VanDerWaalsContact CG-NH1 3.27Å; P67-R131 VanDerWaalsContact CG-NH2 3.26Å
68	A	87.1	Confident	84.1	Confident	80 Å²	80	51.7 Å²	51.7	66%	0.661	32%	0.317	S	S	*	.	H	α-helix	trans	-59.6	-38.5	-171.4	0	0	0	0	0	114.5	I70 V71 E72	A68-I70 VanDerWaalsContact C-N 3.33Å; A68-I70 PolarHBondContact O-N 3.16Å; A68-V71 PolarHBondContact O-N 3.02Å; A68-E72 WeakPolarHBondContact O-CB 3.5Å; A68-E72 PolarHBondContact O-N 3.3Å
69	D	88	Confident	84.2	Confident	40 Å²	40	51 Å²	51	21%	0.214	31%	0.31	C	S	.	.	H	α-helix	trans	-59.4	-39.5	175.8	53.6	-40.6	0	0	0	112.8	P67 S73 R131 H163	P67-D69 WeakPolarHBondContact CB-OD1 3.47Å; P67-D69 PolarHBondContact O-N 2.78Å; D69-S73 WeakPolarHBondContact O-CB 3.22Å; D69-S73 PolarHBondContact O-N 3.41Å; D69-S73 PolarHBondContact O-OG 3.03Å; D69-R131 VanDerWaalsContact CG-NH1 3.25Å; D69-R131 IonicContact OD1-NH1 3.52Å; D69-R131 PolarHBondContact OD1-NH1 3.2Å; D69-R131 IonicContact OD2-NH1 2.98Å; D69-R131 PolarHBondContact OD2-NH1 2.95Å; D69-H163 HydrophobicContact CB-CB 4.38Å
70	I	88.5	Confident	84.2	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	34%	0.34	C	S	.	.	H	α-helix	trans	-74.4	-42.6	178.1	-56.8	-179.5	0	0	0	110.1	P67 A68 E72 S73 L74 V124 H128	P67-I70 HydrophobicContact CG-CD1 4.43Å; P67-I70 PolarHBondContact O-N 2.84Å; P67-I70 VanDerWaalsContact O-N 3.11Å; A68-I70 VanDerWaalsContact C-N 3.33Å; A68-I70 PolarHBondContact O-N 3.16Å; I70-E72 VanDerWaalsContact C-N 3.32Å; I70-E72 PolarHBondContact O-N 3.39Å; I70-S73 WeakPolarHBondContact O-CB 3.43Å; I70-S73 PolarHBondContact O-N 2.93Å; I70-L74 HydrophobicContact CG2-CD1 4.2Å; I70-L74 HydrophobicContact CG2-CG 4.49Å; I70-L74 VanDerWaalsContact O-CG 3.31Å; I70-L74 WeakPolarHBondContact O-CG 3.5Å; I70-L74 PolarHBondContact O-N 2.95Å; I70-V124 HydrophobicContact CG2-CG1 4Å; I70-H128 VanDerWaalsContact CD1-CA 3.42Å; I70-H128 HydrophobicContact CD1-CB 3.48Å; I70-H128 VanDerWaalsContact CD1-CB 3.48Å
71	V	89.3	Confident	84.6	Confident	13 Å²	13	52.2 Å²	52.2	8%	0.079	33%	0.327	C	S	.	.	H	α-helix	trans	-60.2	-44.3	176.1	173.9	0	0	0	0	110.4	L59 A63 L66 P67 A68 L74 K75	L59-V71 HydrophobicContact CD2-CG1 4.01Å; L59-V71 HydrophobicContact CG-CG1 4.14Å; A63-V71 HydrophobicContact CB-CG2 4.47Å; L66-V71 HydrophobicContact CB-CG2 3.94Å; P67-V71 PolarHBondContact O-N 3.12Å; P67-V71 VanDerWaalsContact O-N 3.13Å; A68-V71 PolarHBondContact O-N 3.02Å; V71-L74 PolarHBondContact O-N 2.75Å; V71-K75 HydrophobicContact CG1-CD 4.36Å; V71-K75 WeakPolarHBondContact O-CG 3.46Å; V71-K75 PolarHBondContact O-N 2.97Å
72	E	89	Confident	85	Confident	109 Å²	109	45.9 Å²	45.9	51%	0.509	30%	0.297	S	S	.	.	H	α-helix	trans	-63.6	-43.6	175.7	-172	175.4	-166.5	0	0	111.7	A68 I70 L74 K75 S76 H163	A68-E72 WeakPolarHBondContact O-CB 3.5Å; A68-E72 PolarHBondContact O-N 3.3Å; I70-E72 VanDerWaalsContact C-N 3.32Å; I70-E72 PolarHBondContact O-N 3.39Å; E72-L74 VanDerWaalsContact C-N 3.33Å; E72-L74 PolarHBondContact O-N 2.97Å; E72-K75 PolarHBondContact O-N 3.33Å; E72-S76 WeakPolarHBondContact O-CB 3.48Å; E72-S76 PolarHBondContact O-N 3.38Å; E72-H163 IonicContact OE1-CE1 3.08Å; E72-H163 IonicContact OE2-CE1 2.7Å; E72-H163 IonicContact OE2-ND1 3.07Å
73	S	88.5	Confident	85.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-56.9	-46.7	174.5	-59.8	0	0	0	0	111.2	D69 I70 S76 C77 C160 H163	D69-S73 WeakPolarHBondContact O-CB 3.22Å; D69-S73 PolarHBondContact O-N 3.41Å; D69-S73 PolarHBondContact O-OG 3.03Å; I70-S73 WeakPolarHBondContact O-CB 3.43Å; I70-S73 PolarHBondContact O-N 2.93Å; S73-S76 PolarHBondContact O-N 2.79Å; S73-S76 PolarHBondContact O-OG 3.07Å; S73-C77 PolarHBondContact O-N 3.19Å; S73-C77 VanDerWaalsContact O-N 3.16Å; S73-C77 PolarHBondContact O-SG 3.32Å; S73-C160 PolarHBondContact OG-O 2.96Å; S73-H163 PolarHBondContact OG-CD2 3.29Å
74	L	89.2	Confident	86.2	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-64.4	-42.3	177.4	-69.6	172	0	0	0	112.4	L59 L66 I70 V71 E72 S76 C77 I79 V124	L59-L74 HydrophobicContact CD1-CB 4.46Å; L59-L74 HydrophobicContact CD1-CD1 3.77Å; L59-L74 HydrophobicContact CD2-CB 3.82Å; L66-L74 HydrophobicContact CD1-CD1 4.38Å; I70-L74 HydrophobicContact CG2-CD1 4.2Å; I70-L74 HydrophobicContact CG2-CG 4.49Å; I70-L74 VanDerWaalsContact O-CG 3.31Å; I70-L74 WeakPolarHBondContact O-CG 3.5Å; I70-L74 PolarHBondContact O-N 2.95Å; V71-L74 PolarHBondContact O-N 2.75Å; E72-L74 VanDerWaalsContact C-N 3.33Å; E72-L74 PolarHBondContact O-N 2.97Å; L74-S76 VanDerWaalsContact C-N 3.32Å; L74-S76 PolarHBondContact O-N 2.99Å; L74-C77 VanDerWaalsContact O-CB 3.28Å; L74-C77 WeakPolarHBondContact O-CB 3.34Å; L74-C77 PolarHBondContact O-N 3.42Å; L74-C77 VanDerWaalsContact O-N 3.09Å; L74-I79 HydrophobicContact CB-CB 4.46Å; L74-I79 HydrophobicContact CD2-CD1 3.68Å; L74-I79 WeakPolarHBondContact O-CB 3.26Å; L74-I79 PolarHBondContact O-N 3.48Å; L74-I79 VanDerWaalsContact O-N 3.09Å; L74-V124 HydrophobicContact CD1-CG2 4.19Å; L74-V124 HydrophobicContact CD2-CG2 3.9Å
75	K	88.6	Confident	86.7	Confident	108 Å²	108	40.3 Å²	40.3	47%	0.47	24%	0.244	S	C	.	.	H	α-helix	trans	-60.6	-42.1	174.1	-73.7	-178.3	178	-173.3	0	111.5	L59 V71 E72 C77 G78	L59-K75 HydrophobicContact CD2-CG 3.71Å; V71-K75 HydrophobicContact CG1-CD 4.36Å; V71-K75 WeakPolarHBondContact O-CG 3.46Å; V71-K75 PolarHBondContact O-N 2.97Å; E72-K75 PolarHBondContact O-N 3.33Å; K75-C77 PolarHBondContact O-N 2.94Å; K75-G78 PolarHBondContact O-N 3.48Å
76	S	86.7	Confident	87.2	Confident	59 Å²	59	37.4 Å²	37.4	41%	0.413	23%	0.229	S	C	.	.	H	α-helix	trans	-64.1	-23.1	176.6	85	0	0	0	0	113.1	E72 S73 L74 G78	E72-S76 WeakPolarHBondContact O-CB 3.48Å; E72-S76 PolarHBondContact O-N 3.38Å; S73-S76 PolarHBondContact O-N 2.79Å; S73-S76 PolarHBondContact O-OG 3.07Å; L74-S76 VanDerWaalsContact C-N 3.32Å; L74-S76 PolarHBondContact O-N 2.99Å; S76-G78 PolarHBondContact O-N 3.29Å
77	C	82.1	Confident	87.4	Confident	37 Å²	37	41 Å²	41	25%	0.25	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-4.2	172.4	-58.9	0	0	0	0	113.6	S73 L74 K75 I79 K159	S73-C77 PolarHBondContact O-N 3.19Å; S73-C77 VanDerWaalsContact O-N 3.16Å; S73-C77 PolarHBondContact O-SG 3.32Å; L74-C77 VanDerWaalsContact O-CB 3.28Å; L74-C77 WeakPolarHBondContact O-CB 3.34Å; L74-C77 PolarHBondContact O-N 3.42Å; L74-C77 VanDerWaalsContact O-N 3.09Å; K75-C77 PolarHBondContact O-N 2.94Å; C77-I79 VanDerWaalsContact C-N 3.32Å; C77-I79 HydrophobicContact CB-CD1 3.83Å; C77-I79 HydrophobicContact CB-CG1 4.02Å; C77-K159 VanDerWaalsContact SG-CB 3.52Å
78	G	82.9	Confident	87.7	Confident	59 Å²	59	43.6 Å²	43.6	61%	0.608	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	15.9	-171.4	0	0	0	0	0	113.8	K75 S76 T80	K75-G78 PolarHBondContact O-N 3.48Å; S76-G78 PolarHBondContact O-N 3.29Å; G78-T80 PolarHBondContact O-N 3.39Å
79	I	84.5	Confident	88	Confident	26 Å²	26	39.8 Å²	39.8	13%	0.133	22%	0.223	C	C	.	.			trans	-87.5	106.2	177.2	-58.8	162	0	0	0	108.1	L74 C77 L82 L120	L74-I79 HydrophobicContact CB-CB 4.46Å; L74-I79 HydrophobicContact CD2-CD1 3.68Å; L74-I79 WeakPolarHBondContact O-CB 3.26Å; L74-I79 PolarHBondContact O-N 3.48Å; L74-I79 VanDerWaalsContact O-N 3.09Å; C77-I79 VanDerWaalsContact C-N 3.32Å; C77-I79 HydrophobicContact CB-CD1 3.83Å; C77-I79 HydrophobicContact CB-CG1 4.02Å; I79-L82 HydrophobicContact CG2-CD2 4.19Å; I79-L120 HydrophobicContact CD1-CD1 3.53Å; I79-L120 HydrophobicContact CD1-CD2 4.41Å; I79-L120 HydrophobicContact CG1-CD1 4.5Å
80	T	82.4	Confident	88.3	Confident	103 Å²	103	37.9 Å²	37.9	63%	0.632	21%	0.213	S	C	*	.			trans	-99.2	-24.8	175.8	53.3	0	0	0	0	112.6	L59 G78	L59-T80 WeakPolarHBondContact CB-O 3.49Å; L59-T80 PolarHBondContact N-O 2.99Å; G78-T80 PolarHBondContact O-N 3.39Å
81	V	86.8	Confident	88.5	Confident	60 Å²	60	39.2 Å²	39.2	36%	0.364	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	135.4	-169.8	171.9	0	0	0	0	109.1	V57	V57-V81 CarbonylContact O-C 3.53Å; V57-V81 WeakPolarHBondContact O-CA 3.38Å
82	L	87.7	Confident	88.7	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	130.5	175.2	-63.9	-177.1	0	0	0	110.7	S56 V57 L59 M62 I79 Q86	S56-L82 VanDerWaalsContact CA-O 3.25Å; S56-L82 WeakPolarHBondContact CA-O 3.27Å; S56-L82 WeakPolarHBondContact CB-O 3.37Å; S56-L82 PolarHBondContact OG-O 2.98Å; V57-L82 PolarHBondContact N-O 3.42Å; V57-L82 VanDerWaalsContact N-O 3.08Å; V57-L82 PolarHBondContact O-N 3.32Å; L59-L82 HydrophobicContact CD1-CD1 4.38Å; L59-L82 HydrophobicContact CD1-CD2 4.38Å; L59-L82 HydrophobicContact CD1-CG 4.35Å; M62-L82 HydrophobicContact CB-CD1 4.3Å; M62-L82 HydrophobicContact CE-CD1 3.88Å; M62-L82 HydrophobicContact CG-CD1 3.81Å; I79-L82 HydrophobicContact CG2-CD2 4.19Å; L82-Q86 HydrophobicContact CB-CB 4.17Å; L82-Q86 HydrophobicContact CD2-CB 4.48Å
83	F	89.3	Confident	88.9	Confident	46 Å²	46	38.7 Å²	38.7	20%	0.202	21%	0.214	C	C	.	.			trans	-67.3	158.6	177.8	-63.7	-17	0	0	0	111.8	I52 I85 Q86 K87 S116 A465	I52-F83 HydrophobicContact CG2-CD1 3.51Å; I52-F83 HydrophobicContact CG2-CE1 3.56Å; I52-F83 HydrophobicContact CG2-CG 4.22Å; I52-F83 HydrophobicContact CG2-CZ 4.3Å; F83-I85 VanDerWaalsContact C-N 3.25Å; F83-I85 PolarHBondContact O-N 3.11Å; F83-I85 VanDerWaalsContact O-N 3.1Å; F83-Q86 HydrophobicContact CB-CG 4.45Å; F83-Q86 WeakPolarHBondContact O-CA 3.43Å; F83-Q86 WeakPolarHBondContact O-CB 3.39Å; F83-Q86 PolarHBondContact O-N 3.34Å; F83-K87 PolarHBondContact O-N 3.21Å; F83-S116 WeakPolarHBondContact CD2-O 3.43Å; F83-A465 HydrophobicContact CE2-CB 4.26Å; F83-A465 HydrophobicContact CZ-CB 3.71Å
84	P	88	Confident	89.1	Confident	6 Å²	6	39 Å²	39	4%	0.039	22%	0.215	C	C	.	.	H	α-helix	trans	-54.2	-38.4	-174.2	-29.4	36.1	0	0	0	114.2	V48 S49 D55 K87 E88	V48-P84 HydrophobicContact CG1-CB 3.96Å; V48-P84 WeakPolarHBondContact CG1-O 3.36Å; S49-P84 VanDerWaalsContact O-CB 3.28Å; S49-P84 WeakPolarHBondContact O-CB 3.4Å; D55-P84 HydrophobicContact CB-CG 4.01Å; P84-K87 PolarHBondContact O-N 3.42Å; P84-E88 WeakPolarHBondContact O-CG 3.43Å; P84-E88 PolarHBondContact O-N 3.03Å; P84-E88 VanDerWaalsContact O-N 3.09Å
85	I	89.8	Confident	89.1	Confident	2 Å²	2	42 Å²	42	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-67.9	-34.5	176.3	-163.6	62.2	0	0	0	112.8	V48 F83 V89 I110 S116 F324	V48-I85 HydrophobicContact CB-CD1 4.03Å; V48-I85 HydrophobicContact CG1-CB 4.44Å; V48-I85 HydrophobicContact CG1-CD1 4.17Å; V48-I85 HydrophobicContact CG2-CD1 3.79Å; F83-I85 VanDerWaalsContact C-N 3.25Å; F83-I85 PolarHBondContact O-N 3.11Å; F83-I85 VanDerWaalsContact O-N 3.1Å; I85-V89 HydrophobicContact CD1-CG2 3.84Å; I85-V89 HydrophobicContact CG1-CG2 4.07Å; I85-V89 WeakPolarHBondContact O-CB 3.43Å; I85-V89 WeakPolarHBondContact O-CG2 3.22Å; I85-V89 PolarHBondContact O-N 2.98Å; I85-I110 HydrophobicContact CD1-CG2 4.26Å; I85-I110 HydrophobicContact CG1-CG2 4.02Å; I85-S116 WeakPolarHBondContact CG2-O 3.44Å; I85-F324 HydrophobicContact CD1-CB 4.01Å
86	Q	92.3	Very high	89.2	Confident	5 Å²	5	38.4 Å²	38.4	2%	0.023	21%	0.213	C	C	.	.	H	α-helix	trans	-70.8	-43.2	176.6	-63.8	164.7	-10.1	0	0	110.3	L82 F83 E88 V89 I90 G117 L120	L82-Q86 HydrophobicContact CB-CB 4.17Å; L82-Q86 HydrophobicContact CD2-CB 4.48Å; F83-Q86 HydrophobicContact CB-CG 4.45Å; F83-Q86 WeakPolarHBondContact O-CA 3.43Å; F83-Q86 WeakPolarHBondContact O-CB 3.39Å; F83-Q86 PolarHBondContact O-N 3.34Å; Q86-E88 VanDerWaalsContact C-N 3.32Å; Q86-E88 PolarHBondContact O-N 3.22Å; Q86-V89 PolarHBondContact O-N 3.48Å; Q86-I90 HydrophobicContact CB-CD1 3.87Å; Q86-I90 HydrophobicContact CG-CD1 4.48Å; Q86-I90 VanDerWaalsContact O-CB 3.27Å; Q86-I90 WeakPolarHBondContact O-CB 3.38Å; Q86-I90 VanDerWaalsContact O-CG1 3.3Å; Q86-I90 WeakPolarHBondContact O-CG1 3.31Å; Q86-I90 PolarHBondContact O-N 3.12Å; Q86-G117 VanDerWaalsContact NE2-CA 3.31Å; Q86-G117 PolarHBondContact NE2-O 3.45Å; Q86-L120 HydrophobicContact CG-CB 4.4Å
87	K	89.4	Confident	89.2	Confident	79 Å²	79	36.8 Å²	36.8	34%	0.343	20%	0.2	S	C	.	.	H	α-helix	trans	-56.5	-42.8	175.3	-179.1	-161.6	176.4	165.8	0	112.4	V57 F83 P84 P91	V57-K87 HydrophobicContact CB-CD 4.22Å; V57-K87 HydrophobicContact CB-CG 4.32Å; V57-K87 HydrophobicContact CG2-CD 3.5Å; V57-K87 HydrophobicContact CG2-CG 4.09Å; F83-K87 PolarHBondContact O-N 3.21Å; P84-K87 PolarHBondContact O-N 3.42Å; K87-P91 WeakPolarHBondContact O-CD 3.41Å; K87-P91 WeakPolarHBondContact O-CG 3.39Å
88	E	91.2	Very high	89.4	Confident	79 Å²	79	39.8 Å²	39.8	37%	0.369	22%	0.217	S	C	.	.	H	α-helix	trans	-80.6	-39.6	-178.5	-68.6	-60.9	141.7	0	0	112.5	V48 P84 Q86	V48-E88 HydrophobicContact CB-CG 4.45Å; V48-E88 HydrophobicContact CG1-CB 4.32Å; V48-E88 HydrophobicContact CG1-CG 3.84Å; V48-E88 HydrophobicContact CG2-CB 3.88Å; V48-E88 HydrophobicContact CG2-CG 3.93Å; P84-E88 WeakPolarHBondContact O-CG 3.43Å; P84-E88 PolarHBondContact O-N 3.03Å; P84-E88 VanDerWaalsContact O-N 3.09Å; Q86-E88 VanDerWaalsContact C-N 3.32Å; Q86-E88 PolarHBondContact O-N 3.22Å
89	V	94.6	Very high	89.3	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-82.1	-46.8	-171	175.6	0	0	0	0	112.4	I85 Q86 R92 I93 V108 I110 C121 F324	I85-V89 HydrophobicContact CD1-CG2 3.84Å; I85-V89 HydrophobicContact CG1-CG2 4.07Å; I85-V89 WeakPolarHBondContact O-CB 3.43Å; I85-V89 WeakPolarHBondContact O-CG2 3.22Å; I85-V89 PolarHBondContact O-N 2.98Å; Q86-V89 PolarHBondContact O-N 3.48Å; V89-R92 PolarHBondContact O-N 3.46Å; V89-I93 HydrophobicContact CG1-CD1 3.38Å; V89-I93 HydrophobicContact CG1-CG1 4.16Å; V89-I93 WeakPolarHBondContact O-CG1 3.42Å; V89-I93 PolarHBondContact O-N 3.36Å; V89-I93 VanDerWaalsContact O-N 3.09Å; V89-V108 HydrophobicContact CG1-CG1 4.48Å; V89-I110 HydrophobicContact CG1-CD1 3.91Å; V89-I110 HydrophobicContact CG2-CD1 4.47Å; V89-C121 HydrophobicContact CB-CB 4.14Å; V89-C121 HydrophobicContact CG1-CB 3.74Å; V89-F324 HydrophobicContact CG2-CB 3.77Å; V89-F324 HydrophobicContact CG2-CD1 3.65Å; V89-F324 HydrophobicContact CG2-CD2 3.9Å; V89-F324 HydrophobicContact CG2-CE1 4.14Å; V89-F324 HydrophobicContact CG2-CE2 4.37Å; V89-F324 HydrophobicContact CG2-CG 3.5Å; V89-F324 HydrophobicContact CG2-CZ 4.47Å
90	I	94.5	Very high	89	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-49.7	-173	-65.5	171.4	0	0	0	110.8	M62 L66 Q86 R92 I93 V94 V124 P125	M62-I90 HydrophobicContact CE-CB 4.42Å; M62-I90 HydrophobicContact CE-CG2 4.23Å; L66-I90 HydrophobicContact CD1-CG2 4.46Å; L66-I90 HydrophobicContact CD2-CG2 4.17Å; Q86-I90 HydrophobicContact CB-CD1 3.87Å; Q86-I90 HydrophobicContact CG-CD1 4.48Å; Q86-I90 VanDerWaalsContact O-CB 3.27Å; Q86-I90 WeakPolarHBondContact O-CB 3.38Å; Q86-I90 VanDerWaalsContact O-CG1 3.3Å; Q86-I90 WeakPolarHBondContact O-CG1 3.31Å; Q86-I90 PolarHBondContact O-N 3.12Å; I90-R92 VanDerWaalsContact C-N 3.32Å; I90-R92 PolarHBondContact O-N 3.23Å; I90-I93 PolarHBondContact O-N 3.05Å; I90-V94 WeakPolarHBondContact O-CG2 3.32Å; I90-V94 PolarHBondContact O-N 2.85Å; I90-V94 VanDerWaalsContact O-N 3.14Å; I90-V124 HydrophobicContact CD1-CB 4.17Å; I90-V124 HydrophobicContact CD1-CG1 4.41Å; I90-V124 HydrophobicContact CD1-CG2 4.39Å; I90-V124 HydrophobicContact CG2-CG1 4.03Å; I90-P125 HydrophobicContact CG1-CG 4.47Å; I90-P125 HydrophobicContact CG2-CG 4.28Å
91	P	92	Very high	88.5	Confident	30 Å²	30	46.3 Å²	46.3	20%	0.195	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-40.4	178.9	-26.7	37.4	0	0	0	114.1	M62 L65 K87 I93 V94 E95	M62-P91 HydrophobicContact CE-CG 3.43Å; M62-P91 VanDerWaalsContact CE-CG 3.43Å; M62-P91 HydrophobicContact SD-CG 3.83Å; L65-P91 HydrophobicContact CD2-CB 3.41Å; L65-P91 VanDerWaalsContact CD2-CB 3.41Å; L65-P91 HydrophobicContact CD2-CG 3.75Å; K87-P91 WeakPolarHBondContact O-CD 3.41Å; K87-P91 WeakPolarHBondContact O-CG 3.39Å; P91-I93 VanDerWaalsContact C-N 3.34Å; P91-I93 PolarHBondContact O-N 3.16Å; P91-V94 PolarHBondContact O-N 3.37Å; P91-E95 WeakPolarHBondContact O-CB 3.48Å; P91-E95 PolarHBondContact O-N 2.86Å
92	R	93	Very high	87.9	Confident	112 Å²	112	47.3 Å²	47.3	42%	0.423	23%	0.229	S	C	.	.	H	α-helix	trans	-63.3	-41.9	-178.6	-129.4	68.1	169.8	132.7	-5.5	111.8	V89 I90 E95 W96 F324	V89-R92 PolarHBondContact O-N 3.46Å; I90-R92 VanDerWaalsContact C-N 3.32Å; I90-R92 PolarHBondContact O-N 3.23Å; R92-E95 IonicContact CZ-OE2 2.68Å; R92-E95 IonicContact NH1-OE1 3.44Å; R92-E95 IonicContact NH1-OE2 3.59Å; R92-E95 PolarHBondContact NH1-OE2 3.28Å; R92-E95 PolarHBondContact O-N 3.3Å; R92-W96 HydrophobicContact CB-CH2 4.12Å; R92-W96 HydrophobicContact CB-CZ2 4.11Å; R92-W96 HydrophobicContact CB-CZ3 4.36Å; R92-W96 HydrophobicContact CG-CD2 4.42Å; R92-W96 HydrophobicContact CG-CH2 3.82Å; R92-W96 HydrophobicContact CG-CZ2 3.37Å; R92-W96 HydrophobicContact CG-CZ3 4.48Å; R92-W96 WeakPolarHBondContact O-CB 3.47Å; R92-W96 PolarHBondContact O-N 3.25Å; R92-F324 HydrophobicContact CB-CE1 4.46Å; R92-F324 HydrophobicContact CB-CZ 3.92Å; R92-F324 HydrophobicContact CG-CZ 4.11Å
93	I	93.7	Very high	87.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-42.7	177.5	-63.1	160.7	0	0	0	110.7	V89 I90 P91 N97 V108 C121 P125 F299	V89-I93 HydrophobicContact CG1-CD1 3.38Å; V89-I93 HydrophobicContact CG1-CG1 4.16Å; V89-I93 WeakPolarHBondContact O-CG1 3.42Å; V89-I93 PolarHBondContact O-N 3.36Å; V89-I93 VanDerWaalsContact O-N 3.09Å; I90-I93 PolarHBondContact O-N 3.05Å; P91-I93 VanDerWaalsContact C-N 3.34Å; P91-I93 PolarHBondContact O-N 3.16Å; I93-N97 WeakPolarHBondContact O-CB 3.41Å; I93-N97 PolarHBondContact O-N 3.45Å; I93-N97 PolarHBondContact O-ND2 3.1Å; I93-V108 HydrophobicContact CG1-CG2 4.17Å; I93-C121 VanDerWaalsContact CD1-O 3.29Å; I93-C121 WeakPolarHBondContact CD1-O 3.39Å; I93-P125 HydrophobicContact CB-CB 4.15Å; I93-P125 HydrophobicContact CB-CG 4.1Å; I93-P125 HydrophobicContact CD1-CB 4.48Å; I93-P125 HydrophobicContact CD1-CG 3.88Å; I93-P125 HydrophobicContact CG2-CB 3.55Å; I93-P125 HydrophobicContact CG2-CG 4.03Å; I93-F299 HydrophobicContact CD1-CE1 3.59Å; I93-F299 HydrophobicContact CD1-CZ 4.26Å; I93-F299 HydrophobicContact CG1-CE1 4.2Å; I93-F299 HydrophobicContact CG2-CZ 4.14Å
94	V	91.8	Very high	87	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.03	23%	0.233	C	C	.	.	H	α-helix	trans	-61.8	-50.6	177.9	174	0	0	0	0	110.1	L65 L66 I90 P91 W96 N97 V98 F129	L65-V94 HydrophobicContact CD1-CG1 3.94Å; L65-V94 HydrophobicContact CG-CG1 4.19Å; L66-V94 HydrophobicContact CD2-CG2 4.42Å; I90-V94 WeakPolarHBondContact O-CG2 3.32Å; I90-V94 PolarHBondContact O-N 2.85Å; I90-V94 VanDerWaalsContact O-N 3.14Å; P91-V94 PolarHBondContact O-N 3.37Å; V94-W96 PolarHBondContact O-N 2.92Å; V94-N97 PolarHBondContact O-N 3.14Å; V94-V98 HydrophobicContact CG1-CG2 4.22Å; V94-V98 WeakPolarHBondContact O-CG2 3.46Å; V94-V98 PolarHBondContact O-N 3.28Å; V94-F129 HydrophobicContact CG1-CZ 4.43Å; V94-F129 HydrophobicContact CG2-CE2 4.47Å
95	E	90.4	Very high	87	Confident	65 Å²	65	47.8 Å²	47.8	30%	0.304	24%	0.235	S	C	.	.	H	α-helix	trans	-54.7	-49.4	178	-177.4	-175.2	-174.4	0	0	112.1	P91 R92 N97 V98 Q99	P91-E95 WeakPolarHBondContact O-CB 3.48Å; P91-E95 PolarHBondContact O-N 2.86Å; R92-E95 IonicContact CZ-OE2 2.68Å; R92-E95 IonicContact NH1-OE1 3.44Å; R92-E95 IonicContact NH1-OE2 3.59Å; R92-E95 PolarHBondContact NH1-OE2 3.28Å; R92-E95 PolarHBondContact O-N 3.3Å; E95-N97 VanDerWaalsContact C-N 3.28Å; E95-N97 PolarHBondContact O-N 3.33Å; E95-V98 PolarHBondContact O-N 2.92Å; E95-Q99 WeakPolarHBondContact O-CB 3.29Å; E95-Q99 PolarHBondContact O-N 3.49Å
96	W	89.9	Confident	87	Confident	32 Å²	32	47.8 Å²	47.8	12%	0.121	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-31.1	-179.1	-65.8	-24.7	0	0	0	114	R92 V94 V105 P106 V108 R322 F324	R92-W96 HydrophobicContact CB-CH2 4.12Å; R92-W96 HydrophobicContact CB-CZ2 4.11Å; R92-W96 HydrophobicContact CB-CZ3 4.36Å; R92-W96 HydrophobicContact CG-CD2 4.42Å; R92-W96 HydrophobicContact CG-CH2 3.82Å; R92-W96 HydrophobicContact CG-CZ2 3.37Å; R92-W96 HydrophobicContact CG-CZ3 4.48Å; R92-W96 WeakPolarHBondContact O-CB 3.47Å; R92-W96 PolarHBondContact O-N 3.25Å; V94-W96 PolarHBondContact O-N 2.92Å; W96-V105 WeakPolarHBondContact O-CG1 3.28Å; W96-P106 HydrophobicContact CD2-CG 3.74Å; W96-P106 HydrophobicContact CE3-CG 3.68Å; W96-P106 HydrophobicContact CG-CG 4.19Å; W96-P106 HydrophobicContact CZ3-CG 4.1Å; W96-V108 HydrophobicContact CZ3-CG2 4.06Å; W96-R322 HydrophobicContact CH2-CB 3.71Å; W96-R322 HydrophobicContact CH2-CG 3.69Å; W96-R322 HydrophobicContact CZ2-CG 4.11Å; W96-R322 HydrophobicContact CZ3-CB 4.25Å; W96-R322 HydrophobicContact CZ3-CG 4.28Å; W96-F324 AromaticContact CH2-CE2 3.81Å; W96-F324 HydrophobicContact CH2-CE2 3.81Å; W96-F324 AromaticContact CH2-CZ 3.66Å; W96-F324 HydrophobicContact CH2-CZ 3.66Å; W96-F324 HydrophobicContact CZ2-CZ 4.5Å; W96-F324 HydrophobicContact CZ3-CE2 4.15Å; W96-F324 HydrophobicContact CZ3-CZ 4.27Å
97	N	87.6	Confident	86.9	Confident	26 Å²	26	47.6 Å²	47.6	14%	0.139	24%	0.235	C	C	.	.	H	α-helix	trans	-89.1	-20.1	-178.6	-86.3	-90.8	0	0	0	113.3	I93 V94 E95 F129 R224 Q297	I93-N97 WeakPolarHBondContact O-CB 3.41Å; I93-N97 PolarHBondContact O-N 3.45Å; I93-N97 PolarHBondContact O-ND2 3.1Å; V94-N97 PolarHBondContact O-N 3.14Å; E95-N97 VanDerWaalsContact C-N 3.28Å; E95-N97 PolarHBondContact O-N 3.33Å; N97-F129 HydrophobicContact CB-CD1 4.25Å; N97-F129 HydrophobicContact CB-CD2 4.11Å; N97-F129 HydrophobicContact CB-CE1 3.55Å; N97-F129 HydrophobicContact CB-CE2 3.39Å; N97-F129 HydrophobicContact CB-CZ 3.09Å; N97-R224 PolarHBondContact OD1-NH2 3.21Å; N97-Q297 PolarHBondContact ND2-OE1 3.29Å
98	V	85.5	Confident	87.1	Confident	100 Å²	100	43.9 Å²	43.9	61%	0.606	22%	0.218	S	C	*	.	H	α-helix	trans	-85.8	-39.6	175	171.6	0	0	0	0	111	V94 E95 F100 F129	V94-V98 HydrophobicContact CG1-CG2 4.22Å; V94-V98 WeakPolarHBondContact O-CG2 3.46Å; V94-V98 PolarHBondContact O-N 3.28Å; E95-V98 PolarHBondContact O-N 2.92Å; V98-F100 PolarHBondContact O-N 3.43Å; V98-F129 HydrophobicContact CG2-CE1 4.13Å; V98-F129 HydrophobicContact CG2-CZ 4.24Å
99	Q	80.9	Confident	87.2	Confident	105 Å²	105	40.1 Å²	40.1	49%	0.491	20%	0.201	S	C	.	.	S	Bend	trans	-69.9	127.7	177.4	-78	177.8	-6.8	0	0	110.9	E95 Q101	E95-Q99 WeakPolarHBondContact O-CB 3.29Å; E95-Q99 PolarHBondContact O-N 3.49Å; Q99-Q101 PolarHBondContact O-N 2.86Å
100	F	77.3	Confident	87	Confident	179 Å²	179	40.1 Å²	40.1	79%	0.785	20%	0.201	S	C	*	.			trans	-62.2	127	167.9	177.5	-98.2	0	0	0	109.6	V98	V98-F100 PolarHBondContact O-N 3.43Å
101	Q	72.7	Confident	86.7	Confident	41 Å²	41	40.2 Å²	40.2	19%	0.192	20%	0.201	C	C	.	.			trans	-125	139.9	173.3	-61.6	-173	11.6	0	0	108.4	Q99 V103	Q99-Q101 PolarHBondContact O-N 2.86Å; Q101-V103 HydrophobicContact CB-CG2 4.45Å; Q101-V103 WeakPolarHBondContact CB-O 3.44Å; Q101-V103 PolarHBondContact O-N 3.09Å; Q101-V103 VanDerWaalsContact O-N 3.09Å
102	P	73.9	Confident	86.3	Confident	81 Å²	81	38.8 Å²	38.8	53%	0.526	19%	0.192	S	C	.	.	S	Bend	trans	-70.3	-2.1	176.9	30.6	-35.8	0	0	0	112.9	L289	P102-L289 HydrophobicContact CB-CD2 4.45Å
103	V	78.2	Confident	85.5	Confident	41 Å²	41	33.9 Å²	33.9	25%	0.248	18%	0.175	C	C	.	.	S	Bend	trans	-129.7	155.7	-179.5	-61	0	0	0	0	108.7	Q101 L288	Q101-V103 HydrophobicContact CB-CG2 4.45Å; Q101-V103 WeakPolarHBondContact CB-O 3.44Å; Q101-V103 PolarHBondContact O-N 3.09Å; Q101-V103 VanDerWaalsContact O-N 3.09Å; V103-L288 HydrophobicContact CB-CD2 4.37Å; V103-L288 HydrophobicContact CG1-CD2 4.02Å
104	P	80.6	Confident	84.8	Confident	9 Å²	9	34.6 Å²	34.6	6%	0.058	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-52.5	154.9	175	-28.4	35.9	0	0	0	113.4	F277 A291 P295 F319	P104-F277 HydrophobicContact CG-CD1 4.26Å; P104-A291 HydrophobicContact CG-CB 4.07Å; P104-P295 HydrophobicContact CB-CB 3.77Å; P104-F319 HydrophobicContact CB-CD1 3.83Å; P104-F319 HydrophobicContact CB-CE1 3.59Å; P104-F319 HydrophobicContact CB-CZ 4.28Å; P104-F319 HydrophobicContact CG-CE1 4.08Å; P104-F319 HydrophobicContact CG-CZ 4.28Å; P104-F319 VanDerWaalsContact O-CE1 3.28Å; P104-F319 WeakPolarHBondContact O-CE1 3.34Å
105	V	86.9	Confident	83.9	Confident	12 Å²	12	35.7 Å²	35.7	7%	0.073	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-64.1	146.8	174.5	-63.7	0	0	0	0	110.5	W96 P295 Q297	W96-V105 WeakPolarHBondContact O-CG1 3.28Å; V105-P295 HydrophobicContact CG2-CB 4.31Å; V105-P295 HydrophobicContact CG2-CG 3.94Å; V105-Q297 HydrophobicContact CG2-CB 3.78Å; V105-Q297 HydrophobicContact CG2-CG 3.9Å
106	P	89.6	Confident	83.2	Confident	3 Å²	3	33.2 Å²	33.2	2%	0.019	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-69.3	145.4	179.4	28	-34.4	0	0	0	112.2	W96 Q297 R320 R322	W96-P106 HydrophobicContact CD2-CG 3.74Å; W96-P106 HydrophobicContact CE3-CG 3.68Å; W96-P106 HydrophobicContact CG-CG 4.19Å; W96-P106 HydrophobicContact CZ3-CG 4.1Å; P106-Q297 PolarHBondContact O-NE2 3.33Å; P106-R320 HydrophobicContact CB-CB 4.13Å; P106-R320 WeakPolarHBondContact CB-O 3.46Å; P106-R322 HydrophobicContact CB-CG 3.82Å; P106-R322 HydrophobicContact CG-CG 4.16Å
107	D	91.8	Very high	83	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-69.7	153.5	168.4	-72.2	-21.3	0	0	0	111.1	K298 L318 F319 P321 R322	D107-K298 WeakPolarHBondContact CA-O 3.3Å; D107-K298 HydrophobicContact CB-CB 4.33Å; D107-K298 WeakPolarHBondContact OD1-CB 3.47Å; D107-K298 PolarHBondContact OD1-N 3.17Å; D107-L318 HydrophobicContact CB-CB 4.36Å; D107-L318 HydrophobicContact CB-CD2 4.2Å; D107-L318 WeakPolarHBondContact OD2-CA 3.37Å; D107-F319 WeakPolarHBondContact CB-O 3.27Å; D107-F319 PolarHBondContact N-O 3.2Å; D107-F319 PolarHBondContact OD2-N 3.31Å; D107-P321 CarbonylContact O-C 3.53Å; D107-P321 WeakPolarHBondContact O-CA 3.28Å; D107-R322 PolarHBondContact O-N 3.14Å
108	V	93.8	Very high	83.1	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	123.4	-169.8	-175.9	0	0	0	0	110.4	V89 I93 W96 I110 K298 F299 L300 F324	V89-V108 HydrophobicContact CG1-CG1 4.48Å; I93-V108 HydrophobicContact CG1-CG2 4.17Å; W96-V108 HydrophobicContact CZ3-CG2 4.06Å; V108-I110 HydrophobicContact CG1-CD1 4.39Å; V108-I110 HydrophobicContact CG1-CG1 4.05Å; V108-K298 PolarHBondContact N-O 2.85Å; V108-F299 HydrophobicContact CB-CD1 3.63Å; V108-F299 HydrophobicContact CB-CE1 3.69Å; V108-F299 HydrophobicContact CB-CG 4.45Å; V108-F299 HydrophobicContact CG1-CD1 4.04Å; V108-F299 HydrophobicContact CG1-CE1 4.09Å; V108-F299 HydrophobicContact CG2-CD1 4.18Å; V108-F299 HydrophobicContact CG2-CE1 3.71Å; V108-F299 HydrophobicContact CG2-CZ 4.24Å; V108-F299 CarbonylContact O-C 3.48Å; V108-F299 VanDerWaalsContact O-CA 3.3Å; V108-F299 WeakPolarHBondContact O-CA 3.34Å; V108-L300 PolarHBondContact O-N 3.43Å; V108-F324 HydrophobicContact CG1-CD2 4.08Å; V108-F324 HydrophobicContact CG1-CE2 4.05Å
109	C	92.2	Very high	83.4	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129.6	175.3	-66.3	0	0	0	0	109.2	W41 L300 L305 R322 L323 F324	W41-C109 HydrophobicContact CH2-CB 4.49Å; W41-C109 HydrophobicContact CZ3-CB 4Å; C109-L300 CarbonylContact C-O 3.53Å; C109-L300 VanDerWaalsContact CA-O 3.31Å; C109-L300 WeakPolarHBondContact CA-O 3.31Å; C109-L305 HydrophobicContact CB-CD2 3.73Å; C109-R322 PolarHBondContact N-O 3.43Å; C109-L323 HydrophobicContact CB-CB 4.36Å; C109-L323 HydrophobicContact CB-CD1 3.64Å; C109-L323 CarbonylContact O-C 3.59Å; C109-L323 WeakPolarHBondContact O-CA 3.29Å; C109-F324 PolarHBondContact O-N 3.41Å
110	I	91.5	Very high	84	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	116	-179.9	-54.3	175.4	0	0	0	108.9	I85 V89 V108 K118 C121 L300 V301 S302	I85-I110 HydrophobicContact CD1-CG2 4.26Å; I85-I110 HydrophobicContact CG1-CG2 4.02Å; V89-I110 HydrophobicContact CG1-CD1 3.91Å; V89-I110 HydrophobicContact CG2-CD1 4.47Å; V108-I110 HydrophobicContact CG1-CD1 4.39Å; V108-I110 HydrophobicContact CG1-CG1 4.05Å; I110-K118 HydrophobicContact CG2-CD 4.11Å; I110-K118 HydrophobicContact CG2-CG 4.14Å; I110-C121 HydrophobicContact CD1-CB 3.54Å; I110-L300 PolarHBondContact N-O 3.18Å; I110-V301 HydrophobicContact CB-CG1 4.35Å; I110-V301 HydrophobicContact CB-CG2 4.39Å; I110-V301 HydrophobicContact CD1-CG2 4.23Å; I110-S302 PolarHBondContact O-N 2.65Å
111	S	87.6	Confident	84.9	Confident	2 Å²	2	15.8 Å²	15.8	1%	0.014	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	101	176	-165.3	0	0	0	0	110.4	S302 A306 F324 R325 S326	S111-S302 WeakPolarHBondContact CA-O 3.39Å; S111-A306 VanDerWaalsContact OG-CB 3.3Å; S111-A306 WeakPolarHBondContact OG-CB 3.46Å; S111-A306 PolarHBondContact OG-N 2.72Å; S111-F324 PolarHBondContact N-O 2.96Å; S111-R325 WeakPolarHBondContact O-CA 3.46Å; S111-S326 PolarHBondContact O-N 2.95Å
112	S	83.5	Confident	86	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	10%	0.095	C	C	.	.			trans	-154	148.5	-176.6	-174.5	0	0	0	0	110.9	S116 K118 S302 A303 S326	S112-S116 WeakPolarHBondContact CB-OG 3.48Å; S112-S116 WeakPolarHBondContact OG-CB 3.33Å; S112-S116 PolarHBondContact OG-OG 3.5Å; S112-K118 WeakPolarHBondContact O-CD 3.43Å; S112-K118 WeakPolarHBondContact O-CE 3.48Å; S112-K118 PolarHBondContact O-NZ 2.88Å; S112-S302 PolarHBondContact N-O 2.77Å; S112-A303 VanDerWaalsContact O-CA 3.28Å; S112-A303 WeakPolarHBondContact O-CA 3.32Å; S112-S326 WeakPolarHBondContact CB-OG 3.49Å; S112-S326 PolarHBondContact OG-OG 3.29Å
113	P	76.9	Confident	87.1	Confident	9 Å²	9	10 Å²	10	6%	0.058	7%	0.07	C	C	.	.			trans	-54.2	161.1	-178.3	13.7	-28.5	0	0	0	113.3	S116 K118 T341	P113-S116 WeakPolarHBondContact O-CB 3.36Å; P113-S116 PolarHBondContact O-N 2.9Å; P113-S116 PolarHBondContact O-OG 3.07Å; P113-K118 PolarHBondContact O-NZ 3.26Å; P113-T341 WeakPolarHBondContact CB-O 3.18Å; P113-T341 HydrophobicContact CG-CG2 3.85Å
114	T	77.2	Confident	87.9	Confident	16 Å²	16	8.1 Å²	8.1	10%	0.098	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	145.5	169.7	54.9	0	0	0	0	110.1	S116 A303 G460	T114-S116 VanDerWaalsContact C-N 3.3Å; T114-S116 PolarHBondContact O-N 3.45Å; T114-A303 HydrophobicContact CG2-CB 4.42Å; T114-G460 VanDerWaalsContact OG1-C 3.24Å; T114-G460 WeakPolarHBondContact OG1-CA 3.41Å; T114-G460 PolarHBondContact OG1-O 2.69Å
115	G	73	Confident	88.6	Confident	28 Å²	28	7.7 Å²	7.7	29%	0.289	6%	0.055	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	1.1	-175.3	0	0	0	0	0	115.3	G117	G115-G117 VanDerWaalsContact C-N 3.28Å
116	S	77	Confident	89	Confident	12 Å²	12	7.1 Å²	7.1	8%	0.084	5%	0.052	C	C	.	.	S	Bend	trans	-82.5	-0.6	173.3	69.1	0	0	0	0	114.4	F83 I85 S112 P113 T114 K118	F83-S116 WeakPolarHBondContact CD2-O 3.43Å; I85-S116 WeakPolarHBondContact CG2-O 3.44Å; S112-S116 WeakPolarHBondContact CB-OG 3.48Å; S112-S116 WeakPolarHBondContact OG-CB 3.33Å; S112-S116 PolarHBondContact OG-OG 3.5Å; P113-S116 WeakPolarHBondContact O-CB 3.36Å; P113-S116 PolarHBondContact O-N 2.9Å; P113-S116 PolarHBondContact O-OG 3.07Å; T114-S116 VanDerWaalsContact C-N 3.3Å; T114-S116 PolarHBondContact O-N 3.45Å; S116-K118 WeakPolarHBondContact OG-CG 3.21Å
117	G	84.5	Confident	89.3	Confident	19 Å²	19	7 Å²	7	20%	0.196	5%	0.051	C	C	.	.			trans	85.8	21	175.8	0	0	0	0	0	116	Q86 G115 T119 L120	Q86-G117 VanDerWaalsContact NE2-CA 3.31Å; Q86-G117 PolarHBondContact NE2-O 3.45Å; G115-G117 VanDerWaalsContact C-N 3.28Å; G117-T119 VanDerWaalsContact C-N 3.25Å; G117-T119 PolarHBondContact O-N 2.92Å; G117-T119 VanDerWaalsContact O-N 3.17Å; G117-L120 PolarHBondContact O-N 2.95Å
118	K	89.6	Confident	89.4	Confident	13 Å²	13	7.9 Å²	7.9	6%	0.057	6%	0.055	C	C	.	.	H	α-helix	trans	-51.1	-36.8	-178.9	-58.7	-169.9	-68.7	-86	0	115.1	I110 S112 P113 S116 L120 C121 V301	I110-K118 HydrophobicContact CG2-CD 4.11Å; I110-K118 HydrophobicContact CG2-CG 4.14Å; S112-K118 WeakPolarHBondContact O-CD 3.43Å; S112-K118 WeakPolarHBondContact O-CE 3.48Å; S112-K118 PolarHBondContact O-NZ 2.88Å; P113-K118 PolarHBondContact O-NZ 3.26Å; S116-K118 WeakPolarHBondContact OG-CG 3.21Å; K118-L120 VanDerWaalsContact C-N 3.3Å; K118-L120 PolarHBondContact O-N 2.98Å; K118-C121 WeakPolarHBondContact O-CB 3.36Å; K118-C121 PolarHBondContact O-N 3.35Å; K118-V301 HydrophobicContact CB-CG1 3.77Å; K118-V301 HydrophobicContact CD-CG1 3.72Å; K118-V301 HydrophobicContact CG-CG1 4.36Å
119	T	93.2	Very high	89.3	Confident	30 Å²	30	9.2 Å²	9.2	18%	0.184	6%	0.061	C	C	.	.	H	α-helix	trans	-57.1	-43.2	-176.7	-54.9	0	0	0	0	112.1	G117 C121 Y122 V123 V153 Q156	G117-T119 VanDerWaalsContact C-N 3.25Å; G117-T119 PolarHBondContact O-N 2.92Å; G117-T119 VanDerWaalsContact O-N 3.17Å; T119-C121 PolarHBondContact O-N 3.21Å; T119-Y122 HydrophobicContact CG2-CE2 4.45Å; T119-Y122 WeakPolarHBondContact O-CD1 3.44Å; T119-Y122 PolarHBondContact O-N 3.2Å; T119-V123 HydrophobicContact CG2-CG2 3.91Å; T119-V123 VanDerWaalsContact O-CG2 3.28Å; T119-V123 WeakPolarHBondContact O-CG2 3.48Å; T119-V123 PolarHBondContact O-N 3.25Å; T119-V123 VanDerWaalsContact O-N 3.12Å; T119-V153 HydrophobicContact CG2-CB 4.47Å; T119-V153 HydrophobicContact CG2-CG1 4.23Å; T119-V153 HydrophobicContact CG2-CG2 3.85Å; T119-Q156 HydrophobicContact CG2-CB 4.26Å; T119-Q156 HydrophobicContact CG2-CG 4.08Å
120	L	93.5	Very high	89.4	Confident	15 Å²	15	9.3 Å²	9.3	8%	0.079	6%	0.062	C	C	.	.	H	α-helix	trans	-68.5	-21.3	-179.6	-67.8	177.2	0	0	0	113.2	I79 Q86 G117 K118 Y122 V123 V124	I79-L120 HydrophobicContact CD1-CD1 3.53Å; I79-L120 HydrophobicContact CD1-CD2 4.41Å; I79-L120 HydrophobicContact CG1-CD1 4.5Å; Q86-L120 HydrophobicContact CG-CB 4.4Å; G117-L120 PolarHBondContact O-N 2.95Å; K118-L120 VanDerWaalsContact C-N 3.3Å; K118-L120 PolarHBondContact O-N 2.98Å; L120-Y122 PolarHBondContact O-N 3.25Å; L120-V123 HydrophobicContact CD2-CB 4.47Å; L120-V124 HydrophobicContact CB-CG2 4.41Å; L120-V124 HydrophobicContact CD2-CG2 4.39Å; L120-V124 WeakPolarHBondContact O-CB 3.38Å; L120-V124 PolarHBondContact O-N 2.88Å; L120-V124 VanDerWaalsContact O-N 3.14Å
121	C	95.4	Very high	89.4	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.2	-27.6	178.3	-61.8	0	0	0	0	113	V89 I93 I110 K118 T119 P125	V89-C121 HydrophobicContact CB-CB 4.14Å; V89-C121 HydrophobicContact CG1-CB 3.74Å; I93-C121 VanDerWaalsContact CD1-O 3.29Å; I93-C121 WeakPolarHBondContact CD1-O 3.39Å; I110-C121 HydrophobicContact CD1-CB 3.54Å; K118-C121 WeakPolarHBondContact O-CB 3.36Å; K118-C121 PolarHBondContact O-N 3.35Å; T119-C121 PolarHBondContact O-N 3.21Å; C121-P125 VanDerWaalsContact O-CD 3.26Å; C121-P125 WeakPolarHBondContact O-CD 3.46Å; C121-P125 VanDerWaalsContact O-CG 3.28Å; C121-P125 WeakPolarHBondContact O-CG 3.3Å
122	Y	97	Very high	89.4	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-107.6	-31.9	174	61.5	-101	0	0	0	112.7	T119 L120 V124 P125 I126 I142 V153 F157 V227 D229 V301	T119-Y122 HydrophobicContact CG2-CE2 4.45Å; T119-Y122 WeakPolarHBondContact O-CD1 3.44Å; T119-Y122 PolarHBondContact O-N 3.2Å; L120-Y122 PolarHBondContact O-N 3.25Å; Y122-V124 PolarHBondContact O-N 3.03Å; Y122-P125 WeakPolarHBondContact O-CD 3.23Å; Y122-I126 HydrophobicContact CD2-CD1 4.23Å; Y122-I126 VanDerWaalsContact O-CB 3.26Å; Y122-I126 WeakPolarHBondContact O-CB 3.27Å; Y122-I126 WeakPolarHBondContact O-CD1 3.44Å; Y122-I126 WeakPolarHBondContact O-CG1 3.29Å; Y122-I126 PolarHBondContact O-N 2.87Å; Y122-I142 HydrophobicContact CE2-CG2 4.29Å; Y122-V153 HydrophobicContact CE2-CG1 4.08Å; Y122-V153 WeakPolarHBondContact OH-CG1 3.47Å; Y122-F157 HydrophobicContact CD2-CZ 4.18Å; Y122-F157 HydrophobicContact CE2-CE2 4.11Å; Y122-F157 HydrophobicContact CE2-CZ 4.19Å; Y122-V227 HydrophobicContact CD1-CG1 3.97Å; Y122-V227 HydrophobicContact CD2-CG1 3.97Å; Y122-V227 HydrophobicContact CD2-CG2 3.99Å; Y122-V227 HydrophobicContact CE1-CG1 3.95Å; Y122-V227 HydrophobicContact CE2-CG1 4.01Å; Y122-V227 HydrophobicContact CG-CG1 3.95Å; Y122-V227 HydrophobicContact CG-CG2 4.23Å; Y122-D229 PolarHBondContact OH-OD2 2.84Å; Y122-V301 HydrophobicContact CD1-CG2 3.88Å; Y122-V301 HydrophobicContact CE1-CG2 4.08Å
123	V	96.5	Very high	89.6	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-58.8	-49.7	178.1	170.7	0	0	0	0	111	T119 L120 I126 V127 Q156 F157 C160	T119-V123 HydrophobicContact CG2-CG2 3.91Å; T119-V123 VanDerWaalsContact O-CG2 3.28Å; T119-V123 WeakPolarHBondContact O-CG2 3.48Å; T119-V123 PolarHBondContact O-N 3.25Å; T119-V123 VanDerWaalsContact O-N 3.12Å; L120-V123 HydrophobicContact CD2-CB 4.47Å; V123-I126 PolarHBondContact O-N 2.83Å; V123-V127 HydrophobicContact CG1-CG2 4.47Å; V123-V127 WeakPolarHBondContact O-CG2 3.49Å; V123-V127 PolarHBondContact O-N 2.91Å; V123-Q156 HydrophobicContact CG2-CB 4.37Å; V123-F157 HydrophobicContact CB-CD1 4.5Å; V123-F157 HydrophobicContact CB-CE1 4.17Å; V123-F157 HydrophobicContact CB-CZ 4.31Å; V123-F157 HydrophobicContact CG1-CD1 3.9Å; V123-F157 HydrophobicContact CG1-CE1 4.03Å; V123-F157 HydrophobicContact CG1-CG 4.35Å; V123-F157 HydrophobicContact CG2-CD1 4.33Å; V123-F157 HydrophobicContact CG2-CD2 4.11Å; V123-F157 HydrophobicContact CG2-CE1 4.02Å; V123-F157 HydrophobicContact CG2-CE2 3.78Å; V123-F157 HydrophobicContact CG2-CG 4.37Å; V123-F157 HydrophobicContact CG2-CZ 3.73Å; V123-C160 HydrophobicContact CG1-CB 3.81Å; V123-C160 VanDerWaalsContact CG1-SG 3.6Å
124	V	94.9	Very high	89.9	Confident	1 Å²	1	26 Å²	26	1%	0.006	15%	0.147	C	C	.	.	H	α-helix	trans	-64.3	-51.1	-175.1	172.1	0	0	0	0	111.7	L66 I70 L74 I90 L120 Y122 I126 V127 H128	L66-V124 HydrophobicContact CD1-CG1 3.95Å; L66-V124 HydrophobicContact CD2-CG1 3.92Å; I70-V124 HydrophobicContact CG2-CG1 4Å; L74-V124 HydrophobicContact CD1-CG2 4.19Å; L74-V124 HydrophobicContact CD2-CG2 3.9Å; I90-V124 HydrophobicContact CD1-CB 4.17Å; I90-V124 HydrophobicContact CD1-CG1 4.41Å; I90-V124 HydrophobicContact CD1-CG2 4.39Å; I90-V124 HydrophobicContact CG2-CG1 4.03Å; L120-V124 HydrophobicContact CB-CG2 4.41Å; L120-V124 HydrophobicContact CD2-CG2 4.39Å; L120-V124 WeakPolarHBondContact O-CB 3.38Å; L120-V124 PolarHBondContact O-N 2.88Å; L120-V124 VanDerWaalsContact O-N 3.14Å; Y122-V124 PolarHBondContact O-N 3.03Å; V124-I126 PolarHBondContact O-N 3.17Å; V124-V127 PolarHBondContact O-N 2.89Å; V124-H128 WeakPolarHBondContact O-CB 3.33Å; V124-H128 PolarHBondContact O-N 2.8Å
125	P	95	Very high	90.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.6	-37.6	177.2	-25.2	36.7	0	0	0	113.9	I90 I93 C121 Y122 H128 F129	I90-P125 HydrophobicContact CG1-CG 4.47Å; I90-P125 HydrophobicContact CG2-CG 4.28Å; I93-P125 HydrophobicContact CB-CB 4.15Å; I93-P125 HydrophobicContact CB-CG 4.1Å; I93-P125 HydrophobicContact CD1-CB 4.48Å; I93-P125 HydrophobicContact CD1-CG 3.88Å; I93-P125 HydrophobicContact CG2-CB 3.55Å; I93-P125 HydrophobicContact CG2-CG 4.03Å; C121-P125 VanDerWaalsContact O-CD 3.26Å; C121-P125 WeakPolarHBondContact O-CD 3.46Å; C121-P125 VanDerWaalsContact O-CG 3.28Å; C121-P125 WeakPolarHBondContact O-CG 3.3Å; Y122-P125 WeakPolarHBondContact O-CD 3.23Å; P125-H128 WeakPolarHBondContact O-CB 3.21Å; P125-H128 PolarHBondContact O-N 2.9Å; P125-F129 WeakPolarHBondContact O-CD2 3.32Å; P125-F129 PolarHBondContact O-N 2.9Å
126	I	96.2	Very high	91	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.7	-48.9	178.4	-71.9	170.6	0	0	0	110.3	Y122 V123 V124 H128 F129 L130 A140 F157 I198 F225 V227	Y122-I126 HydrophobicContact CD2-CD1 4.23Å; Y122-I126 VanDerWaalsContact O-CB 3.26Å; Y122-I126 WeakPolarHBondContact O-CB 3.27Å; Y122-I126 WeakPolarHBondContact O-CD1 3.44Å; Y122-I126 WeakPolarHBondContact O-CG1 3.29Å; Y122-I126 PolarHBondContact O-N 2.87Å; V123-I126 PolarHBondContact O-N 2.83Å; V124-I126 PolarHBondContact O-N 3.17Å; I126-H128 VanDerWaalsContact C-N 3.3Å; I126-H128 PolarHBondContact O-N 3.11Å; I126-F129 PolarHBondContact O-N 3.37Å; I126-L130 HydrophobicContact CG2-CD1 3.75Å; I126-L130 HydrophobicContact CG2-CG 4.25Å; I126-L130 WeakPolarHBondContact O-CB 3.39Å; I126-L130 VanDerWaalsContact O-CG 3.25Å; I126-L130 WeakPolarHBondContact O-CG 3.44Å; I126-L130 PolarHBondContact O-N 2.99Å; I126-A140 HydrophobicContact CG2-CB 3.61Å; I126-F157 HydrophobicContact CB-CE1 4.32Å; I126-F157 HydrophobicContact CD1-CZ 4.31Å; I126-F157 HydrophobicContact CG2-CE1 4.06Å; I126-I198 HydrophobicContact CG2-CD1 4.39Å; I126-F225 HydrophobicContact CB-CD2 4.37Å; I126-F225 HydrophobicContact CD1-CB 4.03Å; I126-F225 HydrophobicContact CD1-CG 4.41Å; I126-F225 HydrophobicContact CG1-CB 3.99Å; I126-F225 HydrophobicContact CG1-CD1 4.3Å; I126-F225 HydrophobicContact CG1-CD2 3.94Å; I126-F225 HydrophobicContact CG1-CE2 4.47Å; I126-F225 HydrophobicContact CG1-CG 3.82Å; I126-F225 HydrophobicContact CG2-CD2 4.1Å; I126-V227 HydrophobicContact CD1-CG2 3.62Å
127	V	95.5	Very high	91.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.5	-43.9	177	170.9	0	0	0	0	110.5	V123 V124 F129 L130 R131 F157 C160 T161 T164 L166 I198	V123-V127 HydrophobicContact CG1-CG2 4.47Å; V123-V127 WeakPolarHBondContact O-CG2 3.49Å; V123-V127 PolarHBondContact O-N 2.91Å; V124-V127 PolarHBondContact O-N 2.89Å; V127-F129 VanDerWaalsContact C-N 3.34Å; V127-F129 PolarHBondContact O-N 3.46Å; V127-L130 PolarHBondContact O-N 3.25Å; V127-R131 WeakPolarHBondContact O-CB 3.32Å; V127-R131 PolarHBondContact O-N 3.42Å; V127-F157 HydrophobicContact CG2-CD1 4.08Å; V127-F157 HydrophobicContact CG2-CE1 4.36Å; V127-C160 HydrophobicContact CG2-CB 4.2Å; V127-T161 HydrophobicContact CG1-CG2 4.46Å; V127-T161 HydrophobicContact CG2-CG2 3.79Å; V127-T164 HydrophobicContact CG1-CG2 4.25Å; V127-L166 HydrophobicContact CB-CD1 4.32Å; V127-L166 HydrophobicContact CG1-CD1 3.83Å; V127-L166 HydrophobicContact CG2-CD1 4.38Å; V127-I198 HydrophobicContact CG2-CD1 4.37Å
128	H	93.5	Very high	92	Very high	20 Å²	20	32.9 Å²	32.9	9%	0.093	17%	0.167	C	C	.	.	H	α-helix	trans	-53.6	-47.7	176.8	176.1	84.6	0	0	0	113	P67 I70 V124 P125 I126 R131	P67-H128 VanDerWaalsContact CD-CE1 3.42Å; P67-H128 WeakPolarHBondContact CD-CE1 3.47Å; P67-H128 WeakPolarHBondContact CD-ND1 3.49Å; I70-H128 VanDerWaalsContact CD1-CA 3.42Å; I70-H128 HydrophobicContact CD1-CB 3.48Å; I70-H128 VanDerWaalsContact CD1-CB 3.48Å; V124-H128 WeakPolarHBondContact O-CB 3.33Å; V124-H128 PolarHBondContact O-N 2.8Å; P125-H128 WeakPolarHBondContact O-CB 3.21Å; P125-H128 PolarHBondContact O-N 2.9Å; I126-H128 VanDerWaalsContact C-N 3.3Å; I126-H128 PolarHBondContact O-N 3.11Å; H128-R131 WeakPolarHBondContact O-CD 3.44Å; H128-R131 WeakPolarHBondContact O-CG 3.32Å
129	F	92.1	Very high	92.3	Very high	28 Å²	28	33.9 Å²	33.9	12%	0.123	17%	0.171	C	C	.	.	H	α-helix	trans	-83.1	-20.1	-177.2	-74.5	-60.5	0	0	0	114.8	V94 N97 V98 P125 I126 V127 F225	V94-F129 HydrophobicContact CG1-CZ 4.43Å; V94-F129 HydrophobicContact CG2-CE2 4.47Å; N97-F129 HydrophobicContact CB-CD1 4.25Å; N97-F129 HydrophobicContact CB-CD2 4.11Å; N97-F129 HydrophobicContact CB-CE1 3.55Å; N97-F129 HydrophobicContact CB-CE2 3.39Å; N97-F129 HydrophobicContact CB-CZ 3.09Å; V98-F129 HydrophobicContact CG2-CE1 4.13Å; V98-F129 HydrophobicContact CG2-CZ 4.24Å; P125-F129 WeakPolarHBondContact O-CD2 3.32Å; P125-F129 PolarHBondContact O-N 2.9Å; I126-F129 PolarHBondContact O-N 3.37Å; V127-F129 VanDerWaalsContact C-N 3.34Å; V127-F129 PolarHBondContact O-N 3.46Å; F129-F225 HydrophobicContact CB-CE2 3.91Å; F129-F225 HydrophobicContact CB-CZ 3.75Å; F129-F225 HydrophobicContact CD2-CZ 4.03Å; F129-F225 HydrophobicContact CG-CZ 4.18Å
130	L	93.7	Very high	92.4	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-93.3	-18.2	-179.2	-64.5	-171.1	0	0	0	113.5	I126 V127 D132 R133 R139 A140 L166 I198 F225	I126-L130 HydrophobicContact CG2-CD1 3.75Å; I126-L130 HydrophobicContact CG2-CG 4.25Å; I126-L130 WeakPolarHBondContact O-CB 3.39Å; I126-L130 VanDerWaalsContact O-CG 3.25Å; I126-L130 WeakPolarHBondContact O-CG 3.44Å; I126-L130 PolarHBondContact O-N 2.99Å; V127-L130 PolarHBondContact O-N 3.25Å; L130-D132 PolarHBondContact O-N 2.99Å; L130-R133 VanDerWaalsContact O-CB 3.26Å; L130-R133 WeakPolarHBondContact O-CB 3.3Å; L130-R133 VanDerWaalsContact O-CG 3.22Å; L130-R133 WeakPolarHBondContact O-CG 3.36Å; L130-R133 PolarHBondContact O-N 3.19Å; L130-R133 VanDerWaalsContact O-N 3.14Å; L130-R139 HydrophobicContact CD1-CB 3.93Å; L130-R139 HydrophobicContact CD2-CB 3.55Å; L130-R139 HydrophobicContact CD2-CG 4.26Å; L130-R139 HydrophobicContact CG-CB 4.41Å; L130-A140 HydrophobicContact CD1-CB 3.85Å; L130-L166 VanDerWaalsContact C-CD2 3.48Å; L130-L166 HydrophobicContact CB-CD1 4.47Å; L130-L166 HydrophobicContact CB-CD2 3.64Å; L130-L166 WeakPolarHBondContact O-CD2 3.45Å; L130-I198 HydrophobicContact CD1-CD1 4.5Å; L130-I198 HydrophobicContact CD1-CG1 4.01Å; L130-F225 HydrophobicContact CD1-CD2 4.39Å; L130-F225 HydrophobicContact CD2-CD2 4.16Å; L130-F225 HydrophobicContact CD2-CE2 3.92Å; L130-F225 HydrophobicContact CG-CD2 4.22Å; L130-F225 HydrophobicContact CG-CE2 4.06Å
131	R	91.2	Very high	92.6	Very high	62 Å²	62	31.8 Å²	31.8	23%	0.234	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-34.6	-177.6	75.4	-167.2	-172	142.5	1.4	113.8	P67 D69 V127 H128 R133 T164	P67-R131 VanDerWaalsContact CG-NH1 3.27Å; P67-R131 VanDerWaalsContact CG-NH2 3.26Å; D69-R131 VanDerWaalsContact CG-NH1 3.25Å; D69-R131 IonicContact OD1-NH1 3.52Å; D69-R131 PolarHBondContact OD1-NH1 3.2Å; D69-R131 IonicContact OD2-NH1 2.98Å; D69-R131 PolarHBondContact OD2-NH1 2.95Å; V127-R131 WeakPolarHBondContact O-CB 3.32Å; V127-R131 PolarHBondContact O-N 3.42Å; H128-R131 WeakPolarHBondContact O-CD 3.44Å; H128-R131 WeakPolarHBondContact O-CG 3.32Å; R131-R133 PolarHBondContact O-N 3.06Å; R131-T164 HydrophobicContact CB-CG2 4.29Å
132	D	87.9	Confident	92.7	Very high	117 Å²	117	31.8 Å²	31.8	63%	0.626	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	14.9	-176.4	-60.3	-48.8	0	0	0	111.9	L130	L130-D132 PolarHBondContact O-N 2.99Å
133	R	88.1	Confident	92.7	Very high	47 Å²	47	31.8 Å²	31.8	18%	0.177	16%	0.158	C	C	.	.			trans	-65.3	150.5	178.6	70.6	143.1	-162.3	-73.9	8.6	111.6	L130 R131 L135 T165 L166 D197	L130-R133 VanDerWaalsContact O-CB 3.26Å; L130-R133 WeakPolarHBondContact O-CB 3.3Å; L130-R133 VanDerWaalsContact O-CG 3.22Å; L130-R133 WeakPolarHBondContact O-CG 3.36Å; L130-R133 PolarHBondContact O-N 3.19Å; L130-R133 VanDerWaalsContact O-N 3.14Å; R131-R133 PolarHBondContact O-N 3.06Å; R133-L135 WeakPolarHBondContact CD-O 3.36Å; R133-T165 PolarHBondContact NH2-O 3.49Å; R133-L166 VanDerWaalsContact NH1-CA 3.34Å; R133-D197 WeakPolarHBondContact CD-OD1 3.48Å; R133-D197 IonicContact CZ-OD1 3.81Å; R133-D197 IonicContact CZ-OD2 2.98Å; R133-D197 IonicContact NE-OD1 3.26Å; R133-D197 PolarHBondContact NE-OD1 2.79Å; R133-D197 IonicContact NE-OD2 3.32Å; R133-D197 IonicContact NH1-OD1 2.76Å; R133-D197 PolarHBondContact NH1-OD1 2.78Å; R133-D197 IonicContact NH1-OD2 3.05Å; R133-D197 PolarHBondContact NH1-OD2 3.08Å; R133-D197 IonicContact NH2-OD1 3.69Å; R133-D197 IonicContact NH2-OD2 3.51Å; R133-D197 PolarHBondContact NH2-OD2 3.49Å
134	V	83.8	Confident	92.5	Very high	135 Å²	135	31.8 Å²	31.8	82%	0.818	16%	0.158	S	C	*	.	S	Bend	trans	-94.5	-40.3	178	-176.1	0	0	0	0	112.6
135	L	85.5	Confident	92.2	Very high	106 Å²	106	32.3 Å²	32.3	56%	0.555	16%	0.162	S	C	*	.	S	Bend	trans	-128.9	138.1	-175.3	-70.3	175	0	0	0	111.3	R133 R137 R139	R133-L135 WeakPolarHBondContact CD-O 3.36Å; L135-R137 PolarHBondContact O-N 3.44Å; L135-R139 PolarHBondContact O-NH1 3.3Å; L135-R139 PolarHBondContact O-NH2 2.91Å
136	P	87.2	Confident	91.8	Very high	42 Å²	42	34.3 Å²	34.3	27%	0.273	17%	0.174	S	C	.	.			trans	-68	126.9	178.1	28.6	-33.7	0	0	0	111.6	T195 D197	P136-T195 WeakPolarHBondContact CB-O 3.14Å; P136-D197 WeakPolarHBondContact CA-OD1 3.4Å
137	R	89.9	Confident	91.3	Very high	69 Å²	69	34.9 Å²	34.9	26%	0.26	18%	0.179	S	C	.	.			trans	-159	149.4	176.8	-68.3	-64.2	178.9	-108.8	13	107.8	L135 R139 C196 D197 Y222	L135-R137 PolarHBondContact O-N 3.44Å; R137-R139 WeakPolarHBondContact O-CG 3.29Å; R137-R139 PolarHBondContact O-N 3.43Å; R137-R139 PolarHBondContact O-NH1 2.86Å; R137-C196 CarbonylContact C-O 3.59Å; R137-D197 PolarHBondContact N-OD1 3.49Å; R137-D197 WeakPolarHBondContact O-CA 3.43Å; R137-Y222 HydrophobicContact CB-CD2 4.24Å; R137-Y222 HydrophobicContact CB-CG 4.34Å; R137-Y222 HydrophobicContact CG-CD2 3.92Å; R137-Y222 HydrophobicContact CG-CE2 4.37Å; R137-Y222 HydrophobicContact CG-CG 4.22Å
138	I	93.2	Very high	90.8	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	18%	0.183	C	C	.	.			trans	-61.5	106.3	173.7	-58.2	169.7	0	0	0	108.5	A194 C196 L199 F218 L220 Y222 L223	I138-A194 HydrophobicContact CD1-CB 4.21Å; I138-A194 HydrophobicContact CG1-CB 4.2Å; I138-C196 VanDerWaalsContact CG1-SG 3.6Å; I138-C196 PolarHBondContact N-O 3.09Å; I138-L199 HydrophobicContact CD1-CD2 4.33Å; I138-L199 HydrophobicContact CG2-CB 4.3Å; I138-F218 HydrophobicContact CD1-CD2 4.08Å; I138-F218 HydrophobicContact CD1-CE2 3.7Å; I138-F218 HydrophobicContact CD1-CZ 4.21Å; I138-L220 HydrophobicContact CB-CD2 4.35Å; I138-L220 HydrophobicContact CD1-CD2 4.42Å; I138-L220 HydrophobicContact CG2-CD2 3.75Å; I138-Y222 CarbonylContact O-C 3.51Å; I138-L223 HydrophobicContact CG2-CD1 4.12Å
139	R	94.3	Very high	90.5	Very high	35 Å²	35	35.4 Å²	35.4	13%	0.132	18%	0.182	C	C	.	.			trans	-115.6	-20	-179.6	-74.2	-176.6	-176.3	81.5	-3.5	112.8	L130 L135 R137 D197 Y222 R224 F225	L130-R139 HydrophobicContact CD1-CB 3.93Å; L130-R139 HydrophobicContact CD2-CB 3.55Å; L130-R139 HydrophobicContact CD2-CG 4.26Å; L130-R139 HydrophobicContact CG-CB 4.41Å; L135-R139 PolarHBondContact O-NH1 3.3Å; L135-R139 PolarHBondContact O-NH2 2.91Å; R137-R139 WeakPolarHBondContact O-CG 3.29Å; R137-R139 PolarHBondContact O-N 3.43Å; R137-R139 PolarHBondContact O-NH1 2.86Å; R139-D197 PolarHBondContact N-O 3.17Å; R139-D197 IonicContact NH1-OD1 3.69Å; R139-Y222 WeakPolarHBondContact CG-O 3.33Å; R139-R224 WeakPolarHBondContact O-CA 3.31Å; R139-R224 PolarHBondContact O-N 3.11Å; R139-F225 PolarHBondContact O-N 2.98Å
140	A	97	Very high	90.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133	170.1	0	0	0	0	0	110.8	I126 L130 I142 D197 I198 L199 F225	I126-A140 HydrophobicContact CG2-CB 3.61Å; L130-A140 HydrophobicContact CD1-CB 3.85Å; A140-I142 HydrophobicContact CB-CD1 4.12Å; A140-D197 PolarHBondContact N-O 3.13Å; A140-I198 HydrophobicContact CB-CB 4.48Å; A140-I198 HydrophobicContact CB-CG1 4.21Å; A140-I198 HydrophobicContact CB-CG2 4.24Å; A140-I198 WeakPolarHBondContact O-CA 3.48Å; A140-L199 PolarHBondContact O-N 2.83Å; A140-F225 CarbonylContact C-O 3.54Å; A140-F225 VanDerWaalsContact CA-O 3.31Å; A140-F225 WeakPolarHBondContact CA-O 3.5Å; A140-F225 HydrophobicContact CB-CB 4.12Å
141	L	97.5	Very high	90.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	120	175.4	176.1	59.6	0	0	0	108	I143 L199 A201 L206 L220 L223 F225 L226 V227	L141-I143 HydrophobicContact CD1-CG1 4.33Å; L141-I143 HydrophobicContact CD2-CD1 4.12Å; L141-I143 HydrophobicContact CD2-CG1 4.39Å; L141-I143 HydrophobicContact CG-CD1 4.24Å; L141-I143 HydrophobicContact CG-CG1 3.96Å; L141-L199 CarbonylContact C-O 3.56Å; L141-L199 WeakPolarHBondContact CA-O 3.14Å; L141-L199 HydrophobicContact CD1-CB 4.13Å; L141-L199 HydrophobicContact CD1-CD2 4.05Å; L141-L199 HydrophobicContact CD1-CG 4.14Å; L141-A201 HydrophobicContact CD1-CB 4.29Å; L141-L206 HydrophobicContact CD1-CD1 4.21Å; L141-L206 HydrophobicContact CD1-CD2 4.36Å; L141-L206 HydrophobicContact CD2-CD1 4.42Å; L141-L206 HydrophobicContact CD2-CD2 3.98Å; L141-L220 HydrophobicContact CD2-CD1 4.09Å; L141-L220 HydrophobicContact CD2-CD2 4.49Å; L141-L223 HydrophobicContact CB-CD1 3.57Å; L141-L223 HydrophobicContact CB-CD2 4.12Å; L141-L223 HydrophobicContact CB-CG 4.49Å; L141-L223 HydrophobicContact CD2-CD2 4.46Å; L141-F225 PolarHBondContact N-O 2.96Å; L141-L226 HydrophobicContact CB-CD1 4.15Å; L141-L226 HydrophobicContact CD2-CD1 3.98Å; L141-L226 HydrophobicContact CG-CD1 4.03Å; L141-L226 CarbonylContact O-C 3.59Å; L141-L226 WeakPolarHBondContact O-CA 3.41Å; L141-V227 PolarHBondContact O-N 3.12Å
142	I	97.9	Very high	90.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.6	179.7	-58.5	89.6	0	0	0	107.4	Y122 A140 L144 V153 F157 I198 L199 V200 A201 V227	Y122-I142 HydrophobicContact CE2-CG2 4.29Å; A140-I142 HydrophobicContact CB-CD1 4.12Å; I142-L144 HydrophobicContact CB-CD1 4.39Å; I142-L144 HydrophobicContact CG2-CD1 3.57Å; I142-L144 HydrophobicContact CG2-CG 4.26Å; I142-V153 HydrophobicContact CG2-CG1 4.14Å; I142-F157 HydrophobicContact CB-CE2 4.5Å; I142-F157 HydrophobicContact CD1-CD2 4.45Å; I142-F157 HydrophobicContact CD1-CE1 4.43Å; I142-F157 HydrophobicContact CD1-CE2 3.52Å; I142-F157 HydrophobicContact CD1-CZ 3.5Å; I142-F157 HydrophobicContact CG1-CE2 3.69Å; I142-F157 HydrophobicContact CG1-CZ 3.84Å; I142-I198 HydrophobicContact CD1-CG2 3.52Å; I142-L199 PolarHBondContact N-O 2.92Å; I142-V200 HydrophobicContact CB-CG2 4.42Å; I142-V200 HydrophobicContact CD1-CG2 4.4Å; I142-V200 CarbonylContact O-C 3.52Å; I142-V200 WeakPolarHBondContact O-CA 3.34Å; I142-A201 PolarHBondContact O-N 3.4Å; I142-V227 HydrophobicContact CB-CB 4.23Å; I142-V227 HydrophobicContact CG1-CB 3.87Å; I142-V227 HydrophobicContact CG1-CG2 3.84Å; I142-V227 HydrophobicContact CG2-CB 4.02Å; I142-V227 HydrophobicContact CG2-CG1 4.17Å
143	I	95.6	Very high	90.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128	-175.9	-51.1	-177.9	0	0	0	108.4	L141 A201 P203 L206 L226 V227 L228 D229 L234 W242 I246	L141-I143 HydrophobicContact CD1-CG1 4.33Å; L141-I143 HydrophobicContact CD2-CD1 4.12Å; L141-I143 HydrophobicContact CD2-CG1 4.39Å; L141-I143 HydrophobicContact CG-CD1 4.24Å; L141-I143 HydrophobicContact CG-CG1 3.96Å; I143-A201 WeakPolarHBondContact CA-O 3.43Å; I143-P203 HydrophobicContact CG2-CG 3.75Å; I143-L206 HydrophobicContact CD1-CD2 3.72Å; I143-L206 HydrophobicContact CG1-CD2 4.25Å; I143-L226 HydrophobicContact CD1-CD1 3.94Å; I143-L226 HydrophobicContact CG1-CD1 4.35Å; I143-V227 PolarHBondContact N-O 3.1Å; I143-L228 HydrophobicContact CB-CD2 3.98Å; I143-L228 HydrophobicContact CD1-CD2 3.93Å; I143-L228 HydrophobicContact CG1-CD2 4.26Å; I143-D229 PolarHBondContact O-N 3.17Å; I143-D229 VanDerWaalsContact O-N 3.13Å; I143-L234 HydrophobicContact CB-CD1 4.5Å; I143-L234 HydrophobicContact CG2-CD1 4.23Å; I143-L234 HydrophobicContact CG2-CD2 4.05Å; I143-W242 HydrophobicContact CD1-CH2 4.47Å; I143-W242 HydrophobicContact CD1-CZ3 3.83Å; I143-W242 HydrophobicContact CG2-CH2 4.07Å; I143-W242 HydrophobicContact CG2-CZ3 4.17Å; I143-I246 HydrophobicContact CD1-CD1 3.4Å; I143-I246 VanDerWaalsContact CD1-CD1 3.4Å
144	L	93.4	Very high	90.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.165	C	C	.	.			trans	-131.6	146.8	-179	-56.3	97.2	0	0	0	110.5	I142 T146 L149 A150 V153 V200 A201 T202 P203 D229	I142-L144 HydrophobicContact CB-CD1 4.39Å; I142-L144 HydrophobicContact CG2-CD1 3.57Å; I142-L144 HydrophobicContact CG2-CG 4.26Å; L144-T146 VanDerWaalsContact C-N 3.33Å; L144-T146 PolarHBondContact O-N 3.37Å; L144-L149 HydrophobicContact CB-CB 4.12Å; L144-L149 HydrophobicContact CD2-CB 3.76Å; L144-A150 HydrophobicContact CB-CB 4.31Å; L144-A150 HydrophobicContact CD1-CB 4.06Å; L144-V153 HydrophobicContact CD2-CB 3.93Å; L144-V153 HydrophobicContact CD2-CG2 3.49Å; L144-V153 VanDerWaalsContact CD2-CG2 3.49Å; L144-V200 HydrophobicContact CD1-CG1 3.45Å; L144-V200 VanDerWaalsContact CD1-CG1 3.45Å; L144-A201 PolarHBondContact N-O 2.98Å; L144-T202 WeakPolarHBondContact O-CA 3.28Å; L144-P203 VanDerWaalsContact O-CD 3.31Å; L144-P203 WeakPolarHBondContact O-CD 3.41Å; L144-D229 HydrophobicContact CD2-CB 4.12Å; L144-D229 HydrophobicContact CG-CB 4.26Å
145	P	87.9	Confident	91.3	Very high	13 Å²	13	27.5 Å²	27.5	8%	0.084	15%	0.145	C	C	.	.	S	Bend	trans	-71.6	-28.4	-173.3	27.1	-34.9	0	0	0	113	L149 D229 E230 R233 L234	P145-L149 HydrophobicContact CG-CD1 3.92Å; P145-D229 WeakPolarHBondContact CD-O 2.82Å; P145-E230 HydrophobicContact CG-CB 3.9Å; P145-R233 HydrophobicContact CB-CB 4.36Å; P145-R233 HydrophobicContact CB-CG 3.91Å; P145-R233 HydrophobicContact CG-CB 4.27Å; P145-R233 HydrophobicContact CG-CG 4.16Å; P145-L234 HydrophobicContact CB-CD2 3.96Å; P145-L234 HydrophobicContact CB-CG 4.24Å
146	T	85.9	Confident	91.7	Very high	41 Å²	41	24.5 Å²	24.5	25%	0.252	13%	0.128	S	C	.	.	S	Bend	trans	-126.2	149.3	-177	72.9	0	0	0	0	112	L144 D148 L149 A150	L144-T146 VanDerWaalsContact C-N 3.33Å; L144-T146 PolarHBondContact O-N 3.37Å; T146-D148 VanDerWaalsContact C-N 3.32Å; T146-D148 PolarHBondContact O-N 3.26Å; T146-L149 PolarHBondContact O-N 3.37Å; T146-L149 WeakPolarHBondContact OG1-CD1 3.13Å; T146-L149 WeakPolarHBondContact OG1-CG 3.35Å; T146-L149 PolarHBondContact OG1-N 3.4Å; T146-A150 PolarHBondContact O-N 3.04Å
147	A	87.3	Confident	92.1	Very high	13 Å²	13	22.5 Å²	22.5	11%	0.107	12%	0.115	C	C	.	.	H	α-helix	trans	-65.8	-33.5	178.6	0	0	0	0	0	113.4	A150 S151 T172 Q174 T202	A147-A150 PolarHBondContact O-N 3.28Å; A147-S151 PolarHBondContact O-N 2.88Å; A147-T172 HydrophobicContact CB-CG2 3.9Å; A147-Q174 HydrophobicContact CB-CG 4.24Å; A147-T202 HydrophobicContact CB-CG2 4.43Å
148	D	83.6	Confident	92.4	Very high	16 Å²	16	22.2 Å²	22.2	9%	0.086	12%	0.121	C	C	.	.	H	α-helix	trans	-61.5	-43.9	174.7	-76.4	-87	0	0	0	111.1	T146 S151 Q152 R410 K414 I435	T146-D148 VanDerWaalsContact C-N 3.32Å; T146-D148 PolarHBondContact O-N 3.26Å; D148-S151 PolarHBondContact O-N 3.23Å; D148-Q152 PolarHBondContact O-N 3.13Å; D148-Q152 VanDerWaalsContact O-N 3.08Å; D148-R410 IonicContact OD2-CZ 3.93Å; D148-R410 IonicContact OD2-NH1 3.35Å; D148-R410 PolarHBondContact OD2-NH1 3.04Å; D148-K414 IonicContact OD1-NZ 3.07Å; D148-K414 PolarHBondContact OD1-NZ 3.12Å; D148-K414 VanDerWaalsContact OD1-NZ 3.08Å; D148-I435 HydrophobicContact CB-CG1 4.36Å
149	L	87.2	Confident	92.4	Very high	15 Å²	15	26.8 Å²	26.8	8%	0.079	14%	0.141	C	C	.	.	H	α-helix	trans	-63.3	-46	173.4	-81.2	166.6	0	0	0	111.9	L144 P145 T146 S151 Q152 V153 E230	L144-L149 HydrophobicContact CB-CB 4.12Å; L144-L149 HydrophobicContact CD2-CB 3.76Å; P145-L149 HydrophobicContact CG-CD1 3.92Å; T146-L149 PolarHBondContact O-N 3.37Å; T146-L149 WeakPolarHBondContact OG1-CD1 3.13Å; T146-L149 WeakPolarHBondContact OG1-CG 3.35Å; T146-L149 PolarHBondContact OG1-N 3.4Å; L149-S151 VanDerWaalsContact C-N 3.28Å; L149-S151 PolarHBondContact O-N 2.95Å; L149-Q152 WeakPolarHBondContact O-CB 3.43Å; L149-Q152 PolarHBondContact O-N 2.9Å; L149-Q152 VanDerWaalsContact O-N 3.09Å; L149-V153 PolarHBondContact O-N 2.89Å; L149-E230 HydrophobicContact CD1-CG 3.91Å
150	A	92.4	Very high	92.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59	-42.5	-179.7	0	0	0	0	0	111.2	L144 T146 A147 V153 F154 L170 T172 V200 T202	L144-A150 HydrophobicContact CB-CB 4.31Å; L144-A150 HydrophobicContact CD1-CB 4.06Å; T146-A150 PolarHBondContact O-N 3.04Å; A147-A150 PolarHBondContact O-N 3.28Å; A150-V153 PolarHBondContact O-N 2.75Å; A150-F154 WeakPolarHBondContact O-CB 3.26Å; A150-F154 PolarHBondContact O-N 3.42Å; A150-L170 HydrophobicContact CB-CD1 3.63Å; A150-T172 HydrophobicContact CB-CG2 3.71Å; A150-V200 HydrophobicContact CB-CG1 4.05Å; A150-V200 WeakPolarHBondContact O-CG1 3.41Å; A150-T202 HydrophobicContact CB-CG2 4.36Å
151	S	91.2	Very high	92.1	Very high	47 Å²	47	25.8 Å²	25.8	33%	0.329	14%	0.138	S	C	.	.	H	α-helix	trans	-61.8	-43.6	173.5	-167	0	0	0	0	112.1	A147 D148 L149 V153 F154 D155	A147-S151 PolarHBondContact O-N 2.88Å; D148-S151 PolarHBondContact O-N 3.23Å; L149-S151 VanDerWaalsContact C-N 3.28Å; L149-S151 PolarHBondContact O-N 2.95Å; S151-V153 PolarHBondContact O-N 3.27Å; S151-F154 WeakPolarHBondContact O-CB 3.5Å; S151-F154 PolarHBondContact O-N 3.45Å; S151-D155 VanDerWaalsContact O-CG 3.23Å; S151-D155 PolarHBondContact O-N 2.91Å
152	Q	87.8	Confident	91.8	Very high	60 Å²	60	34.6 Å²	34.6	28%	0.28	17%	0.172	S	C	.	.	H	α-helix	trans	-62	-45.5	178.9	-179.9	-173.2	-21.1	0	0	112	D148 L149 D155 Q156	D148-Q152 PolarHBondContact O-N 3.13Å; D148-Q152 VanDerWaalsContact O-N 3.08Å; L149-Q152 WeakPolarHBondContact O-CB 3.43Å; L149-Q152 PolarHBondContact O-N 2.9Å; L149-Q152 VanDerWaalsContact O-N 3.09Å; Q152-D155 PolarHBondContact O-N 2.82Å; Q152-Q156 WeakPolarHBondContact O-CG 3.44Å; Q152-Q156 PolarHBondContact O-N 3.11Å
153	V	94.1	Very high	91.3	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-71.6	-37	179.9	173.5	0	0	0	0	111.1	T119 Y122 I142 L144 L149 A150 S151 D155 Q156 F157	T119-V153 HydrophobicContact CG2-CB 4.47Å; T119-V153 HydrophobicContact CG2-CG1 4.23Å; T119-V153 HydrophobicContact CG2-CG2 3.85Å; Y122-V153 HydrophobicContact CE2-CG1 4.08Å; Y122-V153 WeakPolarHBondContact OH-CG1 3.47Å; I142-V153 HydrophobicContact CG2-CG1 4.14Å; L144-V153 HydrophobicContact CD2-CB 3.93Å; L144-V153 HydrophobicContact CD2-CG2 3.49Å; L144-V153 VanDerWaalsContact CD2-CG2 3.49Å; L149-V153 PolarHBondContact O-N 2.89Å; A150-V153 PolarHBondContact O-N 2.75Å; S151-V153 PolarHBondContact O-N 3.27Å; V153-D155 VanDerWaalsContact C-N 3.32Å; V153-D155 PolarHBondContact O-N 2.79Å; V153-Q156 WeakPolarHBondContact O-CB 3.45Å; V153-Q156 PolarHBondContact O-N 3.38Å; V153-Q156 VanDerWaalsContact O-N 3.11Å; V153-F157 HydrophobicContact CG1-CD2 3.87Å; V153-F157 HydrophobicContact CG1-CE2 3.73Å; V153-F157 WeakPolarHBondContact O-CD2 3.27Å; V153-F157 PolarHBondContact O-N 2.92Å
154	F	96.2	Very high	91.1	Very high	45 Å²	45	39.7 Å²	39.7	20%	0.197	20%	0.197	C	C	.	.	H	α-helix	trans	-55.3	-46.5	169.7	172.3	-99.9	0	0	0	111.7	A150 S151 Q156 F157 V158 T168 L170 V200	A150-F154 WeakPolarHBondContact O-CB 3.26Å; A150-F154 PolarHBondContact O-N 3.42Å; S151-F154 WeakPolarHBondContact O-CB 3.5Å; S151-F154 PolarHBondContact O-N 3.45Å; F154-Q156 VanDerWaalsContact C-N 3.26Å; F154-Q156 PolarHBondContact O-N 3.05Å; F154-F157 PolarHBondContact O-N 3.39Å; F154-F157 VanDerWaalsContact O-N 3.12Å; F154-V158 HydrophobicContact CD1-CG2 4.06Å; F154-V158 HydrophobicContact CD2-CG2 4.24Å; F154-V158 HydrophobicContact CE1-CG2 3.61Å; F154-V158 HydrophobicContact CE2-CG2 3.8Å; F154-V158 HydrophobicContact CG-CG2 4.37Å; F154-V158 HydrophobicContact CZ-CG2 3.46Å; F154-V158 VanDerWaalsContact CZ-CG2 3.46Å; F154-V158 WeakPolarHBondContact O-CG2 3.41Å; F154-V158 PolarHBondContact O-N 2.92Å; F154-T168 HydrophobicContact CD2-CG2 3.6Å; F154-T168 HydrophobicContact CE2-CG2 3.75Å; F154-T168 WeakPolarHBondContact CE2-O 3.4Å; F154-L170 HydrophobicContact CB-CB 4.2Å; F154-L170 HydrophobicContact CB-CD1 4.14Å; F154-L170 HydrophobicContact CB-CD2 4.25Å; F154-L170 HydrophobicContact CB-CG 4.43Å; F154-L170 HydrophobicContact CD1-CB 4.28Å; F154-L170 HydrophobicContact CD1-CD2 4.26Å; F154-L170 HydrophobicContact CD2-CB 3.62Å; F154-L170 HydrophobicContact CE2-CB 3.99Å; F154-L170 HydrophobicContact CG-CB 3.77Å; F154-L170 HydrophobicContact CG-CD2 4.23Å; F154-L170 HydrophobicContact CG-CG 4.43Å; F154-L170 HydrophobicContact CZ-CB 4.47Å; F154-V200 HydrophobicContact CB-CB 4.41Å; F154-V200 HydrophobicContact CB-CG1 4.46Å; F154-V200 HydrophobicContact CB-CG2 4.34Å
155	D	93.1	Very high	91	Very high	72 Å²	72	45 Å²	45	39%	0.385	23%	0.229	S	C	.	.	H	α-helix	trans	-61.4	-35.3	176.9	-67.6	-21.3	0	0	0	112	S151 Q152 V153 K159	S151-D155 VanDerWaalsContact O-CG 3.23Å; S151-D155 PolarHBondContact O-N 2.91Å; Q152-D155 PolarHBondContact O-N 2.82Å; V153-D155 VanDerWaalsContact C-N 3.32Å; V153-D155 PolarHBondContact O-N 2.79Å; D155-K159 WeakPolarHBondContact O-CB 3.38Å; D155-K159 WeakPolarHBondContact O-CD 3.46Å; D155-K159 WeakPolarHBondContact O-CG 3.34Å; D155-K159 PolarHBondContact O-N 2.88Å
156	Q	93.2	Very high	91.3	Very high	43 Å²	43	45 Å²	45	20%	0.201	23%	0.229	C	C	.	.	H	α-helix	trans	-66.1	-42.3	174.4	-65.6	-61.6	-40.7	0	0	111.8	T119 V123 Q152 V153 F154 C160	T119-Q156 HydrophobicContact CG2-CB 4.26Å; T119-Q156 HydrophobicContact CG2-CG 4.08Å; V123-Q156 HydrophobicContact CG2-CB 4.37Å; Q152-Q156 WeakPolarHBondContact O-CG 3.44Å; Q152-Q156 PolarHBondContact O-N 3.11Å; V153-Q156 WeakPolarHBondContact O-CB 3.45Å; V153-Q156 PolarHBondContact O-N 3.38Å; V153-Q156 VanDerWaalsContact O-N 3.11Å; F154-Q156 VanDerWaalsContact C-N 3.26Å; F154-Q156 PolarHBondContact O-N 3.05Å; Q156-C160 WeakPolarHBondContact O-CB 3.41Å; Q156-C160 PolarHBondContact O-N 3.43Å; Q156-C160 PolarHBondContact O-SG 2.87Å
157	F	96.2	Very high	91.7	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-52.1	173.7	-83.7	-71.2	0	0	0	111.4	Y122 V123 I126 V127 I142 V153 F154 K159 C160 T161 T168 I198 V200	Y122-F157 HydrophobicContact CD2-CZ 4.18Å; Y122-F157 HydrophobicContact CE2-CE2 4.11Å; Y122-F157 HydrophobicContact CE2-CZ 4.19Å; V123-F157 HydrophobicContact CB-CD1 4.5Å; V123-F157 HydrophobicContact CB-CE1 4.17Å; V123-F157 HydrophobicContact CB-CZ 4.31Å; V123-F157 HydrophobicContact CG1-CD1 3.9Å; V123-F157 HydrophobicContact CG1-CE1 4.03Å; V123-F157 HydrophobicContact CG1-CG 4.35Å; V123-F157 HydrophobicContact CG2-CD1 4.33Å; V123-F157 HydrophobicContact CG2-CD2 4.11Å; V123-F157 HydrophobicContact CG2-CE1 4.02Å; V123-F157 HydrophobicContact CG2-CE2 3.78Å; V123-F157 HydrophobicContact CG2-CG 4.37Å; V123-F157 HydrophobicContact CG2-CZ 3.73Å; I126-F157 HydrophobicContact CB-CE1 4.32Å; I126-F157 HydrophobicContact CD1-CZ 4.31Å; I126-F157 HydrophobicContact CG2-CE1 4.06Å; V127-F157 HydrophobicContact CG2-CD1 4.08Å; V127-F157 HydrophobicContact CG2-CE1 4.36Å; I142-F157 HydrophobicContact CB-CE2 4.5Å; I142-F157 HydrophobicContact CD1-CD2 4.45Å; I142-F157 HydrophobicContact CD1-CE1 4.43Å; I142-F157 HydrophobicContact CD1-CE2 3.52Å; I142-F157 HydrophobicContact CD1-CZ 3.5Å; I142-F157 HydrophobicContact CG1-CE2 3.69Å; I142-F157 HydrophobicContact CG1-CZ 3.84Å; V153-F157 HydrophobicContact CG1-CD2 3.87Å; V153-F157 HydrophobicContact CG1-CE2 3.73Å; V153-F157 WeakPolarHBondContact O-CD2 3.27Å; V153-F157 PolarHBondContact O-N 2.92Å; F154-F157 PolarHBondContact O-N 3.39Å; F154-F157 VanDerWaalsContact O-N 3.12Å; F157-K159 PolarHBondContact O-N 3.38Å; F157-C160 CarbonylContact O-C 3.55Å; F157-C160 PolarHBondContact O-N 2.86Å; F157-T161 WeakPolarHBondContact O-CB 3.37Å; F157-T161 WeakPolarHBondContact O-CG2 3.01Å; F157-T161 PolarHBondContact O-N 3.1Å; F157-T161 PolarHBondContact O-OG1 2.87Å; F157-T168 HydrophobicContact CB-CG2 3.68Å; F157-T168 HydrophobicContact CG-CG2 4.35Å; F157-I198 HydrophobicContact CD1-CD1 3.73Å; F157-I198 HydrophobicContact CD1-CG2 3.88Å; F157-I198 HydrophobicContact CD2-CG2 4.21Å; F157-I198 HydrophobicContact CE1-CD1 4.02Å; F157-I198 HydrophobicContact CE1-CG2 3.91Å; F157-I198 HydrophobicContact CE2-CG2 4.24Å; F157-I198 HydrophobicContact CG-CG2 4.04Å; F157-I198 HydrophobicContact CZ-CG2 4.09Å; F157-V200 HydrophobicContact CD2-CG2 3.97Å; F157-V200 HydrophobicContact CE2-CG2 4.34Å
158	V	95.1	Very high	92.2	Very high	64 Å²	64	45.3 Å²	45.3	39%	0.388	23%	0.231	S	C	.	.	H	α-helix	trans	-52.6	-45.4	-180	170.4	0	0	0	0	111.2	F154 T161 R162	F154-V158 HydrophobicContact CD1-CG2 4.06Å; F154-V158 HydrophobicContact CD2-CG2 4.24Å; F154-V158 HydrophobicContact CE1-CG2 3.61Å; F154-V158 HydrophobicContact CE2-CG2 3.8Å; F154-V158 HydrophobicContact CG-CG2 4.37Å; F154-V158 HydrophobicContact CZ-CG2 3.46Å; F154-V158 VanDerWaalsContact CZ-CG2 3.46Å; F154-V158 WeakPolarHBondContact O-CG2 3.41Å; F154-V158 PolarHBondContact O-N 2.92Å; V158-T161 WeakPolarHBondContact CA-OG1 3.23Å; V158-T161 PolarHBondContact O-N 2.7Å; V158-T161 PolarHBondContact O-OG1 2.85Å; V158-T161 VanDerWaalsContact O-OG1 3.12Å; V158-R162 PolarHBondContact O-N 3.49Å
159	K	92.5	Very high	92.8	Very high	98 Å²	98	45 Å²	45	43%	0.426	23%	0.23	S	C	.	.	H	α-helix	trans	-63.5	-45.8	176.5	-73.2	171.9	-176.9	178.3	0	112.7	C77 D155 F157 T161 R162	C77-K159 VanDerWaalsContact SG-CB 3.52Å; D155-K159 WeakPolarHBondContact O-CB 3.38Å; D155-K159 WeakPolarHBondContact O-CD 3.46Å; D155-K159 WeakPolarHBondContact O-CG 3.34Å; D155-K159 PolarHBondContact O-N 2.88Å; F157-K159 PolarHBondContact O-N 3.38Å; K159-T161 VanDerWaalsContact C-N 3.32Å; K159-T161 PolarHBondContact O-N 3.07Å; K159-R162 WeakPolarHBondContact O-CB 3.36Å; K159-R162 PolarHBondContact O-N 3.41Å
160	C	92.3	Very high	93.3	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.014	23%	0.233	C	C	.	.	H	α-helix	trans	-71.9	-23.2	179	-65.6	0	0	0	0	113.4	S73 V123 V127 Q156 F157	S73-C160 PolarHBondContact OG-O 2.96Å; V123-C160 HydrophobicContact CG1-CB 3.81Å; V123-C160 VanDerWaalsContact CG1-SG 3.6Å; V127-C160 HydrophobicContact CG2-CB 4.2Å; Q156-C160 WeakPolarHBondContact O-CB 3.41Å; Q156-C160 PolarHBondContact O-N 3.43Å; Q156-C160 PolarHBondContact O-SG 2.87Å; F157-C160 CarbonylContact O-C 3.55Å; F157-C160 PolarHBondContact O-N 2.86Å
161	T	93.4	Very high	93.4	Very high	12 Å²	12	45.7 Å²	45.7	7%	0.074	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-1.5	179.2	56.1	0	0	0	0	113.8	V127 F157 V158 K159 H163 T164 L166 I198	V127-T161 HydrophobicContact CG1-CG2 4.46Å; V127-T161 HydrophobicContact CG2-CG2 3.79Å; F157-T161 WeakPolarHBondContact O-CB 3.37Å; F157-T161 WeakPolarHBondContact O-CG2 3.01Å; F157-T161 PolarHBondContact O-N 3.1Å; F157-T161 PolarHBondContact O-OG1 2.87Å; V158-T161 WeakPolarHBondContact CA-OG1 3.23Å; V158-T161 PolarHBondContact O-N 2.7Å; V158-T161 PolarHBondContact O-OG1 2.85Å; V158-T161 VanDerWaalsContact O-OG1 3.12Å; K159-T161 VanDerWaalsContact C-N 3.32Å; K159-T161 PolarHBondContact O-N 3.07Å; T161-H163 PolarHBondContact O-N 2.68Å; T161-H163 VanDerWaalsContact O-N 3.12Å; T161-T164 WeakPolarHBondContact CA-OG1 3.36Å; T161-T164 PolarHBondContact O-N 2.93Å; T161-T164 PolarHBondContact O-OG1 2.8Å; T161-L166 HydrophobicContact CG2-CB 3.83Å; T161-L166 HydrophobicContact CG2-CD1 3.82Å; T161-L166 HydrophobicContact CG2-CG 4.48Å; T161-I198 HydrophobicContact CG2-CD1 4.09Å
162	R	90.8	Very high	93.5	Very high	185 Å²	185	44.3 Å²	44.3	70%	0.698	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-34.8	-172	-175	178.2	-176.4	168.9	0.5	114.3	V158 K159	V158-R162 PolarHBondContact O-N 3.49Å; K159-R162 WeakPolarHBondContact O-CB 3.36Å; K159-R162 PolarHBondContact O-N 3.41Å
163	H	88.7	Confident	93.5	Very high	78 Å²	78	43.5 Å²	43.5	36%	0.361	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	17.6	-179.2	-62.8	-99.3	0	0	0	112.7	D69 E72 S73 T161	D69-H163 HydrophobicContact CB-CB 4.38Å; E72-H163 IonicContact OE1-CE1 3.08Å; E72-H163 IonicContact OE2-CE1 2.7Å; E72-H163 IonicContact OE2-ND1 3.07Å; S73-H163 PolarHBondContact OG-CD2 3.29Å; T161-H163 PolarHBondContact O-N 2.68Å; T161-H163 VanDerWaalsContact O-N 3.12Å
164	T	90.5	Very high	93.1	Very high	28 Å²	28	48 Å²	48	17%	0.172	25%	0.251	C	S	.	.	S	Bend	trans	-125.7	166.2	-177.5	73.9	0	0	0	0	110.7	V127 R131 T161 L166	V127-T164 HydrophobicContact CG1-CG2 4.25Å; R131-T164 HydrophobicContact CB-CG2 4.29Å; T161-T164 WeakPolarHBondContact CA-OG1 3.36Å; T161-T164 PolarHBondContact O-N 2.93Å; T161-T164 PolarHBondContact O-OG1 2.8Å; T164-L166 HydrophobicContact CG2-CD1 4.23Å; T164-L166 PolarHBondContact O-N 3.45Å; T164-L166 WeakPolarHBondContact OG1-CB 3.46Å; T164-L166 WeakPolarHBondContact OG1-CD1 3.03Å; T164-L166 WeakPolarHBondContact OG1-CG 3.3Å; T164-L166 PolarHBondContact OG1-N 3.07Å
165	T	91.5	Very high	92.6	Very high	111 Å²	111	50.2 Å²	50.2	68%	0.681	26%	0.263	S	S	*	.			trans	-86.3	12.5	171.8	59	0	0	0	0	112.8	R133	R133-T165 PolarHBondContact NH2-O 3.49Å
166	L	95	Very high	92.5	Very high	15 Å²	15	54.6 Å²	54.6	8%	0.079	28%	0.278	C	S	.	.			trans	-71	132.4	-176.8	-60.5	165.5	0	0	0	112.2	V127 L130 R133 T161 T164 D197 I198	V127-L166 HydrophobicContact CB-CD1 4.32Å; V127-L166 HydrophobicContact CG1-CD1 3.83Å; V127-L166 HydrophobicContact CG2-CD1 4.38Å; L130-L166 VanDerWaalsContact C-CD2 3.48Å; L130-L166 HydrophobicContact CB-CD1 4.47Å; L130-L166 HydrophobicContact CB-CD2 3.64Å; L130-L166 WeakPolarHBondContact O-CD2 3.45Å; R133-L166 VanDerWaalsContact NH1-CA 3.34Å; T161-L166 HydrophobicContact CG2-CB 3.83Å; T161-L166 HydrophobicContact CG2-CD1 3.82Å; T161-L166 HydrophobicContact CG2-CG 4.48Å; T164-L166 HydrophobicContact CG2-CD1 4.23Å; T164-L166 PolarHBondContact O-N 3.45Å; T164-L166 WeakPolarHBondContact OG1-CB 3.46Å; T164-L166 WeakPolarHBondContact OG1-CD1 3.03Å; T164-L166 WeakPolarHBondContact OG1-CG 3.3Å; T164-L166 PolarHBondContact OG1-N 3.07Å; L166-D197 HydrophobicContact CD2-CB 4.46Å; L166-I198 HydrophobicContact CD1-CD1 4.46Å
167	S	94.5	Very high	92.4	Very high	40 Å²	40	54.8 Å²	54.8	28%	0.28	28%	0.278	S	S	.	.			trans	-98.4	121.1	172.2	179.6	0	0	0	0	110	D197 I198	S167-D197 PolarHBondContact N-OD2 3.09Å; S167-D197 PolarHBondContact O-N 2.95Å; S167-I198 PolarHBondContact O-N 3.45Å; S167-I198 VanDerWaalsContact O-N 3.08Å
168	T	96.7	Very high	92.2	Very high	20 Å²	20	61.4 Å²	61.4	12%	0.123	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134.7	174.9	-53.6	0	0	0	0	109.2	F154 F157 I198 V200	F154-T168 HydrophobicContact CD2-CG2 3.6Å; F154-T168 HydrophobicContact CE2-CG2 3.75Å; F154-T168 WeakPolarHBondContact CE2-O 3.4Å; F157-T168 HydrophobicContact CB-CG2 3.68Å; F157-T168 HydrophobicContact CG-CG2 4.35Å; T168-I198 CarbonylContact C-O 3.57Å; T168-I198 WeakPolarHBondContact CA-O 3.06Å; T168-I198 HydrophobicContact CG2-CB 4.07Å; T168-I198 HydrophobicContact CG2-CG2 4Å; T168-V200 HydrophobicContact CG2-CG2 4.31Å
169	V	96.8	Very high	92	Very high	8 Å²	8	61.4 Å²	61.4	5%	0.048	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	142.9	178.2	177.7	0	0	0	0	111.1	I171 K183 I184 C196 I198 L199 V200	V169-I171 HydrophobicContact CG1-CG2 4.27Å; V169-K183 HydrophobicContact CG1-CB 3.91Å; V169-K183 HydrophobicContact CG1-CD 4.43Å; V169-K183 HydrophobicContact CG2-CB 4.35Å; V169-I184 HydrophobicContact CB-CG1 4.47Å; V169-I184 HydrophobicContact CG1-CD1 4.49Å; V169-I184 HydrophobicContact CG1-CG1 3.78Å; V169-C196 HydrophobicContact CB-CB 4.1Å; V169-C196 HydrophobicContact CG2-CB 3.51Å; V169-I198 PolarHBondContact N-O 2.86Å; V169-L199 HydrophobicContact CB-CD1 4.17Å; V169-L199 HydrophobicContact CG1-CD1 4.23Å; V169-V200 PolarHBondContact O-N 2.69Å
170	L	96.8	Very high	92	Very high	30 Å²	30	56.9 Å²	56.9	16%	0.157	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128	176.7	176.6	64.5	0	0	0	111.3	A150 F154 T172 V200	A150-L170 HydrophobicContact CB-CD1 3.63Å; F154-L170 HydrophobicContact CB-CB 4.2Å; F154-L170 HydrophobicContact CB-CD1 4.14Å; F154-L170 HydrophobicContact CB-CD2 4.25Å; F154-L170 HydrophobicContact CB-CG 4.43Å; F154-L170 HydrophobicContact CD1-CB 4.28Å; F154-L170 HydrophobicContact CD1-CD2 4.26Å; F154-L170 HydrophobicContact CD2-CB 3.62Å; F154-L170 HydrophobicContact CE2-CB 3.99Å; F154-L170 HydrophobicContact CG-CB 3.77Å; F154-L170 HydrophobicContact CG-CD2 4.23Å; F154-L170 HydrophobicContact CG-CG 4.43Å; F154-L170 HydrophobicContact CZ-CB 4.47Å; L170-T172 HydrophobicContact CD1-CG2 3.5Å; L170-T172 VanDerWaalsContact CD1-CG2 3.5Å; L170-T172 HydrophobicContact CD2-CG2 4.37Å; L170-T172 HydrophobicContact CG-CG2 3.87Å; L170-V200 CarbonylContact C-O 3.59Å; L170-V200 WeakPolarHBondContact CA-O 3.2Å; L170-V200 HydrophobicContact CD1-CB 4.09Å; L170-V200 HydrophobicContact CD1-CG1 3.97Å
171	I	95.5	Very high	91.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	109.4	175.1	59.2	169.7	0	0	0	112.3	V169 D180 I184 L199 V200 A201 T202 R205	V169-I171 HydrophobicContact CG1-CG2 4.27Å; I171-D180 HydrophobicContact CG2-CB 3.78Å; I171-I184 HydrophobicContact CD1-CD1 4.43Å; I171-I184 HydrophobicContact CG2-CD1 3.77Å; I171-L199 HydrophobicContact CD1-CD1 3.89Å; I171-L199 HydrophobicContact CD1-CD2 3.91Å; I171-L199 HydrophobicContact CD1-CG 4.12Å; I171-L199 HydrophobicContact CG1-CD1 3.85Å; I171-L199 HydrophobicContact CG1-CG 4.29Å; I171-L199 HydrophobicContact CG2-CD1 4.25Å; I171-V200 PolarHBondContact N-O 3.39Å; I171-A201 HydrophobicContact CD1-CB 3.89Å; I171-A201 HydrophobicContact CG1-CB 3.52Å; I171-A201 VanDerWaalsContact O-CA 3.31Å; I171-A201 WeakPolarHBondContact O-CA 3.47Å; I171-T202 PolarHBondContact O-N 2.72Å; I171-T202 VanDerWaalsContact O-N 3.14Å; I171-R205 HydrophobicContact CB-CG 3.78Å; I171-R205 HydrophobicContact CD1-CG 4.33Å; I171-R205 HydrophobicContact CG1-CG 4.26Å
172	T	91.8	Very high	91.8	Very high	19 Å²	19	65.5 Å²	65.5	12%	0.117	33%	0.326	C	S	.	.			trans	-125.7	4.2	-173.2	61.1	0	0	0	0	114.7	A147 A150 L170 Q174 T202	A147-T172 HydrophobicContact CB-CG2 3.9Å; A150-T172 HydrophobicContact CB-CG2 3.71Å; L170-T172 HydrophobicContact CD1-CG2 3.5Å; L170-T172 VanDerWaalsContact CD1-CG2 3.5Å; L170-T172 HydrophobicContact CD2-CG2 4.37Å; L170-T172 HydrophobicContact CG-CG2 3.87Å; T172-Q174 PolarHBondContact O-N 3.3Å; T172-Q174 PolarHBondContact OG1-OE1 3.08Å; T172-T202 WeakPolarHBondContact CA-OG1 3.2Å; T172-T202 HydrophobicContact CG2-CG2 4.12Å
173	G	88.9	Confident	91.9	Very high	42 Å²	42	60.6 Å²	60.6	43%	0.433	31%	0.31	S	S	.	.	S	Bend	trans	75.4	-3.3	-176.2	0	0	0	0	0	114.5	Q175	G173-Q175 VanDerWaalsContact C-N 3.31Å; G173-Q175 PolarHBondContact O-N 3.44Å
174	Q	85.2	Confident	92	Very high	96 Å²	96	56.9 Å²	56.9	45%	0.449	29%	0.293	S	S	.	.	S	Bend	trans	-78.9	-17.2	-179.5	-65.4	177.3	-32.2	0	0	113.7	A147 T172 P407	A147-Q174 HydrophobicContact CB-CG 4.24Å; T172-Q174 PolarHBondContact O-N 3.3Å; T172-Q174 PolarHBondContact OG1-OE1 3.08Å; Q174-P407 HydrophobicContact CG-CG 4.47Å
175	Q	86.5	Confident	92	Very high	92 Å²	92	56.1 Å²	56.1	43%	0.43	29%	0.287	S	S	.	.	S	Bend	trans	-109.3	160.2	174.2	-62	-177.6	39.3	0	0	109.4	G173 N179 R205	G173-Q175 VanDerWaalsContact C-N 3.31Å; G173-Q175 PolarHBondContact O-N 3.44Å; Q175-N179 HydrophobicContact CB-CB 4.43Å; Q175-R205 PolarHBondContact O-NH2 3.09Å
176	K	90.7	Very high	91.8	Very high	163 Å²	163	57.2 Å²	57.2	71%	0.709	28%	0.282	S	S	*	.			trans	-60.1	142.2	173.3	-65.5	-175.4	177.8	-176.7	0	110.1	Q178 N179	K176-Q178 PolarHBondContact O-N 3.12Å; K176-Q178 VanDerWaalsContact O-N 3.17Å; K176-N179 WeakPolarHBondContact O-CB 3.4Å; K176-N179 PolarHBondContact O-N 3.23Å
177	F	91.7	Very high	91.4	Very high	47 Å²	47	64.4 Å²	64.4	21%	0.206	32%	0.315	C	S	.	.	H	α-helix	trans	-52.4	-39.6	-179.6	-172	-95.7	0	0	0	113.2	N179 D180 V181 R205 D208 H209 L214	F177-N179 PolarHBondContact O-N 3.41Å; F177-N179 VanDerWaalsContact O-N 3.15Å; F177-D180 WeakPolarHBondContact O-CB 3.31Å; F177-D180 PolarHBondContact O-N 3.11Å; F177-V181 HydrophobicContact CD1-CG2 3.68Å; F177-V181 HydrophobicContact CE1-CG2 3.46Å; F177-V181 VanDerWaalsContact CE1-CG2 3.46Å; F177-V181 HydrophobicContact CZ-CG2 4.22Å; F177-V181 WeakPolarHBondContact O-CG2 3.43Å; F177-V181 PolarHBondContact O-N 3.31Å; F177-R205 VanDerWaalsContact N-NH2 3.14Å; F177-D208 HydrophobicContact CD2-CB 4.07Å; F177-D208 HydrophobicContact CE2-CB 3.81Å; F177-H209 AromaticContact CE2-CD2 3.73Å; F177-H209 AromaticContact CE2-CE1 3.6Å; F177-H209 AromaticContact CE2-CG 3.92Å; F177-H209 AromaticContact CE2-ND1 3.85Å; F177-H209 AromaticContact CE2-NE2 3.55Å; F177-H209 AromaticContact CZ-CE1 3.78Å; F177-H209 AromaticContact CZ-ND1 3.83Å; F177-L214 HydrophobicContact CE1-CD1 4.25Å
178	Q	90.8	Very high	90.9	Very high	139 Å²	139	65 Å²	65	65%	0.65	32%	0.317	S	S	*	.	H	α-helix	trans	-57.6	-30.5	177	-65.8	179.3	-6.8	0	0	114	K176 D180 K182	K176-Q178 PolarHBondContact O-N 3.12Å; K176-Q178 VanDerWaalsContact O-N 3.17Å; Q178-D180 VanDerWaalsContact C-N 3.34Å; Q178-K182 WeakPolarHBondContact O-CG 3.4Å; Q178-K182 PolarHBondContact O-N 2.79Å
179	N	92.1	Very high	90.2	Very high	65 Å²	65	72.6 Å²	72.6	35%	0.348	36%	0.357	S	S	.	.	H	α-helix	trans	-71.3	-34.3	176.8	-68.9	-3.5	0	0	0	111.4	Q175 K176 F177 K183	Q175-N179 HydrophobicContact CB-CB 4.43Å; K176-N179 WeakPolarHBondContact O-CB 3.4Å; K176-N179 PolarHBondContact O-N 3.23Å; F177-N179 PolarHBondContact O-N 3.41Å; F177-N179 VanDerWaalsContact O-N 3.15Å; N179-K183 WeakPolarHBondContact O-CG 3.43Å; N179-K183 PolarHBondContact O-N 3.27Å
180	D	92.2	Very high	89.2	Confident	3 Å²	3	83.2 Å²	83.2	2%	0.016	40%	0.396	C	S	.	.	H	α-helix	trans	-72.2	-39	178.1	-61.5	-13.9	0	0	0	109.8	I171 F177 Q178 K182 K183 I184 R205	I171-D180 HydrophobicContact CG2-CB 3.78Å; F177-D180 WeakPolarHBondContact O-CB 3.31Å; F177-D180 PolarHBondContact O-N 3.11Å; Q178-D180 VanDerWaalsContact C-N 3.34Å; D180-K182 VanDerWaalsContact C-N 3.34Å; D180-K182 PolarHBondContact O-N 2.89Å; D180-K183 PolarHBondContact O-N 3.42Å; D180-K183 VanDerWaalsContact O-N 3.09Å; D180-I184 WeakPolarHBondContact O-CB 2.93Å; D180-I184 WeakPolarHBondContact O-CG1 3.41Å; D180-I184 PolarHBondContact O-N 3.4Å; D180-R205 IonicContact OD2-CZ 3.09Å; D180-R205 IonicContact OD2-NE 3.03Å; D180-R205 PolarHBondContact OD2-NE 3.23Å; D180-R205 IonicContact OD2-NH2 3.87Å; D180-R205 PolarHBondContact OD2-NH2 2.86Å
181	V	90.4	Very high	88.4	Confident	28 Å²	28	83.5 Å²	83.5	17%	0.17	41%	0.406	C	S	.	.	H	α-helix	trans	-56.3	-47.5	174.2	175.4	0	0	0	0	111.4	F177 K183 I184 Y185 L214	F177-V181 HydrophobicContact CD1-CG2 3.68Å; F177-V181 HydrophobicContact CE1-CG2 3.46Å; F177-V181 VanDerWaalsContact CE1-CG2 3.46Å; F177-V181 HydrophobicContact CZ-CG2 4.22Å; F177-V181 WeakPolarHBondContact O-CG2 3.43Å; F177-V181 PolarHBondContact O-N 3.31Å; V181-K183 PolarHBondContact O-N 3.22Å; V181-I184 PolarHBondContact O-N 3.34Å; V181-Y185 HydrophobicContact CB-CD2 4.2Å; V181-Y185 HydrophobicContact CG1-CD2 3.86Å; V181-Y185 HydrophobicContact CG1-CE2 4.48Å; V181-Y185 HydrophobicContact CG2-CD2 4.49Å; V181-Y185 HydrophobicContact CG2-CE2 4.37Å; V181-Y185 WeakPolarHBondContact O-CD2 3.3Å; V181-Y185 PolarHBondContact O-N 3.21Å; V181-L214 HydrophobicContact CB-CD1 4.24Å; V181-L214 HydrophobicContact CG1-CD1 3.63Å; V181-L214 HydrophobicContact CG2-CD1 3.49Å; V181-L214 VanDerWaalsContact CG2-CD1 3.49Å
182	K	90.8	Very high	87.8	Confident	166 Å²	166	86 Å²	86	72%	0.722	42%	0.419	S	S	*	.	H	α-helix	trans	-64.5	-26.3	178.6	-70.4	177.6	-178.2	-176.2	0	113.9	Q178 D180	Q178-K182 WeakPolarHBondContact O-CG 3.4Å; Q178-K182 PolarHBondContact O-N 2.79Å; D180-K182 VanDerWaalsContact C-N 3.34Å; D180-K182 PolarHBondContact O-N 2.89Å
183	K	91.8	Very high	87.3	Confident	82 Å²	82	87 Å²	87	36%	0.357	42%	0.424	S	S	.	.	H	α-helix	trans	-85.2	-39.2	179.2	-69.7	170.7	-168.1	165	0	112.1	V169 N179 D180 V181	V169-K183 HydrophobicContact CG1-CB 3.91Å; V169-K183 HydrophobicContact CG1-CD 4.43Å; V169-K183 HydrophobicContact CG2-CB 4.35Å; N179-K183 WeakPolarHBondContact O-CG 3.43Å; N179-K183 PolarHBondContact O-N 3.27Å; D180-K183 PolarHBondContact O-N 3.42Å; D180-K183 VanDerWaalsContact O-N 3.09Å; V181-K183 PolarHBondContact O-N 3.22Å
184	I	91.3	Very high	87.2	Confident	0 Å²	0	85.5 Å²	85.5	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-82.2	-44	-174.7	-67.3	172.9	0	0	0	110.5	V169 I171 D180 V181 A194 T195 L199	V169-I184 HydrophobicContact CB-CG1 4.47Å; V169-I184 HydrophobicContact CG1-CD1 4.49Å; V169-I184 HydrophobicContact CG1-CG1 3.78Å; I171-I184 HydrophobicContact CD1-CD1 4.43Å; I171-I184 HydrophobicContact CG2-CD1 3.77Å; D180-I184 WeakPolarHBondContact O-CB 2.93Å; D180-I184 WeakPolarHBondContact O-CG1 3.41Å; D180-I184 PolarHBondContact O-N 3.4Å; V181-I184 PolarHBondContact O-N 3.34Å; I184-A194 HydrophobicContact CG2-CB 4.24Å; I184-A194 CarbonylContact O-C 3.54Å; I184-A194 WeakPolarHBondContact O-CA 2.99Å; I184-T195 PolarHBondContact O-N 3.49Å; I184-T195 PolarHBondContact O-OG1 2.81Å; I184-L199 HydrophobicContact CD1-CD1 4.07Å; I184-L199 HydrophobicContact CG1-CD1 4.42Å
185	Y	90.7	Very high	87.4	Confident	12 Å²	12	83 Å²	83	5%	0.047	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	148.1	-166.6	-47.6	-80.9	0	0	0	112.8	V181 L192 I193 A194 H209 A217 F218	V181-Y185 HydrophobicContact CB-CD2 4.2Å; V181-Y185 HydrophobicContact CG1-CD2 3.86Å; V181-Y185 HydrophobicContact CG1-CE2 4.48Å; V181-Y185 HydrophobicContact CG2-CD2 4.49Å; V181-Y185 HydrophobicContact CG2-CE2 4.37Å; V181-Y185 WeakPolarHBondContact O-CD2 3.3Å; V181-Y185 PolarHBondContact O-N 3.21Å; Y185-L192 VanDerWaalsContact CB-CD1 3.44Å; Y185-L192 HydrophobicContact CD1-CD2 4.27Å; Y185-L192 HydrophobicContact CD1-CG 4.14Å; Y185-L192 HydrophobicContact CD2-CD2 4.21Å; Y185-L192 HydrophobicContact CG-CD1 4.31Å; Y185-L192 HydrophobicContact CG-CD2 3.91Å; Y185-L192 HydrophobicContact CG-CG 3.91Å; Y185-I193 WeakPolarHBondContact CA-O 3.39Å; Y185-A194 HydrophobicContact CD1-CB 4.27Å; Y185-A194 HydrophobicContact CE1-CB 4.47Å; Y185-H209 PolarHBondContact OH-ND1 3.42Å; Y185-A217 HydrophobicContact CD1-CB 4.18Å; Y185-A217 HydrophobicContact CE1-CB 3.92Å; Y185-A217 WeakPolarHBondContact CE1-O 3.41Å; Y185-F218 WeakPolarHBondContact OH-CB 3.28Å; Y185-F218 WeakPolarHBondContact OH-CD2 3.4Å
186	K	88.5	Confident	87.7	Confident	134 Å²	134	78.7 Å²	78.7	58%	0.583	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.1	131.4	168.5	-174.4	177.5	178	-178.9	0	108.8	I193 T195	K186-I193 PolarHBondContact N-O 2.82Å; K186-I193 PolarHBondContact O-N 3.28Å; K186-T195 HydrophobicContact CB-CG2 3.54Å; K186-T195 HydrophobicContact CD-CG2 4.36Å
187	E	85.7	Confident	87.9	Confident	167 Å²	167	71 Å²	71	78%	0.78	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	132	172.7	-167.6	167.9	-167.1	0	0	109.3	L192	E187-L192 HydrophobicContact CB-CD1 4.38Å
188	T	83.6	Confident	88.2	Confident	52 Å²	52	68.7 Å²	68.7	32%	0.319	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	167.7	178.9	66.9	0	0	0	0	109	R190 G191 I193	T188-R190 PolarHBondContact O-N 2.8Å; T188-R190 PolarHBondContact OG1-N 3.03Å; T188-G191 PolarHBondContact N-O 3.4Å; T188-G191 PolarHBondContact O-N 3.39Å; T188-G191 PolarHBondContact OG1-O 3.49Å; T188-I193 HydrophobicContact CG2-CD1 4.24Å; T188-I193 VanDerWaalsContact OG1-CD1 3.23Å; T188-I193 WeakPolarHBondContact OG1-CD1 3.34Å
189	D	82	Confident	88.5	Confident	179 Å²	179	62.1 Å²	62.1	96%	0.957	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-18.8	176.8	-48.9	-25.1	0	0	0	113.3
190	R	75.7	Confident	88.8	Confident	232 Å²	232	59 Å²	59	88%	0.875	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	11.5	177	-58.1	-174.7	-174.4	-170.1	1.1	113.3	T188 I193	T188-R190 PolarHBondContact O-N 2.8Å; T188-R190 PolarHBondContact OG1-N 3.03Å; R190-I193 HydrophobicContact CB-CD1 4.38Å
191	G	79.7	Confident	89	Confident	35 Å²	35	58.9 Å²	58.9	36%	0.361	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	97.8	-166.5	-176.3	0	0	0	0	0	113.7	T188 I193	T188-G191 PolarHBondContact N-O 3.4Å; T188-G191 PolarHBondContact O-N 3.39Å; T188-G191 PolarHBondContact OG1-O 3.49Å; G191-I193 PolarHBondContact O-N 3.01Å
192	L	82.9	Confident	89.2	Confident	53 Å²	53	58.1 Å²	58.1	28%	0.277	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	116.3	-175	-168.1	65.4	0	0	0	110.3	Y185 E187 L214 A217	Y185-L192 VanDerWaalsContact CB-CD1 3.44Å; Y185-L192 HydrophobicContact CD1-CD2 4.27Å; Y185-L192 HydrophobicContact CD1-CG 4.14Å; Y185-L192 HydrophobicContact CD2-CD2 4.21Å; Y185-L192 HydrophobicContact CG-CD1 4.31Å; Y185-L192 HydrophobicContact CG-CD2 3.91Å; Y185-L192 HydrophobicContact CG-CG 3.91Å; E187-L192 HydrophobicContact CB-CD1 4.38Å; L192-L214 HydrophobicContact CD2-CD1 4.18Å; L192-L214 HydrophobicContact CD2-CD2 4.14Å; L192-A217 HydrophobicContact CB-CB 4.06Å; L192-A217 HydrophobicContact CD2-CB 3.83Å; L192-A217 HydrophobicContact CG-CB 4.11Å
193	I	82.8	Confident	89.2	Confident	41 Å²	41	50.2 Å²	50.2	21%	0.21	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.5	-173.8	-60.7	179.6	0	0	0	110.2	Y185 K186 T188 R190 G191 T195	Y185-I193 WeakPolarHBondContact CA-O 3.39Å; K186-I193 PolarHBondContact N-O 2.82Å; K186-I193 PolarHBondContact O-N 3.28Å; T188-I193 HydrophobicContact CG2-CD1 4.24Å; T188-I193 VanDerWaalsContact OG1-CD1 3.23Å; T188-I193 WeakPolarHBondContact OG1-CD1 3.34Å; R190-I193 HydrophobicContact CB-CD1 4.38Å; G191-I193 PolarHBondContact O-N 3.01Å; I193-T195 PolarHBondContact O-N 3.13Å
194	A	85.7	Confident	89.1	Confident	9 Å²	9	47.9 Å²	47.9	7%	0.074	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	123.8	172	0	0	0	0	0	111.2	I138 I184 Y185	I138-A194 HydrophobicContact CD1-CB 4.21Å; I138-A194 HydrophobicContact CG1-CB 4.2Å; I184-A194 HydrophobicContact CG2-CB 4.24Å; I184-A194 CarbonylContact O-C 3.54Å; I184-A194 WeakPolarHBondContact O-CA 2.99Å; Y185-A194 HydrophobicContact CD1-CB 4.27Å; Y185-A194 HydrophobicContact CE1-CB 4.47Å
195	T	89.4	Confident	89.2	Confident	45 Å²	45	48.7 Å²	48.7	28%	0.276	25%	0.25	S	C	.	.			trans	-101.4	-6.5	177.5	50.9	0	0	0	0	113.5	P136 I184 K186 I193	P136-T195 WeakPolarHBondContact CB-O 3.14Å; I184-T195 PolarHBondContact O-N 3.49Å; I184-T195 PolarHBondContact O-OG1 2.81Å; K186-T195 HydrophobicContact CB-CG2 3.54Å; K186-T195 HydrophobicContact CD-CG2 4.36Å; I193-T195 PolarHBondContact O-N 3.13Å
196	C	93.1	Very high	89.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.248	C	C	.	.			trans	-84.1	151.2	174.9	68.5	0	0	0	0	112.1	R137 I138 V169	R137-C196 CarbonylContact C-O 3.59Å; I138-C196 VanDerWaalsContact CG1-SG 3.6Å; I138-C196 PolarHBondContact N-O 3.09Å; V169-C196 HydrophobicContact CB-CB 4.1Å; V169-C196 HydrophobicContact CG2-CB 3.51Å
197	D	95.4	Very high	89.5	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	23%	0.234	C	C	.	.	S	Bend	trans	-109.6	-38.7	179	-53.3	-75.5	0	0	0	112.5	R133 P136 R137 R139 A140 L166 S167	R133-D197 WeakPolarHBondContact CD-OD1 3.48Å; R133-D197 IonicContact CZ-OD1 3.81Å; R133-D197 IonicContact CZ-OD2 2.98Å; R133-D197 IonicContact NE-OD1 3.26Å; R133-D197 PolarHBondContact NE-OD1 2.79Å; R133-D197 IonicContact NE-OD2 3.32Å; R133-D197 IonicContact NH1-OD1 2.76Å; R133-D197 PolarHBondContact NH1-OD1 2.78Å; R133-D197 IonicContact NH1-OD2 3.05Å; R133-D197 PolarHBondContact NH1-OD2 3.08Å; R133-D197 IonicContact NH2-OD1 3.69Å; R133-D197 IonicContact NH2-OD2 3.51Å; R133-D197 PolarHBondContact NH2-OD2 3.49Å; P136-D197 WeakPolarHBondContact CA-OD1 3.4Å; R137-D197 PolarHBondContact N-OD1 3.49Å; R137-D197 WeakPolarHBondContact O-CA 3.43Å; R139-D197 PolarHBondContact N-O 3.17Å; R139-D197 IonicContact NH1-OD1 3.69Å; A140-D197 PolarHBondContact N-O 3.13Å; L166-D197 HydrophobicContact CD2-CB 4.46Å; S167-D197 PolarHBondContact N-OD2 3.09Å; S167-D197 PolarHBondContact O-N 2.95Å
198	I	97.9	Very high	89.8	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116.7	-178.6	-54.8	176.3	0	0	0	107.2	I126 V127 L130 A140 I142 F157 T161 L166 S167 T168 V169	I126-I198 HydrophobicContact CG2-CD1 4.39Å; V127-I198 HydrophobicContact CG2-CD1 4.37Å; L130-I198 HydrophobicContact CD1-CD1 4.5Å; L130-I198 HydrophobicContact CD1-CG1 4.01Å; A140-I198 HydrophobicContact CB-CB 4.48Å; A140-I198 HydrophobicContact CB-CG1 4.21Å; A140-I198 HydrophobicContact CB-CG2 4.24Å; A140-I198 WeakPolarHBondContact O-CA 3.48Å; I142-I198 HydrophobicContact CD1-CG2 3.52Å; F157-I198 HydrophobicContact CD1-CD1 3.73Å; F157-I198 HydrophobicContact CD1-CG2 3.88Å; F157-I198 HydrophobicContact CD2-CG2 4.21Å; F157-I198 HydrophobicContact CE1-CD1 4.02Å; F157-I198 HydrophobicContact CE1-CG2 3.91Å; F157-I198 HydrophobicContact CE2-CG2 4.24Å; F157-I198 HydrophobicContact CG-CG2 4.04Å; F157-I198 HydrophobicContact CZ-CG2 4.09Å; T161-I198 HydrophobicContact CG2-CD1 4.09Å; L166-I198 HydrophobicContact CD1-CD1 4.46Å; S167-I198 PolarHBondContact O-N 3.45Å; S167-I198 VanDerWaalsContact O-N 3.08Å; T168-I198 CarbonylContact C-O 3.57Å; T168-I198 WeakPolarHBondContact CA-O 3.06Å; T168-I198 HydrophobicContact CG2-CB 4.07Å; T168-I198 HydrophobicContact CG2-CG2 4Å; V169-I198 PolarHBondContact N-O 2.86Å
199	L	97.8	Very high	90.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	118.9	178.2	-173.1	62	0	0	0	109.6	I138 A140 L141 I142 V169 I171 I184 F218	I138-L199 HydrophobicContact CD1-CD2 4.33Å; I138-L199 HydrophobicContact CG2-CB 4.3Å; A140-L199 PolarHBondContact O-N 2.83Å; L141-L199 CarbonylContact C-O 3.56Å; L141-L199 WeakPolarHBondContact CA-O 3.14Å; L141-L199 HydrophobicContact CD1-CB 4.13Å; L141-L199 HydrophobicContact CD1-CD2 4.05Å; L141-L199 HydrophobicContact CD1-CG 4.14Å; I142-L199 PolarHBondContact N-O 2.92Å; V169-L199 HydrophobicContact CB-CD1 4.17Å; V169-L199 HydrophobicContact CG1-CD1 4.23Å; I171-L199 HydrophobicContact CD1-CD1 3.89Å; I171-L199 HydrophobicContact CD1-CD2 3.91Å; I171-L199 HydrophobicContact CD1-CG 4.12Å; I171-L199 HydrophobicContact CG1-CD1 3.85Å; I171-L199 HydrophobicContact CG1-CG 4.29Å; I171-L199 HydrophobicContact CG2-CD1 4.25Å; I184-L199 HydrophobicContact CD1-CD1 4.07Å; I184-L199 HydrophobicContact CG1-CD1 4.42Å; L199-F218 HydrophobicContact CD2-CE2 3.59Å; L199-F218 HydrophobicContact CD2-CZ 3.69Å
200	V	98.2	Very high	90.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.3	173.4	-173.2	0	0	0	0	108	I142 L144 A150 F154 F157 T168 V169 L170 I171	I142-V200 HydrophobicContact CB-CG2 4.42Å; I142-V200 HydrophobicContact CD1-CG2 4.4Å; I142-V200 CarbonylContact O-C 3.52Å; I142-V200 WeakPolarHBondContact O-CA 3.34Å; L144-V200 HydrophobicContact CD1-CG1 3.45Å; L144-V200 VanDerWaalsContact CD1-CG1 3.45Å; A150-V200 HydrophobicContact CB-CG1 4.05Å; A150-V200 WeakPolarHBondContact O-CG1 3.41Å; F154-V200 HydrophobicContact CB-CB 4.41Å; F154-V200 HydrophobicContact CB-CG1 4.46Å; F154-V200 HydrophobicContact CB-CG2 4.34Å; F157-V200 HydrophobicContact CD2-CG2 3.97Å; F157-V200 HydrophobicContact CE2-CG2 4.34Å; T168-V200 HydrophobicContact CG2-CG2 4.31Å; V169-V200 PolarHBondContact O-N 2.69Å; L170-V200 CarbonylContact C-O 3.59Å; L170-V200 WeakPolarHBondContact CA-O 3.2Å; L170-V200 HydrophobicContact CD1-CB 4.09Å; L170-V200 HydrophobicContact CD1-CG1 3.97Å; I171-V200 PolarHBondContact N-O 3.39Å
201	A	96.1	Very high	91.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	151.5	-167.9	0	0	0	0	0	113.8	L141 I142 I143 L144 I171 L206	L141-A201 HydrophobicContact CD1-CB 4.29Å; I142-A201 PolarHBondContact O-N 3.4Å; I143-A201 WeakPolarHBondContact CA-O 3.43Å; L144-A201 PolarHBondContact N-O 2.98Å; I171-A201 HydrophobicContact CD1-CB 3.89Å; I171-A201 HydrophobicContact CG1-CB 3.52Å; I171-A201 VanDerWaalsContact O-CA 3.31Å; I171-A201 WeakPolarHBondContact O-CA 3.47Å; A201-L206 HydrophobicContact CB-CB 4.21Å
202	T	93.3	Very high	91.6	Very high	12 Å²	12	23.9 Å²	23.9	7%	0.074	14%	0.135	C	C	.	.			trans	-94.4	146.7	160.2	55.7	0	0	0	0	110.1	L144 A147 A150 I171 T172 G204 R205 L206	L144-T202 WeakPolarHBondContact O-CA 3.28Å; A147-T202 HydrophobicContact CB-CG2 4.43Å; A150-T202 HydrophobicContact CB-CG2 4.36Å; I171-T202 PolarHBondContact O-N 2.72Å; I171-T202 VanDerWaalsContact O-N 3.14Å; T172-T202 WeakPolarHBondContact CA-OG1 3.2Å; T172-T202 HydrophobicContact CG2-CG2 4.12Å; T202-G204 PolarHBondContact O-N 2.9Å; T202-R205 PolarHBondContact O-N 3.29Å; T202-R205 VanDerWaalsContact O-N 3.16Å; T202-L206 PolarHBondContact O-N 2.77Å
203	P	91.8	Very high	91.6	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-52.4	-49.4	-173.9	-28.3	33.4	0	0	0	114.8	I143 L144 R205 L206 Q207 L234 Y238 W242	I143-P203 HydrophobicContact CG2-CG 3.75Å; L144-P203 VanDerWaalsContact O-CD 3.31Å; L144-P203 WeakPolarHBondContact O-CD 3.41Å; P203-R205 VanDerWaalsContact C-N 3.31Å; P203-R205 PolarHBondContact O-N 2.61Å; P203-L206 WeakPolarHBondContact O-CB 3.47Å; P203-L206 PolarHBondContact O-N 3.11Å; P203-L206 VanDerWaalsContact O-N 3.07Å; P203-Q207 PolarHBondContact O-N 3.4Å; P203-L234 HydrophobicContact CG-CD2 3.62Å; P203-Y238 HydrophobicContact CB-CD1 3.99Å; P203-Y238 HydrophobicContact CB-CE1 3.66Å; P203-Y238 HydrophobicContact CB-CE2 4.34Å; P203-Y238 HydrophobicContact CB-CG 4.46Å; P203-Y238 HydrophobicContact CG-CD1 4.42Å; P203-Y238 HydrophobicContact CG-CD2 4.2Å; P203-Y238 HydrophobicContact CG-CE1 4.04Å; P203-Y238 HydrophobicContact CG-CE2 3.8Å; P203-W242 HydrophobicContact CG-CH2 4.39Å
204	G	90.6	Very high	91.7	Very high	32 Å²	32	26.7 Å²	26.7	33%	0.33	16%	0.156	S	C	.	.	H	α-helix	trans	-58.3	-43	-178.3	0	0	0	0	0	112.7	T202 Q207 D208	T202-G204 PolarHBondContact O-N 2.9Å; G204-Q207 PolarHBondContact O-N 2.89Å; G204-D208 PolarHBondContact O-N 3.25Å
205	R	93	Very high	91.5	Very high	18 Å²	18	28.5 Å²	28.5	7%	0.068	17%	0.169	C	C	.	.	H	α-helix	trans	-70.7	-35.4	176.2	-174.2	49.5	151.8	-139.4	-21.2	113	I171 Q175 F177 D180 T202 P203 Q207 D208 H209	I171-R205 HydrophobicContact CB-CG 3.78Å; I171-R205 HydrophobicContact CD1-CG 4.33Å; I171-R205 HydrophobicContact CG1-CG 4.26Å; Q175-R205 PolarHBondContact O-NH2 3.09Å; F177-R205 VanDerWaalsContact N-NH2 3.14Å; D180-R205 IonicContact OD2-CZ 3.09Å; D180-R205 IonicContact OD2-NE 3.03Å; D180-R205 PolarHBondContact OD2-NE 3.23Å; D180-R205 IonicContact OD2-NH2 3.87Å; D180-R205 PolarHBondContact OD2-NH2 2.86Å; T202-R205 PolarHBondContact O-N 3.29Å; T202-R205 VanDerWaalsContact O-N 3.16Å; P203-R205 VanDerWaalsContact C-N 3.31Å; P203-R205 PolarHBondContact O-N 2.61Å; R205-Q207 VanDerWaalsContact C-N 3.27Å; R205-Q207 PolarHBondContact O-N 3.18Å; R205-D208 WeakPolarHBondContact CD-OD2 3.42Å; R205-D208 IonicContact CZ-OD2 3.56Å; R205-D208 IonicContact NE-OD2 3.85Å; R205-D208 IonicContact NH1-OD2 2.81Å; R205-D208 PolarHBondContact NH1-OD2 2.94Å; R205-D208 WeakPolarHBondContact O-CB 3.48Å; R205-D208 PolarHBondContact O-N 2.9Å; R205-H209 PolarHBondContact O-CD2 3.1Å; R205-H209 PolarHBondContact O-N 2.92Å
206	L	93.7	Very high	91.1	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-61.1	-39.9	174.4	179.9	61.9	0	0	0	111	L141 I143 A201 T202 P203 D208 H209 L210 F218 I246	L141-L206 HydrophobicContact CD1-CD1 4.21Å; L141-L206 HydrophobicContact CD1-CD2 4.36Å; L141-L206 HydrophobicContact CD2-CD1 4.42Å; L141-L206 HydrophobicContact CD2-CD2 3.98Å; I143-L206 HydrophobicContact CD1-CD2 3.72Å; I143-L206 HydrophobicContact CG1-CD2 4.25Å; A201-L206 HydrophobicContact CB-CB 4.21Å; T202-L206 PolarHBondContact O-N 2.77Å; P203-L206 WeakPolarHBondContact O-CB 3.47Å; P203-L206 PolarHBondContact O-N 3.11Å; P203-L206 VanDerWaalsContact O-N 3.07Å; L206-D208 PolarHBondContact O-N 3.44Å; L206-H209 WeakPolarHBondContact O-CB 3.36Å; L206-H209 PolarHBondContact O-N 2.82Å; L206-H209 VanDerWaalsContact O-N 3.07Å; L206-L210 HydrophobicContact CG-CD1 4.21Å; L206-L210 WeakPolarHBondContact O-CG 3.45Å; L206-L210 PolarHBondContact O-N 2.61Å; L206-F218 HydrophobicContact CD1-CE1 3.97Å; L206-F218 HydrophobicContact CD1-CZ 3.58Å; L206-I246 HydrophobicContact CD2-CD1 3.54Å; L206-I246 HydrophobicContact CD2-CG1 4.1Å
207	Q	91.6	Very high	90.6	Very high	61 Å²	61	34 Å²	34	29%	0.285	19%	0.193	S	C	.	.	H	α-helix	trans	-62.5	-38.6	175.8	-72.9	-176.1	-39.3	0	0	113	P203 G204 R205 H209 L210 H211 W242 E245	P203-Q207 PolarHBondContact O-N 3.4Å; G204-Q207 PolarHBondContact O-N 2.89Å; R205-Q207 VanDerWaalsContact C-N 3.27Å; R205-Q207 PolarHBondContact O-N 3.18Å; Q207-H209 PolarHBondContact O-N 3.47Å; Q207-L210 PolarHBondContact O-N 2.76Å; Q207-L210 VanDerWaalsContact O-N 3.1Å; Q207-H211 PolarHBondContact O-N 3.07Å; Q207-H211 PolarHBondContact O-ND1 3.29Å; Q207-W242 VanDerWaalsContact NE2-CB 3.26Å; Q207-E245 PolarHBondContact NE2-OE2 3.08Å
208	D	92.5	Very high	90.3	Very high	71 Å²	71	34.7 Å²	34.7	38%	0.38	20%	0.196	S	C	.	.	H	α-helix	trans	-55.7	-36.6	172.6	-64.3	-18.4	0	0	0	111.4	F177 G204 R205 L206 G212	F177-D208 HydrophobicContact CD2-CB 4.07Å; F177-D208 HydrophobicContact CE2-CB 3.81Å; G204-D208 PolarHBondContact O-N 3.25Å; R205-D208 WeakPolarHBondContact CD-OD2 3.42Å; R205-D208 IonicContact CZ-OD2 3.56Å; R205-D208 IonicContact NE-OD2 3.85Å; R205-D208 IonicContact NH1-OD2 2.81Å; R205-D208 PolarHBondContact NH1-OD2 2.94Å; R205-D208 WeakPolarHBondContact O-CB 3.48Å; R205-D208 PolarHBondContact O-N 2.9Å; L206-D208 PolarHBondContact O-N 3.44Å; D208-G212 WeakPolarHBondContact O-CA 3.39Å; D208-G212 PolarHBondContact O-N 2.79Å
209	H	91.8	Very high	89.7	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-78.4	-31	177.7	-78.5	-85.7	0	0	0	113.1	F177 Y185 R205 L206 Q207 S215 F218	F177-H209 AromaticContact CE2-CD2 3.73Å; F177-H209 AromaticContact CE2-CE1 3.6Å; F177-H209 AromaticContact CE2-CG 3.92Å; F177-H209 AromaticContact CE2-ND1 3.85Å; F177-H209 AromaticContact CE2-NE2 3.55Å; F177-H209 AromaticContact CZ-CE1 3.78Å; F177-H209 AromaticContact CZ-ND1 3.83Å; Y185-H209 PolarHBondContact OH-ND1 3.42Å; R205-H209 PolarHBondContact O-CD2 3.1Å; R205-H209 PolarHBondContact O-N 2.92Å; L206-H209 WeakPolarHBondContact O-CB 3.36Å; L206-H209 PolarHBondContact O-N 2.82Å; L206-H209 VanDerWaalsContact O-N 3.07Å; Q207-H209 PolarHBondContact O-N 3.47Å; H209-S215 WeakPolarHBondContact O-CA 3.45Å; H209-F218 HydrophobicContact CB-CD1 4.5Å; H209-F218 HydrophobicContact CB-CD2 3.85Å; H209-F218 HydrophobicContact CB-CE2 4.02Å; H209-F218 HydrophobicContact CB-CG 4.09Å; H209-F218 HydrophobicContact CB-CZ 4.41Å
210	L	90.4	Very high	89.2	Confident	22 Å²	22	37.2 Å²	37.2	12%	0.115	21%	0.213	C	C	.	.	H	α-helix	trans	-74.7	-37.1	178.2	-71.2	173.5	0	0	0	113.1	L206 Q207 S215 F218 L220 I246 A249	L206-L210 HydrophobicContact CG-CD1 4.21Å; L206-L210 WeakPolarHBondContact O-CG 3.45Å; L206-L210 PolarHBondContact O-N 2.61Å; Q207-L210 PolarHBondContact O-N 2.76Å; Q207-L210 VanDerWaalsContact O-N 3.1Å; L210-S215 WeakPolarHBondContact O-CB 3.4Å; L210-F218 HydrophobicContact CD2-CD1 3.7Å; L210-F218 HydrophobicContact CD2-CE1 3.66Å; L210-F218 HydrophobicContact CG-CD1 4.44Å; L210-F218 HydrophobicContact CG-CE1 4.27Å; L210-L220 HydrophobicContact CD2-CD1 4.39Å; L210-I246 HydrophobicContact CD1-CG1 4.04Å; L210-A249 HydrophobicContact CD2-CB 3.48Å; L210-A249 VanDerWaalsContact CD2-CB 3.48Å
211	H	88.9	Confident	88.5	Confident	116 Å²	116	37.8 Å²	37.8	54%	0.537	22%	0.216	S	C	.	.	H	α-helix	trans	-116	-10.5	-173.8	-57.2	100.5	0	0	0	113.9	Q207 E245	Q207-H211 PolarHBondContact O-N 3.07Å; Q207-H211 PolarHBondContact O-ND1 3.29Å; H211-E245 VanDerWaalsContact CE1-CD 3.46Å; H211-E245 IonicContact CE1-OE2 2.73Å; H211-E245 PolarHBondContact CE1-OE2 3.45Å; H211-E245 VanDerWaalsContact CE1-OE2 3.26Å
212	G	87.1	Confident	88.1	Confident	18 Å²	18	40.6 Å²	40.6	19%	0.186	23%	0.227	C	C	.	.	S	Bend	trans	-71.4	-177.7	-179	0	0	0	0	0	113.7	D208 L214 S215	D208-G212 WeakPolarHBondContact O-CA 3.39Å; D208-G212 PolarHBondContact O-N 2.79Å; G212-L214 PolarHBondContact O-N 3.5Å; G212-S215 VanDerWaalsContact O-CB 3.28Å; G212-S215 WeakPolarHBondContact O-CB 3.37Å; G212-S215 PolarHBondContact O-N 3.21Å; G212-S215 PolarHBondContact O-OG 3.37Å; G212-S215 VanDerWaalsContact O-OG 3.13Å
213	P	83.2	Confident	88	Confident	110 Å²	110	40 Å²	40	71%	0.714	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-20	-172.5	25	-34.9	0	0	0	114.1	H216	P213-H216 PolarHBondContact O-CE1 3.28Å; P213-H216 PolarHBondContact O-ND1 3.02Å
214	L	84.1	Confident	88	Confident	42 Å²	42	42.3 Å²	42.3	22%	0.22	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	18.6	179.2	-60.3	178.6	0	0	0	113.1	F177 V181 L192 G212 H216 A217 F218	F177-L214 HydrophobicContact CE1-CD1 4.25Å; V181-L214 HydrophobicContact CB-CD1 4.24Å; V181-L214 HydrophobicContact CG1-CD1 3.63Å; V181-L214 HydrophobicContact CG2-CD1 3.49Å; V181-L214 VanDerWaalsContact CG2-CD1 3.49Å; L192-L214 HydrophobicContact CD2-CD1 4.18Å; L192-L214 HydrophobicContact CD2-CD2 4.14Å; G212-L214 PolarHBondContact O-N 3.5Å; L214-H216 PolarHBondContact O-N 3.19Å; L214-A217 WeakPolarHBondContact O-CB 3.49Å; L214-A217 PolarHBondContact O-N 3.45Å; L214-F218 PolarHBondContact O-N 3.22Å
215	S	82.9	Confident	88.2	Confident	48 Å²	48	40.8 Å²	40.8	34%	0.336	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-53.3	-38.6	178.5	54	0	0	0	0	113.1	H209 L210 G212 A217 F218	H209-S215 WeakPolarHBondContact O-CA 3.45Å; L210-S215 WeakPolarHBondContact O-CB 3.4Å; G212-S215 VanDerWaalsContact O-CB 3.28Å; G212-S215 WeakPolarHBondContact O-CB 3.37Å; G212-S215 PolarHBondContact O-N 3.21Å; G212-S215 PolarHBondContact O-OG 3.37Å; G212-S215 VanDerWaalsContact O-OG 3.13Å; S215-A217 PolarHBondContact O-N 3.32Å; S215-F218 PolarHBondContact O-N 2.9Å
216	H	80.7	Confident	88.3	Confident	149 Å²	149	40.2 Å²	40.2	69%	0.69	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-59.3	-27.7	176	65.3	-86.7	0	0	0	113.9	P213 L214	P213-H216 PolarHBondContact O-CE1 3.28Å; P213-H216 PolarHBondContact O-ND1 3.02Å; L214-H216 PolarHBondContact O-N 3.19Å
217	A	82.8	Confident	88.4	Confident	11 Å²	11	40.2 Å²	40.2	9%	0.091	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-88.6	-16.4	177.3	0	0	0	0	0	112.7	Y185 L192 L214 S215 C219	Y185-A217 HydrophobicContact CD1-CB 4.18Å; Y185-A217 HydrophobicContact CE1-CB 3.92Å; Y185-A217 WeakPolarHBondContact CE1-O 3.41Å; L192-A217 HydrophobicContact CB-CB 4.06Å; L192-A217 HydrophobicContact CD2-CB 3.83Å; L192-A217 HydrophobicContact CG-CB 4.11Å; L214-A217 WeakPolarHBondContact O-CB 3.49Å; L214-A217 PolarHBondContact O-N 3.45Å; S215-A217 PolarHBondContact O-N 3.32Å; A217-C219 PolarHBondContact O-N 3.38Å
218	F	88	Confident	88.5	Confident	15 Å²	15	37.8 Å²	37.8	7%	0.066	20%	0.204	C	C	.	.			trans	-89.2	94.5	-179.5	-168	-95.9	0	0	0	111	I138 Y185 L199 L206 H209 L210 L214 S215 L220	I138-F218 HydrophobicContact CD1-CD2 4.08Å; I138-F218 HydrophobicContact CD1-CE2 3.7Å; I138-F218 HydrophobicContact CD1-CZ 4.21Å; Y185-F218 WeakPolarHBondContact OH-CB 3.28Å; Y185-F218 WeakPolarHBondContact OH-CD2 3.4Å; L199-F218 HydrophobicContact CD2-CE2 3.59Å; L199-F218 HydrophobicContact CD2-CZ 3.69Å; L206-F218 HydrophobicContact CD1-CE1 3.97Å; L206-F218 HydrophobicContact CD1-CZ 3.58Å; H209-F218 HydrophobicContact CB-CD1 4.5Å; H209-F218 HydrophobicContact CB-CD2 3.85Å; H209-F218 HydrophobicContact CB-CE2 4.02Å; H209-F218 HydrophobicContact CB-CG 4.09Å; H209-F218 HydrophobicContact CB-CZ 4.41Å; L210-F218 HydrophobicContact CD2-CD1 3.7Å; L210-F218 HydrophobicContact CD2-CE1 3.66Å; L210-F218 HydrophobicContact CG-CD1 4.44Å; L210-F218 HydrophobicContact CG-CE1 4.27Å; L214-F218 PolarHBondContact O-N 3.22Å; S215-F218 PolarHBondContact O-N 2.9Å; F218-L220 HydrophobicContact CD1-CG 4.28Å; F218-L220 HydrophobicContact CE1-CD1 3.9Å; F218-L220 HydrophobicContact CE1-CD2 3.73Å; F218-L220 HydrophobicContact CE1-CG 3.68Å; F218-L220 HydrophobicContact CZ-CD2 3.9Å; F218-L220 HydrophobicContact CZ-CG 4.36Å
219	C	85.1	Confident	88.5	Confident	52 Å²	52	34.8 Å²	34.8	35%	0.351	19%	0.187	S	C	.	.			trans	-107.8	120.5	-175.8	-178.3	0	0	0	0	111.8	A217 T221	A217-C219 PolarHBondContact O-N 3.38Å; C219-T221 VanDerWaalsContact SG-CB 3.55Å; C219-T221 PolarHBondContact SG-OG1 3.46Å
220	L	88.6	Confident	88.3	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.192	C	C	.	.			trans	-101.8	8.3	174	-63.2	-177.2	0	0	0	113.6	I138 L141 L210 F218 Y222 L223 A249 I250	I138-L220 HydrophobicContact CB-CD2 4.35Å; I138-L220 HydrophobicContact CD1-CD2 4.42Å; I138-L220 HydrophobicContact CG2-CD2 3.75Å; L141-L220 HydrophobicContact CD2-CD1 4.09Å; L141-L220 HydrophobicContact CD2-CD2 4.49Å; L210-L220 HydrophobicContact CD2-CD1 4.39Å; F218-L220 HydrophobicContact CD1-CG 4.28Å; F218-L220 HydrophobicContact CE1-CD1 3.9Å; F218-L220 HydrophobicContact CE1-CD2 3.73Å; F218-L220 HydrophobicContact CE1-CG 3.68Å; F218-L220 HydrophobicContact CZ-CD2 3.9Å; F218-L220 HydrophobicContact CZ-CG 4.36Å; L220-Y222 PolarHBondContact O-N 3.33Å; L220-L223 HydrophobicContact CB-CB 4.45Å; L220-L223 WeakPolarHBondContact O-CB 3.49Å; L220-L223 PolarHBondContact O-N 3.08Å; L220-A249 HydrophobicContact CD1-CB 4.08Å; L220-I250 HydrophobicContact CB-CG1 4.01Å; L220-I250 HydrophobicContact CD1-CG1 4.15Å
221	T	83.6	Confident	88.1	Confident	12 Å²	12	34.7 Å²	34.7	7%	0.074	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.8	-177	-52.3	0	0	0	0	114	C219 K273 V274	C219-T221 VanDerWaalsContact SG-CB 3.55Å; C219-T221 PolarHBondContact SG-OG1 3.46Å; T221-K273 HydrophobicContact CG2-CB 3.69Å; T221-K273 HydrophobicContact CG2-CD 3.48Å; T221-K273 VanDerWaalsContact CG2-CD 3.48Å; T221-K273 HydrophobicContact CG2-CG 3.42Å; T221-K273 VanDerWaalsContact CG2-CG 3.42Å; T221-V274 WeakPolarHBondContact O-CG2 3.4Å; T221-V274 PolarHBondContact O-N 3.17Å; T221-V274 VanDerWaalsContact O-N 3.14Å
222	Y	86.5	Confident	87.7	Confident	59 Å²	59	29.4 Å²	29.4	23%	0.231	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	10.6	178.5	-56.9	-76.1	0	0	0	113.3	R137 I138 R139 L220 R224 P271 F294	R137-Y222 HydrophobicContact CB-CD2 4.24Å; R137-Y222 HydrophobicContact CB-CG 4.34Å; R137-Y222 HydrophobicContact CG-CD2 3.92Å; R137-Y222 HydrophobicContact CG-CE2 4.37Å; R137-Y222 HydrophobicContact CG-CG 4.22Å; I138-Y222 CarbonylContact O-C 3.51Å; R139-Y222 WeakPolarHBondContact CG-O 3.33Å; L220-Y222 PolarHBondContact O-N 3.33Å; Y222-R224 PolarHBondContact O-N 3.28Å; Y222-R224 VanDerWaalsContact O-N 3.14Å; Y222-P271 HydrophobicContact CE1-CB 4.18Å; Y222-F294 WeakPolarHBondContact O-CE1 3.39Å
223	L	91.1	Very high	87.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.165	C	C	.	.			trans	-68.5	110.1	-174.5	-170.3	74.1	0	0	0	111.5	I138 L141 L220 L226 I250 V274 L296	I138-L223 HydrophobicContact CG2-CD1 4.12Å; L141-L223 HydrophobicContact CB-CD1 3.57Å; L141-L223 HydrophobicContact CB-CD2 4.12Å; L141-L223 HydrophobicContact CB-CG 4.49Å; L141-L223 HydrophobicContact CD2-CD2 4.46Å; L220-L223 HydrophobicContact CB-CB 4.45Å; L220-L223 WeakPolarHBondContact O-CB 3.49Å; L220-L223 PolarHBondContact O-N 3.08Å; L223-L226 HydrophobicContact CD2-CB 4.22Å; L223-I250 HydrophobicContact CD2-CD1 3.59Å; L223-I250 HydrophobicContact CD2-CG1 3.76Å; L223-V274 WeakPolarHBondContact O-CG2 3.45Å; L223-L296 HydrophobicContact CB-CD1 4.45Å; L223-L296 HydrophobicContact CD2-CD1 3.96Å; L223-L296 HydrophobicContact CG-CD1 4.01Å; L223-L296 VanDerWaalsContact O-CD1 3.3Å; L223-L296 WeakPolarHBondContact O-CD1 3.41Å
224	R	91.2	Very high	87.4	Confident	49 Å²	49	26.4 Å²	26.4	19%	0.185	13%	0.131	C	C	.	.			trans	-87.7	-33.3	177.3	-175	175.4	173.6	174.9	-0.4	112.5	N97 R139 Y222 F294 L296 Q297	N97-R224 PolarHBondContact OD1-NH2 3.21Å; R139-R224 WeakPolarHBondContact O-CA 3.31Å; R139-R224 PolarHBondContact O-N 3.11Å; Y222-R224 PolarHBondContact O-N 3.28Å; Y222-R224 VanDerWaalsContact O-N 3.14Å; R224-F294 HydrophobicContact CB-CE1 4.3Å; R224-F294 HydrophobicContact CB-CZ 4.14Å; R224-L296 WeakPolarHBondContact O-CA 3.5Å; R224-Q297 PolarHBondContact O-N 2.83Å
225	F	95.3	Very high	87.1	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	126.4	-173.7	-57.5	-66.3	0	0	0	111.3	I126 F129 L130 R139 A140 L141 Q297 F299	I126-F225 HydrophobicContact CB-CD2 4.37Å; I126-F225 HydrophobicContact CD1-CB 4.03Å; I126-F225 HydrophobicContact CD1-CG 4.41Å; I126-F225 HydrophobicContact CG1-CB 3.99Å; I126-F225 HydrophobicContact CG1-CD1 4.3Å; I126-F225 HydrophobicContact CG1-CD2 3.94Å; I126-F225 HydrophobicContact CG1-CE2 4.47Å; I126-F225 HydrophobicContact CG1-CG 3.82Å; I126-F225 HydrophobicContact CG2-CD2 4.1Å; F129-F225 HydrophobicContact CB-CE2 3.91Å; F129-F225 HydrophobicContact CB-CZ 3.75Å; F129-F225 HydrophobicContact CD2-CZ 4.03Å; F129-F225 HydrophobicContact CG-CZ 4.18Å; L130-F225 HydrophobicContact CD1-CD2 4.39Å; L130-F225 HydrophobicContact CD2-CD2 4.16Å; L130-F225 HydrophobicContact CD2-CE2 3.92Å; L130-F225 HydrophobicContact CG-CD2 4.22Å; L130-F225 HydrophobicContact CG-CE2 4.06Å; R139-F225 PolarHBondContact O-N 2.98Å; A140-F225 CarbonylContact C-O 3.54Å; A140-F225 VanDerWaalsContact CA-O 3.31Å; A140-F225 WeakPolarHBondContact CA-O 3.5Å; A140-F225 HydrophobicContact CB-CB 4.12Å; L141-F225 PolarHBondContact N-O 2.96Å; F225-Q297 WeakPolarHBondContact CA-O 3.4Å; F225-Q297 HydrophobicContact CD1-CB 4.04Å; F225-Q297 HydrophobicContact CE1-CB 4.25Å; F225-F299 AromaticContact CD1-CE2 3.86Å; F225-F299 HydrophobicContact CD1-CE2 3.86Å; F225-F299 HydrophobicContact CE1-CE2 4.5Å
226	L	95	Very high	86.8	Confident	7 Å²	7	25.5 Å²	25.5	4%	0.037	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121.7	171.7	175.2	63.3	0	0	0	108.9	L141 I143 L223 L228 I246 I250 L296 Q297 K298 F299	L141-L226 HydrophobicContact CB-CD1 4.15Å; L141-L226 HydrophobicContact CD2-CD1 3.98Å; L141-L226 HydrophobicContact CG-CD1 4.03Å; L141-L226 CarbonylContact O-C 3.59Å; L141-L226 WeakPolarHBondContact O-CA 3.41Å; I143-L226 HydrophobicContact CD1-CD1 3.94Å; I143-L226 HydrophobicContact CG1-CD1 4.35Å; L223-L226 HydrophobicContact CD2-CB 4.22Å; L226-L228 HydrophobicContact CD1-CD2 4.45Å; L226-I246 HydrophobicContact CD2-CG2 4.46Å; L226-I250 HydrophobicContact CD2-CD1 4.31Å; L226-L296 HydrophobicContact CB-CD1 4.02Å; L226-Q297 PolarHBondContact N-O 2.98Å; L226-Q297 VanDerWaalsContact N-O 3.1Å; L226-K298 HydrophobicContact CB-CG 4.47Å; L226-K298 CarbonylContact O-C 3.55Å; L226-K298 VanDerWaalsContact O-CA 3.3Å; L226-K298 WeakPolarHBondContact O-CA 3.49Å; L226-F299 PolarHBondContact O-N 2.73Å
227	V	96.1	Very high	86.6	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129.4	179.2	-174.1	0	0	0	0	109.7	Y122 I126 L141 I142 I143 F299	Y122-V227 HydrophobicContact CD1-CG1 3.97Å; Y122-V227 HydrophobicContact CD2-CG1 3.97Å; Y122-V227 HydrophobicContact CD2-CG2 3.99Å; Y122-V227 HydrophobicContact CE1-CG1 3.95Å; Y122-V227 HydrophobicContact CE2-CG1 4.01Å; Y122-V227 HydrophobicContact CG-CG1 3.95Å; Y122-V227 HydrophobicContact CG-CG2 4.23Å; I126-V227 HydrophobicContact CD1-CG2 3.62Å; L141-V227 PolarHBondContact O-N 3.12Å; I142-V227 HydrophobicContact CB-CB 4.23Å; I142-V227 HydrophobicContact CG1-CB 3.87Å; I142-V227 HydrophobicContact CG1-CG2 3.84Å; I142-V227 HydrophobicContact CG2-CB 4.02Å; I142-V227 HydrophobicContact CG2-CG1 4.17Å; I143-V227 PolarHBondContact N-O 3.1Å; V227-F299 HydrophobicContact CB-CB 4.19Å; V227-F299 HydrophobicContact CG1-CB 3.99Å; V227-F299 HydrophobicContact CG2-CB 3.96Å; V227-F299 HydrophobicContact CG2-CD2 4.07Å; V227-F299 HydrophobicContact CG2-CG 4.22Å
228	L	93.6	Very high	86.1	Confident	11 Å²	11	24.9 Å²	24.9	6%	0.058	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	97.6	171.2	-53.7	173.4	0	0	0	107.1	I143 L226 A231 L234 W242 F243 F299 L300 V301 I315	I143-L228 HydrophobicContact CB-CD2 3.98Å; I143-L228 HydrophobicContact CD1-CD2 3.93Å; I143-L228 HydrophobicContact CG1-CD2 4.26Å; L226-L228 HydrophobicContact CD1-CD2 4.45Å; L228-A231 HydrophobicContact CB-CB 4.41Å; L228-L234 HydrophobicContact CB-CD1 4.09Å; L228-L234 HydrophobicContact CD2-CD1 4.41Å; L228-W242 HydrophobicContact CD2-CH2 4.35Å; L228-F243 HydrophobicContact CD1-CE1 3.34Å; L228-F243 HydrophobicContact CD1-CZ 3.64Å; L228-F243 HydrophobicContact CD2-CE1 3.66Å; L228-F243 HydrophobicContact CD2-CZ 4.02Å; L228-F243 HydrophobicContact CG-CE1 4.13Å; L228-F243 HydrophobicContact CG-CZ 4.42Å; L228-F299 PolarHBondContact N-O 3.11Å; L228-L300 HydrophobicContact CB-CD1 3.95Å; L228-L300 HydrophobicContact CD1-CD1 3.94Å; L228-V301 PolarHBondContact O-N 3.31Å; L228-I315 HydrophobicContact CD1-CD1 4.2Å
229	D	92.5	Very high	85.4	Confident	7 Å²	7	30.1 Å²	30.1	4%	0.037	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	144	178.6	-155.9	-5.9	0	0	0	110.6	Y122 I143 L144 P145 A231 L234 V301	Y122-D229 PolarHBondContact OH-OD2 2.84Å; I143-D229 PolarHBondContact O-N 3.17Å; I143-D229 VanDerWaalsContact O-N 3.13Å; L144-D229 HydrophobicContact CD2-CB 4.12Å; L144-D229 HydrophobicContact CG-CB 4.26Å; P145-D229 WeakPolarHBondContact CD-O 2.82Å; D229-A231 VanDerWaalsContact C-N 3.27Å; D229-A231 PolarHBondContact O-N 3.44Å; D229-L234 WeakPolarHBondContact O-CD1 3.38Å; D229-V301 CarbonylContact C-O 3.57Å; D229-V301 WeakPolarHBondContact OD1-CG1 3.47Å
230	E	88	Confident	84.8	Confident	21 Å²	21	30.7 Å²	30.7	10%	0.098	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	49.7	-164.2	-58.1	-75.3	-164.3	0	0	111.4	P145 L149 D232 R233 L234 V301 H457	P145-E230 HydrophobicContact CG-CB 3.9Å; L149-E230 HydrophobicContact CD1-CG 3.91Å; E230-D232 VanDerWaalsContact C-N 3.32Å; E230-D232 PolarHBondContact O-N 3.42Å; E230-R233 HydrophobicContact CB-CB 4.44Å; E230-R233 WeakPolarHBondContact O-CA 3.35Å; E230-R233 VanDerWaalsContact O-CB 3.32Å; E230-R233 WeakPolarHBondContact O-CB 3.4Å; E230-R233 PolarHBondContact O-N 3.5Å; E230-L234 PolarHBondContact O-N 3.2Å; E230-L234 VanDerWaalsContact O-N 3.13Å; E230-V301 WeakPolarHBondContact CA-O 3.48Å; E230-V301 PolarHBondContact N-O 3.18Å; E230-H457 IonicContact OE2-CE1 2.81Å
231	A	86.6	Confident	84.4	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-58.3	-37.2	-171.4	0	0	0	0	0	115.6	L228 D229 R233 L234 L235 L300 V301	L228-A231 HydrophobicContact CB-CB 4.41Å; D229-A231 VanDerWaalsContact C-N 3.27Å; D229-A231 PolarHBondContact O-N 3.44Å; A231-R233 PolarHBondContact O-N 3.3Å; A231-L234 PolarHBondContact O-N 3.41Å; A231-L235 WeakPolarHBondContact O-CB 3.42Å; A231-L235 WeakPolarHBondContact O-CD1 3.43Å; A231-L235 WeakPolarHBondContact O-CG 3.16Å; A231-L235 PolarHBondContact O-N 3.49Å; A231-L300 HydrophobicContact CB-CD1 3.17Å; A231-L300 HydrophobicContact CB-CG 3.82Å; A231-V301 PolarHBondContact N-O 3.04Å
232	D	79.6	Confident	84.3	Confident	5 Å²	5	35 Å²	35	3%	0.027	18%	0.175	C	C	.	.	H	α-helix	trans	-54.6	-36.7	172.6	56	-48.6	0	0	0	111.8	E230 A236 S302 T304 V311 Q453 H457	E230-D232 VanDerWaalsContact C-N 3.32Å; E230-D232 PolarHBondContact O-N 3.42Å; D232-A236 VanDerWaalsContact O-CB 3.3Å; D232-A236 WeakPolarHBondContact O-CB 3.47Å; D232-A236 PolarHBondContact O-N 3.07Å; D232-S302 WeakPolarHBondContact OD1-CB 3.34Å; D232-S302 PolarHBondContact OD1-OG 3.41Å; D232-T304 PolarHBondContact OD2-OG1 3.05Å; D232-V311 HydrophobicContact CB-CG2 4.33Å; D232-Q453 PolarHBondContact OD2-NE2 2.9Å; D232-H457 IonicContact OD2-CE1 2.76Å; D232-H457 IonicContact OD2-NE2 2.61Å; D232-H457 PolarHBondContact OD2-NE2 2.82Å
233	R	79.1	Confident	84	Confident	65 Å²	65	33.4 Å²	33.4	25%	0.245	17%	0.169	C	C	.	.	H	α-helix	trans	-77.6	-44.9	176.5	-171.5	63.4	179	168	14.4	112.2	P145 E230 A231 L235 A236 D237	P145-R233 HydrophobicContact CB-CB 4.36Å; P145-R233 HydrophobicContact CB-CG 3.91Å; P145-R233 HydrophobicContact CG-CB 4.27Å; P145-R233 HydrophobicContact CG-CG 4.16Å; E230-R233 HydrophobicContact CB-CB 4.44Å; E230-R233 WeakPolarHBondContact O-CA 3.35Å; E230-R233 VanDerWaalsContact O-CB 3.32Å; E230-R233 WeakPolarHBondContact O-CB 3.4Å; E230-R233 PolarHBondContact O-N 3.5Å; A231-R233 PolarHBondContact O-N 3.3Å; R233-L235 PolarHBondContact O-N 3.46Å; R233-A236 PolarHBondContact O-N 2.85Å; R233-A236 VanDerWaalsContact O-N 3.15Å; R233-D237 WeakPolarHBondContact CD-OD2 3.5Å; R233-D237 IonicContact CZ-OD1 2.77Å; R233-D237 IonicContact CZ-OD2 2.69Å; R233-D237 IonicContact NE-OD1 3.61Å; R233-D237 PolarHBondContact NE-OD1 2.73Å; R233-D237 VanDerWaalsContact NE-OD1 3.08Å; R233-D237 IonicContact NE-OD2 2.82Å; R233-D237 PolarHBondContact NE-OD2 3.44Å; R233-D237 IonicContact NH1-OD1 3.99Å; R233-D237 PolarHBondContact NH1-OD1 3.37Å; R233-D237 VanDerWaalsContact NH1-OD1 3.15Å; R233-D237 IonicContact NH2-OD1 3.08Å; R233-D237 PolarHBondContact NH2-OD1 2.94Å; R233-D237 IonicContact NH2-OD2 2.78Å; R233-D237 PolarHBondContact NH2-OD2 3.43Å; R233-D237 WeakPolarHBondContact O-CB 3.4Å; R233-D237 PolarHBondContact O-N 2.96Å
234	L	84.7	Confident	83.5	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-55	-37.5	177.6	-77.2	170.6	0	0	0	112.2	I143 P145 P203 L228 D229 E230 A231 Y238 W242	I143-L234 HydrophobicContact CB-CD1 4.5Å; I143-L234 HydrophobicContact CG2-CD1 4.23Å; I143-L234 HydrophobicContact CG2-CD2 4.05Å; P145-L234 HydrophobicContact CB-CD2 3.96Å; P145-L234 HydrophobicContact CB-CG 4.24Å; P203-L234 HydrophobicContact CG-CD2 3.62Å; L228-L234 HydrophobicContact CB-CD1 4.09Å; L228-L234 HydrophobicContact CD2-CD1 4.41Å; D229-L234 WeakPolarHBondContact O-CD1 3.38Å; E230-L234 PolarHBondContact O-N 3.2Å; E230-L234 VanDerWaalsContact O-N 3.13Å; A231-L234 PolarHBondContact O-N 3.41Å; L234-Y238 HydrophobicContact CD2-CD2 4.47Å; L234-Y238 HydrophobicContact CD2-CE2 4.34Å; L234-Y238 WeakPolarHBondContact O-CB 3.48Å; L234-Y238 WeakPolarHBondContact O-CD2 3.4Å; L234-Y238 PolarHBondContact O-N 3.07Å; L234-W242 HydrophobicContact CB-CZ2 4.3Å; L234-W242 HydrophobicContact CD2-CH2 4.45Å; L234-W242 HydrophobicContact CD2-CZ2 4.48Å
235	L	79.3	Confident	83.2	Confident	3 Å²	3	38.6 Å²	38.6	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-88.4	-14.2	-178.2	-71.2	159.1	0	0	0	114.6	A231 R233 F243 V311 K314 I315	A231-L235 WeakPolarHBondContact O-CB 3.42Å; A231-L235 WeakPolarHBondContact O-CD1 3.43Å; A231-L235 WeakPolarHBondContact O-CG 3.16Å; A231-L235 PolarHBondContact O-N 3.49Å; R233-L235 PolarHBondContact O-N 3.46Å; L235-F243 HydrophobicContact CD2-CD2 3.78Å; L235-F243 HydrophobicContact CD2-CE2 3.18Å; L235-F243 HydrophobicContact CD2-CZ 3.92Å; L235-F243 HydrophobicContact CG-CE2 3.84Å; L235-F243 HydrophobicContact CG-CZ 4.28Å; L235-V311 HydrophobicContact CB-CG2 4.13Å; L235-V311 HydrophobicContact CD1-CB 3.81Å; L235-V311 HydrophobicContact CD1-CG1 3.38Å; L235-V311 HydrophobicContact CD1-CG2 3.8Å; L235-K314 HydrophobicContact CB-CD 4.33Å; L235-K314 HydrophobicContact CD2-CB 3.97Å; L235-K314 HydrophobicContact CD2-CD 4.39Å; L235-K314 PolarHBondContact O-NZ 3.05Å; L235-I315 HydrophobicContact CD1-CD1 3.62Å; L235-I315 HydrophobicContact CD1-CG1 3.77Å; L235-I315 HydrophobicContact CD2-CG1 4.14Å
236	A	76.4	Confident	82.8	Confident	68 Å²	68	38.8 Å²	38.8	56%	0.562	19%	0.194	S	C	*	.	H	α-helix	trans	-85.3	-40.6	172.4	0	0	0	0	0	111.2	D232 R233	D232-A236 VanDerWaalsContact O-CB 3.3Å; D232-A236 WeakPolarHBondContact O-CB 3.47Å; D232-A236 PolarHBondContact O-N 3.07Å; R233-A236 PolarHBondContact O-N 2.85Å; R233-A236 VanDerWaalsContact O-N 3.15Å
237	D	75	Confident	82.1	Confident	72 Å²	72	40.7 Å²	40.7	39%	0.385	20%	0.204	S	C	.	.	H	α-helix	trans	-85.1	-23.6	-172.9	-74.6	3.7	0	0	0	113.7	R233	R233-D237 WeakPolarHBondContact CD-OD2 3.5Å; R233-D237 IonicContact CZ-OD1 2.77Å; R233-D237 IonicContact CZ-OD2 2.69Å; R233-D237 IonicContact NE-OD1 3.61Å; R233-D237 PolarHBondContact NE-OD1 2.73Å; R233-D237 VanDerWaalsContact NE-OD1 3.08Å; R233-D237 IonicContact NE-OD2 2.82Å; R233-D237 PolarHBondContact NE-OD2 3.44Å; R233-D237 IonicContact NH1-OD1 3.99Å; R233-D237 PolarHBondContact NH1-OD1 3.37Å; R233-D237 VanDerWaalsContact NH1-OD1 3.15Å; R233-D237 IonicContact NH2-OD1 3.08Å; R233-D237 PolarHBondContact NH2-OD1 2.94Å; R233-D237 IonicContact NH2-OD2 2.78Å; R233-D237 PolarHBondContact NH2-OD2 3.43Å; R233-D237 WeakPolarHBondContact O-CB 3.4Å; R233-D237 PolarHBondContact O-N 2.96Å
238	Y	73.8	Confident	81.5	Confident	74 Å²	74	43.9 Å²	43.9	29%	0.29	22%	0.222	S	C	.	.	S	Bend	trans	-126	143.1	-172.7	-60.1	-95	0	0	0	111.6	P203 L234 W242	P203-Y238 HydrophobicContact CB-CD1 3.99Å; P203-Y238 HydrophobicContact CB-CE1 3.66Å; P203-Y238 HydrophobicContact CB-CE2 4.34Å; P203-Y238 HydrophobicContact CB-CG 4.46Å; P203-Y238 HydrophobicContact CG-CD1 4.42Å; P203-Y238 HydrophobicContact CG-CD2 4.2Å; P203-Y238 HydrophobicContact CG-CE1 4.04Å; P203-Y238 HydrophobicContact CG-CE2 3.8Å; L234-Y238 HydrophobicContact CD2-CD2 4.47Å; L234-Y238 HydrophobicContact CD2-CE2 4.34Å; L234-Y238 WeakPolarHBondContact O-CB 3.48Å; L234-Y238 WeakPolarHBondContact O-CD2 3.4Å; L234-Y238 PolarHBondContact O-N 3.07Å; Y238-W242 VanDerWaalsContact CB-CD1 3.41Å
239	D	72.7	Confident	81.1	Confident	125 Å²	125	44.8 Å²	44.8	67%	0.668	23%	0.23	S	C	*	.			trans	-68.1	159.3	-178.8	-166.1	4.6	0	0	0	112.5	Q241 W242	D239-Q241 PolarHBondContact O-N 3.2Å; D239-W242 PolarHBondContact O-NE1 3.29Å; D239-W242 VanDerWaalsContact O-NE1 3.07Å
240	L	72.7	Confident	80.7	Confident	65 Å²	65	44.5 Å²	44.5	34%	0.34	23%	0.229	S	C	.	.	H	α-helix	trans	-63.6	-16.2	-180	-68.6	171.2	0	0	0	113.8	W242 F243 K244 K314	L240-W242 PolarHBondContact O-N 3.08Å; L240-F243 PolarHBondContact O-N 2.85Å; L240-K244 PolarHBondContact O-N 3.16Å; L240-K314 HydrophobicContact CD1-CG 4.38Å; L240-K314 HydrophobicContact CD2-CB 3.52Å; L240-K314 HydrophobicContact CD2-CD 4.15Å; L240-K314 HydrophobicContact CD2-CG 3.66Å; L240-K314 HydrophobicContact CG-CG 4.43Å
241	Q	78.7	Confident	80.2	Confident	96 Å²	96	45.2 Å²	45.2	45%	0.449	23%	0.232	S	C	.	.	H	α-helix	trans	-63.6	-41.7	-175.2	-173.2	59.1	18.9	0	0	113.1	D239 F243 K244 E245	D239-Q241 PolarHBondContact O-N 3.2Å; Q241-F243 VanDerWaalsContact C-N 3.28Å; Q241-F243 PolarHBondContact O-N 3.49Å; Q241-K244 WeakPolarHBondContact O-CB 3.43Å; Q241-K244 PolarHBondContact O-N 3.37Å; Q241-K244 VanDerWaalsContact O-N 3.12Å; Q241-E245 WeakPolarHBondContact O-CG 3.41Å; Q241-E245 PolarHBondContact O-N 3.23Å
242	W	82.6	Confident	79.2	Confident	8 Å²	8	48.7 Å²	48.7	3%	0.03	25%	0.25	C	S	.	.	H	α-helix	trans	-67.3	-30.1	-179.5	73.8	-93.6	0	0	0	112.6	I143 P203 Q207 L228 L234 Y238 D239 L240 E245 I246	I143-W242 HydrophobicContact CD1-CH2 4.47Å; I143-W242 HydrophobicContact CD1-CZ3 3.83Å; I143-W242 HydrophobicContact CG2-CH2 4.07Å; I143-W242 HydrophobicContact CG2-CZ3 4.17Å; P203-W242 HydrophobicContact CG-CH2 4.39Å; Q207-W242 VanDerWaalsContact NE2-CB 3.26Å; L228-W242 HydrophobicContact CD2-CH2 4.35Å; L234-W242 HydrophobicContact CB-CZ2 4.3Å; L234-W242 HydrophobicContact CD2-CH2 4.45Å; L234-W242 HydrophobicContact CD2-CZ2 4.48Å; Y238-W242 VanDerWaalsContact CB-CD1 3.41Å; D239-W242 PolarHBondContact O-NE1 3.29Å; D239-W242 VanDerWaalsContact O-NE1 3.07Å; L240-W242 PolarHBondContact O-N 3.08Å; W242-E245 WeakPolarHBondContact O-CB 3.42Å; W242-E245 PolarHBondContact O-N 3.09Å; W242-I246 HydrophobicContact CE3-CD1 3.35Å; W242-I246 HydrophobicContact CE3-CG1 4.27Å; W242-I246 HydrophobicContact CZ3-CD1 3.34Å; W242-I246 WeakPolarHBondContact O-CG1 3.37Å; W242-I246 PolarHBondContact O-N 2.71Å
243	F	80.4	Confident	78	Confident	25 Å²	25	50.4 Å²	50.4	11%	0.11	26%	0.262	C	S	.	.	H	α-helix	trans	-65.8	-41.7	173.3	-89.7	-69.5	0	0	0	111.4	L228 L235 L240 Q241 E245 I246 D247	L228-F243 HydrophobicContact CD1-CE1 3.34Å; L228-F243 HydrophobicContact CD1-CZ 3.64Å; L228-F243 HydrophobicContact CD2-CE1 3.66Å; L228-F243 HydrophobicContact CD2-CZ 4.02Å; L228-F243 HydrophobicContact CG-CE1 4.13Å; L228-F243 HydrophobicContact CG-CZ 4.42Å; L235-F243 HydrophobicContact CD2-CD2 3.78Å; L235-F243 HydrophobicContact CD2-CE2 3.18Å; L235-F243 HydrophobicContact CD2-CZ 3.92Å; L235-F243 HydrophobicContact CG-CE2 3.84Å; L235-F243 HydrophobicContact CG-CZ 4.28Å; L240-F243 PolarHBondContact O-N 2.85Å; Q241-F243 VanDerWaalsContact C-N 3.28Å; Q241-F243 PolarHBondContact O-N 3.49Å; F243-E245 VanDerWaalsContact C-N 3.3Å; F243-E245 PolarHBondContact O-N 2.91Å; F243-I246 PolarHBondContact O-N 3.01Å; F243-D247 PolarHBondContact O-N 3.45Å
244	K	80.7	Confident	76.2	Confident	118 Å²	118	54.8 Å²	54.8	51%	0.513	29%	0.291	S	S	.	.	H	α-helix	trans	-62.4	-40.2	174.4	-65.6	177.4	-176.7	172.9	0	111.3	L240 Q241 I246 D247 N248	L240-K244 PolarHBondContact O-N 3.16Å; Q241-K244 WeakPolarHBondContact O-CB 3.43Å; Q241-K244 PolarHBondContact O-N 3.37Å; Q241-K244 VanDerWaalsContact O-N 3.12Å; K244-I246 PolarHBondContact O-N 3.39Å; K244-D247 PolarHBondContact O-N 3.23Å; K244-N248 WeakPolarHBondContact O-CB 3.44Å; K244-N248 PolarHBondContact O-N 2.91Å; K244-N248 PolarHBondContact O-ND2 2.97Å; K244-N248 PolarHBondContact O-OD1 2.69Å
245	E	85.3	Confident	74.3	Confident	40 Å²	40	58 Å²	58	19%	0.187	31%	0.311	C	S	.	.	H	α-helix	trans	-60.9	-43.2	175.8	-69	162.4	-171.5	0	0	111.8	Q207 H211 Q241 W242 F243 N248 A249	Q207-E245 PolarHBondContact NE2-OE2 3.08Å; H211-E245 VanDerWaalsContact CE1-CD 3.46Å; H211-E245 IonicContact CE1-OE2 2.73Å; H211-E245 PolarHBondContact CE1-OE2 3.45Å; H211-E245 VanDerWaalsContact CE1-OE2 3.26Å; Q241-E245 WeakPolarHBondContact O-CG 3.41Å; Q241-E245 PolarHBondContact O-N 3.23Å; W242-E245 WeakPolarHBondContact O-CB 3.42Å; W242-E245 PolarHBondContact O-N 3.09Å; F243-E245 VanDerWaalsContact C-N 3.3Å; F243-E245 PolarHBondContact O-N 2.91Å; E245-N248 PolarHBondContact O-N 3.09Å; E245-A249 WeakPolarHBondContact O-CB 3.37Å; E245-A249 PolarHBondContact O-N 3.25Å
246	I	85.8	Confident	72.2	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-65.7	-46.5	175.3	-69.1	176.6	0	0	0	111.2	I143 L206 L210 L226 W242 F243 K244 N248 A249 I250	I143-I246 HydrophobicContact CD1-CD1 3.4Å; I143-I246 VanDerWaalsContact CD1-CD1 3.4Å; L206-I246 HydrophobicContact CD2-CD1 3.54Å; L206-I246 HydrophobicContact CD2-CG1 4.1Å; L210-I246 HydrophobicContact CD1-CG1 4.04Å; L226-I246 HydrophobicContact CD2-CG2 4.46Å; W242-I246 HydrophobicContact CE3-CD1 3.35Å; W242-I246 HydrophobicContact CE3-CG1 4.27Å; W242-I246 HydrophobicContact CZ3-CD1 3.34Å; W242-I246 WeakPolarHBondContact O-CG1 3.37Å; W242-I246 PolarHBondContact O-N 2.71Å; F243-I246 PolarHBondContact O-N 3.01Å; K244-I246 PolarHBondContact O-N 3.39Å; I246-N248 VanDerWaalsContact C-N 3.25Å; I246-N248 PolarHBondContact O-N 3.1Å; I246-A249 PolarHBondContact O-N 3.15Å; I246-A249 VanDerWaalsContact O-N 3.15Å; I246-I250 HydrophobicContact CG2-CD1 3.6Å; I246-I250 HydrophobicContact CG2-CG1 4.3Å; I246-I250 WeakPolarHBondContact O-CD1 3.32Å; I246-I250 VanDerWaalsContact O-CG1 3.23Å; I246-I250 WeakPolarHBondContact O-CG1 3.44Å; I246-I250 PolarHBondContact O-N 2.93Å
247	D	81.3	Confident	70.5	Confident	46 Å²	46	66.7 Å²	66.7	25%	0.246	35%	0.354	C	S	.	.	H	α-helix	trans	-57.1	-43.6	176.1	-94.2	-9.7	0	0	0	110.2	F243 K244 I250 F251 R276	F243-D247 PolarHBondContact O-N 3.45Å; K244-D247 PolarHBondContact O-N 3.23Å; D247-I250 PolarHBondContact O-N 2.8Å; D247-F251 HydrophobicContact CB-CD2 4.32Å; D247-F251 WeakPolarHBondContact O-CB 3.4Å; D247-F251 WeakPolarHBondContact O-CD2 3.41Å; D247-F251 PolarHBondContact O-N 3.15Å; D247-R276 PolarHBondContact O-NH2 3.17Å
248	N	83.2	Confident	68.6	Low	68 Å²	68	67.2 Å²	67.2	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-66	-41.7	176.2	-66.3	-8.7	0	0	0	111.4	K244 E245 I246 I250 F251 D252 R276	K244-N248 WeakPolarHBondContact O-CB 3.44Å; K244-N248 PolarHBondContact O-N 2.91Å; K244-N248 PolarHBondContact O-ND2 2.97Å; K244-N248 PolarHBondContact O-OD1 2.69Å; E245-N248 PolarHBondContact O-N 3.09Å; I246-N248 VanDerWaalsContact C-N 3.25Å; I246-N248 PolarHBondContact O-N 3.1Å; N248-I250 PolarHBondContact O-N 2.9Å; N248-F251 PolarHBondContact O-N 3.3Å; N248-D252 HydrophobicContact CB-CB 4.39Å; N248-D252 WeakPolarHBondContact CB-OD2 3.45Å; N248-D252 VanDerWaalsContact CG-OD2 3.28Å; N248-D252 CarbonylContact O-C 3.59Å; N248-D252 VanDerWaalsContact O-CA 3.27Å; N248-D252 WeakPolarHBondContact O-CA 3.19Å; N248-D252 VanDerWaalsContact O-CB 3.25Å; N248-D252 WeakPolarHBondContact O-CB 3.35Å; N248-D252 PolarHBondContact O-N 3.04Å; N248-D252 PolarHBondContact OD1-OD2 2.91Å; N248-R276 PolarHBondContact OD1-NH2 2.75Å
249	A	84.6	Confident	66.5	Low	29 Å²	29	71.5 Å²	71.5	24%	0.24	39%	0.386	C	S	.	.	H	α-helix	trans	-64.1	-29	176.5	0	0	0	0	0	113.5	L210 L220 E245 I246	L210-A249 HydrophobicContact CD2-CB 3.48Å; L210-A249 VanDerWaalsContact CD2-CB 3.48Å; L220-A249 HydrophobicContact CD1-CB 4.08Å; E245-A249 WeakPolarHBondContact O-CB 3.37Å; E245-A249 PolarHBondContact O-N 3.25Å; I246-A249 PolarHBondContact O-N 3.15Å; I246-A249 VanDerWaalsContact O-N 3.15Å
250	I	83.5	Confident	64.6	Low	1 Å²	1	71.2 Å²	71.2	1%	0.005	39%	0.391	C	S	.	.	H	α-helix	trans	-77.5	-45.1	175.7	-65.3	162.7	0	0	0	111	L220 L223 L226 I246 D247 N248 V274 L296	L220-I250 HydrophobicContact CB-CG1 4.01Å; L220-I250 HydrophobicContact CD1-CG1 4.15Å; L223-I250 HydrophobicContact CD2-CD1 3.59Å; L223-I250 HydrophobicContact CD2-CG1 3.76Å; L226-I250 HydrophobicContact CD2-CD1 4.31Å; I246-I250 HydrophobicContact CG2-CD1 3.6Å; I246-I250 HydrophobicContact CG2-CG1 4.3Å; I246-I250 WeakPolarHBondContact O-CD1 3.32Å; I246-I250 VanDerWaalsContact O-CG1 3.23Å; I246-I250 WeakPolarHBondContact O-CG1 3.44Å; I246-I250 PolarHBondContact O-N 2.93Å; D247-I250 PolarHBondContact O-N 2.8Å; N248-I250 PolarHBondContact O-N 2.9Å; I250-V274 HydrophobicContact CG2-CB 4.43Å; I250-V274 HydrophobicContact CG2-CG1 4.2Å; I250-L296 HydrophobicContact CD1-CD2 4.19Å; I250-L296 HydrophobicContact CG2-CD2 4.25Å
251	F	77.7	Confident	63	Low	36 Å²	36	75.8 Å²	75.8	16%	0.158	41%	0.405	C	S	.	.	H	α-helix	trans	-103.1	-37.5	-167.9	-63.3	-60.1	0	0	0	114.9	D247 N248 S253 V274 R276 L296	D247-F251 HydrophobicContact CB-CD2 4.32Å; D247-F251 WeakPolarHBondContact O-CB 3.4Å; D247-F251 WeakPolarHBondContact O-CD2 3.41Å; D247-F251 PolarHBondContact O-N 3.15Å; N248-F251 PolarHBondContact O-N 3.3Å; F251-S253 VanDerWaalsContact C-N 3.29Å; F251-S253 PolarHBondContact O-N 3.19Å; F251-S253 VanDerWaalsContact O-N 3.11Å; F251-V274 HydrophobicContact CD1-CG1 4.29Å; F251-V274 HydrophobicContact CE1-CG1 3.71Å; F251-R276 HydrophobicContact CB-CB 3.93Å; F251-R276 HydrophobicContact CB-CG 4.27Å; F251-R276 HydrophobicContact CD1-CB 3.48Å; F251-R276 VanDerWaalsContact CD1-CB 3.48Å; F251-R276 HydrophobicContact CD1-CG 4Å; F251-R276 VanDerWaalsContact CD1-N 3.29Å; F251-R276 HydrophobicContact CD2-CB 4.26Å; F251-R276 HydrophobicContact CD2-CG 3.9Å; F251-R276 VanDerWaalsContact CD2-NE 3.3Å; F251-R276 VanDerWaalsContact CE1-CA 3.45Å; F251-R276 HydrophobicContact CE1-CB 3.99Å; F251-R276 HydrophobicContact CE1-CG 4.28Å; F251-R276 HydrophobicContact CE2-CG 4.23Å; F251-R276 HydrophobicContact CG-CB 3.63Å; F251-R276 HydrophobicContact CG-CG 3.79Å; F251-R276 HydrophobicContact CZ-CG 4.41Å; F251-L296 HydrophobicContact CZ-CD2 3.97Å
252	D	67.1	Low	60.9	Low	75 Å²	75	75.5 Å²	75.5	40%	0.401	41%	0.414	S	S	.	.			trans	-87.6	70.4	178.7	-59	-21.8	0	0	0	108.7	N248 N254 R276	N248-D252 HydrophobicContact CB-CB 4.39Å; N248-D252 WeakPolarHBondContact CB-OD2 3.45Å; N248-D252 VanDerWaalsContact CG-OD2 3.28Å; N248-D252 CarbonylContact O-C 3.59Å; N248-D252 VanDerWaalsContact O-CA 3.27Å; N248-D252 WeakPolarHBondContact O-CA 3.19Å; N248-D252 VanDerWaalsContact O-CB 3.25Å; N248-D252 WeakPolarHBondContact O-CB 3.35Å; N248-D252 PolarHBondContact O-N 3.04Å; N248-D252 PolarHBondContact OD1-OD2 2.91Å; D252-N254 VanDerWaalsContact C-N 3.34Å; D252-N254 PolarHBondContact O-N 3.07Å; D252-R276 IonicContact OD1-CZ 3.93Å; D252-R276 IonicContact OD1-NH1 2.87Å; D252-R276 PolarHBondContact OD1-NH1 3.29Å; D252-R276 IonicContact OD2-NH1 3.68Å
253	S	54.3	Low	58.6	Low	40 Å²	40	85.8 Å²	85.8	28%	0.28	46%	0.459	S	S	.	.			trans	-67.3	101.5	163.3	66.9	0	0	0	0	107.3	F251 T255 K273	F251-S253 VanDerWaalsContact C-N 3.29Å; F251-S253 PolarHBondContact O-N 3.19Å; F251-S253 VanDerWaalsContact O-N 3.11Å; S253-T255 PolarHBondContact O-N 3.3Å; S253-T255 PolarHBondContact O-OG1 3.39Å; S253-T255 PolarHBondContact OG-OG1 3.21Å; S253-K273 PolarHBondContact OG-NZ 3.28Å
254	N	41.2	Very low	56.3	Low	157 Å²	157	89.4 Å²	89.4	84%	0.84	49%	0.486	S	S	*	.			trans	-56.2	17.9	166.9	-84	-21.9	0	0	0	114.2	D252 S256	D252-N254 VanDerWaalsContact C-N 3.34Å; D252-N254 PolarHBondContact O-N 3.07Å; N254-S256 PolarHBondContact O-N 2.98Å
255	T	43.6	Very low	54.2	Low	69 Å²	69	87.9 Å²	87.9	42%	0.423	50%	0.503	S	S	.	.			trans	-66.8	86.3	154.9	53.2	0	0	0	0	106.2	S253 D257 K273	S253-T255 PolarHBondContact O-N 3.3Å; S253-T255 PolarHBondContact O-OG1 3.39Å; S253-T255 PolarHBondContact OG-OG1 3.21Å; T255-D257 PolarHBondContact O-N 3.15Å; T255-K273 PolarHBondContact OG1-NZ 2.9Å
256	S	36.3	Very low	51.7	Low	81 Å²	81	96.3 Å²	96.3	57%	0.566	53%	0.533	S	S	*	.			trans	-33.1	129.3	137.9	48.8	0	0	0	0	107.1	N254 S258	N254-S256 PolarHBondContact O-N 2.98Å; S256-S258 VanDerWaalsContact CB-OG 3.26Å; S256-S258 WeakPolarHBondContact CB-OG 3.45Å; S256-S258 PolarHBondContact O-N 3.34Å; S256-S258 PolarHBondContact O-OG 3.14Å; S256-S258 PolarHBondContact OG-OG 3.09Å
257	D	40.8	Very low	49.3	Very low	171 Å²	171	105.7 Å²	105.7	91%	0.914	58%	0.577	S	S	*	*	S	Bend	trans	-63.5	36	-179.6	-72.3	-51.6	0	0	0	113.2	T255	T255-D257 PolarHBondContact O-N 3.15Å
258	S	33.6	Very low	47.3	Very low	84 Å²	84	110.3 Å²	110.3	59%	0.587	60%	0.601	S	S	*	*			trans	-120.3	26.2	-171.3	52.5	0	0	0	0	113	S256 P260	S256-S258 VanDerWaalsContact CB-OG 3.26Å; S256-S258 WeakPolarHBondContact CB-OG 3.45Å; S256-S258 PolarHBondContact O-N 3.34Å; S256-S258 PolarHBondContact O-OG 3.14Å; S256-S258 PolarHBondContact OG-OG 3.09Å; S258-P260 WeakPolarHBondContact O-CD 3.35Å
259	E	31.2	Very low	45	Very low	164 Å²	164	114.6 Å²	114.6	77%	0.766	62%	0.623	S	S	*	*	S	Bend	trans	-93	104.1	146.5	-79.6	-165.3	166.9	0	0	107.4	Y261	E259-Y261 PolarHBondContact O-N 3.4Å
260	P	32.5	Very low	42.9	Very low	118 Å²	118	117.6 Å²	117.6	77%	0.766	64%	0.64	S	S	*	*			trans	-67.6	104.2	-177.5	27.6	-30.9	0	0	0	107.3	S258 S262	S258-P260 WeakPolarHBondContact O-CD 3.35Å; P260-S262 PolarHBondContact O-N 3.31Å
261	Y	38.2	Very low	41.2	Very low	161 Å²	161	120 Å²	120	63%	0.631	66%	0.655	S	S	*	*			trans	-42.7	116.5	165.7	-69.7	-87.7	0	0	0	107.3	E259	E259-Y261 PolarHBondContact O-N 3.4Å
262	S	35.1	Very low	40	Very low	91 Å²	91	123 Å²	123	64%	0.636	67%	0.673	S	S	*	*			trans	-42.5	140.6	-164.7	67	0	0	0	0	112.3	P260 C264	P260-S262 PolarHBondContact O-N 3.31Å; S262-C264 PolarHBondContact O-N 3.02Å
263	K	34.9	Very low	39.4	Very low	224 Å²	224	122.5 Å²	122.5	97%	0.974	67%	0.667	S	S	*	*	S	Bend	trans	-51.7	6.3	174.3	-78.6	-179.4	173.1	178.2	0	116.3	G265	K263-G265 PolarHBondContact O-N 3.43Å
264	C	32.3	Very low	39.5	Very low	101 Å²	101	121 Å²	121	68%	0.682	66%	0.656	S	S	*	*	S	Bend	trans	-83	103.5	170.9	-157.1	0	0	0	0	108.3	S262 R266	S262-C264 PolarHBondContact O-N 3.02Å; C264-R266 PolarHBondContact O-N 3.41Å
265	G	36.5	Very low	40.2	Very low	85 Å²	85	120.6 Å²	120.6	88%	0.876	64%	0.643	S	S	*	*	S	Bend	trans	-65.2	52.8	-168.9	0	0	0	0	0	117	K263	K263-G265 PolarHBondContact O-N 3.43Å
266	R	33	Very low	41	Very low	217 Å²	217	122.2 Å²	122.2	82%	0.819	64%	0.641	S	S	*	*			trans	-115.2	109.1	154.1	-80.2	-176.5	176.4	-154.2	-1.3	106.2	C264 L268	C264-R266 PolarHBondContact O-N 3.41Å; R266-L268 PolarHBondContact O-N 3.05Å
267	Q	33.6	Very low	42.1	Very low	202 Å²	202	120 Å²	120	94%	0.944	62%	0.622	S	S	*	*			trans	-59.6	80.9	166.2	-75.1	171.8	-21.8	0	0	108	L269	Q267-L269 PolarHBondContact O-N 3.23Å
268	L	39.9	Very low	42.8	Very low	143 Å²	143	121.3 Å²	121.3	75%	0.749	61%	0.614	S	S	*	*			trans	-62.4	121.6	167.1	-76.4	162.7	0	0	0	105.2	R266	R266-L268 PolarHBondContact O-N 3.05Å
269	L	36.1	Very low	43.7	Very low	157 Å²	157	120.7 Å²	120.7	82%	0.822	61%	0.614	S	S	*	*			trans	-44.3	134	178.6	-70.1	164.9	0	0	0	109	Q267	Q267-L269 PolarHBondContact O-N 3.23Å
270	P	39.9	Very low	44.6	Very low	93 Å²	93	116.8 Å²	116.8	60%	0.604	60%	0.601	S	S	*	*			trans	-52.8	144	178.1	21.7	-31.9	0	0	0	109.2	L272	P270-L272 PolarHBondContact O-N 3.23Å
271	P	47.2	Very low	45.2	Very low	50 Å²	50	117 Å²	117	33%	0.325	61%	0.613	S	S	.	*			trans	-52.8	139.9	-179.3	21.3	-31.6	0	0	0	109.8	Y222 K273	Y222-P271 HydrophobicContact CE1-CB 4.18Å; P271-K273 WeakPolarHBondContact O-CG 3.04Å; P271-K273 PolarHBondContact O-N 3.14Å
272	L	51.9	Low	45.9	Very low	101 Å²	101	113.7 Å²	113.7	53%	0.529	62%	0.619	S	S	.	*			trans	-60.6	99.2	177.8	-67.9	171	0	0	0	108.8	P270 K293 F294	P270-L272 PolarHBondContact O-N 3.23Å; L272-K293 HydrophobicContact CD2-CB 4.38Å; L272-F294 HydrophobicContact CB-CB 4.29Å; L272-F294 HydrophobicContact CB-CD2 4.27Å; L272-F294 HydrophobicContact CB-CG 4.25Å; L272-F294 HydrophobicContact CD1-CD2 4.49Å
273	K	55.1	Low	47.1	Very low	63 Å²	63	110.6 Å²	110.6	27%	0.274	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-98.4	143.8	174.6	-61.9	-171.3	170.7	-176.5	0	108.9	T221 S253 T255 P271 R275	T221-K273 HydrophobicContact CG2-CB 3.69Å; T221-K273 HydrophobicContact CG2-CD 3.48Å; T221-K273 VanDerWaalsContact CG2-CD 3.48Å; T221-K273 HydrophobicContact CG2-CG 3.42Å; T221-K273 VanDerWaalsContact CG2-CG 3.42Å; S253-K273 PolarHBondContact OG-NZ 3.28Å; T255-K273 PolarHBondContact OG1-NZ 2.9Å; P271-K273 WeakPolarHBondContact O-CG 3.04Å; P271-K273 PolarHBondContact O-N 3.14Å; K273-R275 PolarHBondContact O-N 2.91Å
274	V	56.2	Low	48.4	Very low	8 Å²	8	102.6 Å²	102.6	5%	0.048	57%	0.569	C	S	.	*	P	Polyproline II helix	trans	-62.6	128.1	167.5	-176.7	0	0	0	0	108.1	T221 L223 I250 F251 F294 L296	T221-V274 WeakPolarHBondContact O-CG2 3.4Å; T221-V274 PolarHBondContact O-N 3.17Å; T221-V274 VanDerWaalsContact O-N 3.14Å; L223-V274 WeakPolarHBondContact O-CG2 3.45Å; I250-V274 HydrophobicContact CG2-CB 4.43Å; I250-V274 HydrophobicContact CG2-CG1 4.2Å; F251-V274 HydrophobicContact CD1-CG1 4.29Å; F251-V274 HydrophobicContact CE1-CG1 3.71Å; V274-F294 HydrophobicContact CG2-CD1 3.76Å; V274-F294 HydrophobicContact CG2-CE1 4.02Å; V274-L296 HydrophobicContact CG1-CB 3.65Å
275	R	56.3	Low	50.1	Low	150 Å²	150	102.1 Å²	102.1	57%	0.566	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-103.6	138	175.5	-75.9	-169.7	151.9	-168.6	-6.5	111	K273 F277	K273-R275 PolarHBondContact O-N 2.91Å; R275-F277 PolarHBondContact O-N 3.06Å; R275-F277 VanDerWaalsContact O-N 3.16Å
276	R	61.2	Low	51.7	Low	103 Å²	103	104.7 Å²	104.7	39%	0.389	55%	0.554	S	S	.	*			trans	-66.3	115	173.6	-161.8	176.6	-108.8	149.1	-8.2	107.6	D247 N248 F251 D252	D247-R276 PolarHBondContact O-NH2 3.17Å; N248-R276 PolarHBondContact OD1-NH2 2.75Å; F251-R276 HydrophobicContact CB-CB 3.93Å; F251-R276 HydrophobicContact CB-CG 4.27Å; F251-R276 HydrophobicContact CD1-CB 3.48Å; F251-R276 VanDerWaalsContact CD1-CB 3.48Å; F251-R276 HydrophobicContact CD1-CG 4Å; F251-R276 VanDerWaalsContact CD1-N 3.29Å; F251-R276 HydrophobicContact CD2-CB 4.26Å; F251-R276 HydrophobicContact CD2-CG 3.9Å; F251-R276 VanDerWaalsContact CD2-NE 3.3Å; F251-R276 VanDerWaalsContact CE1-CA 3.45Å; F251-R276 HydrophobicContact CE1-CB 3.99Å; F251-R276 HydrophobicContact CE1-CG 4.28Å; F251-R276 HydrophobicContact CE2-CG 4.23Å; F251-R276 HydrophobicContact CG-CB 3.63Å; F251-R276 HydrophobicContact CG-CG 3.79Å; F251-R276 HydrophobicContact CZ-CG 4.41Å; D252-R276 IonicContact OD1-CZ 3.93Å; D252-R276 IonicContact OD1-NH1 2.87Å; D252-R276 PolarHBondContact OD1-NH1 3.29Å; D252-R276 IonicContact OD2-NH1 3.68Å
277	F	58.5	Low	53.3	Low	35 Å²	35	99.6 Å²	99.6	15%	0.154	54%	0.539	C	S	.	.			trans	-117.1	117.8	176.3	-178.2	-108.9	0	0	0	109.3	P104 R275 A279 L288 A291 F319	P104-F277 HydrophobicContact CG-CD1 4.26Å; R275-F277 PolarHBondContact O-N 3.06Å; R275-F277 VanDerWaalsContact O-N 3.16Å; F277-A279 HydrophobicContact CE1-CB 3.63Å; F277-A279 HydrophobicContact CZ-CB 3.87Å; F277-L288 HydrophobicContact CD1-CD2 4.28Å; F277-L288 HydrophobicContact CD2-CD2 4.48Å; F277-L288 HydrophobicContact CE1-CD2 3.37Å; F277-L288 HydrophobicContact CE1-CG 4.24Å; F277-L288 HydrophobicContact CE2-CD2 3.66Å; F277-L288 HydrophobicContact CE2-CG 3.61Å; F277-L288 HydrophobicContact CZ-CD1 4.25Å; F277-L288 HydrophobicContact CZ-CD2 3.04Å; F277-L288 HydrophobicContact CZ-CG 3.41Å; F277-L288 VanDerWaalsContact CZ-CG 3.41Å; F277-A291 HydrophobicContact CB-CB 3.82Å; F277-A291 HydrophobicContact CD2-CB 4.37Å; F277-A291 HydrophobicContact CG-CB 4.13Å; F277-F319 HydrophobicContact CD1-CD2 4.12Å; F277-F319 AromaticContact CD1-CE2 3.82Å; F277-F319 HydrophobicContact CD1-CE2 3.82Å; F277-F319 HydrophobicContact CD1-CZ 4.42Å; F277-F319 HydrophobicContact CE1-CD2 4.26Å; F277-F319 AromaticContact CE1-CE2 3.56Å; F277-F319 HydrophobicContact CE1-CE2 3.56Å; F277-F319 HydrophobicContact CE1-CZ 4.13Å
278	R	56.1	Low	54.9	Low	197 Å²	197	91.8 Å²	91.8	74%	0.743	50%	0.504	S	S	*	.			trans	-110.8	111.5	165.4	-76.6	-175	176.5	175	0.1	106.6	T280 S283	R278-T280 HydrophobicContact CB-CG2 4.36Å; R278-T280 PolarHBondContact O-N 2.87Å; R278-S283 PolarHBondContact O-OG 2.85Å; R278-S283 VanDerWaalsContact O-OG 3.1Å
279	A	51.9	Low	56.1	Low	71 Å²	71	89 Å²	89	59%	0.587	49%	0.489	S	S	*	.			trans	-64.8	79.7	171.2	0	0	0	0	0	109.6	F277 F319	F277-A279 HydrophobicContact CE1-CB 3.63Å; F277-A279 HydrophobicContact CZ-CB 3.87Å; A279-F319 HydrophobicContact CB-CE2 4.09Å
280	T	49.7	Very low	57.5	Low	83 Å²	83	84.9 Å²	84.9	51%	0.509	47%	0.468	S	S	.	.			trans	-89.5	154.8	163.4	63.3	0	0	0	0	107.8	R278 A282 S283	R278-T280 HydrophobicContact CB-CG2 4.36Å; R278-T280 PolarHBondContact O-N 2.87Å; T280-A282 PolarHBondContact O-N 3.09Å; T280-S283 PolarHBondContact N-OG 3.45Å; T280-S283 WeakPolarHBondContact O-CB 3.37Å; T280-S283 PolarHBondContact O-N 3.44Å; T280-S283 PolarHBondContact O-OG 2.97Å; T280-S283 PolarHBondContact OG1-OG 2.9Å
281	A	46.9	Very low	58.7	Low	122 Å²	122	80.7 Å²	80.7	100%	1.008	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-16.3	177.6	0	0	0	0	0	113.5
282	A	51	Low	59.4	Low	92 Å²	92	79.4 Å²	79.4	76%	0.76	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	3.4	177.9	0	0	0	0	0	114.7	T280 C284	T280-A282 PolarHBondContact O-N 3.09Å; A282-C284 PolarHBondContact O-N 3.09Å
283	S	60.3	Low	60.1	Low	26 Å²	26	81.2 Å²	81.2	18%	0.182	44%	0.438	C	S	.	.			trans	-68.9	125.5	-174.3	-45.2	0	0	0	0	111.1	R278 T280	R278-S283 PolarHBondContact O-OG 2.85Å; R278-S283 VanDerWaalsContact O-OG 3.1Å; T280-S283 PolarHBondContact N-OG 3.45Å; T280-S283 WeakPolarHBondContact O-CB 3.37Å; T280-S283 PolarHBondContact O-N 3.44Å; T280-S283 PolarHBondContact O-OG 2.97Å; T280-S283 PolarHBondContact OG1-OG 2.9Å
284	C	63.5	Low	60.9	Low	56 Å²	56	79.9 Å²	79.9	38%	0.378	43%	0.432	S	S	.	.			trans	-66.1	137.1	178	-176.5	0	0	0	0	110.6	A282 E286 E287 L288	A282-C284 PolarHBondContact O-N 3.09Å; C284-E286 PolarHBondContact O-N 3.18Å; C284-E286 VanDerWaalsContact O-N 3.1Å; C284-E287 HydrophobicContact CB-CG 4.29Å; C284-E287 PolarHBondContact O-N 3.35Å; C284-L288 PolarHBondContact O-N 2.91Å
285	P	68.2	Low	62	Low	91 Å²	91	80.4 Å²	80.4	59%	0.591	44%	0.436	S	S	*	.	H	α-helix	trans	-52.7	-31.6	175.8	-28.2	35.1	0	0	0	114.1	L288 L289	P285-L288 WeakPolarHBondContact O-CB 3.25Å; P285-L288 PolarHBondContact O-N 3.12Å; P285-L289 WeakPolarHBondContact O-CG 3.31Å; P285-L289 PolarHBondContact O-N 3.32Å
286	E	68.9	Low	63.4	Low	138 Å²	138	74.1 Å²	74.1	65%	0.645	41%	0.413	S	S	*	.	H	α-helix	trans	-66.1	-40.2	177.5	-63.9	177.4	171.8	0	0	112.6	C284 L288 L289 L290	C284-E286 PolarHBondContact O-N 3.18Å; C284-E286 VanDerWaalsContact O-N 3.1Å; E286-L288 VanDerWaalsContact C-N 3.32Å; E286-L288 PolarHBondContact O-N 3.43Å; E286-L289 PolarHBondContact O-N 2.98Å; E286-L290 WeakPolarHBondContact O-CB 3.15Å; E286-L290 VanDerWaalsContact O-CG 3.27Å; E286-L290 WeakPolarHBondContact O-CG 3.16Å; E286-L290 PolarHBondContact O-N 3.11Å
287	E	67.9	Low	64.9	Low	110 Å²	110	69.2 Å²	69.2	51%	0.514	40%	0.395	S	S	.	.	H	α-helix	trans	-65.6	-38.9	176.5	-68.4	-171.8	156.1	0	0	111.4	C284 L290 A291	C284-E287 HydrophobicContact CB-CG 4.29Å; C284-E287 PolarHBondContact O-N 3.35Å; E287-L290 PolarHBondContact O-N 2.89Å; E287-A291 VanDerWaalsContact O-CB 3.28Å; E287-A291 WeakPolarHBondContact O-CB 3.48Å; E287-A291 PolarHBondContact O-N 2.86Å
288	L	65.7	Low	66.5	Low	39 Å²	39	68.9 Å²	68.9	20%	0.204	39%	0.393	C	S	.	.	H	α-helix	trans	-58.3	-50.1	173	-93.4	167.3	0	0	0	111.5	V103 F277 C284 P285 E286 L290 A291 A292	V103-L288 HydrophobicContact CB-CD2 4.37Å; V103-L288 HydrophobicContact CG1-CD2 4.02Å; F277-L288 HydrophobicContact CD1-CD2 4.28Å; F277-L288 HydrophobicContact CD2-CD2 4.48Å; F277-L288 HydrophobicContact CE1-CD2 3.37Å; F277-L288 HydrophobicContact CE1-CG 4.24Å; F277-L288 HydrophobicContact CE2-CD2 3.66Å; F277-L288 HydrophobicContact CE2-CG 3.61Å; F277-L288 HydrophobicContact CZ-CD1 4.25Å; F277-L288 HydrophobicContact CZ-CD2 3.04Å; F277-L288 HydrophobicContact CZ-CG 3.41Å; F277-L288 VanDerWaalsContact CZ-CG 3.41Å; C284-L288 PolarHBondContact O-N 2.91Å; P285-L288 WeakPolarHBondContact O-CB 3.25Å; P285-L288 PolarHBondContact O-N 3.12Å; E286-L288 VanDerWaalsContact C-N 3.32Å; E286-L288 PolarHBondContact O-N 3.43Å; L288-L290 VanDerWaalsContact C-N 3.33Å; L288-L290 PolarHBondContact O-N 2.69Å; L288-A291 PolarHBondContact O-N 2.98Å; L288-A292 VanDerWaalsContact O-CB 3.28Å; L288-A292 WeakPolarHBondContact O-CB 3.45Å; L288-A292 PolarHBondContact O-N 3.03Å
289	L	65.9	Low	68.4	Low	84 Å²	84	59.6 Å²	59.6	44%	0.44	36%	0.358	S	S	.	.	H	α-helix	trans	-63.3	-39.2	178.7	-70.8	171.3	0	0	0	112	P102 P285 E286 A292 K293	P102-L289 HydrophobicContact CB-CD2 4.45Å; P285-L289 WeakPolarHBondContact O-CG 3.31Å; P285-L289 PolarHBondContact O-N 3.32Å; E286-L289 PolarHBondContact O-N 2.98Å; L289-A292 PolarHBondContact O-N 3.12Å; L289-K293 PolarHBondContact O-N 3.43Å
290	L	66.1	Low	70.3	Confident	71 Å²	71	56.3 Å²	56.3	37%	0.372	33%	0.331	S	S	.	.	H	α-helix	trans	-69.9	-42.8	177.7	-71.4	171.1	0	0	0	112.1	E286 E287 L288 A292 K293	E286-L290 WeakPolarHBondContact O-CB 3.15Å; E286-L290 VanDerWaalsContact O-CG 3.27Å; E286-L290 WeakPolarHBondContact O-CG 3.16Å; E286-L290 PolarHBondContact O-N 3.11Å; E287-L290 PolarHBondContact O-N 2.89Å; L288-L290 VanDerWaalsContact C-N 3.33Å; L288-L290 PolarHBondContact O-N 2.69Å; L290-A292 VanDerWaalsContact C-N 3.26Å; L290-A292 PolarHBondContact O-N 2.93Å; L290-K293 HydrophobicContact CD2-CD 4.29Å; L290-K293 WeakPolarHBondContact O-CB 3.34Å; L290-K293 PolarHBondContact O-N 3.31Å
291	A	63.9	Low	72.3	Confident	5 Å²	5	52.3 Å²	52.3	4%	0.041	31%	0.307	C	S	.	.	H	α-helix	trans	-63.6	-34.6	174.5	0	0	0	0	0	111.6	P104 F277 E287 L288 K293 F294 P295	P104-A291 HydrophobicContact CG-CB 4.07Å; F277-A291 HydrophobicContact CB-CB 3.82Å; F277-A291 HydrophobicContact CD2-CB 4.37Å; F277-A291 HydrophobicContact CG-CB 4.13Å; E287-A291 VanDerWaalsContact O-CB 3.28Å; E287-A291 WeakPolarHBondContact O-CB 3.48Å; E287-A291 PolarHBondContact O-N 2.86Å; L288-A291 PolarHBondContact O-N 2.98Å; A291-K293 VanDerWaalsContact C-N 3.25Å; A291-K293 PolarHBondContact O-N 2.78Å; A291-F294 CarbonylContact O-C 3.5Å; A291-F294 PolarHBondContact O-N 2.99Å; A291-P295 WeakPolarHBondContact O-CA 3.21Å
292	A	63.1	Low	74.2	Confident	23 Å²	23	46.5 Å²	46.5	19%	0.19	26%	0.259	C	S	.	.	H	α-helix	trans	-68.2	-19.5	176.2	0	0	0	0	0	113.6	L288 L289 L290 F294 P295	L288-A292 VanDerWaalsContact O-CB 3.28Å; L288-A292 WeakPolarHBondContact O-CB 3.45Å; L288-A292 PolarHBondContact O-N 3.03Å; L289-A292 PolarHBondContact O-N 3.12Å; L290-A292 VanDerWaalsContact C-N 3.26Å; L290-A292 PolarHBondContact O-N 2.93Å; A292-F294 VanDerWaalsContact C-N 3.35Å; A292-P295 WeakPolarHBondContact O-CD 3.42Å
293	K	66.6	Low	75.5	Confident	138 Å²	138	42.6 Å²	42.6	60%	0.6	23%	0.226	S	C	*	.	H	α-helix	trans	-68.4	-32.8	176.7	-72.2	-178.2	-178.7	-179	0	113.1	L272 L289 L290 A291	L272-K293 HydrophobicContact CD2-CB 4.38Å; L289-K293 PolarHBondContact O-N 3.43Å; L290-K293 HydrophobicContact CD2-CD 4.29Å; L290-K293 WeakPolarHBondContact O-CB 3.34Å; L290-K293 PolarHBondContact O-N 3.31Å; A291-K293 VanDerWaalsContact C-N 3.25Å; A291-K293 PolarHBondContact O-N 2.78Å
294	F	71.4	Confident	76	Confident	35 Å²	35	41.5 Å²	41.5	15%	0.154	22%	0.218	C	C	.	.	S	Bend	trans	-148.5	70.3	179.4	-155.1	-100	0	0	0	111.1	Y222 R224 L272 V274 A291 A292	Y222-F294 WeakPolarHBondContact O-CE1 3.39Å; R224-F294 HydrophobicContact CB-CE1 4.3Å; R224-F294 HydrophobicContact CB-CZ 4.14Å; L272-F294 HydrophobicContact CB-CB 4.29Å; L272-F294 HydrophobicContact CB-CD2 4.27Å; L272-F294 HydrophobicContact CB-CG 4.25Å; L272-F294 HydrophobicContact CD1-CD2 4.49Å; V274-F294 HydrophobicContact CG2-CD1 3.76Å; V274-F294 HydrophobicContact CG2-CE1 4.02Å; A291-F294 CarbonylContact O-C 3.5Å; A291-F294 PolarHBondContact O-N 2.99Å; A292-F294 VanDerWaalsContact C-N 3.35Å
295	P	78.1	Confident	76.3	Confident	19 Å²	19	38.9 Å²	38.9	12%	0.123	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-77.8	138.7	-173.4	32.1	-34.7	0	0	0	111	P104 V105 A291 A292 Q297	P104-P295 HydrophobicContact CB-CB 3.77Å; V105-P295 HydrophobicContact CG2-CB 4.31Å; V105-P295 HydrophobicContact CG2-CG 3.94Å; A291-P295 WeakPolarHBondContact O-CA 3.21Å; A292-P295 WeakPolarHBondContact O-CD 3.42Å; P295-Q297 PolarHBondContact O-N 3.18Å
296	L	87.1	Confident	76	Confident	18 Å²	18	35.5 Å²	35.5	9%	0.094	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-74.7	118.7	163	174.5	72.6	0	0	0	108.2	L223 R224 L226 I250 F251 V274 K298	L223-L296 HydrophobicContact CB-CD1 4.45Å; L223-L296 HydrophobicContact CD2-CD1 3.96Å; L223-L296 HydrophobicContact CG-CD1 4.01Å; L223-L296 VanDerWaalsContact O-CD1 3.3Å; L223-L296 WeakPolarHBondContact O-CD1 3.41Å; R224-L296 WeakPolarHBondContact O-CA 3.5Å; L226-L296 HydrophobicContact CB-CD1 4.02Å; I250-L296 HydrophobicContact CD1-CD2 4.19Å; I250-L296 HydrophobicContact CG2-CD2 4.25Å; F251-L296 HydrophobicContact CZ-CD2 3.97Å; V274-L296 HydrophobicContact CG1-CB 3.65Å; L296-K298 HydrophobicContact CD2-CG 4.14Å; L296-K298 HydrophobicContact CG-CG 4.19Å
297	Q	92.3	Very high	75.5	Confident	1 Å²	1	32 Å²	32	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.7	171.4	-169.9	173	32.1	0	0	109.7	N97 V105 P106 R224 F225 L226 P295 F299	N97-Q297 PolarHBondContact ND2-OE1 3.29Å; V105-Q297 HydrophobicContact CG2-CB 3.78Å; V105-Q297 HydrophobicContact CG2-CG 3.9Å; P106-Q297 PolarHBondContact O-NE2 3.33Å; R224-Q297 PolarHBondContact O-N 2.83Å; F225-Q297 WeakPolarHBondContact CA-O 3.4Å; F225-Q297 HydrophobicContact CD1-CB 4.04Å; F225-Q297 HydrophobicContact CE1-CB 4.25Å; L226-Q297 PolarHBondContact N-O 2.98Å; L226-Q297 VanDerWaalsContact N-O 3.1Å; P295-Q297 PolarHBondContact O-N 3.18Å; Q297-F299 HydrophobicContact CB-CE2 4.34Å; Q297-F299 HydrophobicContact CG-CE2 3.89Å; Q297-F299 HydrophobicContact CG-CZ 4.14Å
298	K	92.7	Very high	75.3	Confident	28 Å²	28	28.5 Å²	28.5	12%	0.122	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	139.9	-179.9	-54	174.8	-174.8	177.6	0	110.3	D107 V108 L226 L296 G317 L318	D107-K298 WeakPolarHBondContact CA-O 3.3Å; D107-K298 HydrophobicContact CB-CB 4.33Å; D107-K298 WeakPolarHBondContact OD1-CB 3.47Å; D107-K298 PolarHBondContact OD1-N 3.17Å; V108-K298 PolarHBondContact N-O 2.85Å; L226-K298 HydrophobicContact CB-CG 4.47Å; L226-K298 CarbonylContact O-C 3.55Å; L226-K298 VanDerWaalsContact O-CA 3.3Å; L226-K298 WeakPolarHBondContact O-CA 3.49Å; L296-K298 HydrophobicContact CD2-CG 4.14Å; L296-K298 HydrophobicContact CG-CG 4.19Å; K298-G317 PolarHBondContact NZ-O 3.14Å; K298-L318 HydrophobicContact CB-CD2 4.07Å; K298-L318 HydrophobicContact CD-CD2 4.03Å
299	F	94.8	Very high	75	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.009	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	123.5	175.5	-67.9	-96.1	0	0	0	109.5	I93 V108 F225 L226 V227 L228 Q297	I93-F299 HydrophobicContact CD1-CE1 3.59Å; I93-F299 HydrophobicContact CD1-CZ 4.26Å; I93-F299 HydrophobicContact CG1-CE1 4.2Å; I93-F299 HydrophobicContact CG2-CZ 4.14Å; V108-F299 HydrophobicContact CB-CD1 3.63Å; V108-F299 HydrophobicContact CB-CE1 3.69Å; V108-F299 HydrophobicContact CB-CG 4.45Å; V108-F299 HydrophobicContact CG1-CD1 4.04Å; V108-F299 HydrophobicContact CG1-CE1 4.09Å; V108-F299 HydrophobicContact CG2-CD1 4.18Å; V108-F299 HydrophobicContact CG2-CE1 3.71Å; V108-F299 HydrophobicContact CG2-CZ 4.24Å; V108-F299 CarbonylContact O-C 3.48Å; V108-F299 VanDerWaalsContact O-CA 3.3Å; V108-F299 WeakPolarHBondContact O-CA 3.34Å; F225-F299 AromaticContact CD1-CE2 3.86Å; F225-F299 HydrophobicContact CD1-CE2 3.86Å; F225-F299 HydrophobicContact CE1-CE2 4.5Å; L226-F299 PolarHBondContact O-N 2.73Å; V227-F299 HydrophobicContact CB-CB 4.19Å; V227-F299 HydrophobicContact CG1-CB 3.99Å; V227-F299 HydrophobicContact CG2-CB 3.96Å; V227-F299 HydrophobicContact CG2-CD2 4.07Å; V227-F299 HydrophobicContact CG2-CG 4.22Å; L228-F299 PolarHBondContact N-O 3.11Å; Q297-F299 HydrophobicContact CB-CE2 4.34Å; Q297-F299 HydrophobicContact CG-CE2 3.89Å; Q297-F299 HydrophobicContact CG-CZ 4.14Å
300	L	92.1	Very high	74.9	Confident	1 Å²	1	29 Å²	29	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	106.8	176.8	-166	65.3	0	0	0	109.5	V108 C109 I110 L228 A231 L305 V311 I315 L318	V108-L300 PolarHBondContact O-N 3.43Å; C109-L300 CarbonylContact C-O 3.53Å; C109-L300 VanDerWaalsContact CA-O 3.31Å; C109-L300 WeakPolarHBondContact CA-O 3.31Å; I110-L300 PolarHBondContact N-O 3.18Å; L228-L300 HydrophobicContact CB-CD1 3.95Å; L228-L300 HydrophobicContact CD1-CD1 3.94Å; A231-L300 HydrophobicContact CB-CD1 3.17Å; A231-L300 HydrophobicContact CB-CG 3.82Å; L300-L305 HydrophobicContact CB-CD2 4.2Å; L300-L305 HydrophobicContact CD2-CD1 3.43Å; L300-L305 VanDerWaalsContact CD2-CD1 3.43Å; L300-L305 HydrophobicContact CD2-CD2 3.82Å; L300-L305 HydrophobicContact CD2-CG 4.24Å; L300-L305 HydrophobicContact CG-CD1 3.83Å; L300-L305 HydrophobicContact CG-CD2 3.83Å; L300-V311 HydrophobicContact CD2-CG1 4.15Å; L300-I315 HydrophobicContact CD1-CD1 3.21Å; L300-I315 HydrophobicContact CD2-CD1 3.45Å; L300-I315 VanDerWaalsContact CD2-CD1 3.45Å; L300-I315 HydrophobicContact CG-CD1 4Å; L300-L318 HydrophobicContact CD2-CD1 4.2Å
301	V	92.2	Very high	74.8	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.2	-172.5	-173.4	0	0	0	0	109	I110 K118 Y122 L228 D229 E230 A231	I110-V301 HydrophobicContact CB-CG1 4.35Å; I110-V301 HydrophobicContact CB-CG2 4.39Å; I110-V301 HydrophobicContact CD1-CG2 4.23Å; K118-V301 HydrophobicContact CB-CG1 3.77Å; K118-V301 HydrophobicContact CD-CG1 3.72Å; K118-V301 HydrophobicContact CG-CG1 4.36Å; Y122-V301 HydrophobicContact CD1-CG2 3.88Å; Y122-V301 HydrophobicContact CE1-CG2 4.08Å; L228-V301 PolarHBondContact O-N 3.31Å; D229-V301 CarbonylContact C-O 3.57Å; D229-V301 WeakPolarHBondContact OD1-CG1 3.47Å; E230-V301 WeakPolarHBondContact CA-O 3.48Å; E230-V301 PolarHBondContact N-O 3.18Å; A231-V301 PolarHBondContact N-O 3.04Å
302	S	86	Confident	74.9	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	158.4	175.7	156.3	0	0	0	0	111.2	I110 S111 S112 D232 T304 L305	I110-S302 PolarHBondContact O-N 2.65Å; S111-S302 WeakPolarHBondContact CA-O 3.39Å; S112-S302 PolarHBondContact N-O 2.77Å; D232-S302 WeakPolarHBondContact OD1-CB 3.34Å; D232-S302 PolarHBondContact OD1-OG 3.41Å; S302-T304 VanDerWaalsContact C-N 3.34Å; S302-T304 PolarHBondContact OG-N 2.94Å; S302-T304 VanDerWaalsContact OG-N 3.1Å; S302-L305 PolarHBondContact OG-N 3.12Å
303	A	78.4	Confident	75.1	Confident	10 Å²	10	32 Å²	32	8%	0.083	16%	0.156	C	C	.	.	S	Bend	trans	-70.8	-32.3	173.5	0	0	0	0	0	113	S112 T114	S112-A303 VanDerWaalsContact O-CA 3.28Å; S112-A303 WeakPolarHBondContact O-CA 3.32Å; T114-A303 HydrophobicContact CG2-CB 4.42Å
304	T	71.2	Confident	75.1	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.018	15%	0.146	C	C	.	.	S	Bend	trans	-123.9	11.2	-167.9	56.2	0	0	0	0	112.9	D232 S302 A306 Y307 I340 Q453	D232-T304 PolarHBondContact OD2-OG1 3.05Å; S302-T304 VanDerWaalsContact C-N 3.34Å; S302-T304 PolarHBondContact OG-N 2.94Å; S302-T304 VanDerWaalsContact OG-N 3.1Å; T304-A306 PolarHBondContact O-N 3.48Å; T304-Y307 VanDerWaalsContact O-CB 3.3Å; T304-Y307 WeakPolarHBondContact O-CB 3.35Å; T304-Y307 PolarHBondContact O-N 3.44Å; T304-I340 HydrophobicContact CG2-CG1 4.03Å; T304-Q453 HydrophobicContact CG2-CB 4.4Å; T304-Q453 HydrophobicContact CG2-CG 3.84Å; T304-Q453 PolarHBondContact OG1-NE2 3.44Å
305	L	70.1	Confident	74.9	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.005	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-44.5	-40.7	-179.2	-173.5	58.8	0	0	0	114.2	C109 L300 S302 Y307 N308 V311 L323	C109-L305 HydrophobicContact CB-CD2 3.73Å; L300-L305 HydrophobicContact CB-CD2 4.2Å; L300-L305 HydrophobicContact CD2-CD1 3.43Å; L300-L305 VanDerWaalsContact CD2-CD1 3.43Å; L300-L305 HydrophobicContact CD2-CD2 3.82Å; L300-L305 HydrophobicContact CD2-CG 4.24Å; L300-L305 HydrophobicContact CG-CD1 3.83Å; L300-L305 HydrophobicContact CG-CD2 3.83Å; S302-L305 PolarHBondContact OG-N 3.12Å; L305-Y307 PolarHBondContact O-N 2.88Å; L305-N308 PolarHBondContact O-N 3.25Å; L305-V311 HydrophobicContact CD1-CB 4.36Å; L305-V311 HydrophobicContact CD1-CG1 3.34Å; L305-L323 HydrophobicContact CD2-CD1 4.36Å
306	A	61.1	Low	74	Confident	19 Å²	19	31.8 Å²	31.8	16%	0.157	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-47.9	-20.2	175.8	0	0	0	0	0	116.5	S111 T304 R325	S111-A306 VanDerWaalsContact OG-CB 3.3Å; S111-A306 WeakPolarHBondContact OG-CB 3.46Å; S111-A306 PolarHBondContact OG-N 2.72Å; T304-A306 PolarHBondContact O-N 3.48Å; A306-R325 VanDerWaalsContact CB-NE 3.3Å; A306-R325 PolarHBondContact O-NH2 3.47Å
307	Y	59.8	Low	73.3	Confident	64 Å²	64	32.7 Å²	32.7	25%	0.251	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-106.7	-35	-171.7	-83.1	-95.8	0	0	0	115.1	T304 L305 S309 Q338 M339 I340	T304-Y307 VanDerWaalsContact O-CB 3.3Å; T304-Y307 WeakPolarHBondContact O-CB 3.35Å; T304-Y307 PolarHBondContact O-N 3.44Å; L305-Y307 PolarHBondContact O-N 2.88Å; Y307-S309 VanDerWaalsContact C-N 3.29Å; Y307-S309 PolarHBondContact O-N 2.81Å; Y307-Q338 HydrophobicContact CE1-CB 3.92Å; Y307-Q338 HydrophobicContact CE1-CG 4.48Å; Y307-Q338 WeakPolarHBondContact OH-CA 3.06Å; Y307-Q338 PolarHBondContact OH-O 3.17Å; Y307-Q338 VanDerWaalsContact OH-O 3.12Å; Y307-M339 HydrophobicContact CE2-CB 4.08Å; Y307-M339 WeakPolarHBondContact CE2-O 3.21Å; Y307-M339 WeakPolarHBondContact OH-CA 3.34Å; Y307-M339 PolarHBondContact OH-N 2.72Å; Y307-I340 HydrophobicContact CD2-CG1 3.94Å; Y307-I340 HydrophobicContact CE1-CD1 4.09Å; Y307-I340 HydrophobicContact CE1-CG1 4.14Å; Y307-I340 HydrophobicContact CE2-CB 3.69Å; Y307-I340 HydrophobicContact CE2-CD1 4.13Å; Y307-I340 HydrophobicContact CE2-CG1 3.29Å; Y307-I340 WeakPolarHBondContact OH-CA 3Å; Y307-I340 WeakPolarHBondContact OH-CB 3.34Å; Y307-I340 WeakPolarHBondContact OH-CD1 3.48Å; Y307-I340 WeakPolarHBondContact OH-CG1 3.28Å; Y307-I340 PolarHBondContact OH-N 3.29Å
308	N	62.5	Low	72.7	Confident	37 Å²	37	34.3 Å²	34.3	20%	0.198	20%	0.195	C	C	.	.			trans	-91	82.4	-166.1	-162.4	-31.9	0	0	0	105.9	L305 D310 V311 I312	L305-N308 PolarHBondContact O-N 3.25Å; N308-D310 PolarHBondContact O-N 2.89Å; N308-D310 WeakPolarHBondContact OD1-CB 3.45Å; N308-D310 PolarHBondContact OD1-N 2.96Å; N308-V311 HydrophobicContact CB-CB 4Å; N308-V311 HydrophobicContact CB-CG2 3.68Å; N308-V311 VanDerWaalsContact O-CB 3.32Å; N308-V311 WeakPolarHBondContact O-CB 3.14Å; N308-V311 PolarHBondContact O-N 2.83Å; N308-V311 PolarHBondContact OD1-N 3.13Å; N308-V311 VanDerWaalsContact OD1-N 3.08Å; N308-I312 PolarHBondContact O-N 3.3Å
309	S	58.8	Low	72.3	Confident	39 Å²	39	34.8 Å²	34.8	27%	0.273	20%	0.198	S	C	.	.	H	α-helix	trans	-52	-35.9	173.3	49.1	0	0	0	0	110	Y307 V311 I312 Y313	Y307-S309 VanDerWaalsContact C-N 3.29Å; Y307-S309 PolarHBondContact O-N 2.81Å; S309-V311 VanDerWaalsContact C-N 3.29Å; S309-V311 PolarHBondContact O-N 2.52Å; S309-I312 WeakPolarHBondContact O-CA 3.41Å; S309-I312 WeakPolarHBondContact O-CB 3.37Å; S309-I312 PolarHBondContact O-N 3.32Å; S309-Y313 WeakPolarHBondContact O-CD2 3.45Å; S309-Y313 PolarHBondContact O-N 3.47Å
310	D	63.8	Low	71.9	Confident	94 Å²	94	39.6 Å²	39.6	50%	0.503	22%	0.216	S	C	.	.	H	α-helix	trans	-63.7	-36.5	-179.8	-49.9	-22.4	0	0	0	111	N308 I312 Y313 K314	N308-D310 PolarHBondContact O-N 2.89Å; N308-D310 WeakPolarHBondContact OD1-CB 3.45Å; N308-D310 PolarHBondContact OD1-N 2.96Å; D310-I312 VanDerWaalsContact C-N 3.3Å; D310-I312 PolarHBondContact O-N 3.33Å; D310-Y313 PolarHBondContact O-N 3.08Å; D310-K314 WeakPolarHBondContact O-CA 3.09Å; D310-K314 WeakPolarHBondContact O-CB 3.46Å; D310-K314 WeakPolarHBondContact O-CG 3.33Å; D310-K314 PolarHBondContact O-N 3.48Å
311	V	66	Low	71.7	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-58.5	-45.4	172.4	160	0	0	0	0	111.1	D232 L235 L300 L305 N308 S309 I315	D232-V311 HydrophobicContact CB-CG2 4.33Å; L235-V311 HydrophobicContact CB-CG2 4.13Å; L235-V311 HydrophobicContact CD1-CB 3.81Å; L235-V311 HydrophobicContact CD1-CG1 3.38Å; L235-V311 HydrophobicContact CD1-CG2 3.8Å; L300-V311 HydrophobicContact CD2-CG1 4.15Å; L305-V311 HydrophobicContact CD1-CB 4.36Å; L305-V311 HydrophobicContact CD1-CG1 3.34Å; N308-V311 HydrophobicContact CB-CB 4Å; N308-V311 HydrophobicContact CB-CG2 3.68Å; N308-V311 VanDerWaalsContact O-CB 3.32Å; N308-V311 WeakPolarHBondContact O-CB 3.14Å; N308-V311 PolarHBondContact O-N 2.83Å; N308-V311 PolarHBondContact OD1-N 3.13Å; N308-V311 VanDerWaalsContact OD1-N 3.08Å; S309-V311 VanDerWaalsContact C-N 3.29Å; S309-V311 PolarHBondContact O-N 2.52Å; V311-I315 HydrophobicContact CG1-CD1 4.27Å; V311-I315 WeakPolarHBondContact O-CG1 3.4Å; V311-I315 PolarHBondContact O-N 3.22Å; V311-I315 VanDerWaalsContact O-N 3.12Å
312	I	65.5	Low	71.6	Confident	22 Å²	22	45.7 Å²	45.7	11%	0.113	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-47.6	179.2	-69	169.2	0	0	0	110.7	P39 W41 V42 N308 S309 D310 G316	P39-I312 HydrophobicContact CG-CG2 4.39Å; W41-I312 HydrophobicContact CH2-CD1 3.74Å; W41-I312 HydrophobicContact CH2-CG1 3.9Å; W41-I312 HydrophobicContact CH2-CG2 4.45Å; W41-I312 HydrophobicContact CZ2-CB 4.29Å; W41-I312 HydrophobicContact CZ2-CD1 3.74Å; W41-I312 HydrophobicContact CZ2-CG1 3.84Å; W41-I312 HydrophobicContact CZ2-CG2 3.55Å; V42-I312 HydrophobicContact CG2-CD1 3.74Å; N308-I312 PolarHBondContact O-N 3.3Å; S309-I312 WeakPolarHBondContact O-CA 3.41Å; S309-I312 WeakPolarHBondContact O-CB 3.37Å; S309-I312 PolarHBondContact O-N 3.32Å; D310-I312 VanDerWaalsContact C-N 3.3Å; D310-I312 PolarHBondContact O-N 3.33Å; I312-G316 PolarHBondContact O-N 3.33Å; I312-G316 VanDerWaalsContact O-N 3.11Å
313	Y	66.2	Low	71.8	Confident	139 Å²	139	45.9 Å²	45.9	55%	0.545	24%	0.242	S	C	.	.	H	α-helix	trans	-66.8	-41.3	179.5	-77.2	-69.8	0	0	0	112.4	S309 D310 I315 G316	S309-Y313 WeakPolarHBondContact O-CD2 3.45Å; S309-Y313 PolarHBondContact O-N 3.47Å; D310-Y313 PolarHBondContact O-N 3.08Å; Y313-I315 VanDerWaalsContact C-N 3.32Å; Y313-I315 PolarHBondContact O-N 2.81Å; Y313-G316 VanDerWaalsContact O-CA 3.32Å; Y313-G316 WeakPolarHBondContact O-CA 3.49Å; Y313-G316 PolarHBondContact O-N 2.83Å; Y313-G316 VanDerWaalsContact O-N 3.15Å
314	K	66.8	Low	72.4	Confident	92 Å²	92	45.6 Å²	45.6	40%	0.4	24%	0.239	S	C	.	.	H	α-helix	trans	-62.3	-38.7	178.8	-81.6	176.5	174.1	-175.3	0	112	L235 L240 D310	L235-K314 HydrophobicContact CB-CD 4.33Å; L235-K314 HydrophobicContact CD2-CB 3.97Å; L235-K314 HydrophobicContact CD2-CD 4.39Å; L235-K314 PolarHBondContact O-NZ 3.05Å; L240-K314 HydrophobicContact CD1-CG 4.38Å; L240-K314 HydrophobicContact CD2-CB 3.52Å; L240-K314 HydrophobicContact CD2-CD 4.15Å; L240-K314 HydrophobicContact CD2-CG 3.66Å; L240-K314 HydrophobicContact CG-CG 4.43Å; D310-K314 WeakPolarHBondContact O-CA 3.09Å; D310-K314 WeakPolarHBondContact O-CB 3.46Å; D310-K314 WeakPolarHBondContact O-CG 3.33Å; D310-K314 PolarHBondContact O-N 3.48Å
315	I	66.9	Low	73	Confident	26 Å²	26	46.3 Å²	46.3	13%	0.133	24%	0.241	C	C	.	.	H	α-helix	trans	-71.7	-38.3	175.2	-69.2	168.6	0	0	0	110.5	L228 L235 L300 V311 Y313 G317 L318	L228-I315 HydrophobicContact CD1-CD1 4.2Å; L235-I315 HydrophobicContact CD1-CD1 3.62Å; L235-I315 HydrophobicContact CD1-CG1 3.77Å; L235-I315 HydrophobicContact CD2-CG1 4.14Å; L300-I315 HydrophobicContact CD1-CD1 3.21Å; L300-I315 HydrophobicContact CD2-CD1 3.45Å; L300-I315 VanDerWaalsContact CD2-CD1 3.45Å; L300-I315 HydrophobicContact CG-CD1 4Å; V311-I315 HydrophobicContact CG1-CD1 4.27Å; V311-I315 WeakPolarHBondContact O-CG1 3.4Å; V311-I315 PolarHBondContact O-N 3.22Å; V311-I315 VanDerWaalsContact O-N 3.12Å; Y313-I315 VanDerWaalsContact C-N 3.32Å; Y313-I315 PolarHBondContact O-N 2.81Å; I315-G317 PolarHBondContact O-N 3.06Å; I315-L318 HydrophobicContact CG2-CD1 4.45Å; I315-L318 HydrophobicContact CG2-CD2 3.76Å; I315-L318 HydrophobicContact CG2-CG 3.73Å
316	G	59.5	Low	73.6	Confident	69 Å²	69	46.4 Å²	46.4	71%	0.711	24%	0.242	S	C	*	.			trans	57.9	-8.8	164.6	0	0	0	0	0	118.3	I312 Y313	I312-G316 PolarHBondContact O-N 3.33Å; I312-G316 VanDerWaalsContact O-N 3.11Å; Y313-G316 VanDerWaalsContact O-CA 3.32Å; Y313-G316 WeakPolarHBondContact O-CA 3.49Å; Y313-G316 PolarHBondContact O-N 2.83Å; Y313-G316 VanDerWaalsContact O-N 3.15Å
317	G	72.2	Confident	74.2	Confident	37 Å²	37	52.1 Å²	52.1	38%	0.381	26%	0.263	S	S	.	.			trans	-142.7	34.1	-166.2	0	0	0	0	0	112.7	K298 I315	K298-G317 PolarHBondContact NZ-O 3.14Å; I315-G317 PolarHBondContact O-N 3.06Å
318	L	81	Confident	74.4	Confident	35 Å²	35	50.6 Å²	50.6	18%	0.183	26%	0.264	C	S	.	.			trans	-77	135.1	166.9	-64	178.5	0	0	0	109.8	D107 K298 L300 I315 P321	D107-L318 HydrophobicContact CB-CB 4.36Å; D107-L318 HydrophobicContact CB-CD2 4.2Å; D107-L318 WeakPolarHBondContact OD2-CA 3.37Å; K298-L318 HydrophobicContact CB-CD2 4.07Å; K298-L318 HydrophobicContact CD-CD2 4.03Å; L300-L318 HydrophobicContact CD2-CD1 4.2Å; I315-L318 HydrophobicContact CG2-CD1 4.45Å; I315-L318 HydrophobicContact CG2-CD2 3.76Å; I315-L318 HydrophobicContact CG2-CG 3.73Å; L318-P321 HydrophobicContact CB-CB 4.03Å; L318-P321 HydrophobicContact CB-CG 4.12Å; L318-P321 HydrophobicContact CD1-CB 4.03Å
319	F	83.1	Confident	73.7	Confident	38 Å²	38	56.8 Å²	56.8	17%	0.167	29%	0.285	C	S	.	.	S	Bend	trans	-93.9	116.9	177.1	-176.6	-101.9	0	0	0	110.9	P104 D107 F277 A279	P104-F319 HydrophobicContact CB-CD1 3.83Å; P104-F319 HydrophobicContact CB-CE1 3.59Å; P104-F319 HydrophobicContact CB-CZ 4.28Å; P104-F319 HydrophobicContact CG-CE1 4.08Å; P104-F319 HydrophobicContact CG-CZ 4.28Å; P104-F319 VanDerWaalsContact O-CE1 3.28Å; P104-F319 WeakPolarHBondContact O-CE1 3.34Å; D107-F319 WeakPolarHBondContact CB-O 3.27Å; D107-F319 PolarHBondContact N-O 3.2Å; D107-F319 PolarHBondContact OD2-N 3.31Å; F277-F319 HydrophobicContact CD1-CD2 4.12Å; F277-F319 AromaticContact CD1-CE2 3.82Å; F277-F319 HydrophobicContact CD1-CE2 3.82Å; F277-F319 HydrophobicContact CD1-CZ 4.42Å; F277-F319 HydrophobicContact CE1-CD2 4.26Å; F277-F319 AromaticContact CE1-CE2 3.56Å; F277-F319 HydrophobicContact CE1-CE2 3.56Å; F277-F319 HydrophobicContact CE1-CZ 4.13Å; A279-F319 HydrophobicContact CB-CE2 4.09Å
320	R	86.6	Confident	72.8	Confident	104 Å²	104	65.9 Å²	65.9	39%	0.392	31%	0.314	S	S	.	.	S	Bend	trans	43.6	53.3	180	-63.5	176.6	69.3	-155	6.1	113.3	P106 R322	P106-R320 HydrophobicContact CB-CB 4.13Å; P106-R320 WeakPolarHBondContact CB-O 3.46Å; R320-R322 PolarHBondContact O-N 3.32Å
321	P	87.1	Confident	71.6	Confident	16 Å²	16	63.2 Å²	63.2	10%	0.104	31%	0.305	C	S	.	.			trans	-58.8	137.4	-172.7	24.7	-35	0	0	0	112.5	W41 D107 L318	W41-P321 HydrophobicContact CB-CG 4.27Å; W41-P321 HydrophobicContact CD2-CB 3.93Å; W41-P321 HydrophobicContact CD2-CG 3.48Å; W41-P321 VanDerWaalsContact CD2-CG 3.48Å; W41-P321 HydrophobicContact CE3-CB 3.86Å; W41-P321 HydrophobicContact CE3-CG 3.96Å; W41-P321 HydrophobicContact CG-CB 4.46Å; W41-P321 HydrophobicContact CG-CG 3.62Å; W41-P321 HydrophobicContact CH2-CB 4.35Å; W41-P321 HydrophobicContact CZ2-CB 4.38Å; W41-P321 HydrophobicContact CZ2-CG 4.13Å; W41-P321 HydrophobicContact CZ3-CB 4.08Å; W41-P321 HydrophobicContact CZ3-CG 4.48Å; D107-P321 CarbonylContact O-C 3.53Å; D107-P321 WeakPolarHBondContact O-CA 3.28Å; L318-P321 HydrophobicContact CB-CB 4.03Å; L318-P321 HydrophobicContact CB-CG 4.12Å; L318-P321 HydrophobicContact CD1-CB 4.03Å
322	R	91.4	Very high	69.9	Low	112 Å²	112	70.4 Å²	70.4	42%	0.423	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	114	174.8	-64.6	-64.1	-170.5	172.8	2.1	109.9	W96 P106 D107 C109 R320 F324	W96-R322 HydrophobicContact CH2-CB 3.71Å; W96-R322 HydrophobicContact CH2-CG 3.69Å; W96-R322 HydrophobicContact CZ2-CG 4.11Å; W96-R322 HydrophobicContact CZ3-CB 4.25Å; W96-R322 HydrophobicContact CZ3-CG 4.28Å; P106-R322 HydrophobicContact CB-CG 3.82Å; P106-R322 HydrophobicContact CG-CG 4.16Å; D107-R322 PolarHBondContact O-N 3.14Å; C109-R322 PolarHBondContact N-O 3.43Å; R320-R322 PolarHBondContact O-N 3.32Å; R322-F324 HydrophobicContact CB-CE2 4.38Å
323	L	89.7	Confident	68.3	Low	5 Å²	5	72.2 Å²	72.2	3%	0.026	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	118.5	-179.9	-175.7	56.1	0	0	0	111.7	W41 V42 S45 T46 C109 L305 R325	W41-L323 HydrophobicContact CE3-CB 3.94Å; W41-L323 HydrophobicContact CZ3-CB 3.81Å; W41-L323 HydrophobicContact CZ3-CD2 4.34Å; W41-L323 HydrophobicContact CZ3-CG 4.45Å; V42-L323 HydrophobicContact CB-CD2 4.4Å; V42-L323 HydrophobicContact CG1-CD2 3.92Å; S45-L323 CarbonylContact C-O 3.48Å; S45-L323 WeakPolarHBondContact CA-O 3.33Å; T46-L323 PolarHBondContact N-O 3.06Å; C109-L323 HydrophobicContact CB-CB 4.36Å; C109-L323 HydrophobicContact CB-CD1 3.64Å; C109-L323 CarbonylContact O-C 3.59Å; C109-L323 WeakPolarHBondContact O-CA 3.29Å; L305-L323 HydrophobicContact CD2-CD1 4.36Å; L323-R325 HydrophobicContact CG-CB 4.45Å
324	F	91	Very high	66.6	Low	4 Å²	4	77.2 Å²	77.2	2%	0.018	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	118.2	164.9	-63.2	-94.1	0	0	0	109	T46 V48 I85 V89 R92 W96 V108 C109 S111 R322	T46-F324 HydrophobicContact CG2-CD1 4.05Å; T46-F324 HydrophobicContact CG2-CE1 4.23Å; V48-F324 HydrophobicContact CG2-CD1 4.42Å; I85-F324 HydrophobicContact CD1-CB 4.01Å; V89-F324 HydrophobicContact CG2-CB 3.77Å; V89-F324 HydrophobicContact CG2-CD1 3.65Å; V89-F324 HydrophobicContact CG2-CD2 3.9Å; V89-F324 HydrophobicContact CG2-CE1 4.14Å; V89-F324 HydrophobicContact CG2-CE2 4.37Å; V89-F324 HydrophobicContact CG2-CG 3.5Å; V89-F324 HydrophobicContact CG2-CZ 4.47Å; R92-F324 HydrophobicContact CB-CE1 4.46Å; R92-F324 HydrophobicContact CB-CZ 3.92Å; R92-F324 HydrophobicContact CG-CZ 4.11Å; W96-F324 AromaticContact CH2-CE2 3.81Å; W96-F324 HydrophobicContact CH2-CE2 3.81Å; W96-F324 AromaticContact CH2-CZ 3.66Å; W96-F324 HydrophobicContact CH2-CZ 3.66Å; W96-F324 HydrophobicContact CZ2-CZ 4.5Å; W96-F324 HydrophobicContact CZ3-CE2 4.15Å; W96-F324 HydrophobicContact CZ3-CZ 4.27Å; V108-F324 HydrophobicContact CG1-CD2 4.08Å; V108-F324 HydrophobicContact CG1-CE2 4.05Å; C109-F324 PolarHBondContact O-N 3.41Å; S111-F324 PolarHBondContact N-O 2.96Å; R322-F324 HydrophobicContact CB-CE2 4.38Å
325	R	85	Confident	64.9	Low	17 Å²	17	81.3 Å²	81.3	6%	0.064	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130.6	-175.8	-178	-173.9	-85.2	165.4	-14.2	110.1	T46 I47 V48 S111 A306 L323 M339	T46-R325 PolarHBondContact O-N 3.16Å; I47-R325 CarbonylContact C-O 3.57Å; I47-R325 WeakPolarHBondContact CA-O 3.33Å; V48-R325 PolarHBondContact N-O 3Å; S111-R325 WeakPolarHBondContact O-CA 3.46Å; A306-R325 VanDerWaalsContact CB-NE 3.3Å; A306-R325 PolarHBondContact O-NH2 3.47Å; L323-R325 HydrophobicContact CG-CB 4.45Å; R325-M339 PolarHBondContact NH1-SD 3.35Å
326	S	81.4	Confident	63.5	Low	4 Å²	4	82.3 Å²	82.3	3%	0.028	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	139	169.2	-72.6	0	0	0	0	111.1	V48 S111 S112 A328 T341	V48-S326 WeakPolarHBondContact O-CA 2.92Å; S111-S326 PolarHBondContact O-N 2.95Å; S112-S326 WeakPolarHBondContact CB-OG 3.49Å; S112-S326 PolarHBondContact OG-OG 3.29Å; S326-A328 PolarHBondContact O-N 3.07Å; S326-T341 PolarHBondContact O-OG1 2.67Å
327	K	74.5	Confident	62.5	Low	139 Å²	139	83.8 Å²	83.8	60%	0.604	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-54.1	124	-179.9	-165.9	170.6	-177.4	172.4	0	111.2	I47 V48 R50	I47-K327 HydrophobicContact CG2-CB 3.79Å; I47-K327 HydrophobicContact CG2-CD 4.5Å; I47-K327 HydrophobicContact CG2-CG 4.06Å; V48-K327 PolarHBondContact O-N 3.29Å; R50-K327 PolarHBondContact NH2-O 3.24Å
328	A	63.4	Low	61.4	Low	31 Å²	31	86.1 Å²	86.1	26%	0.256	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-73.5	152.8	174.8	0	0	0	0	0	110.8	S326 M339	S326-A328 PolarHBondContact O-N 3.07Å; A328-M339 HydrophobicContact CB-CB 4.45Å
329	Y	48.8	Very low	60.1	Low	167 Å²	167	87.7 Å²	87.7	66%	0.655	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-74.8	136.8	169.4	-166.8	-95.8	0	0	0	108.1	A331	Y329-A331 PolarHBondContact O-N 3.45Å
330	R	40	Very low	59	Low	231 Å²	231	86.9 Å²	86.9	87%	0.872	43%	0.434	S	S	*	.			trans	-66.7	101.4	170.5	-84.5	-175.6	171.7	167.4	-3	107.3	V332	R330-V332 PolarHBondContact O-N 3.41Å
331	A	38.2	Very low	58	Low	38 Å²	38	82.3 Å²	82.3	31%	0.314	42%	0.417	S	S	.	.			trans	-52.5	122.8	160.1	0	0	0	0	0	107.5	Y329 G333 Y491	Y329-A331 PolarHBondContact O-N 3.45Å; A331-G333 VanDerWaalsContact C-N 3.3Å; A331-G333 PolarHBondContact O-N 3.36Å; A331-Y491 HydrophobicContact CB-CE2 3.77Å; A331-Y491 WeakPolarHBondContact CB-OH 3.48Å
332	V	29.5	Very low	57.3	Low	153 Å²	153	81.9 Å²	81.9	93%	0.927	41%	0.414	S	S	*	.	S	Bend	trans	-68.1	97	168.8	178.3	0	0	0	0	105.7	R330	R330-V332 PolarHBondContact O-N 3.41Å
333	G	32.3	Very low	56.3	Low	60 Å²	60	77.3 Å²	77.3	62%	0.619	40%	0.399	S	S	*	.	S	Bend	trans	166.5	121.8	-177	0	0	0	0	0	110.5	A331	A331-G333 VanDerWaalsContact C-N 3.3Å; A331-G333 PolarHBondContact O-N 3.36Å
334	R	30.5	Very low	55.4	Low	244 Å²	244	82.2 Å²	82.2	92%	0.921	42%	0.422	S	S	*	.	S	Bend	trans	-70	140.9	170.5	-68.5	179.5	176.1	175.3	-1	107.6
335	I	31.3	Very low	54.9	Low	177 Å²	177	84.7 Å²	84.7	91%	0.908	44%	0.435	S	S	*	.	S	Bend	trans	90.7	116.1	168.7	-48.5	163.3	0	0	0	115
336	G	38.3	Very low	54.9	Low	47 Å²	47	84.7 Å²	84.7	49%	0.485	44%	0.436	S	S	.	.			trans	125.4	120	164.9	0	0	0	0	0	113.8	Q338	G336-Q338 PolarHBondContact O-N 3.16Å
337	P	38.4	Very low	55.2	Low	100 Å²	100	87.8 Å²	87.8	65%	0.649	45%	0.453	S	S	*	.			trans	-73.7	39.1	178.3	32.8	-34.5	0	0	0	112.7	M339	P337-M339 WeakPolarHBondContact O-CG 3.45Å; P337-M339 PolarHBondContact O-N 3.3Å
338	Q	47.5	Very low	56	Low	87 Å²	87	82.1 Å²	82.1	41%	0.407	43%	0.428	S	S	.	.			trans	-85.6	80.5	-175.5	-56.8	-169.7	25.9	0	0	110.7	Y307 G336 I340	Y307-Q338 HydrophobicContact CE1-CB 3.92Å; Y307-Q338 HydrophobicContact CE1-CG 4.48Å; Y307-Q338 WeakPolarHBondContact OH-CA 3.06Å; Y307-Q338 PolarHBondContact OH-O 3.17Å; Y307-Q338 VanDerWaalsContact OH-O 3.12Å; G336-Q338 PolarHBondContact O-N 3.16Å; Q338-I340 PolarHBondContact O-N 2.94Å
339	M	55	Low	57.4	Low	68 Å²	68	81.5 Å²	81.5	34%	0.335	42%	0.42	S	S	.	.			trans	-88.4	46.3	-173.2	-55.3	-178.2	73.7	0	0	119.5	Y307 R325 A328 P337 T341	Y307-M339 HydrophobicContact CE2-CB 4.08Å; Y307-M339 WeakPolarHBondContact CE2-O 3.21Å; Y307-M339 WeakPolarHBondContact OH-CA 3.34Å; Y307-M339 PolarHBondContact OH-N 2.72Å; R325-M339 PolarHBondContact NH1-SD 3.35Å; A328-M339 HydrophobicContact CB-CB 4.45Å; P337-M339 WeakPolarHBondContact O-CG 3.45Å; P337-M339 PolarHBondContact O-N 3.3Å; M339-T341 PolarHBondContact O-OG1 3.27Å
340	I	59.2	Low	59.4	Low	21 Å²	21	75.2 Å²	75.2	11%	0.108	40%	0.396	C	S	.	.			trans	-90.8	129.1	-164.5	-98	149.4	0	0	0	102.7	T304 Y307 Q338 F342 L452 Q453 A456	T304-I340 HydrophobicContact CG2-CG1 4.03Å; Y307-I340 HydrophobicContact CD2-CG1 3.94Å; Y307-I340 HydrophobicContact CE1-CD1 4.09Å; Y307-I340 HydrophobicContact CE1-CG1 4.14Å; Y307-I340 HydrophobicContact CE2-CB 3.69Å; Y307-I340 HydrophobicContact CE2-CD1 4.13Å; Y307-I340 HydrophobicContact CE2-CG1 3.29Å; Y307-I340 WeakPolarHBondContact OH-CA 3Å; Y307-I340 WeakPolarHBondContact OH-CB 3.34Å; Y307-I340 WeakPolarHBondContact OH-CD1 3.48Å; Y307-I340 WeakPolarHBondContact OH-CG1 3.28Å; Y307-I340 PolarHBondContact OH-N 3.29Å; Q338-I340 PolarHBondContact O-N 2.94Å; I340-F342 HydrophobicContact CB-CE2 4.3Å; I340-F342 HydrophobicContact CG2-CD2 3.92Å; I340-F342 HydrophobicContact CG2-CE1 4.16Å; I340-F342 HydrophobicContact CG2-CE2 3.38Å; I340-F342 HydrophobicContact CG2-CZ 3.51Å; I340-L452 HydrophobicContact CB-CD2 4.45Å; I340-L452 HydrophobicContact CD1-CB 3.9Å; I340-L452 HydrophobicContact CD1-CD2 3.78Å; I340-L452 HydrophobicContact CD1-CG 3.65Å; I340-Q453 HydrophobicContact CD1-CB 4.46Å; I340-A456 HydrophobicContact CG2-CB 3.62Å
341	T	64.8	Low	61.8	Low	7 Å²	7	64.6 Å²	64.6	4%	0.043	36%	0.357	C	S	.	.			trans	-103.1	108.3	-168.4	-57.2	0	0	0	0	107.4	R50 P113 S326 M339	R50-T341 VanDerWaalsContact CZ-CG2 3.45Å; P113-T341 WeakPolarHBondContact CB-O 3.18Å; P113-T341 HydrophobicContact CG-CG2 3.85Å; S326-T341 PolarHBondContact O-OG1 2.67Å; M339-T341 PolarHBondContact O-OG1 3.27Å
342	F	73.3	Confident	64.2	Low	8 Å²	8	66 Å²	66	4%	0.035	36%	0.359	C	S	.	.			trans	-86.6	165.2	175.5	-68.5	-82.1	0	0	0	111.9	R50 I340 L346 L452 Y455 A456 A459	R50-F342 WeakPolarHBondContact CD-O 3.35Å; R50-F342 PolarHBondContact NE-O 3.08Å; R50-F342 PolarHBondContact NH1-O 2.95Å; I340-F342 HydrophobicContact CB-CE2 4.3Å; I340-F342 HydrophobicContact CG2-CD2 3.92Å; I340-F342 HydrophobicContact CG2-CE1 4.16Å; I340-F342 HydrophobicContact CG2-CE2 3.38Å; I340-F342 HydrophobicContact CG2-CZ 3.51Å; F342-L346 HydrophobicContact CD1-CD2 4.49Å; F342-L452 HydrophobicContact CE2-CD1 4.31Å; F342-L452 HydrophobicContact CZ-CD1 3.78Å; F342-L452 HydrophobicContact CZ-CG 4.24Å; F342-Y455 HydrophobicContact CD1-CE1 4.41Å; F342-Y455 AromaticContact CE1-CD1 3.48Å; F342-Y455 HydrophobicContact CE1-CD1 3.48Å; F342-Y455 VanDerWaalsContact CE1-CD1 3.48Å; F342-Y455 AromaticContact CE1-CE1 3.63Å; F342-Y455 HydrophobicContact CE1-CE1 3.63Å; F342-Y455 AromaticContact CZ-CD1 3.82Å; F342-Y455 HydrophobicContact CZ-CD1 3.82Å; F342-Y455 HydrophobicContact CZ-CE1 4.11Å; F342-A456 HydrophobicContact CD1-CB 4.3Å; F342-A456 HydrophobicContact CE1-CB 3.67Å; F342-A456 HydrophobicContact CZ-CB 4.08Å; F342-A459 HydrophobicContact CD1-CB 4.03Å; F342-A459 HydrophobicContact CE1-CB 4.26Å
343	P	70.4	Confident	66.9	Low	16 Å²	16	59.4 Å²	59.4	10%	0.104	32%	0.32	C	S	.	.			trans	-58.3	154.5	164.7	-19.9	31.9	0	0	0	111.7	L346 A463	P343-L346 HydrophobicContact CB-CB 4.27Å; P343-A463 HydrophobicContact CB-CB 3.64Å; P343-A463 HydrophobicContact CG-CB 4.32Å
344	Q	70.7	Confident	69.6	Low	108 Å²	108	61.3 Å²	61.3	51%	0.505	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-42.8	-175.3	-175.2	178.9	-10.5	0	0	113.1	L346	Q344-L346 VanDerWaalsContact C-N 3.27Å; Q344-L346 PolarHBondContact O-N 3.49Å
345	N	81.3	Confident	72.3	Confident	56 Å²	56	53.2 Å²	53.2	30%	0.299	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	39.8	-173.4	-58.6	-21.6	0	0	0	110.6	G466 S468 G469	N345-G466 PolarHBondContact ND2-O 3.2Å; N345-S468 CarbonylContact O-C 3.58Å; N345-S468 VanDerWaalsContact O-CA 3.31Å; N345-S468 WeakPolarHBondContact O-CA 3.35Å; N345-G469 PolarHBondContact O-N 3.35Å
346	L	84.7	Confident	75	Confident	17 Å²	17	49.4 Å²	49.4	9%	0.089	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	118.3	179.7	-178	72.9	0	0	0	109.3	F342 P343 Q344 E348 A459 T462 A463 G469 I471	F342-L346 HydrophobicContact CD1-CD2 4.49Å; P343-L346 HydrophobicContact CB-CB 4.27Å; Q344-L346 VanDerWaalsContact C-N 3.27Å; Q344-L346 PolarHBondContact O-N 3.49Å; L346-E348 HydrophobicContact CD2-CG 3.73Å; L346-E348 HydrophobicContact CG-CG 3.9Å; L346-A459 HydrophobicContact CD2-CB 3.58Å; L346-T462 HydrophobicContact CD1-CG2 3.4Å; L346-A463 HydrophobicContact CB-CB 4.22Å; L346-A463 HydrophobicContact CD1-CB 4.27Å; L346-G469 WeakPolarHBondContact CA-O 3.46Å; L346-I471 HydrophobicContact CD1-CB 4.29Å; L346-I471 HydrophobicContact CD1-CG2 3.91Å; L346-I471 HydrophobicContact CD2-CG2 4.08Å; L346-I471 HydrophobicContact CG-CG2 4.04Å
347	D	88.3	Confident	77.4	Confident	69 Å²	69	52.4 Å²	52.4	37%	0.369	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	112.3	168.6	-77.3	-44.9	0	0	0	109.6	G469 I470 I471 R497	D347-G469 PolarHBondContact N-O 3.37Å; D347-I470 HydrophobicContact CB-CG1 4.34Å; D347-I471 PolarHBondContact O-N 2.99Å; D347-R497 IonicContact OD1-CZ 3.99Å; D347-R497 IonicContact OD1-NH2 2.9Å; D347-R497 PolarHBondContact OD1-NH2 2.86Å
348	E	90.5	Very high	80	Confident	19 Å²	19	47.8 Å²	47.8	9%	0.089	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	113.9	-178.2	-56.4	-177	-114.7	0	0	110.2	L346 Y455 I471 R495 L496 R497	L346-E348 HydrophobicContact CD2-CG 3.73Å; L346-E348 HydrophobicContact CG-CG 3.9Å; E348-Y455 WeakPolarHBondContact OE2-CE1 3.48Å; E348-Y455 PolarHBondContact OE2-OH 2.96Å; E348-I471 HydrophobicContact CB-CG2 4.24Å; E348-I471 HydrophobicContact CG-CG2 4.04Å; E348-R495 IonicContact OE1-CZ 3.73Å; E348-R495 IonicContact OE1-NE 3.08Å; E348-R495 PolarHBondContact OE1-NE 2.74Å; E348-R495 IonicContact OE1-NH2 2.67Å; E348-R495 PolarHBondContact OE1-NH2 2.92Å; E348-R495 IonicContact OE2-NE 3.7Å; E348-L496 HydrophobicContact CB-CD2 3.9Å; E348-R497 PolarHBondContact O-N 2.86Å; E348-R497 VanDerWaalsContact O-N 3.1Å
349	L	92.5	Very high	82.2	Confident	18 Å²	18	44.2 Å²	44.2	9%	0.094	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	156.4	-170.8	-56.6	173.3	0	0	0	111.6	I470 I471 I472 T473 R497 F499	L349-I470 HydrophobicContact CD1-CG2 3.8Å; L349-I471 PolarHBondContact N-O 3.39Å; L349-I472 HydrophobicContact CB-CG1 4.15Å; L349-I472 HydrophobicContact CD1-CG1 4.36Å; L349-I472 WeakPolarHBondContact O-CA 3.49Å; L349-T473 PolarHBondContact O-N 3.49Å; L349-R497 CarbonylContact C-O 3.6Å; L349-R497 WeakPolarHBondContact CA-O 3.43Å; L349-R497 HydrophobicContact CD2-CB 3.93Å; L349-F499 HydrophobicContact CB-CB 4.18Å; L349-F499 HydrophobicContact CD1-CD2 3.52Å; L349-F499 HydrophobicContact CD1-CE2 4.15Å; L349-F499 HydrophobicContact CD1-CG 4.38Å
350	F	91	Very high	84	Confident	35 Å²	35	41 Å²	41	15%	0.154	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	152.3	170.4	77.9	-84.2	0	0	0	112.6	D352 T473 M475 L496 R497 P498 F499	F350-D352 HydrophobicContact CE2-CB 4.39Å; F350-T473 CarbonylContact C-O 3.56Å; F350-T473 VanDerWaalsContact CA-O 3.23Å; F350-T473 WeakPolarHBondContact CA-O 3.3Å; F350-M475 HydrophobicContact CB-CE 3.76Å; F350-M475 HydrophobicContact CB-CG 4.36Å; F350-M475 HydrophobicContact CB-SD 3.89Å; F350-M475 HydrophobicContact CD2-CG 4.01Å; F350-M475 HydrophobicContact CD2-SD 3.64Å; F350-M475 HydrophobicContact CE2-SD 4.42Å; F350-M475 HydrophobicContact CG-CE 4.38Å; F350-M475 HydrophobicContact CG-SD 3.92Å; F350-L496 HydrophobicContact CB-CB 4.01Å; F350-L496 HydrophobicContact CB-CD1 3.99Å; F350-L496 HydrophobicContact CD1-CB 3.55Å; F350-L496 HydrophobicContact CE1-CB 4.46Å; F350-L496 WeakPolarHBondContact CE1-O 3.34Å; F350-L496 HydrophobicContact CG-CB 4.18Å; F350-R497 VanDerWaalsContact CD1-C 3.48Å; F350-R497 VanDerWaalsContact CD1-O 3.3Å; F350-R497 WeakPolarHBondContact CD1-O 3.45Å; F350-R497 PolarHBondContact N-O 3.43Å; F350-P498 HydrophobicContact CE1-CB 3.97Å; F350-P498 HydrophobicContact CZ-CB 3.99Å; F350-F499 WeakPolarHBondContact O-CB 3.46Å; F350-F499 PolarHBondContact O-N 3.16Å
351	I	90.5	Very high	85.6	Confident	8 Å²	8	40 Å²	40	4%	0.041	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.1	168.5	-62.1	170.9	0	0	0	107.4	V361 L365 I472 T473 L474 M475 F499 F501	I351-V361 HydrophobicContact CD1-CG1 3.78Å; I351-V361 HydrophobicContact CG2-CG1 4.15Å; I351-L365 HydrophobicContact CD1-CD1 4Å; I351-L365 HydrophobicContact CD1-CD2 4.07Å; I351-L365 HydrophobicContact CD1-CG 4.37Å; I351-I472 HydrophobicContact CD1-CG2 3.68Å; I351-I472 HydrophobicContact CG1-CG2 3.82Å; I351-T473 PolarHBondContact N-O 2.85Å; I351-L474 HydrophobicContact CB-CD2 3.88Å; I351-L474 HydrophobicContact CD1-CD2 4.1Å; I351-L474 HydrophobicContact CG1-CD2 4.43Å; I351-M475 PolarHBondContact O-N 3.29Å; I351-M475 VanDerWaalsContact O-N 3.1Å; I351-F499 HydrophobicContact CD1-CB 4.49Å; I351-F499 HydrophobicContact CD1-CD1 3.69Å; I351-F499 HydrophobicContact CD1-CE1 4.43Å; I351-F499 HydrophobicContact CD1-CG 4.47Å; I351-F499 HydrophobicContact CG1-CB 3.8Å; I351-F499 HydrophobicContact CG1-CD1 3.9Å; I351-F499 HydrophobicContact CG1-CG 4.29Å; I351-F501 HydrophobicContact CD1-CB 4.32Å; I351-F501 HydrophobicContact CD1-CD2 3.98Å; I351-F501 HydrophobicContact CD1-CG 4.23Å; I351-F501 HydrophobicContact CG1-CB 4.49Å
352	D	87.7	Confident	87	Confident	67 Å²	67	39.7 Å²	39.7	36%	0.358	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	121.2	171.9	-174.5	19.6	0	0	0	110.7	F350 M475 K480	F350-D352 HydrophobicContact CE2-CB 4.39Å; D352-M475 CarbonylContact C-O 3.53Å; D352-M475 VanDerWaalsContact CA-O 3.29Å; D352-M475 WeakPolarHBondContact CA-O 3.33Å; D352-K480 VanDerWaalsContact CG-CE 3.45Å; D352-K480 IonicContact OD1-NZ 3.88Å; D352-K480 IonicContact OD2-NZ 2.8Å; D352-K480 PolarHBondContact OD2-NZ 3.25Å
353	C	87.8	Confident	88	Confident	15 Å²	15	40.7 Å²	40.7	10%	0.101	21%	0.209	C	C	.	.			trans	-158	149.3	179	56.8	0	0	0	0	112.5	V361 M475 S476	C353-V361 HydrophobicContact CB-CG2 4.12Å; C353-M475 PolarHBondContact N-O 3Å; C353-S476 WeakPolarHBondContact O-CA 3.36Å
354	E	87.9	Confident	89.1	Confident	100 Å²	100	40.5 Å²	40.5	47%	0.467	21%	0.207	S	C	.	.			trans	-59.4	143.6	172.2	-65.9	176.5	158.4	0	0	111	T356 R357 K358	E354-T356 PolarHBondContact O-N 3.28Å; E354-T356 VanDerWaalsContact O-N 3.07Å; E354-R357 HydrophobicContact CB-CG 4.3Å; E354-R357 PolarHBondContact O-N 2.93Å; E354-R357 IonicContact OE2-CZ 2.91Å; E354-R357 IonicContact OE2-NE 2.69Å; E354-R357 PolarHBondContact OE2-NE 2.98Å; E354-R357 IonicContact OE2-NH2 2.75Å; E354-R357 PolarHBondContact OE2-NH2 3.24Å; E354-K358 PolarHBondContact O-N 2.7Å
355	P	87.4	Confident	90.1	Very high	74 Å²	74	35.3 Å²	35.3	48%	0.481	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-33.8	179.6	-27.6	35.3	0	0	0	113.9	R357 K358	P355-R357 PolarHBondContact O-N 3.13Å; P355-K358 PolarHBondContact O-N 3.22Å
356	T	87.8	Confident	90.7	Very high	98 Å²	98	32.8 Å²	32.8	60%	0.601	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-23.2	178.2	55.6	0	0	0	0	113.4	E354 Y513	E354-T356 PolarHBondContact O-N 3.28Å; E354-T356 VanDerWaalsContact O-N 3.07Å; T356-Y513 PolarHBondContact O-OH 3.45Å
357	R	89.2	Confident	91	Very high	109 Å²	109	34.1 Å²	34.1	41%	0.411	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-15.7	-178.6	-58.5	-176.2	-164.9	-160.5	1.1	113.1	E354 P355 P359 L360 V361	E354-R357 HydrophobicContact CB-CG 4.3Å; E354-R357 PolarHBondContact O-N 2.93Å; E354-R357 IonicContact OE2-CZ 2.91Å; E354-R357 IonicContact OE2-NE 2.69Å; E354-R357 PolarHBondContact OE2-NE 2.98Å; E354-R357 IonicContact OE2-NH2 2.75Å; E354-R357 PolarHBondContact OE2-NH2 3.24Å; P355-R357 PolarHBondContact O-N 3.13Å; R357-P359 VanDerWaalsContact C-CD 3.45Å; R357-P359 VanDerWaalsContact C-N 3.33Å; R357-L360 WeakPolarHBondContact O-CB 3.47Å; R357-L360 PolarHBondContact O-N 2.81Å; R357-V361 PolarHBondContact O-N 2.92Å
358	K	92.6	Very high	91	Very high	3 Å²	3	37.4 Å²	37.4	1%	0.013	19%	0.187	C	C	.	.	H	α-helix	trans	-47.2	-46.8	179.1	-71.2	-175.3	177.8	-170.8	0	113.2	E354 P355 L360 V361 V362 Y446 L474 E479	E354-K358 PolarHBondContact O-N 2.7Å; P355-K358 PolarHBondContact O-N 3.22Å; K358-L360 VanDerWaalsContact C-N 3.29Å; K358-L360 PolarHBondContact O-N 2.82Å; K358-V361 WeakPolarHBondContact O-CB 3.34Å; K358-V361 PolarHBondContact O-N 2.9Å; K358-V362 WeakPolarHBondContact O-CG2 3.33Å; K358-V362 PolarHBondContact O-N 2.8Å; K358-Y446 HydrophobicContact CB-CD2 4.06Å; K358-Y446 HydrophobicContact CB-CE2 3.45Å; K358-Y446 VanDerWaalsContact CB-CE2 3.45Å; K358-Y446 PolarHBondContact NZ-O 2.83Å; K358-L474 HydrophobicContact CB-CD1 4.06Å; K358-L474 HydrophobicContact CD-CB 4.21Å; K358-L474 HydrophobicContact CG-CB 4.22Å; K358-L474 HydrophobicContact CG-CD1 4.28Å; K358-L474 PolarHBondContact NZ-O 3.21Å; K358-E479 VanDerWaalsContact NZ-CD 3.34Å; K358-E479 IonicContact NZ-OE1 2.78Å; K358-E479 PolarHBondContact NZ-OE1 2.94Å; K358-E479 IonicContact NZ-OE2 2.98Å; K358-E479 PolarHBondContact NZ-OE2 3.32Å
359	P	94	Very high	91.1	Very high	12 Å²	12	38.5 Å²	38.5	8%	0.078	19%	0.192	C	C	.	.	H	α-helix	trans	-64.2	-33.8	-179.3	-20.8	32.4	0	0	0	113.5	R357 V362 Y363 L387 L390 Y446 Y513	R357-P359 VanDerWaalsContact C-CD 3.45Å; R357-P359 VanDerWaalsContact C-N 3.33Å; P359-V362 PolarHBondContact O-N 2.86Å; P359-Y363 PolarHBondContact O-N 2.84Å; P359-L387 HydrophobicContact CB-CD1 3.86Å; P359-L390 HydrophobicContact CB-CD2 3.69Å; P359-L390 HydrophobicContact CG-CD2 4.28Å; P359-Y446 HydrophobicContact CG-CE2 4.06Å; P359-Y513 HydrophobicContact CB-CE2 3.99Å
360	L	92.2	Very high	90.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-70.1	-39.4	176.2	-171.7	59.9	0	0	0	111.6	R357 K358 V362 Y363 C364 M394 L506 M510 Y513	R357-L360 WeakPolarHBondContact O-CB 3.47Å; R357-L360 PolarHBondContact O-N 2.81Å; K358-L360 VanDerWaalsContact C-N 3.29Å; K358-L360 PolarHBondContact O-N 2.82Å; L360-V362 VanDerWaalsContact C-N 3.33Å; L360-V362 PolarHBondContact O-N 3.48Å; L360-Y363 HydrophobicContact CD1-CD1 4.38Å; L360-Y363 WeakPolarHBondContact O-CB 3.43Å; L360-Y363 PolarHBondContact O-N 2.6Å; L360-C364 PolarHBondContact O-N 3.1Å; L360-C364 PolarHBondContact O-SG 3.13Å; L360-M394 HydrophobicContact CD1-CE 3.85Å; L360-L506 HydrophobicContact CB-CD2 4.21Å; L360-L506 HydrophobicContact CD2-CB 3.92Å; L360-L506 HydrophobicContact CD2-CD2 3.86Å; L360-L506 HydrophobicContact CD2-CG 4.46Å; L360-L506 HydrophobicContact CG-CD2 3.64Å; L360-M510 HydrophobicContact CD2-CG 4.02Å; L360-M510 HydrophobicContact CD2-SD 3.31Å; L360-M510 WeakPolarHBondContact CD2-SD 3.47Å; L360-Y513 HydrophobicContact CB-CD1 4.45Å; L360-Y513 HydrophobicContact CB-CD2 4.25Å; L360-Y513 HydrophobicContact CB-CE1 4.49Å; L360-Y513 HydrophobicContact CB-CE2 4.3Å; L360-Y513 HydrophobicContact CB-CG 4.32Å; L360-Y513 HydrophobicContact CD1-CD2 4.16Å; L360-Y513 HydrophobicContact CD1-CG 3.98Å; L360-Y513 HydrophobicContact CD2-CD1 4.3Å; L360-Y513 HydrophobicContact CD2-CG 4.4Å; L360-Y513 HydrophobicContact CG-CG 4.48Å
361	V	93.2	Very high	90.4	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-45.1	172.5	176.2	0	0	0	0	110.3	I351 C353 R357 K358 Y363 C364 L365 L474 F501 L506	I351-V361 HydrophobicContact CD1-CG1 3.78Å; I351-V361 HydrophobicContact CG2-CG1 4.15Å; C353-V361 HydrophobicContact CB-CG2 4.12Å; R357-V361 PolarHBondContact O-N 2.92Å; K358-V361 WeakPolarHBondContact O-CB 3.34Å; K358-V361 PolarHBondContact O-N 2.9Å; V361-Y363 VanDerWaalsContact C-N 3.34Å; V361-Y363 PolarHBondContact O-N 3.18Å; V361-C364 PolarHBondContact O-N 3.02Å; V361-L365 HydrophobicContact CG1-CD1 4.16Å; V361-L365 HydrophobicContact CG1-CG 4.38Å; V361-L365 WeakPolarHBondContact O-CG 3.3Å; V361-L365 PolarHBondContact O-N 3Å; V361-L474 HydrophobicContact CG1-CD1 4.42Å; V361-L474 HydrophobicContact CG1-CD2 3.73Å; V361-F501 HydrophobicContact CG1-CE2 4.34Å; V361-F501 HydrophobicContact CG1-CZ 4.25Å; V361-F501 HydrophobicContact CG2-CE1 4.39Å; V361-L506 HydrophobicContact CG2-CD2 4.05Å
362	V	94.7	Very high	90.2	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-56.9	-48.5	174.3	177	0	0	0	0	110.8	K358 P359 L360 C364 L365 L366 L391 I444 Y446 L474	K358-V362 WeakPolarHBondContact O-CG2 3.33Å; K358-V362 PolarHBondContact O-N 2.8Å; P359-V362 PolarHBondContact O-N 2.86Å; L360-V362 VanDerWaalsContact C-N 3.33Å; L360-V362 PolarHBondContact O-N 3.48Å; V362-C364 VanDerWaalsContact C-N 3.31Å; V362-C364 PolarHBondContact O-N 3.08Å; V362-L365 PolarHBondContact O-N 3.29Å; V362-L365 VanDerWaalsContact O-N 3.17Å; V362-L366 HydrophobicContact CG1-CD1 4.42Å; V362-L366 HydrophobicContact CG1-CG 4.3Å; V362-L366 WeakPolarHBondContact O-CG 3.35Å; V362-L366 PolarHBondContact O-N 2.9Å; V362-L391 HydrophobicContact CG1-CD1 3.95Å; V362-L391 HydrophobicContact CG1-CD2 4.34Å; V362-I444 HydrophobicContact CG1-CD1 4.38Å; V362-I444 HydrophobicContact CG2-CG2 4.27Å; V362-Y446 HydrophobicContact CG2-CD2 3.78Å; V362-Y446 HydrophobicContact CG2-CE2 4.46Å; V362-L474 HydrophobicContact CG2-CD1 3.7Å
363	Y	94	Very high	90.4	Very high	29 Å²	29	52.6 Å²	52.6	11%	0.114	26%	0.256	C	S	.	.	H	α-helix	trans	-56.2	-43.6	177.9	171.6	-91.5	0	0	0	112.9	P359 L360 V361 L366 S367 L391 M394 K396 S509	P359-Y363 PolarHBondContact O-N 2.84Å; L360-Y363 HydrophobicContact CD1-CD1 4.38Å; L360-Y363 WeakPolarHBondContact O-CB 3.43Å; L360-Y363 PolarHBondContact O-N 2.6Å; V361-Y363 VanDerWaalsContact C-N 3.34Å; V361-Y363 PolarHBondContact O-N 3.18Å; Y363-L366 PolarHBondContact O-N 3.03Å; Y363-S367 PolarHBondContact O-N 2.5Å; Y363-S367 VanDerWaalsContact O-N 3.16Å; Y363-S367 PolarHBondContact O-OG 2.85Å; Y363-L391 HydrophobicContact CD2-CD2 4.41Å; Y363-M394 HydrophobicContact CD1-CE 3.9Å; Y363-M394 HydrophobicContact CD2-CB 3.82Å; Y363-M394 HydrophobicContact CD2-CE 3.68Å; Y363-M394 HydrophobicContact CD2-SD 4.2Å; Y363-M394 HydrophobicContact CE1-CE 4.27Å; Y363-M394 HydrophobicContact CE2-CB 3.76Å; Y363-M394 HydrophobicContact CE2-CE 4.06Å; Y363-M394 WeakPolarHBondContact CE2-O 3.48Å; Y363-M394 HydrophobicContact CG-CE 3.6Å; Y363-M394 HydrophobicContact CG-SD 4.4Å; Y363-K396 HydrophobicContact CD2-CD 4.31Å; Y363-K396 HydrophobicContact CD2-CG 3.65Å; Y363-K396 HydrophobicContact CE2-CD 4.07Å; Y363-K396 HydrophobicContact CE2-CG 3.72Å; Y363-S509 WeakPolarHBondContact CE1-OG 3.42Å
364	C	92.1	Very high	90.7	Very high	11 Å²	11	51.9 Å²	51.9	7%	0.074	25%	0.251	C	S	.	.	H	α-helix	trans	-67.3	-40.8	177.1	-70.5	0	0	0	0	111.9	L360 V361 V362 L366 S367 R368 F501	L360-C364 PolarHBondContact O-N 3.1Å; L360-C364 PolarHBondContact O-SG 3.13Å; V361-C364 PolarHBondContact O-N 3.02Å; V362-C364 VanDerWaalsContact C-N 3.31Å; V362-C364 PolarHBondContact O-N 3.08Å; C364-L366 VanDerWaalsContact C-N 3.33Å; C364-L366 PolarHBondContact O-N 3.35Å; C364-S367 WeakPolarHBondContact O-CB 3.41Å; C364-S367 PolarHBondContact O-N 3.47Å; C364-R368 PolarHBondContact O-N 2.89Å; C364-F501 HydrophobicContact CB-CE2 3.85Å; C364-F501 HydrophobicContact CB-CZ 3.47Å; C364-F501 VanDerWaalsContact CB-CZ 3.47Å
365	L	93.2	Very high	91	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.7	-41.7	173.4	-70.1	174.9	0	0	0	111.8	I351 V361 V362 S367 R368 F369 I444 I472 L474 F499 F501	I351-L365 HydrophobicContact CD1-CD1 4Å; I351-L365 HydrophobicContact CD1-CD2 4.07Å; I351-L365 HydrophobicContact CD1-CG 4.37Å; V361-L365 HydrophobicContact CG1-CD1 4.16Å; V361-L365 HydrophobicContact CG1-CG 4.38Å; V361-L365 WeakPolarHBondContact O-CG 3.3Å; V361-L365 PolarHBondContact O-N 3Å; V362-L365 PolarHBondContact O-N 3.29Å; V362-L365 VanDerWaalsContact O-N 3.17Å; L365-S367 PolarHBondContact O-N 3.48Å; L365-R368 PolarHBondContact O-N 2.86Å; L365-F369 HydrophobicContact CD2-CD2 4.35Å; L365-F369 HydrophobicContact CD2-CE2 4.02Å; L365-F369 WeakPolarHBondContact O-CB 3.1Å; L365-F369 WeakPolarHBondContact O-CD2 3.17Å; L365-F369 PolarHBondContact O-N 2.62Å; L365-I444 HydrophobicContact CB-CD1 4.02Å; L365-I444 HydrophobicContact CD1-CD1 3.94Å; L365-I444 HydrophobicContact CD1-CG1 4.34Å; L365-I472 HydrophobicContact CD1-CD1 4.27Å; L365-I472 HydrophobicContact CD1-CG2 4.2Å; L365-I472 HydrophobicContact CD2-CD1 3.82Å; L365-L474 HydrophobicContact CD1-CD2 4.49Å; L365-F499 HydrophobicContact CD2-CE1 3.94Å; L365-F501 HydrophobicContact CD2-CD2 4.27Å; L365-F501 HydrophobicContact CD2-CE2 4.2Å; L365-F501 HydrophobicContact CG-CE2 4.37Å
366	L	92.8	Very high	91.3	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-27.8	174.3	-65.7	-174.4	0	0	0	112.8	V362 Y363 C364 I374 L391 K396 V398 A424	V362-L366 HydrophobicContact CG1-CD1 4.42Å; V362-L366 HydrophobicContact CG1-CG 4.3Å; V362-L366 WeakPolarHBondContact O-CG 3.35Å; V362-L366 PolarHBondContact O-N 2.9Å; Y363-L366 PolarHBondContact O-N 3.03Å; C364-L366 VanDerWaalsContact C-N 3.33Å; C364-L366 PolarHBondContact O-N 3.35Å; L366-I374 HydrophobicContact CD2-CB 4.07Å; L366-I374 HydrophobicContact CD2-CD1 3.44Å; L366-I374 VanDerWaalsContact CD2-CD1 3.44Å; L366-I374 HydrophobicContact CD2-CG1 4.3Å; L366-I374 HydrophobicContact CD2-CG2 3.93Å; L366-L391 HydrophobicContact CD1-CD1 4.05Å; L366-L391 HydrophobicContact CD1-CD2 4.13Å; L366-K396 HydrophobicContact CB-CD 4.41Å; L366-K396 HydrophobicContact CD1-CB 4.23Å; L366-K396 HydrophobicContact CD1-CG 4.15Å; L366-V398 HydrophobicContact CD1-CG1 3.84Å; L366-A424 HydrophobicContact CD1-CB 4.4Å; L366-A424 HydrophobicContact CD2-CB 3.54Å
367	S	90.9	Very high	91.6	Very high	44 Å²	44	39.2 Å²	39.2	31%	0.308	18%	0.179	S	C	.	.	H	α-helix	trans	-82.1	-40.6	177	-51.3	0	0	0	0	111.6	Y363 C364 L365 F369 K396	Y363-S367 PolarHBondContact O-N 2.5Å; Y363-S367 VanDerWaalsContact O-N 3.16Å; Y363-S367 PolarHBondContact O-OG 2.85Å; C364-S367 WeakPolarHBondContact O-CB 3.41Å; C364-S367 PolarHBondContact O-N 3.47Å; L365-S367 PolarHBondContact O-N 3.48Å; S367-F369 VanDerWaalsContact C-N 3.34Å; S367-K396 WeakPolarHBondContact OG-CE 3.33Å; S367-K396 PolarHBondContact OG-NZ 2.92Å
368	R	89.9	Confident	91.8	Very high	139 Å²	139	34 Å²	34	53%	0.525	16%	0.159	S	C	.	.	H	α-helix	trans	-69.4	-32.9	178.9	-174.6	166.2	-179.9	162.4	-5.7	112.7	C364 L365 D500	C364-R368 PolarHBondContact O-N 2.89Å; L365-R368 PolarHBondContact O-N 2.86Å; R368-D500 PolarHBondContact NH1-O 3.12Å
369	F	90.6	Very high	91.5	Very high	42 Å²	42	37.5 Å²	37.5	18%	0.184	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	40.5	179.2	-66.4	-86.9	0	0	0	111.7	L365 S367 H371 A372 I374 L442 I470 I472 F499	L365-F369 HydrophobicContact CD2-CD2 4.35Å; L365-F369 HydrophobicContact CD2-CE2 4.02Å; L365-F369 WeakPolarHBondContact O-CB 3.1Å; L365-F369 WeakPolarHBondContact O-CD2 3.17Å; L365-F369 PolarHBondContact O-N 2.62Å; S367-F369 VanDerWaalsContact C-N 3.34Å; F369-H371 PolarHBondContact O-N 2.66Å; F369-H371 VanDerWaalsContact O-N 3.1Å; F369-A372 HydrophobicContact CB-CB 4.03Å; F369-A372 WeakPolarHBondContact O-CB 3.28Å; F369-A372 PolarHBondContact O-N 2.95Å; F369-I374 HydrophobicContact CB-CD1 3.91Å; F369-L442 HydrophobicContact CB-CD2 4.18Å; F369-L442 HydrophobicContact CD1-CD2 4.47Å; F369-L442 HydrophobicContact CD2-CD2 3.64Å; F369-L442 HydrophobicContact CE2-CD2 4.08Å; F369-L442 HydrophobicContact CG-CD2 3.86Å; F369-I470 HydrophobicContact CE1-CD1 3.95Å; F369-I470 HydrophobicContact CZ-CD1 4.41Å; F369-I472 HydrophobicContact CE2-CD1 4.26Å; F369-F499 HydrophobicContact CE2-CZ 4.09Å; F369-F499 HydrophobicContact CZ-CE2 4.44Å; F369-F499 HydrophobicContact CZ-CZ 4.14Å
370	E	85.4	Confident	91.2	Very high	135 Å²	135	39.4 Å²	39.4	63%	0.631	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-28.8	-174	-174.8	170.6	-163.2	0	0	114.1
371	H	84.3	Confident	90.9	Very high	191 Å²	191	41.8 Å²	41.8	88%	0.884	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-5.3	177.9	-55.3	-47.7	0	0	0	114.1	F369	F369-H371 PolarHBondContact O-N 2.66Å; F369-H371 VanDerWaalsContact O-N 3.1Å
372	A	87	Confident	90.7	Very high	23 Å²	23	49.9 Å²	49.9	19%	0.19	23%	0.23	C	C	.	.	S	Bend	trans	-91.4	147.2	178.8	0	0	0	0	0	110.9	F369 I374	F369-A372 HydrophobicContact CB-CB 4.03Å; F369-A372 WeakPolarHBondContact O-CB 3.28Å; F369-A372 PolarHBondContact O-N 2.95Å; A372-I374 HydrophobicContact CB-CG1 4.25Å
373	R	91.3	Very high	90.6	Very high	75 Å²	75	53 Å²	53	28%	0.283	24%	0.244	S	C	.	.			trans	-83	121.1	165.3	-70.4	173.1	-73.2	145.3	1.4	108.6	L417 D438 D439 L440 G441 L442	R373-L417 HydrophobicContact CB-CD1 4.33Å; R373-L417 HydrophobicContact CB-CD2 4.5Å; R373-L417 HydrophobicContact CB-CG 4.35Å; R373-L417 HydrophobicContact CG-CD1 4.4Å; R373-L417 HydrophobicContact CG-CG 4.33Å; R373-D438 VanDerWaalsContact NH1-C 3.35Å; R373-D438 PolarHBondContact NH1-O 3.38Å; R373-D439 PolarHBondContact NH2-O 2.82Å; R373-L440 HydrophobicContact CB-CD2 4Å; R373-G441 PolarHBondContact O-N 2.82Å; R373-L442 PolarHBondContact O-N 2.89Å
374	I	94.2	Very high	90.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	135.2	-168.8	-54.3	176.3	0	0	0	110.6	L366 F369 A372 S423 A424 I425 L442 I444	L366-I374 HydrophobicContact CD2-CB 4.07Å; L366-I374 HydrophobicContact CD2-CD1 3.44Å; L366-I374 VanDerWaalsContact CD2-CD1 3.44Å; L366-I374 HydrophobicContact CD2-CG1 4.3Å; L366-I374 HydrophobicContact CD2-CG2 3.93Å; F369-I374 HydrophobicContact CB-CD1 3.91Å; A372-I374 HydrophobicContact CB-CG1 4.25Å; I374-S423 PolarHBondContact N-O 3.3Å; I374-A424 HydrophobicContact CB-CB 3.86Å; I374-A424 HydrophobicContact CG2-CB 4.25Å; I374-A424 CarbonylContact O-C 3.56Å; I374-A424 WeakPolarHBondContact O-CA 3.28Å; I374-I425 PolarHBondContact O-N 3.36Å; I374-L442 WeakPolarHBondContact CA-O 3.27Å; I374-L442 HydrophobicContact CD1-CD2 4.18Å; I374-L442 HydrophobicContact CG1-CB 4.21Å; I374-L442 HydrophobicContact CG1-CD2 4.36Å; I374-L442 HydrophobicContact CG2-CD2 4.3Å; I374-L442 HydrophobicContact CG2-CG 4.35Å; I374-I444 HydrophobicContact CG2-CD1 3.67Å; I374-I444 HydrophobicContact CG2-CG1 3.98Å
375	L	93.7	Very high	90.5	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	124.5	170.2	-175.7	69.8	0	0	0	109.7	F377 I425 A432 F437 L440 L442 V443 I444 R461	L375-F377 HydrophobicContact CD2-CD2 4.44Å; L375-F377 HydrophobicContact CD2-CE1 4.35Å; L375-F377 HydrophobicContact CD2-CE2 3.58Å; L375-F377 HydrophobicContact CD2-CZ 3.54Å; L375-F377 HydrophobicContact CG-CE2 4.12Å; L375-F377 HydrophobicContact CG-CZ 4.34Å; L375-I425 HydrophobicContact CD1-CB 4.01Å; L375-I425 HydrophobicContact CD1-CG2 3.99Å; L375-A432 HydrophobicContact CD2-CB 4.38Å; L375-F437 HydrophobicContact CD1-CD1 4.41Å; L375-F437 HydrophobicContact CD1-CD2 4.4Å; L375-F437 HydrophobicContact CD1-CE1 3.81Å; L375-F437 HydrophobicContact CD1-CE2 3.8Å; L375-F437 HydrophobicContact CD1-CZ 3.46Å; L375-F437 VanDerWaalsContact CD1-CZ 3.46Å; L375-F437 HydrophobicContact CD2-CD2 3.71Å; L375-F437 HydrophobicContact CD2-CE2 3.51Å; L375-F437 HydrophobicContact CD2-CG 4.44Å; L375-F437 HydrophobicContact CD2-CZ 4.09Å; L375-F437 HydrophobicContact CG-CE2 4.32Å; L375-F437 HydrophobicContact CG-CZ 4.44Å; L375-L440 HydrophobicContact CB-CD1 3.46Å; L375-L440 VanDerWaalsContact CB-CD1 3.46Å; L375-L440 HydrophobicContact CB-CD2 4.32Å; L375-L440 HydrophobicContact CB-CG 4.47Å; L375-L440 HydrophobicContact CD2-CD1 3.71Å; L375-L440 HydrophobicContact CG-CD1 4.19Å; L375-L442 PolarHBondContact N-O 3.12Å; L375-L442 VanDerWaalsContact N-O 3.07Å; L375-V443 CarbonylContact O-C 3.53Å; L375-V443 WeakPolarHBondContact O-CA 3.36Å; L375-I444 PolarHBondContact O-N 3.33Å; L375-R461 HydrophobicContact CD2-CB 4.06Å; L375-R461 HydrophobicContact CD2-CG 3.87Å
376	C	95	Very high	90.5	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.014	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.7	179.8	-173.5	0	0	0	0	110.6	I425 V426 C427 I444	C376-I425 PolarHBondContact N-O 3.32Å; C376-V426 HydrophobicContact CB-CG2 4.3Å; C376-V426 WeakPolarHBondContact O-CA 3.29Å; C376-C427 PolarHBondContact O-N 3Å; C376-I444 CarbonylContact C-O 3.55Å; C376-I444 VanDerWaalsContact CA-O 3.32Å; C376-I444 WeakPolarHBondContact CA-O 3.43Å; C376-I444 HydrophobicContact CB-CB 4.34Å
377	F	93.5	Very high	90.6	Very high	4 Å²	4	60.3 Å²	60.3	2%	0.018	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128.2	-179.7	-75.6	-75.2	0	0	0	111.6	L375 C427 Q429 A432 V443 I444 Y446 D447 M458 R461	L375-F377 HydrophobicContact CD2-CD2 4.44Å; L375-F377 HydrophobicContact CD2-CE1 4.35Å; L375-F377 HydrophobicContact CD2-CE2 3.58Å; L375-F377 HydrophobicContact CD2-CZ 3.54Å; L375-F377 HydrophobicContact CG-CE2 4.12Å; L375-F377 HydrophobicContact CG-CZ 4.34Å; F377-C427 CarbonylContact C-O 3.58Å; F377-C427 WeakPolarHBondContact CA-O 3.36Å; F377-Q429 HydrophobicContact CB-CG 4.3Å; F377-Q429 HydrophobicContact CD1-CB 4.39Å; F377-Q429 HydrophobicContact CD1-CG 4.05Å; F377-A432 HydrophobicContact CD1-CB 4.18Å; F377-A432 HydrophobicContact CE1-CB 3.22Å; F377-A432 HydrophobicContact CZ-CB 3.73Å; F377-V443 HydrophobicContact CD2-CG1 3.58Å; F377-V443 HydrophobicContact CE2-CG1 3.57Å; F377-I444 PolarHBondContact N-O 3.32Å; F377-Y446 VanDerWaalsContact O-CB 3.27Å; F377-Y446 WeakPolarHBondContact O-CB 3.41Å; F377-Y446 PolarHBondContact O-N 3.05Å; F377-D447 PolarHBondContact O-N 2.85Å; F377-M458 HydrophobicContact CB-SD 3.67Å; F377-M458 HydrophobicContact CD1-CG 4.18Å; F377-M458 HydrophobicContact CD1-SD 4.15Å; F377-M458 HydrophobicContact CD2-CB 3.98Å; F377-M458 HydrophobicContact CD2-CG 3.79Å; F377-M458 HydrophobicContact CD2-SD 3.78Å; F377-M458 HydrophobicContact CE1-CG 4.1Å; F377-M458 HydrophobicContact CE2-CB 3.76Å; F377-M458 HydrophobicContact CE2-CG 3.78Å; F377-M458 HydrophobicContact CE2-SD 4.39Å; F377-M458 HydrophobicContact CG-CG 3.98Å; F377-M458 HydrophobicContact CG-SD 3.63Å; F377-M458 HydrophobicContact CZ-CB 4.22Å; F377-M458 HydrophobicContact CZ-CG 3.92Å; F377-R461 HydrophobicContact CE2-CG 4.04Å; F377-R461 HydrophobicContact CZ-CG 3.72Å
378	T	92.2	Very high	90.8	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	160	171	56.5	0	0	0	0	109.9	T380 H383 S384 L387 V426 C427 T428 Q429 Y446 D447	T378-T380 PolarHBondContact OG1-O 3.25Å; T378-H383 HydrophobicContact CG2-CB 4.15Å; T378-S384 WeakPolarHBondContact OG1-CA 3.07Å; T378-S384 VanDerWaalsContact OG1-CB 3.3Å; T378-S384 WeakPolarHBondContact OG1-CB 3.28Å; T378-S384 PolarHBondContact OG1-N 2.97Å; T378-L387 HydrophobicContact CG2-CD2 4.08Å; T378-V426 HydrophobicContact CG2-CG1 4.03Å; T378-C427 PolarHBondContact N-O 3.35Å; T378-C427 PolarHBondContact OG1-O 3.26Å; T378-T428 VanDerWaalsContact O-CA 3.26Å; T378-T428 WeakPolarHBondContact O-CA 3.34Å; T378-Q429 PolarHBondContact O-N 3.32Å; T378-Y446 HydrophobicContact CG2-CD1 3.84Å; T378-Y446 HydrophobicContact CG2-CG 4.18Å; T378-D447 WeakPolarHBondContact CA-OD2 3.08Å
379	E	86.3	Confident	91	Very high	75 Å²	75	53.4 Å²	53.4	35%	0.35	24%	0.243	S	C	.	.	S	Bend	trans	-77.6	-47.5	178.2	-178.3	179.4	-137.7	0	0	111.1	D447 R450	E379-D447 HydrophobicContact CB-CB 3.77Å; E379-D447 WeakPolarHBondContact CB-OD2 3.23Å; E379-D447 PolarHBondContact N-OD2 2.91Å; E379-R450 IonicContact OE1-CZ 3.44Å; E379-R450 IonicContact OE1-NE 3.63Å; E379-R450 PolarHBondContact OE1-NE 3.15Å; E379-R450 IonicContact OE1-NH2 2.89Å; E379-R450 PolarHBondContact OE1-NH2 3.36Å
380	T	88.1	Confident	91.2	Very high	52 Å²	52	51.8 Å²	51.8	32%	0.319	24%	0.235	S	C	.	.	S	Bend	trans	-112.1	151.2	-174.7	73.2	0	0	0	0	112.2	T378 R382 H383 S384	T378-T380 PolarHBondContact OG1-O 3.25Å; T380-R382 PolarHBondContact O-N 3.05Å; T380-H383 PolarHBondContact O-N 2.7Å; T380-H383 VanDerWaalsContact O-N 3.12Å; T380-H383 PolarHBondContact OG1-CD2 3.47Å; T380-H383 VanDerWaalsContact OG1-CD2 3.26Å; T380-H383 VanDerWaalsContact OG1-CG 3.25Å; T380-H383 PolarHBondContact OG1-N 3Å; T380-H383 VanDerWaalsContact OG1-N 3.13Å; T380-S384 PolarHBondContact O-N 3.23Å
381	L	87.5	Confident	91.7	Very high	51 Å²	51	45.4 Å²	45.4	27%	0.267	21%	0.206	S	C	.	.	H	α-helix	trans	-61.9	-32.5	175	-176.1	67.7	0	0	0	112.1	H383 S384 H385 S402 Y404 T428	L381-H383 VanDerWaalsContact C-N 3.34Å; L381-S384 WeakPolarHBondContact O-CB 3.45Å; L381-S384 PolarHBondContact O-N 3.23Å; L381-H385 WeakPolarHBondContact O-CB 3.28Å; L381-H385 PolarHBondContact O-N 3.44Å; L381-S402 VanDerWaalsContact CD1-CB 3.4Å; L381-Y404 HydrophobicContact CD2-CD2 3.8Å; L381-Y404 HydrophobicContact CD2-CE2 3.18Å; L381-T428 HydrophobicContact CB-CG2 4.25Å; L381-T428 HydrophobicContact CD1-CG2 4.47Å
382	R	89	Confident	92.2	Very high	171 Å²	171	40.9 Å²	40.9	65%	0.645	18%	0.181	S	C	*	.	H	α-helix	trans	-64.9	-39.1	176	-178.6	177.3	-83	-175.1	-3.9	111.5	T380 R386	T380-R382 PolarHBondContact O-N 3.05Å; R382-R386 WeakPolarHBondContact O-CB 3.08Å; R382-R386 VanDerWaalsContact O-CG 3.27Å; R382-R386 WeakPolarHBondContact O-CG 3.49Å; R382-R386 PolarHBondContact O-N 3.01Å; R382-R386 VanDerWaalsContact O-N 3.09Å
383	H	90.8	Very high	92.5	Very high	66 Å²	66	41.8 Å²	41.8	31%	0.306	18%	0.182	S	C	.	.	H	α-helix	trans	-65.8	-46.9	174.2	-72.6	-170	0	0	0	111.1	T378 T380 L381 H385 R386 L387 D447	T378-H383 HydrophobicContact CG2-CB 4.15Å; T380-H383 PolarHBondContact O-N 2.7Å; T380-H383 VanDerWaalsContact O-N 3.12Å; T380-H383 PolarHBondContact OG1-CD2 3.47Å; T380-H383 VanDerWaalsContact OG1-CD2 3.26Å; T380-H383 VanDerWaalsContact OG1-CG 3.25Å; T380-H383 PolarHBondContact OG1-N 3Å; T380-H383 VanDerWaalsContact OG1-N 3.13Å; L381-H383 VanDerWaalsContact C-N 3.34Å; H383-H385 VanDerWaalsContact C-N 3.33Å; H383-H385 PolarHBondContact O-N 2.95Å; H383-R386 PolarHBondContact O-N 3.1Å; H383-L387 VanDerWaalsContact O-CB 3.23Å; H383-L387 WeakPolarHBondContact O-CB 3.1Å; H383-L387 PolarHBondContact O-N 2.89Å; H383-D447 IonicContact CG-OD2 3.95Å; H383-D447 IonicContact ND1-OD1 3.25Å; H383-D447 IonicContact ND1-OD2 3.26Å; H383-D447 PolarHBondContact ND1-OD2 3.22Å; H383-D447 VanDerWaalsContact ND1-OD2 3.09Å
384	S	92.5	Very high	92.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-49.8	-53.6	174.7	175.5	0	0	0	0	111.7	T378 T380 L381 L387 C388 E400	T378-S384 WeakPolarHBondContact OG1-CA 3.07Å; T378-S384 VanDerWaalsContact OG1-CB 3.3Å; T378-S384 WeakPolarHBondContact OG1-CB 3.28Å; T378-S384 PolarHBondContact OG1-N 2.97Å; T380-S384 PolarHBondContact O-N 3.23Å; L381-S384 WeakPolarHBondContact O-CB 3.45Å; L381-S384 PolarHBondContact O-N 3.23Å; S384-L387 PolarHBondContact O-N 2.98Å; S384-C388 VanDerWaalsContact O-CB 3.29Å; S384-C388 WeakPolarHBondContact O-CB 3.43Å; S384-C388 PolarHBondContact O-N 3.11Å; S384-E400 WeakPolarHBondContact CB-OE1 3.47Å; S384-E400 WeakPolarHBondContact OG-CG 3.37Å; S384-E400 PolarHBondContact OG-OE1 3.07Å
385	H	92.5	Very high	92.5	Very high	86 Å²	86	41.3 Å²	41.3	40%	0.398	20%	0.199	S	C	.	.	H	α-helix	trans	-66.4	-47.6	-175.5	-171.5	60.3	0	0	0	112.4	L381 H383 L387 C388 E389 E400	L381-H385 WeakPolarHBondContact O-CB 3.28Å; L381-H385 PolarHBondContact O-N 3.44Å; H383-H385 VanDerWaalsContact C-N 3.33Å; H383-H385 PolarHBondContact O-N 2.95Å; H385-L387 PolarHBondContact O-N 3.14Å; H385-C388 PolarHBondContact O-N 3.43Å; H385-E389 PolarHBondContact O-N 3.03Å; H385-E400 VanDerWaalsContact CA-OE1 3.28Å; H385-E400 WeakPolarHBondContact CA-OE1 3.26Å; H385-E400 IonicContact CE1-OE2 2.84Å; H385-E400 IonicContact CG-OE2 3.86Å; H385-E400 PolarHBondContact N-OE1 3.43Å; H385-E400 VanDerWaalsContact N-OE1 3.1Å; H385-E400 IonicContact ND1-OE2 3.58Å; H385-E400 PolarHBondContact ND1-OE2 2.86Å
386	R	92.8	Very high	92.5	Very high	106 Å²	106	43 Å²	43	40%	0.4	21%	0.206	S	C	.	.	H	α-helix	trans	-60.8	-44.6	178.4	-75.4	176.3	172.9	-179.4	-4.4	112.1	R382 H383 L390	R382-R386 WeakPolarHBondContact O-CB 3.08Å; R382-R386 VanDerWaalsContact O-CG 3.27Å; R382-R386 WeakPolarHBondContact O-CG 3.49Å; R382-R386 PolarHBondContact O-N 3.01Å; R382-R386 VanDerWaalsContact O-N 3.09Å; H383-R386 PolarHBondContact O-N 3.1Å; R386-L390 VanDerWaalsContact O-CB 3.27Å; R386-L390 WeakPolarHBondContact O-CB 3.49Å; R386-L390 PolarHBondContact O-N 3.4Å
387	L	95	Very high	92.4	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-64.1	-44.5	178.3	178.9	60.9	0	0	0	110.7	P359 T378 H383 S384 H385 L390 L391 V426 Y446	P359-L387 HydrophobicContact CB-CD1 3.86Å; T378-L387 HydrophobicContact CG2-CD2 4.08Å; H383-L387 VanDerWaalsContact O-CB 3.23Å; H383-L387 WeakPolarHBondContact O-CB 3.1Å; H383-L387 PolarHBondContact O-N 2.89Å; S384-L387 PolarHBondContact O-N 2.98Å; H385-L387 PolarHBondContact O-N 3.14Å; L387-L390 PolarHBondContact O-N 3.09Å; L387-L391 HydrophobicContact CD1-CD1 3.9Å; L387-L391 HydrophobicContact CD1-CG 4.07Å; L387-L391 HydrophobicContact CG-CD1 3.89Å; L387-L391 HydrophobicContact CG-CG 4.46Å; L387-L391 WeakPolarHBondContact O-CB 3.44Å; L387-L391 WeakPolarHBondContact O-CG 3.35Å; L387-L391 PolarHBondContact O-N 3.31Å; L387-V426 HydrophobicContact CB-CG1 4.49Å; L387-V426 HydrophobicContact CD2-CG1 4.03Å; L387-V426 HydrophobicContact CD2-CG2 4.48Å; L387-V426 HydrophobicContact CG-CG1 4.47Å; L387-Y446 HydrophobicContact CD1-CD2 4.44Å; L387-Y446 HydrophobicContact CD1-CE2 4.16Å; L387-Y446 HydrophobicContact CD2-CD2 3.74Å; L387-Y446 HydrophobicContact CD2-CE2 4.13Å; L387-Y446 HydrophobicContact CD2-CG 3.97Å
388	C	94.9	Very high	92.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-48.6	179.2	-163.8	0	0	0	0	111.9	S384 H385 L390 L391 R392 V398 E400 V426	S384-C388 VanDerWaalsContact O-CB 3.29Å; S384-C388 WeakPolarHBondContact O-CB 3.43Å; S384-C388 PolarHBondContact O-N 3.11Å; H385-C388 PolarHBondContact O-N 3.43Å; C388-L390 PolarHBondContact O-N 2.45Å; C388-L391 PolarHBondContact O-N 3.44Å; C388-R392 WeakPolarHBondContact O-CG 3.43Å; C388-R392 PolarHBondContact O-N 3.01Å; C388-R392 PolarHBondContact SG-NH2 3.13Å; C388-V398 WeakPolarHBondContact O-CG2 3.46Å; C388-E400 HydrophobicContact CB-CB 4.15Å; C388-V426 HydrophobicContact CB-CB 4.35Å; C388-V426 HydrophobicContact CB-CG2 4.31Å
389	E	94	Very high	92.6	Very high	38 Å²	38	49 Å²	49	18%	0.178	24%	0.236	C	C	.	.	H	α-helix	trans	-62.2	-42	176.8	-77	-59.5	118.3	0	0	112.3	H385 L391 R392 L393 L520 K523	H385-E389 PolarHBondContact O-N 3.03Å; E389-L391 PolarHBondContact O-N 2.93Å; E389-R392 PolarHBondContact O-N 3.22Å; E389-R392 IonicContact OE1-CZ 3.17Å; E389-R392 IonicContact OE1-NH1 3.8Å; E389-R392 PolarHBondContact OE1-NH1 3.45Å; E389-L393 WeakPolarHBondContact O-CG 3.48Å; E389-L393 PolarHBondContact O-N 3.02Å; E389-L520 HydrophobicContact CB-CD1 3.71Å; E389-K523 IonicContact OE2-NZ 3.36Å; E389-K523 PolarHBondContact OE2-NZ 3.1Å
390	L	94.8	Very high	92.9	Very high	7 Å²	7	46.6 Å²	46.6	4%	0.037	22%	0.224	C	C	.	.	H	α-helix	trans	-61.6	-45.9	178.2	-169.5	60.2	0	0	0	111.9	P359 R386 L387 C388 R392 L393 M394 Y513 A516 L517 L520	P359-L390 HydrophobicContact CB-CD2 3.69Å; P359-L390 HydrophobicContact CG-CD2 4.28Å; R386-L390 VanDerWaalsContact O-CB 3.27Å; R386-L390 WeakPolarHBondContact O-CB 3.49Å; R386-L390 PolarHBondContact O-N 3.4Å; L387-L390 PolarHBondContact O-N 3.09Å; C388-L390 PolarHBondContact O-N 2.45Å; L390-R392 VanDerWaalsContact C-N 3.31Å; L390-R392 PolarHBondContact O-N 3.19Å; L390-L393 PolarHBondContact O-N 2.88Å; L390-M394 HydrophobicContact CG-SD 4.34Å; L390-M394 VanDerWaalsContact O-CG 3.3Å; L390-M394 WeakPolarHBondContact O-CG 3.32Å; L390-M394 PolarHBondContact O-N 3.39Å; L390-Y513 HydrophobicContact CD2-CD2 4.43Å; L390-Y513 HydrophobicContact CD2-CE2 3.67Å; L390-Y513 HydrophobicContact CG-CE2 4.46Å; L390-A516 HydrophobicContact CD1-CB 3.81Å; L390-L517 HydrophobicContact CD1-CB 4.47Å; L390-L520 HydrophobicContact CB-CD2 4.08Å; L390-L520 HydrophobicContact CD1-CB 4.37Å; L390-L520 HydrophobicContact CD1-CD2 4.11Å
391	L	95.6	Very high	92.9	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-64.3	-35.8	178.8	-70.3	171.1	0	0	0	112	V362 Y363 L366 L387 C388 E389 M394 G395 K396 V398 V426	V362-L391 HydrophobicContact CG1-CD1 3.95Å; V362-L391 HydrophobicContact CG1-CD2 4.34Å; Y363-L391 HydrophobicContact CD2-CD2 4.41Å; L366-L391 HydrophobicContact CD1-CD1 4.05Å; L366-L391 HydrophobicContact CD1-CD2 4.13Å; L387-L391 HydrophobicContact CD1-CD1 3.9Å; L387-L391 HydrophobicContact CD1-CG 4.07Å; L387-L391 HydrophobicContact CG-CD1 3.89Å; L387-L391 HydrophobicContact CG-CG 4.46Å; L387-L391 WeakPolarHBondContact O-CB 3.44Å; L387-L391 WeakPolarHBondContact O-CG 3.35Å; L387-L391 PolarHBondContact O-N 3.31Å; C388-L391 PolarHBondContact O-N 3.44Å; E389-L391 PolarHBondContact O-N 2.93Å; L391-M394 CarbonylContact O-C 3.5Å; L391-M394 PolarHBondContact O-N 2.96Å; L391-G395 PolarHBondContact O-N 3.1Å; L391-K396 HydrophobicContact CB-CB 4.41Å; L391-K396 WeakPolarHBondContact O-CB 3.48Å; L391-K396 PolarHBondContact O-N 2.92Å; L391-V398 HydrophobicContact CB-CG1 4.25Å; L391-V398 HydrophobicContact CB-CG2 3.74Å; L391-V398 HydrophobicContact CD1-CG1 4.29Å; L391-V426 HydrophobicContact CD1-CG2 4.37Å
392	R	95.2	Very high	92.7	Very high	97 Å²	97	42.3 Å²	42.3	37%	0.366	20%	0.201	S	C	.	.	H	α-helix	trans	-65.2	-43.6	173	-72.3	175.4	-175.8	144.8	4.1	112.3	C388 E389 L390 M394 G395 V398	C388-R392 WeakPolarHBondContact O-CG 3.43Å; C388-R392 PolarHBondContact O-N 3.01Å; C388-R392 PolarHBondContact SG-NH2 3.13Å; E389-R392 PolarHBondContact O-N 3.22Å; E389-R392 IonicContact OE1-CZ 3.17Å; E389-R392 IonicContact OE1-NH1 3.8Å; E389-R392 PolarHBondContact OE1-NH1 3.45Å; L390-R392 VanDerWaalsContact C-N 3.31Å; L390-R392 PolarHBondContact O-N 3.19Å; R392-M394 PolarHBondContact O-N 2.76Å; R392-G395 WeakPolarHBondContact O-CA 3.48Å; R392-G395 PolarHBondContact O-N 3.46Å; R392-V398 HydrophobicContact CG-CG2 3.73Å; R392-V398 PolarHBondContact NE-O 3.49Å; R392-V398 PolarHBondContact NH2-O 2.99Å
393	L	94	Very high	91.9	Very high	42 Å²	42	35.6 Å²	35.6	22%	0.22	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-28.8	175.1	-71.5	176.4	0	0	0	112.2	E389 L390 G395 A516 E519 L520	E389-L393 WeakPolarHBondContact O-CG 3.48Å; E389-L393 PolarHBondContact O-N 3.02Å; L390-L393 PolarHBondContact O-N 2.88Å; L393-G395 PolarHBondContact O-N 3.23Å; L393-A516 HydrophobicContact CB-CB 3.98Å; L393-E519 HydrophobicContact CD1-CB 4.17Å; L393-E519 HydrophobicContact CD1-CG 4.11Å; L393-E519 VanDerWaalsContact CD2-CD 3.47Å; L393-E519 HydrophobicContact CD2-CG 4.16Å; L393-E519 WeakPolarHBondContact CD2-OE1 3.43Å; L393-L520 HydrophobicContact CD1-CB 4.06Å
394	M	93.2	Very high	91.2	Very high	8 Å²	8	42 Å²	42	4%	0.039	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	8.3	172.3	-61.4	176.9	73	0	0	113.4	L360 Y363 L390 L391 R392 M512 Y513 A516	L360-M394 HydrophobicContact CD1-CE 3.85Å; Y363-M394 HydrophobicContact CD1-CE 3.9Å; Y363-M394 HydrophobicContact CD2-CB 3.82Å; Y363-M394 HydrophobicContact CD2-CE 3.68Å; Y363-M394 HydrophobicContact CD2-SD 4.2Å; Y363-M394 HydrophobicContact CE1-CE 4.27Å; Y363-M394 HydrophobicContact CE2-CB 3.76Å; Y363-M394 HydrophobicContact CE2-CE 4.06Å; Y363-M394 WeakPolarHBondContact CE2-O 3.48Å; Y363-M394 HydrophobicContact CG-CE 3.6Å; Y363-M394 HydrophobicContact CG-SD 4.4Å; L390-M394 HydrophobicContact CG-SD 4.34Å; L390-M394 VanDerWaalsContact O-CG 3.3Å; L390-M394 WeakPolarHBondContact O-CG 3.32Å; L390-M394 PolarHBondContact O-N 3.39Å; L391-M394 CarbonylContact O-C 3.5Å; L391-M394 PolarHBondContact O-N 2.96Å; R392-M394 PolarHBondContact O-N 2.76Å; M394-M512 HydrophobicContact CB-SD 4.15Å; M394-Y513 HydrophobicContact CE-CD2 4.09Å; M394-Y513 HydrophobicContact SD-CD2 3.83Å; M394-A516 HydrophobicContact CG-CB 3.64Å
395	G	91.8	Very high	90.6	Very high	57 Å²	57	44.3 Å²	44.3	59%	0.588	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.3	8.8	173.7	0	0	0	0	0	115.8	L391 R392 L393	L391-G395 PolarHBondContact O-N 3.1Å; R392-G395 WeakPolarHBondContact O-CA 3.48Å; R392-G395 PolarHBondContact O-N 3.46Å; L393-G395 PolarHBondContact O-N 3.23Å
396	K	93.8	Very high	90	Very high	35 Å²	35	48.1 Å²	48.1	15%	0.152	23%	0.23	C	C	.	.			trans	-85.4	138.7	176.5	-62.8	-63	-174.8	-178.8	0	111.7	Y363 L366 S367 L391 V398	Y363-K396 HydrophobicContact CD2-CD 4.31Å; Y363-K396 HydrophobicContact CD2-CG 3.65Å; Y363-K396 HydrophobicContact CE2-CD 4.07Å; Y363-K396 HydrophobicContact CE2-CG 3.72Å; L366-K396 HydrophobicContact CB-CD 4.41Å; L366-K396 HydrophobicContact CD1-CB 4.23Å; L366-K396 HydrophobicContact CD1-CG 4.15Å; S367-K396 WeakPolarHBondContact OG-CE 3.33Å; S367-K396 PolarHBondContact OG-NZ 2.92Å; L391-K396 HydrophobicContact CB-CB 4.41Å; L391-K396 WeakPolarHBondContact O-CB 3.48Å; L391-K396 PolarHBondContact O-N 2.92Å; K396-V398 HydrophobicContact CB-CG1 4.02Å; K396-V398 PolarHBondContact O-N 3.1Å; K396-V398 VanDerWaalsContact O-N 3.11Å
397	Q	93.7	Very high	89.1	Confident	125 Å²	125	44.5 Å²	44.5	58%	0.584	22%	0.221	S	C	*	.			trans	-82.2	84.6	176.3	-61.2	-59.4	-30.6	0	0	110.5	K421 L422 S423	Q397-K421 WeakPolarHBondContact CB-O 3.26Å; Q397-L422 CarbonylContact O-C 3.58Å; Q397-L422 WeakPolarHBondContact O-CA 3.13Å; Q397-S423 PolarHBondContact O-N 3.04Å; Q397-S423 PolarHBondContact O-OG 2.99Å
398	V	95	Very high	88.4	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.024	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	140	-177	-60.4	0	0	0	0	113.1	L366 C388 L391 R392 K396 A424	L366-V398 HydrophobicContact CD1-CG1 3.84Å; C388-V398 WeakPolarHBondContact O-CG2 3.46Å; L391-V398 HydrophobicContact CB-CG1 4.25Å; L391-V398 HydrophobicContact CB-CG2 3.74Å; L391-V398 HydrophobicContact CD1-CG1 4.29Å; R392-V398 HydrophobicContact CG-CG2 3.73Å; R392-V398 PolarHBondContact NE-O 3.49Å; R392-V398 PolarHBondContact NH2-O 2.99Å; K396-V398 HydrophobicContact CB-CG1 4.02Å; K396-V398 PolarHBondContact O-N 3.1Å; K396-V398 VanDerWaalsContact O-N 3.11Å; V398-A424 WeakPolarHBondContact CA-O 3.23Å; V398-A424 HydrophobicContact CG1-CB 4.03Å
399	G	93.3	Very high	88	Confident	4 Å²	4	50.3 Å²	50.3	4%	0.041	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	155.9	172.8	0	0	0	0	0	111.9	A424 I425 V426	G399-A424 PolarHBondContact N-O 3.02Å; G399-I425 CarbonylContact O-C 3.5Å; G399-I425 WeakPolarHBondContact O-CA 3.3Å; G399-V426 PolarHBondContact O-N 3.24Å
400	E	93.2	Very high	87.6	Confident	23 Å²	23	49.9 Å²	49.9	11%	0.107	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.7	170	-172.8	179.4	-171.4	0	0	109.6	S384 H385 C388 L405 I413 V426	S384-E400 WeakPolarHBondContact CB-OE1 3.47Å; S384-E400 WeakPolarHBondContact OG-CG 3.37Å; S384-E400 PolarHBondContact OG-OE1 3.07Å; H385-E400 VanDerWaalsContact CA-OE1 3.28Å; H385-E400 WeakPolarHBondContact CA-OE1 3.26Å; H385-E400 IonicContact CE1-OE2 2.84Å; H385-E400 IonicContact CG-OE2 3.86Å; H385-E400 PolarHBondContact N-OE1 3.43Å; H385-E400 VanDerWaalsContact N-OE1 3.1Å; H385-E400 IonicContact ND1-OE2 3.58Å; H385-E400 PolarHBondContact ND1-OE2 2.86Å; C388-E400 HydrophobicContact CB-CB 4.15Å; E400-L405 WeakPolarHBondContact O-CD1 3.31Å; E400-I413 WeakPolarHBondContact O-CD1 3.32Å; E400-V426 CarbonylContact C-O 3.52Å; E400-V426 WeakPolarHBondContact CA-O 3.45Å
401	I	88	Confident	87.1	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113.6	166.6	-65.5	-178.9	0	0	0	109.6	R410 I413 K414 I425 V426 C427 M431 I435 F437	I401-R410 HydrophobicContact CG2-CG 4.12Å; I401-I413 HydrophobicContact CD1-CG2 4.44Å; I401-I413 HydrophobicContact CG1-CB 4.49Å; I401-I413 HydrophobicContact CG1-CG2 4.07Å; I401-K414 HydrophobicContact CD1-CG 4.24Å; I401-I425 HydrophobicContact CB-CG2 4.25Å; I401-I425 HydrophobicContact CD1-CD1 4.13Å; I401-I425 HydrophobicContact CD1-CG2 3.82Å; I401-I425 HydrophobicContact CG1-CG2 3.73Å; I401-V426 PolarHBondContact N-O 3.47Å; I401-C427 HydrophobicContact CB-CB 4.02Å; I401-C427 WeakPolarHBondContact O-CB 3.31Å; I401-M431 HydrophobicContact CG2-CB 4.45Å; I401-I435 HydrophobicContact CD1-CD1 4.14Å; I401-I435 HydrophobicContact CG2-CD1 3.74Å; I401-F437 HydrophobicContact CD1-CE1 4.1Å; I401-F437 HydrophobicContact CD1-CZ 4.23Å
402	S	83	Confident	86.7	Confident	14 Å²	14	57.2 Å²	57.2	10%	0.098	29%	0.29	C	S	.	.			trans	-117.2	165.4	178.2	71.3	0	0	0	0	113.2	L381 Y404 L405 R410	L381-S402 VanDerWaalsContact CD1-CB 3.4Å; S402-Y404 PolarHBondContact O-N 3.07Å; S402-L405 PolarHBondContact O-N 3.38Å; S402-R410 PolarHBondContact O-NE 2.96Å; S402-R410 PolarHBondContact O-NH2 2.94Å
403	G	73.3	Confident	86.5	Confident	30 Å²	30	54.2 Å²	54.2	31%	0.309	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.4	175.5	0	0	0	0	0	114.2	L405 R410 M431	G403-L405 VanDerWaalsContact C-N 3.28Å; G403-L405 PolarHBondContact O-N 3.15Å; G403-R410 PolarHBondContact O-NH2 2.92Å; G403-R410 VanDerWaalsContact O-NH2 3.12Å; G403-M431 WeakPolarHBondContact CA-SD 3.43Å; G403-M431 PolarHBondContact N-SD 2.8Å; G403-M431 VanDerWaalsContact N-SD 3.4Å
404	Y	75.3	Confident	86.1	Confident	200 Å²	200	53.4 Å²	53.4	78%	0.784	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-14.2	-177	-53.3	-57.8	0	0	0	113.4	L381 S402	L381-Y404 HydrophobicContact CD2-CD2 3.8Å; L381-Y404 HydrophobicContact CD2-CE2 3.18Å; S402-Y404 PolarHBondContact O-N 3.07Å
405	L	81.1	Confident	85.9	Confident	49 Å²	49	58.5 Å²	58.5	26%	0.257	30%	0.299	S	S	.	.	S	Bend	trans	-77.6	134.1	176.2	-65.1	178.6	0	0	0	111.2	E400 S402 G403 D409 R410 I413	E400-L405 WeakPolarHBondContact O-CD1 3.31Å; S402-L405 PolarHBondContact O-N 3.38Å; G403-L405 VanDerWaalsContact C-N 3.28Å; G403-L405 PolarHBondContact O-N 3.15Å; L405-D409 HydrophobicContact CD2-CB 4.43Å; L405-R410 HydrophobicContact CB-CG 3.81Å; L405-R410 PolarHBondContact O-NE 3.29Å; L405-R410 VanDerWaalsContact O-NE 3.11Å; L405-R410 PolarHBondContact O-NH2 2.93Å; L405-I413 HydrophobicContact CD1-CD1 3.53Å
406	R	79.5	Confident	85.8	Confident	165 Å²	165	57.6 Å²	57.6	62%	0.623	28%	0.283	S	S	*	.			trans	-66.3	151.9	168.3	-59.8	175	-60.2	-176.8	0	109.5	V408 D409 R410	R406-V408 PolarHBondContact O-N 3.03Å; R406-V408 VanDerWaalsContact O-N 3.17Å; R406-D409 IonicContact CZ-OD2 2.86Å; R406-D409 IonicContact NE-OD2 3.43Å; R406-D409 PolarHBondContact NE-OD2 2.82Å; R406-D409 IonicContact NH2-OD1 3.67Å; R406-D409 IonicContact NH2-OD2 2.88Å; R406-D409 PolarHBondContact NH2-OD2 3.02Å; R406-D409 WeakPolarHBondContact O-CA 3.12Å; R406-D409 WeakPolarHBondContact O-CB 3.46Å; R406-D409 PolarHBondContact O-N 3.45Å; R406-R410 PolarHBondContact O-N 2.84Å
407	P	74.3	Confident	85.7	Confident	30 Å²	30	55.9 Å²	55.9	20%	0.195	28%	0.276	C	S	.	.	H	α-helix	trans	-55.6	-36.6	179.5	-23.8	29.7	0	0	0	114	Q174 D409 R410 S411	Q174-P407 HydrophobicContact CG-CG 4.47Å; P407-D409 VanDerWaalsContact C-N 3.25Å; P407-D409 PolarHBondContact O-N 2.97Å; P407-R410 PolarHBondContact O-N 3.35Å; P407-S411 WeakPolarHBondContact O-CB 3.3Å; P407-S411 PolarHBondContact O-N 3.49Å; P407-S411 PolarHBondContact O-OG 3.35Å; P407-S411 VanDerWaalsContact O-OG 3.13Å
408	V	80.3	Confident	85.4	Confident	95 Å²	95	52.7 Å²	52.7	58%	0.576	26%	0.263	S	S	*	.	H	α-helix	trans	-58.8	-42.8	176.5	177.8	0	0	0	0	110.2	R406 S411 K412	R406-V408 PolarHBondContact O-N 3.03Å; R406-V408 VanDerWaalsContact O-N 3.17Å; V408-S411 PolarHBondContact O-N 3.33Å; V408-K412 WeakPolarHBondContact O-CG 3.46Å; V408-K412 PolarHBondContact O-N 3.08Å
409	D	86	Confident	85	Confident	32 Å²	32	58.1 Å²	58.1	17%	0.171	29%	0.292	C	S	.	.	H	α-helix	trans	-73.5	-36.8	179.3	-58.3	-44.2	0	0	0	110.9	L405 R406 P407 S411 K412 I413	L405-D409 HydrophobicContact CD2-CB 4.43Å; R406-D409 IonicContact CZ-OD2 2.86Å; R406-D409 IonicContact NE-OD2 3.43Å; R406-D409 PolarHBondContact NE-OD2 2.82Å; R406-D409 IonicContact NH2-OD1 3.67Å; R406-D409 IonicContact NH2-OD2 2.88Å; R406-D409 PolarHBondContact NH2-OD2 3.02Å; R406-D409 WeakPolarHBondContact O-CA 3.12Å; R406-D409 WeakPolarHBondContact O-CB 3.46Å; R406-D409 PolarHBondContact O-N 3.45Å; P407-D409 VanDerWaalsContact C-N 3.25Å; P407-D409 PolarHBondContact O-N 2.97Å; D409-S411 VanDerWaalsContact C-N 3.34Å; D409-S411 PolarHBondContact O-N 3.39Å; D409-K412 WeakPolarHBondContact O-CB 3.22Å; D409-K412 PolarHBondContact O-N 2.99Å; D409-K412 IonicContact OD1-NZ 2.75Å; D409-K412 PolarHBondContact OD1-NZ 3.01Å; D409-I413 WeakPolarHBondContact O-CG1 3.36Å; D409-I413 PolarHBondContact O-N 2.93Å; D409-I413 VanDerWaalsContact O-N 3.11Å
410	R	85.8	Confident	84.7	Confident	30 Å²	30	60.9 Å²	60.9	11%	0.113	32%	0.32	C	S	.	.	H	α-helix	trans	-59.4	-43.8	169.9	-61.7	-177.7	-175.5	167.8	1.5	111.8	D148 I401 S402 G403 L405 R406 P407 K412 I413 K414	D148-R410 IonicContact OD2-CZ 3.93Å; D148-R410 IonicContact OD2-NH1 3.35Å; D148-R410 PolarHBondContact OD2-NH1 3.04Å; I401-R410 HydrophobicContact CG2-CG 4.12Å; S402-R410 PolarHBondContact O-NE 2.96Å; S402-R410 PolarHBondContact O-NH2 2.94Å; G403-R410 PolarHBondContact O-NH2 2.92Å; G403-R410 VanDerWaalsContact O-NH2 3.12Å; L405-R410 HydrophobicContact CB-CG 3.81Å; L405-R410 PolarHBondContact O-NE 3.29Å; L405-R410 VanDerWaalsContact O-NE 3.11Å; L405-R410 PolarHBondContact O-NH2 2.93Å; R406-R410 PolarHBondContact O-N 2.84Å; P407-R410 PolarHBondContact O-N 3.35Å; R410-K412 VanDerWaalsContact C-N 3.34Å; R410-K412 PolarHBondContact O-N 3.39Å; R410-I413 PolarHBondContact O-N 3.18Å; R410-K414 VanDerWaalsContact O-CG 3.3Å; R410-K414 WeakPolarHBondContact O-CG 3.25Å; R410-K414 PolarHBondContact O-N 2.92Å
411	S	82.8	Confident	84.5	Confident	51 Å²	51	66.8 Å²	66.8	36%	0.357	35%	0.345	S	S	.	.	H	α-helix	trans	-64.3	-37.2	177.8	-69	0	0	0	0	112.2	P407 V408 D409 K414 Q415	P407-S411 WeakPolarHBondContact O-CB 3.3Å; P407-S411 PolarHBondContact O-N 3.49Å; P407-S411 PolarHBondContact O-OG 3.35Å; P407-S411 VanDerWaalsContact O-OG 3.13Å; V408-S411 PolarHBondContact O-N 3.33Å; D409-S411 VanDerWaalsContact C-N 3.34Å; D409-S411 PolarHBondContact O-N 3.39Å; S411-K414 PolarHBondContact O-N 2.96Å; S411-Q415 WeakPolarHBondContact O-CB 3.26Å; S411-Q415 WeakPolarHBondContact O-CG 3.22Å; S411-Q415 PolarHBondContact O-N 3.39Å
412	K	88.4	Confident	84.7	Confident	111 Å²	111	68 Å²	68	48%	0.483	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-42	172.4	-71.2	172.5	-173.6	166.1	0	112.5	V408 D409 R410 Q415 S416	V408-K412 WeakPolarHBondContact O-CG 3.46Å; V408-K412 PolarHBondContact O-N 3.08Å; D409-K412 WeakPolarHBondContact O-CB 3.22Å; D409-K412 PolarHBondContact O-N 2.99Å; D409-K412 IonicContact OD1-NZ 2.75Å; D409-K412 PolarHBondContact OD1-NZ 3.01Å; R410-K412 VanDerWaalsContact C-N 3.34Å; R410-K412 PolarHBondContact O-N 3.39Å; K412-Q415 PolarHBondContact O-N 2.87Å; K412-S416 WeakPolarHBondContact O-CB 3.35Å; K412-S416 PolarHBondContact O-N 2.81Å; K412-S416 PolarHBondContact O-OG 3.06Å
413	I	90.2	Very high	85.1	Confident	33 Å²	33	68.7 Å²	68.7	17%	0.169	36%	0.356	C	S	.	.	H	α-helix	trans	-65.6	-44	177.1	-64.1	175.1	0	0	0	110.3	E400 I401 L405 D409 R410 Q415 S416 L417 L422 I425	E400-I413 WeakPolarHBondContact O-CD1 3.32Å; I401-I413 HydrophobicContact CD1-CG2 4.44Å; I401-I413 HydrophobicContact CG1-CB 4.49Å; I401-I413 HydrophobicContact CG1-CG2 4.07Å; L405-I413 HydrophobicContact CD1-CD1 3.53Å; D409-I413 WeakPolarHBondContact O-CG1 3.36Å; D409-I413 PolarHBondContact O-N 2.93Å; D409-I413 VanDerWaalsContact O-N 3.11Å; R410-I413 PolarHBondContact O-N 3.18Å; I413-Q415 PolarHBondContact O-N 2.94Å; I413-S416 WeakPolarHBondContact O-CB 3.11Å; I413-S416 PolarHBondContact O-N 3.19Å; I413-S416 VanDerWaalsContact O-N 3.11Å; I413-L417 PolarHBondContact O-N 3.29Å; I413-L422 HydrophobicContact CG2-CD1 3.94Å; I413-I425 HydrophobicContact CG2-CD1 3.83Å; I413-I425 HydrophobicContact CG2-CG1 4.03Å
414	K	86.7	Confident	86.1	Confident	26 Å²	26	67.3 Å²	67.3	11%	0.113	34%	0.342	C	S	.	.	H	α-helix	trans	-58.1	-47.1	174.3	-67.3	172.3	-147.3	177.8	0	111.6	D148 I401 R410 S411 S416 L417 N418 I435 F437	D148-K414 IonicContact OD1-NZ 3.07Å; D148-K414 PolarHBondContact OD1-NZ 3.12Å; D148-K414 VanDerWaalsContact OD1-NZ 3.08Å; I401-K414 HydrophobicContact CD1-CG 4.24Å; R410-K414 VanDerWaalsContact O-CG 3.3Å; R410-K414 WeakPolarHBondContact O-CG 3.25Å; R410-K414 PolarHBondContact O-N 2.92Å; S411-K414 PolarHBondContact O-N 2.96Å; K414-S416 VanDerWaalsContact C-N 3.27Å; K414-S416 PolarHBondContact O-N 3.28Å; K414-L417 WeakPolarHBondContact O-CB 3.26Å; K414-L417 PolarHBondContact O-N 2.78Å; K414-N418 PolarHBondContact O-N 2.82Å; K414-I435 HydrophobicContact CD-CG2 3.71Å; K414-I435 HydrophobicContact CG-CG2 4.34Å; K414-F437 HydrophobicContact CG-CE1 4.34Å
415	Q	88	Confident	87	Confident	115 Å²	115	57.8 Å²	57.8	54%	0.537	31%	0.305	S	S	.	.	H	α-helix	trans	-61.6	-35.9	175.6	-75.6	177.3	-6.4	0	0	112	S411 K412 I413 N418 N419	S411-Q415 WeakPolarHBondContact O-CB 3.26Å; S411-Q415 WeakPolarHBondContact O-CG 3.22Å; S411-Q415 PolarHBondContact O-N 3.39Å; K412-Q415 PolarHBondContact O-N 2.87Å; I413-Q415 PolarHBondContact O-N 2.94Å; Q415-N418 PolarHBondContact O-N 2.83Å; Q415-N419 VanDerWaalsContact O-CB 3.29Å; Q415-N419 WeakPolarHBondContact O-CB 3.5Å; Q415-N419 PolarHBondContact O-N 3.05Å; Q415-N419 PolarHBondContact O-ND2 2.83Å; Q415-N419 PolarHBondContact O-OD1 2.8Å
416	S	91.1	Very high	87.7	Confident	37 Å²	37	55.5 Å²	55.5	26%	0.259	29%	0.293	S	S	.	.	H	α-helix	trans	-67.4	-36.1	176.8	-58.2	0	0	0	0	112.2	K412 I413 K414 K421 L422	K412-S416 WeakPolarHBondContact O-CB 3.35Å; K412-S416 PolarHBondContact O-N 2.81Å; K412-S416 PolarHBondContact O-OG 3.06Å; I413-S416 WeakPolarHBondContact O-CB 3.11Å; I413-S416 PolarHBondContact O-N 3.19Å; I413-S416 VanDerWaalsContact O-N 3.11Å; K414-S416 VanDerWaalsContact C-N 3.27Å; K414-S416 PolarHBondContact O-N 3.28Å; S416-K421 WeakPolarHBondContact O-CA 3.41Å; S416-K421 WeakPolarHBondContact O-CB 3.48Å; S416-K421 PolarHBondContact O-N 3.16Å; S416-L422 PolarHBondContact O-N 3.25Å; S416-L422 VanDerWaalsContact O-N 3.12Å
417	L	90.4	Very high	88.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-45.1	169.8	-179	71	0	0	0	111.5	R373 I413 K414 N419 G420 L422 I425 F437 L440	R373-L417 HydrophobicContact CB-CD1 4.33Å; R373-L417 HydrophobicContact CB-CD2 4.5Å; R373-L417 HydrophobicContact CB-CG 4.35Å; R373-L417 HydrophobicContact CG-CD1 4.4Å; R373-L417 HydrophobicContact CG-CG 4.33Å; I413-L417 PolarHBondContact O-N 3.29Å; K414-L417 WeakPolarHBondContact O-CB 3.26Å; K414-L417 PolarHBondContact O-N 2.78Å; L417-N419 VanDerWaalsContact C-N 3.34Å; L417-N419 PolarHBondContact O-N 3.46Å; L417-G420 PolarHBondContact O-N 3.27Å; L417-G420 VanDerWaalsContact O-N 3.14Å; L417-L422 HydrophobicContact CB-CB 4.43Å; L417-L422 HydrophobicContact CD1-CB 4.32Å; L417-L422 WeakPolarHBondContact CD1-O 3.42Å; L417-I425 HydrophobicContact CB-CD1 3.77Å; L417-I425 HydrophobicContact CB-CG1 4.16Å; L417-I425 HydrophobicContact CD1-CG1 4.43Å; L417-I425 HydrophobicContact CD2-CD1 3.56Å; L417-I425 HydrophobicContact CD2-CG1 3.91Å; L417-I425 HydrophobicContact CG-CD1 4.2Å; L417-I425 HydrophobicContact CG-CG1 4.39Å; L417-F437 HydrophobicContact CD2-CD1 4.46Å; L417-L440 HydrophobicContact CD2-CD2 3.98Å
418	N	86.9	Confident	88.9	Confident	58 Å²	58	46.7 Å²	46.7	31%	0.31	26%	0.257	S	S	.	.	H	α-helix	trans	-65	-36.6	-179.2	-74.6	-14.2	0	0	0	113.1	K414 Q415 G420 D438	K414-N418 PolarHBondContact O-N 2.82Å; Q415-N418 PolarHBondContact O-N 2.83Å; N418-G420 PolarHBondContact O-N 3.14Å; N418-D438 VanDerWaalsContact CG-OD2 3.26Å; N418-D438 PolarHBondContact ND2-OD2 3.32Å; N418-D438 PolarHBondContact OD1-OD2 2.98Å
419	N	88	Confident	88.7	Confident	118 Å²	118	42.9 Å²	42.9	63%	0.631	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	6.4	177.9	-63.5	-7	0	0	0	112.8	Q415 L417 K421	Q415-N419 VanDerWaalsContact O-CB 3.29Å; Q415-N419 WeakPolarHBondContact O-CB 3.5Å; Q415-N419 PolarHBondContact O-N 3.05Å; Q415-N419 PolarHBondContact O-ND2 2.83Å; Q415-N419 PolarHBondContact O-OD1 2.8Å; L417-N419 VanDerWaalsContact C-N 3.34Å; L417-N419 PolarHBondContact O-N 3.46Å; N419-K421 VanDerWaalsContact C-N 3.25Å; N419-K421 PolarHBondContact O-N 2.86Å
420	G	86	Confident	87.9	Confident	61 Å²	61	46 Å²	46	63%	0.629	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.4	10	178.7	0	0	0	0	0	115.2	L417 N418 L422	L417-G420 PolarHBondContact O-N 3.27Å; L417-G420 VanDerWaalsContact O-N 3.14Å; N418-G420 PolarHBondContact O-N 3.14Å; G420-L422 VanDerWaalsContact C-N 3.34Å
421	K	90.2	Very high	87.1	Confident	147 Å²	147	46.7 Å²	46.7	64%	0.639	25%	0.254	S	S	*	.	S	Bend	trans	-72.7	-30.7	175.4	-64.8	-174.3	176.3	-176	0	112.2	Q397 S416 N419	Q397-K421 WeakPolarHBondContact CB-O 3.26Å; S416-K421 WeakPolarHBondContact O-CA 3.41Å; S416-K421 WeakPolarHBondContact O-CB 3.48Å; S416-K421 PolarHBondContact O-N 3.16Å; N419-K421 VanDerWaalsContact C-N 3.25Å; N419-K421 PolarHBondContact O-N 2.86Å
422	L	92.2	Very high	86.1	Confident	27 Å²	27	44.3 Å²	44.3	14%	0.141	24%	0.237	C	C	.	.			trans	-111	140.9	173	-58.6	175	0	0	0	108.7	Q397 I413 S416 L417 G420	Q397-L422 CarbonylContact O-C 3.58Å; Q397-L422 WeakPolarHBondContact O-CA 3.13Å; I413-L422 HydrophobicContact CG2-CD1 3.94Å; S416-L422 PolarHBondContact O-N 3.25Å; S416-L422 VanDerWaalsContact O-N 3.12Å; L417-L422 HydrophobicContact CB-CB 4.43Å; L417-L422 HydrophobicContact CD1-CB 4.32Å; L417-L422 WeakPolarHBondContact CD1-O 3.42Å; G420-L422 VanDerWaalsContact C-N 3.34Å
423	S	90.5	Very high	85.1	Confident	27 Å²	27	40.8 Å²	40.8	19%	0.189	22%	0.221	C	C	.	.	S	Bend	trans	-84.9	-32	171.2	58.3	0	0	0	0	111.8	I374 Q397	I374-S423 PolarHBondContact N-O 3.3Å; Q397-S423 PolarHBondContact O-N 3.04Å; Q397-S423 PolarHBondContact O-OG 2.99Å
424	A	94.6	Very high	83.6	Confident	2 Å²	2	39.3 Å²	39.3	2%	0.017	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	155.9	-179.4	0	0	0	0	0	114.3	L366 I374 V398 G399	L366-A424 HydrophobicContact CD1-CB 4.4Å; L366-A424 HydrophobicContact CD2-CB 3.54Å; I374-A424 HydrophobicContact CB-CB 3.86Å; I374-A424 HydrophobicContact CG2-CB 4.25Å; I374-A424 CarbonylContact O-C 3.56Å; I374-A424 WeakPolarHBondContact O-CA 3.28Å; V398-A424 WeakPolarHBondContact CA-O 3.23Å; V398-A424 HydrophobicContact CG1-CB 4.03Å; G399-A424 PolarHBondContact N-O 3.02Å
425	I	94.5	Very high	82.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.1	166.1	-68.1	175.5	0	0	0	108.8	I374 L375 C376 G399 I401 I413 L417 F437	I374-I425 PolarHBondContact O-N 3.36Å; L375-I425 HydrophobicContact CD1-CB 4.01Å; L375-I425 HydrophobicContact CD1-CG2 3.99Å; C376-I425 PolarHBondContact N-O 3.32Å; G399-I425 CarbonylContact O-C 3.5Å; G399-I425 WeakPolarHBondContact O-CA 3.3Å; I401-I425 HydrophobicContact CB-CG2 4.25Å; I401-I425 HydrophobicContact CD1-CD1 4.13Å; I401-I425 HydrophobicContact CD1-CG2 3.82Å; I401-I425 HydrophobicContact CG1-CG2 3.73Å; I413-I425 HydrophobicContact CG2-CD1 3.83Å; I413-I425 HydrophobicContact CG2-CG1 4.03Å; L417-I425 HydrophobicContact CB-CD1 3.77Å; L417-I425 HydrophobicContact CB-CG1 4.16Å; L417-I425 HydrophobicContact CD1-CG1 4.43Å; L417-I425 HydrophobicContact CD2-CD1 3.56Å; L417-I425 HydrophobicContact CD2-CG1 3.91Å; L417-I425 HydrophobicContact CG-CD1 4.2Å; L417-I425 HydrophobicContact CG-CG1 4.39Å; I425-F437 HydrophobicContact CD1-CD1 4.38Å; I425-F437 HydrophobicContact CD1-CE1 3.86Å; I425-F437 HydrophobicContact CG2-CE1 4.49Å
426	V	94.8	Very high	81.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.1	168.7	-171.4	0	0	0	0	108.5	C376 T378 L387 C388 L391 G399 E400 I401	C376-V426 HydrophobicContact CB-CG2 4.3Å; C376-V426 WeakPolarHBondContact O-CA 3.29Å; T378-V426 HydrophobicContact CG2-CG1 4.03Å; L387-V426 HydrophobicContact CB-CG1 4.49Å; L387-V426 HydrophobicContact CD2-CG1 4.03Å; L387-V426 HydrophobicContact CD2-CG2 4.48Å; L387-V426 HydrophobicContact CG-CG1 4.47Å; C388-V426 HydrophobicContact CB-CB 4.35Å; C388-V426 HydrophobicContact CB-CG2 4.31Å; L391-V426 HydrophobicContact CD1-CG2 4.37Å; G399-V426 PolarHBondContact O-N 3.24Å; E400-V426 CarbonylContact C-O 3.52Å; E400-V426 WeakPolarHBondContact CA-O 3.45Å; I401-V426 PolarHBondContact N-O 3.47Å
427	C	91.5	Very high	80.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	165.1	177	63.5	0	0	0	0	111.5	C376 F377 T378 I401 A432	C376-C427 PolarHBondContact O-N 3Å; F377-C427 CarbonylContact C-O 3.58Å; F377-C427 WeakPolarHBondContact CA-O 3.36Å; T378-C427 PolarHBondContact N-O 3.35Å; T378-C427 PolarHBondContact OG1-O 3.26Å; I401-C427 HydrophobicContact CB-CB 4.02Å; I401-C427 WeakPolarHBondContact O-CB 3.31Å; C427-A432 WeakPolarHBondContact SG-CB 3.21Å
428	T	88.1	Confident	79.7	Confident	11 Å²	11	37.2 Å²	37.2	7%	0.067	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	153.9	169.1	66.1	0	0	0	0	111.2	T378 L381 I430 M431 A432	T378-T428 VanDerWaalsContact O-CA 3.26Å; T378-T428 WeakPolarHBondContact O-CA 3.34Å; L381-T428 HydrophobicContact CB-CG2 4.25Å; L381-T428 HydrophobicContact CD1-CG2 4.47Å; T428-I430 VanDerWaalsContact C-N 3.26Å; T428-I430 PolarHBondContact O-N 2.98Å; T428-M431 PolarHBondContact O-N 3.09Å; T428-M431 WeakPolarHBondContact OG1-CB 3.34Å; T428-M431 WeakPolarHBondContact OG1-CG 3.42Å; T428-M431 PolarHBondContact OG1-N 3.43Å; T428-A432 PolarHBondContact O-N 2.76Å; T428-A432 VanDerWaalsContact O-N 3.09Å
429	Q	75.1	Confident	79	Confident	15 Å²	15	36.2 Å²	36.2	7%	0.07	20%	0.203	C	C	.	.	H	α-helix	trans	-53.9	-43.2	176.2	-61.6	-175.7	14.9	0	0	112.6	F377 T378 M431 A432 R433 M458	F377-Q429 HydrophobicContact CB-CG 4.3Å; F377-Q429 HydrophobicContact CD1-CB 4.39Å; F377-Q429 HydrophobicContact CD1-CG 4.05Å; T378-Q429 PolarHBondContact O-N 3.32Å; Q429-M431 VanDerWaalsContact C-N 3.28Å; Q429-M431 PolarHBondContact O-N 3.25Å; Q429-A432 PolarHBondContact O-N 3.14Å; Q429-R433 WeakPolarHBondContact O-CG 3.4Å; Q429-R433 PolarHBondContact O-N 3.37Å; Q429-M458 HydrophobicContact CG-CG 4.43Å; Q429-M458 HydrophobicContact CG-SD 3.7Å
430	I	69.8	Low	78.8	Confident	97 Å²	97	30.6 Å²	30.6	50%	0.497	17%	0.172	S	C	.	.	H	α-helix	trans	-61	-39.1	178.4	-63.2	167.8	0	0	0	110.8	T428	T428-I430 VanDerWaalsContact C-N 3.26Å; T428-I430 PolarHBondContact O-N 2.98Å
431	M	69.3	Low	78.9	Confident	44 Å²	44	29.2 Å²	29.2	22%	0.217	16%	0.158	C	C	.	.	H	α-helix	trans	-75.7	-36.7	-176.5	-70.6	-62.2	155.1	0	0	113.6	I401 G403 T428 Q429 R433 I435	I401-M431 HydrophobicContact CG2-CB 4.45Å; G403-M431 WeakPolarHBondContact CA-SD 3.43Å; G403-M431 PolarHBondContact N-SD 2.8Å; G403-M431 VanDerWaalsContact N-SD 3.4Å; T428-M431 PolarHBondContact O-N 3.09Å; T428-M431 WeakPolarHBondContact OG1-CB 3.34Å; T428-M431 WeakPolarHBondContact OG1-CG 3.42Å; T428-M431 PolarHBondContact OG1-N 3.43Å; Q429-M431 VanDerWaalsContact C-N 3.28Å; Q429-M431 PolarHBondContact O-N 3.25Å; M431-R433 VanDerWaalsContact C-N 3.25Å; M431-R433 PolarHBondContact O-N 3.47Å; M431-I435 WeakPolarHBondContact O-CD1 2.96Å; M431-I435 WeakPolarHBondContact O-CG1 3.36Å
432	A	62.9	Low	79.1	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-78.3	-11.6	178.8	0	0	0	0	0	113.2	L375 F377 C427 T428 Q429 G434 I435 F437	L375-A432 HydrophobicContact CD2-CB 4.38Å; F377-A432 HydrophobicContact CD1-CB 4.18Å; F377-A432 HydrophobicContact CE1-CB 3.22Å; F377-A432 HydrophobicContact CZ-CB 3.73Å; C427-A432 WeakPolarHBondContact SG-CB 3.21Å; T428-A432 PolarHBondContact O-N 2.76Å; T428-A432 VanDerWaalsContact O-N 3.09Å; Q429-A432 PolarHBondContact O-N 3.14Å; A432-G434 PolarHBondContact O-N 3.4Å; A432-I435 PolarHBondContact O-N 2.67Å; A432-F437 HydrophobicContact CB-CE2 3.9Å; A432-F437 HydrophobicContact CB-CZ 4.32Å
433	R	66.1	Low	79.2	Confident	37 Å²	37	20.9 Å²	20.9	14%	0.14	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	126.1	170.4	-76.5	176.1	-166.6	162.9	9.1	109.2	Q429 M431 I435 E454	Q429-R433 WeakPolarHBondContact O-CG 3.4Å; Q429-R433 PolarHBondContact O-N 3.37Å; M431-R433 VanDerWaalsContact C-N 3.25Å; M431-R433 PolarHBondContact O-N 3.47Å; R433-I435 PolarHBondContact O-N 3.26Å; R433-E454 VanDerWaalsContact NH2-CG 3.34Å; R433-E454 IonicContact NH2-OE1 2.66Å; R433-E454 PolarHBondContact NH2-OE1 3.37Å; R433-E454 VanDerWaalsContact NH2-OE1 3.07Å
434	G	58.8	Low	79.4	Confident	2 Å²	2	19.6 Å²	19.6	2%	0.021	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	-6.7	-179.4	0	0	0	0	0	116.9	A432 S436	A432-G434 PolarHBondContact O-N 3.4Å; G434-S436 PolarHBondContact O-N 3.02Å
435	I	67.6	Low	79.3	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.005	11%	0.111	C	C	.	.			trans	-79.4	117.1	166.5	-64.1	-176.7	0	0	0	107.7	D148 I401 K414 M431 A432 R433 F437 R461	D148-I435 HydrophobicContact CB-CG1 4.36Å; I401-I435 HydrophobicContact CD1-CD1 4.14Å; I401-I435 HydrophobicContact CG2-CD1 3.74Å; K414-I435 HydrophobicContact CD-CG2 3.71Å; K414-I435 HydrophobicContact CG-CG2 4.34Å; M431-I435 WeakPolarHBondContact O-CD1 2.96Å; M431-I435 WeakPolarHBondContact O-CG1 3.36Å; A432-I435 PolarHBondContact O-N 2.67Å; R433-I435 PolarHBondContact O-N 3.26Å; I435-F437 HydrophobicContact CB-CD2 4.45Å; I435-F437 HydrophobicContact CB-CE2 3.8Å; I435-F437 HydrophobicContact CB-CZ 4Å; I435-F437 HydrophobicContact CG2-CD1 4.1Å; I435-F437 HydrophobicContact CG2-CD2 3.85Å; I435-F437 HydrophobicContact CG2-CE1 3.66Å; I435-F437 HydrophobicContact CG2-CE2 3.38Å; I435-F437 HydrophobicContact CG2-CG 4.19Å; I435-F437 HydrophobicContact CG2-CZ 3.29Å; I435-F437 PolarHBondContact O-N 2.79Å; I435-R461 PolarHBondContact O-NH1 2.89Å
436	S	65.7	Low	79.3	Confident	44 Å²	44	20.9 Å²	20.9	31%	0.308	12%	0.116	S	C	.	.			trans	-76	114.8	164.3	-167.4	0	0	0	0	108.8	G434 R464	G434-S436 PolarHBondContact O-N 3.02Å; S436-R464 PolarHBondContact OG-NH1 3.2Å
437	F	72.5	Confident	79	Confident	5 Å²	5	21.5 Å²	21.5	2%	0.022	12%	0.119	C	C	.	.			trans	-95.3	140.1	160.7	-58.4	-82.9	0	0	0	107.3	L375 I401 K414 L417 I425 A432 I435 L440 R464	L375-F437 HydrophobicContact CD1-CD1 4.41Å; L375-F437 HydrophobicContact CD1-CD2 4.4Å; L375-F437 HydrophobicContact CD1-CE1 3.81Å; L375-F437 HydrophobicContact CD1-CE2 3.8Å; L375-F437 HydrophobicContact CD1-CZ 3.46Å; L375-F437 VanDerWaalsContact CD1-CZ 3.46Å; L375-F437 HydrophobicContact CD2-CD2 3.71Å; L375-F437 HydrophobicContact CD2-CE2 3.51Å; L375-F437 HydrophobicContact CD2-CG 4.44Å; L375-F437 HydrophobicContact CD2-CZ 4.09Å; L375-F437 HydrophobicContact CG-CE2 4.32Å; L375-F437 HydrophobicContact CG-CZ 4.44Å; I401-F437 HydrophobicContact CD1-CE1 4.1Å; I401-F437 HydrophobicContact CD1-CZ 4.23Å; K414-F437 HydrophobicContact CG-CE1 4.34Å; L417-F437 HydrophobicContact CD2-CD1 4.46Å; I425-F437 HydrophobicContact CD1-CD1 4.38Å; I425-F437 HydrophobicContact CD1-CE1 3.86Å; I425-F437 HydrophobicContact CG2-CE1 4.49Å; A432-F437 HydrophobicContact CB-CE2 3.9Å; A432-F437 HydrophobicContact CB-CZ 4.32Å; I435-F437 HydrophobicContact CB-CD2 4.45Å; I435-F437 HydrophobicContact CB-CE2 3.8Å; I435-F437 HydrophobicContact CB-CZ 4Å; I435-F437 HydrophobicContact CG2-CD1 4.1Å; I435-F437 HydrophobicContact CG2-CD2 3.85Å; I435-F437 HydrophobicContact CG2-CE1 3.66Å; I435-F437 HydrophobicContact CG2-CE2 3.38Å; I435-F437 HydrophobicContact CG2-CG 4.19Å; I435-F437 HydrophobicContact CG2-CZ 3.29Å; I435-F437 PolarHBondContact O-N 2.79Å; F437-L440 HydrophobicContact CB-CD1 3.64Å; F437-L440 HydrophobicContact CB-CD2 4.02Å; F437-L440 HydrophobicContact CB-CG 3.77Å; F437-L440 HydrophobicContact CD2-CD1 4.18Å; F437-L440 HydrophobicContact CG-CD1 3.96Å; F437-L440 HydrophobicContact CG-CG 4.49Å; F437-R464 PolarHBondContact O-NH1 2.82Å
438	D	68.8	Low	78.6	Confident	84 Å²	84	23 Å²	23	45%	0.449	13%	0.129	S	C	.	.	S	Bend	trans	-65.2	150.9	166.2	-67.7	-31.4	0	0	0	108.6	R373 N418 L440	R373-D438 VanDerWaalsContact NH1-C 3.35Å; R373-D438 PolarHBondContact NH1-O 3.38Å; N418-D438 VanDerWaalsContact CG-OD2 3.26Å; N418-D438 PolarHBondContact ND2-OD2 3.32Å; N418-D438 PolarHBondContact OD1-OD2 2.98Å; D438-L440 PolarHBondContact O-N 3.36Å
439	D	71	Confident	78.3	Confident	38 Å²	38	23 Å²	23	20%	0.203	13%	0.13	C	C	.	.			trans	-33.6	99.1	-169.5	-173.2	44.3	0	0	0	115	R373 K467	R373-D439 PolarHBondContact NH2-O 2.82Å; D439-K467 HydrophobicContact CB-CD 4.33Å; D439-K467 VanDerWaalsContact CG-CD 3.48Å; D439-K467 WeakPolarHBondContact OD2-CD 3.13Å; D439-K467 IonicContact OD2-NZ 2.9Å; D439-K467 PolarHBondContact OD2-NZ 3Å; D439-K467 VanDerWaalsContact OD2-NZ 3.08Å
440	L	85.2	Confident	78.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-78.8	132.2	-177.3	-65.3	166.5	0	0	0	109.3	R373 L375 L417 F437 D438 V443 R461 T462	R373-L440 HydrophobicContact CB-CD2 4Å; L375-L440 HydrophobicContact CB-CD1 3.46Å; L375-L440 VanDerWaalsContact CB-CD1 3.46Å; L375-L440 HydrophobicContact CB-CD2 4.32Å; L375-L440 HydrophobicContact CB-CG 4.47Å; L375-L440 HydrophobicContact CD2-CD1 3.71Å; L375-L440 HydrophobicContact CG-CD1 4.19Å; L417-L440 HydrophobicContact CD2-CD2 3.98Å; F437-L440 HydrophobicContact CB-CD1 3.64Å; F437-L440 HydrophobicContact CB-CD2 4.02Å; F437-L440 HydrophobicContact CB-CG 3.77Å; F437-L440 HydrophobicContact CD2-CD1 4.18Å; F437-L440 HydrophobicContact CG-CD1 3.96Å; F437-L440 HydrophobicContact CG-CG 4.49Å; D438-L440 PolarHBondContact O-N 3.36Å; L440-V443 HydrophobicContact CD1-CG2 4.38Å; L440-R461 HydrophobicContact CD1-CB 3.97Å; L440-T462 WeakPolarHBondContact O-CB 3.43Å; L440-T462 PolarHBondContact O-OG1 2.79Å
441	G	88.2	Confident	78.5	Confident	31 Å²	31	28.3 Å²	28.3	32%	0.32	15%	0.151	S	C	.	.	S	Bend	trans	-73.4	-31	177.4	0	0	0	0	0	112.5	R373 I470	R373-G441 PolarHBondContact O-N 2.82Å; G441-I470 PolarHBondContact O-N 3.48Å
442	L	93.8	Very high	78.7	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	135	-177.8	174	65.9	0	0	0	111.4	F369 R373 I374 L375 I444 I470 I472	F369-L442 HydrophobicContact CB-CD2 4.18Å; F369-L442 HydrophobicContact CD1-CD2 4.47Å; F369-L442 HydrophobicContact CD2-CD2 3.64Å; F369-L442 HydrophobicContact CE2-CD2 4.08Å; F369-L442 HydrophobicContact CG-CD2 3.86Å; R373-L442 PolarHBondContact O-N 2.89Å; I374-L442 WeakPolarHBondContact CA-O 3.27Å; I374-L442 HydrophobicContact CD1-CD2 4.18Å; I374-L442 HydrophobicContact CG1-CB 4.21Å; I374-L442 HydrophobicContact CG1-CD2 4.36Å; I374-L442 HydrophobicContact CG2-CD2 4.3Å; I374-L442 HydrophobicContact CG2-CG 4.35Å; L375-L442 PolarHBondContact N-O 3.12Å; L375-L442 VanDerWaalsContact N-O 3.07Å; L442-I444 HydrophobicContact CD1-CG1 4.47Å; L442-I444 HydrophobicContact CD2-CD1 4.04Å; L442-I444 HydrophobicContact CD2-CG1 3.93Å; L442-I444 HydrophobicContact CG-CG1 3.95Å; L442-I470 CarbonylContact C-O 3.59Å; L442-I470 WeakPolarHBondContact CA-O 3.05Å; L442-I470 HydrophobicContact CD1-CB 3.92Å; L442-I470 HydrophobicContact CD1-CG2 3.72Å; L442-I472 HydrophobicContact CD1-CB 4.34Å; L442-I472 HydrophobicContact CD1-CD1 3.7Å; L442-I472 HydrophobicContact CD1-CG1 3.75Å; L442-I472 HydrophobicContact CD2-CD1 4.46Å
443	V	93.5	Very high	79.1	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.7	167.6	175.5	0	0	0	0	108.4	L375 F377 L440 R461 T462 I470 I471 I472	L375-V443 CarbonylContact O-C 3.53Å; L375-V443 WeakPolarHBondContact O-CA 3.36Å; F377-V443 HydrophobicContact CD2-CG1 3.58Å; F377-V443 HydrophobicContact CE2-CG1 3.57Å; L440-V443 HydrophobicContact CD1-CG2 4.38Å; V443-R461 HydrophobicContact CG2-CB 4.04Å; V443-T462 HydrophobicContact CB-CG2 4.43Å; V443-T462 HydrophobicContact CG2-CG2 3.83Å; V443-I470 PolarHBondContact N-O 3.03Å; V443-I471 HydrophobicContact CB-CB 4.33Å; V443-I471 HydrophobicContact CB-CD1 4.33Å; V443-I471 HydrophobicContact CB-CG1 4.11Å; V443-I471 HydrophobicContact CG1-CD1 3.91Å; V443-I471 HydrophobicContact CG1-CG1 4.03Å; V443-I471 CarbonylContact O-C 3.59Å; V443-I471 VanDerWaalsContact O-CA 3.29Å; V443-I471 WeakPolarHBondContact O-CA 3.41Å; V443-I472 PolarHBondContact O-N 3.12Å
444	I	95.1	Very high	79.5	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	119.1	176.7	-57	175.8	0	0	0	108.2	V362 L365 I374 L375 C376 F377 L442 Y446 I472 L474	V362-I444 HydrophobicContact CG1-CD1 4.38Å; V362-I444 HydrophobicContact CG2-CG2 4.27Å; L365-I444 HydrophobicContact CB-CD1 4.02Å; L365-I444 HydrophobicContact CD1-CD1 3.94Å; L365-I444 HydrophobicContact CD1-CG1 4.34Å; I374-I444 HydrophobicContact CG2-CD1 3.67Å; I374-I444 HydrophobicContact CG2-CG1 3.98Å; L375-I444 PolarHBondContact O-N 3.33Å; C376-I444 CarbonylContact C-O 3.55Å; C376-I444 VanDerWaalsContact CA-O 3.32Å; C376-I444 WeakPolarHBondContact CA-O 3.43Å; C376-I444 HydrophobicContact CB-CB 4.34Å; F377-I444 PolarHBondContact N-O 3.32Å; L442-I444 HydrophobicContact CD1-CG1 4.47Å; L442-I444 HydrophobicContact CD2-CD1 4.04Å; L442-I444 HydrophobicContact CD2-CG1 3.93Å; L442-I444 HydrophobicContact CG-CG1 3.95Å; I444-Y446 PolarHBondContact O-N 3.36Å; I444-I472 CarbonylContact C-O 3.59Å; I444-I472 WeakPolarHBondContact CA-O 3.47Å; I444-L474 HydrophobicContact CG2-CD1 4.42Å; I444-L474 HydrophobicContact CG2-CG 4.34Å
445	C	93.1	Very high	80.5	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	96.8	167.3	-54.9	0	0	0	0	107.6	M458 I472 T473 L474	C445-M458 HydrophobicContact CB-CE 4.48Å; C445-I472 PolarHBondContact N-O 3.5Å; C445-T473 HydrophobicContact CB-CG2 4.01Å; C445-L474 PolarHBondContact O-N 3.26Å
446	Y	94	Very high	81	Confident	28 Å²	28	30.3 Å²	30.3	11%	0.11	16%	0.163	C	C	.	.	S	Bend	trans	-68.2	-44.3	178.2	173.4	-90.4	0	0	0	111	K358 P359 V362 F377 T378 L387 I444 L474	K358-Y446 HydrophobicContact CB-CD2 4.06Å; K358-Y446 HydrophobicContact CB-CE2 3.45Å; K358-Y446 VanDerWaalsContact CB-CE2 3.45Å; K358-Y446 PolarHBondContact NZ-O 2.83Å; P359-Y446 HydrophobicContact CG-CE2 4.06Å; V362-Y446 HydrophobicContact CG2-CD2 3.78Å; V362-Y446 HydrophobicContact CG2-CE2 4.46Å; F377-Y446 VanDerWaalsContact O-CB 3.27Å; F377-Y446 WeakPolarHBondContact O-CB 3.41Å; F377-Y446 PolarHBondContact O-N 3.05Å; T378-Y446 HydrophobicContact CG2-CD1 3.84Å; T378-Y446 HydrophobicContact CG2-CG 4.18Å; L387-Y446 HydrophobicContact CD1-CD2 4.44Å; L387-Y446 HydrophobicContact CD1-CE2 4.16Å; L387-Y446 HydrophobicContact CD2-CD2 3.74Å; L387-Y446 HydrophobicContact CD2-CE2 4.13Å; L387-Y446 HydrophobicContact CD2-CG 3.97Å; I444-Y446 PolarHBondContact O-N 3.36Å; Y446-L474 HydrophobicContact CD2-CD1 4.13Å
447	D	89.2	Confident	81.4	Confident	13 Å²	13	28.9 Å²	28.9	7%	0.07	15%	0.151	C	C	.	.	S	Bend	trans	-104.4	131.8	167.3	-59.1	-49.2	0	0	0	107.9	F377 T378 E379 H383	F377-D447 PolarHBondContact O-N 2.85Å; T378-D447 WeakPolarHBondContact CA-OD2 3.08Å; E379-D447 HydrophobicContact CB-CB 3.77Å; E379-D447 WeakPolarHBondContact CB-OD2 3.23Å; E379-D447 PolarHBondContact N-OD2 2.91Å; H383-D447 IonicContact CG-OD2 3.95Å; H383-D447 IonicContact ND1-OD1 3.25Å; H383-D447 IonicContact ND1-OD2 3.26Å; H383-D447 PolarHBondContact ND1-OD2 3.22Å; H383-D447 VanDerWaalsContact ND1-OD2 3.09Å
448	P	83.7	Confident	81.8	Confident	32 Å²	32	28.8 Å²	28.8	21%	0.208	15%	0.151	C	C	.	.			trans	-62.4	153.9	-180	25.6	-33	0	0	0	111.7	T473 E479	P448-T473 HydrophobicContact CB-CG2 4.1Å; P448-E479 HydrophobicContact CG-CG 4.48Å
449	A	81	Confident	82.4	Confident	11 Å²	11	24.8 Å²	24.8	9%	0.091	13%	0.13	C	C	.	.			trans	-71.2	142.6	175.9	0	0	0	0	0	110.4	T451 E454 M458	A449-T451 VanDerWaalsContact C-N 3.34Å; A449-E454 HydrophobicContact CB-CB 4.06Å; A449-M458 HydrophobicContact CB-CE 3.32Å
450	R	75.6	Confident	82.7	Confident	158 Å²	158	23 Å²	23	60%	0.596	12%	0.12	S	C	*	.	S	Bend	trans	-80.4	-19.2	176.4	-58.7	178.9	179.4	-172.6	-3.3	112.9	E379 E454	E379-R450 IonicContact OE1-CZ 3.44Å; E379-R450 IonicContact OE1-NE 3.63Å; E379-R450 PolarHBondContact OE1-NE 3.15Å; E379-R450 IonicContact OE1-NH2 2.89Å; E379-R450 PolarHBondContact OE1-NH2 3.36Å; R450-E454 PolarHBondContact N-OE2 3.44Å
451	T	73.3	Confident	82.6	Confident	65 Å²	65	23.4 Å²	23.4	40%	0.399	12%	0.122	S	C	.	.	S	Bend	trans	-141.5	156	177.1	73.8	0	0	0	0	111.1	A449 Q453 E454 Y455	A449-T451 VanDerWaalsContact C-N 3.34Å; T451-Q453 PolarHBondContact O-N 3.3Å; T451-E454 PolarHBondContact O-N 3.12Å; T451-E454 VanDerWaalsContact O-N 3.14Å; T451-E454 WeakPolarHBondContact OG1-CG 3.49Å; T451-E454 PolarHBondContact OG1-N 3.02Å; T451-Y455 PolarHBondContact O-N 3.19Å
452	L	73	Confident	82.4	Confident	16 Å²	16	22 Å²	22	8%	0.084	11%	0.107	C	C	.	.	H	α-helix	trans	-59.7	-30.6	175.2	-169.1	63.4	0	0	0	112.4	I340 F342 Y455 A456 Y491 L492	I340-L452 HydrophobicContact CB-CD2 4.45Å; I340-L452 HydrophobicContact CD1-CB 3.9Å; I340-L452 HydrophobicContact CD1-CD2 3.78Å; I340-L452 HydrophobicContact CD1-CG 3.65Å; F342-L452 HydrophobicContact CE2-CD1 4.31Å; F342-L452 HydrophobicContact CZ-CD1 3.78Å; F342-L452 HydrophobicContact CZ-CG 4.24Å; L452-Y455 HydrophobicContact CD1-CD1 4.46Å; L452-A456 WeakPolarHBondContact O-CB 3.35Å; L452-A456 PolarHBondContact O-N 3.05Å; L452-Y491 HydrophobicContact CD1-CD1 4.4Å; L452-Y491 HydrophobicContact CD2-CD1 3.91Å; L452-Y491 HydrophobicContact CD2-CE1 4.16Å; L452-L492 HydrophobicContact CD1-CD1 3.97Å
453	Q	71	Confident	81.8	Confident	55 Å²	55	22.3 Å²	22.3	26%	0.257	11%	0.11	S	C	.	.	H	α-helix	trans	-65.5	-47.6	175.3	174	169.8	11.8	0	0	111.1	D232 T304 I340 T451 Y455 A456 H457	D232-Q453 PolarHBondContact OD2-NE2 2.9Å; T304-Q453 HydrophobicContact CG2-CB 4.4Å; T304-Q453 HydrophobicContact CG2-CG 3.84Å; T304-Q453 PolarHBondContact OG1-NE2 3.44Å; I340-Q453 HydrophobicContact CD1-CB 4.46Å; T451-Q453 PolarHBondContact O-N 3.3Å; Q453-Y455 VanDerWaalsContact C-N 3.31Å; Q453-Y455 PolarHBondContact O-N 2.85Å; Q453-A456 WeakPolarHBondContact O-CB 3.47Å; Q453-A456 PolarHBondContact O-N 3.4Å; Q453-H457 PolarHBondContact O-CD2 2.9Å; Q453-H457 PolarHBondContact O-N 3.14Å; Q453-H457 VanDerWaalsContact O-N 3.09Å
454	E	75.5	Confident	81.1	Confident	43 Å²	43	24 Å²	24	20%	0.201	12%	0.116	C	C	.	.	H	α-helix	trans	-59.8	-44.8	176.6	-65.6	-166.2	139.1	0	0	111.6	R433 A449 R450 T451 A456 H457 M458	R433-E454 VanDerWaalsContact NH2-CG 3.34Å; R433-E454 IonicContact NH2-OE1 2.66Å; R433-E454 PolarHBondContact NH2-OE1 3.37Å; R433-E454 VanDerWaalsContact NH2-OE1 3.07Å; A449-E454 HydrophobicContact CB-CB 4.06Å; R450-E454 PolarHBondContact N-OE2 3.44Å; T451-E454 PolarHBondContact O-N 3.12Å; T451-E454 VanDerWaalsContact O-N 3.14Å; T451-E454 WeakPolarHBondContact OG1-CG 3.49Å; T451-E454 PolarHBondContact OG1-N 3.02Å; E454-A456 VanDerWaalsContact C-N 3.34Å; E454-A456 PolarHBondContact O-N 3.35Å; E454-H457 PolarHBondContact O-N 2.74Å; E454-H457 VanDerWaalsContact O-N 3.17Å; E454-M458 PolarHBondContact O-N 3.1Å; E454-M458 VanDerWaalsContact O-N 3.11Å
455	Y	80.3	Confident	79.9	Confident	1 Å²	1	26.1 Å²	26.1	0%	0.004	13%	0.133	C	C	.	.	H	α-helix	trans	-58.9	-44	175	-179.1	-98.2	0	0	0	112	F342 E348 T451 L452 Q453 H457 M458 A459 I471 L492 L496	F342-Y455 HydrophobicContact CD1-CE1 4.41Å; F342-Y455 AromaticContact CE1-CD1 3.48Å; F342-Y455 HydrophobicContact CE1-CD1 3.48Å; F342-Y455 VanDerWaalsContact CE1-CD1 3.48Å; F342-Y455 AromaticContact CE1-CE1 3.63Å; F342-Y455 HydrophobicContact CE1-CE1 3.63Å; F342-Y455 AromaticContact CZ-CD1 3.82Å; F342-Y455 HydrophobicContact CZ-CD1 3.82Å; F342-Y455 HydrophobicContact CZ-CE1 4.11Å; E348-Y455 WeakPolarHBondContact OE2-CE1 3.48Å; E348-Y455 PolarHBondContact OE2-OH 2.96Å; T451-Y455 PolarHBondContact O-N 3.19Å; L452-Y455 HydrophobicContact CD1-CD1 4.46Å; Q453-Y455 VanDerWaalsContact C-N 3.31Å; Q453-Y455 PolarHBondContact O-N 2.85Å; Y455-H457 VanDerWaalsContact C-N 3.29Å; Y455-H457 PolarHBondContact O-N 3.03Å; Y455-M458 HydrophobicContact CD2-CE 4.36Å; Y455-M458 PolarHBondContact O-N 2.86Å; Y455-M458 VanDerWaalsContact O-N 3.12Å; Y455-A459 HydrophobicContact CE1-CB 4.4Å; Y455-A459 VanDerWaalsContact O-CB 3.28Å; Y455-A459 WeakPolarHBondContact O-CB 3.06Å; Y455-A459 PolarHBondContact O-N 2.77Å; Y455-I471 HydrophobicContact CD2-CD1 4.47Å; Y455-I471 HydrophobicContact CE2-CD1 3.87Å; Y455-I471 HydrophobicContact CE2-CG1 4.4Å; Y455-I471 WeakPolarHBondContact OH-CG2 3.43Å; Y455-L492 HydrophobicContact CD1-CD1 3.37Å; Y455-L492 HydrophobicContact CD2-CD1 3.79Å; Y455-L492 HydrophobicContact CD2-CD2 4.17Å; Y455-L492 HydrophobicContact CE1-CD1 3.6Å; Y455-L492 HydrophobicContact CE2-CD1 3.99Å; Y455-L492 HydrophobicContact CG-CD1 3.47Å; Y455-L492 VanDerWaalsContact CG-CD1 3.47Å; Y455-L492 HydrophobicContact CG-CD2 4.22Å; Y455-L496 HydrophobicContact CE2-CD2 4.44Å; Y455-L496 WeakPolarHBondContact OH-CD2 3.06Å
456	A	77	Confident	78.9	Confident	12 Å²	12	26.9 Å²	26.9	10%	0.099	14%	0.141	C	C	.	.	H	α-helix	trans	-59.8	-36.2	176	0	0	0	0	0	113.5	I340 F342 L452 Q453 E454 G460	I340-A456 HydrophobicContact CG2-CB 3.62Å; F342-A456 HydrophobicContact CD1-CB 4.3Å; F342-A456 HydrophobicContact CE1-CB 3.67Å; F342-A456 HydrophobicContact CZ-CB 4.08Å; L452-A456 WeakPolarHBondContact O-CB 3.35Å; L452-A456 PolarHBondContact O-N 3.05Å; Q453-A456 WeakPolarHBondContact O-CB 3.47Å; Q453-A456 PolarHBondContact O-N 3.4Å; E454-A456 VanDerWaalsContact C-N 3.34Å; E454-A456 PolarHBondContact O-N 3.35Å; A456-G460 PolarHBondContact O-N 2.81Å
457	H	75.6	Confident	78.3	Confident	14 Å²	14	30.8 Å²	30.8	7%	0.065	16%	0.159	C	C	.	.	H	α-helix	trans	-70.2	-34.6	175.4	-68.8	-69.9	0	0	0	113.1	E230 D232 Q453 E454 Y455 R461	E230-H457 IonicContact OE2-CE1 2.81Å; D232-H457 IonicContact OD2-CE1 2.76Å; D232-H457 IonicContact OD2-NE2 2.61Å; D232-H457 PolarHBondContact OD2-NE2 2.82Å; Q453-H457 PolarHBondContact O-CD2 2.9Å; Q453-H457 PolarHBondContact O-N 3.14Å; Q453-H457 VanDerWaalsContact O-N 3.09Å; E454-H457 PolarHBondContact O-N 2.74Å; E454-H457 VanDerWaalsContact O-N 3.17Å; Y455-H457 VanDerWaalsContact C-N 3.29Å; Y455-H457 PolarHBondContact O-N 3.03Å; H457-R461 PolarHBondContact O-NE 2.84Å; H457-R461 VanDerWaalsContact O-NE 3.11Å
458	M	81	Confident	78.1	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.015	19%	0.185	C	C	.	.	H	α-helix	trans	-70	-52.1	174.6	-67.4	-168.7	-70.8	0	0	111.1	F377 Q429 C445 A449 E454 Y455 G460 R461 I471	F377-M458 HydrophobicContact CB-SD 3.67Å; F377-M458 HydrophobicContact CD1-CG 4.18Å; F377-M458 HydrophobicContact CD1-SD 4.15Å; F377-M458 HydrophobicContact CD2-CB 3.98Å; F377-M458 HydrophobicContact CD2-CG 3.79Å; F377-M458 HydrophobicContact CD2-SD 3.78Å; F377-M458 HydrophobicContact CE1-CG 4.1Å; F377-M458 HydrophobicContact CE2-CB 3.76Å; F377-M458 HydrophobicContact CE2-CG 3.78Å; F377-M458 HydrophobicContact CE2-SD 4.39Å; F377-M458 HydrophobicContact CG-CG 3.98Å; F377-M458 HydrophobicContact CG-SD 3.63Å; F377-M458 HydrophobicContact CZ-CB 4.22Å; F377-M458 HydrophobicContact CZ-CG 3.92Å; Q429-M458 HydrophobicContact CG-CG 4.43Å; Q429-M458 HydrophobicContact CG-SD 3.7Å; C445-M458 HydrophobicContact CB-CE 4.48Å; A449-M458 HydrophobicContact CB-CE 3.32Å; E454-M458 PolarHBondContact O-N 3.1Å; E454-M458 VanDerWaalsContact O-N 3.11Å; Y455-M458 HydrophobicContact CD2-CE 4.36Å; Y455-M458 PolarHBondContact O-N 2.86Å; Y455-M458 VanDerWaalsContact O-N 3.12Å; M458-G460 PolarHBondContact O-N 2.76Å; M458-R461 VanDerWaalsContact O-CB 3.3Å; M458-R461 WeakPolarHBondContact O-CB 3.11Å; M458-R461 WeakPolarHBondContact O-CG 3.47Å; M458-R461 PolarHBondContact O-N 2.88Å; M458-I471 HydrophobicContact CB-CD1 4.27Å
459	A	81.4	Confident	78.3	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-51.8	-40.5	173.8	0	0	0	0	0	112.1	F342 L346 Y455 R461 T462 I471	F342-A459 HydrophobicContact CD1-CB 4.03Å; F342-A459 HydrophobicContact CE1-CB 4.26Å; L346-A459 HydrophobicContact CD2-CB 3.58Å; Y455-A459 HydrophobicContact CE1-CB 4.4Å; Y455-A459 VanDerWaalsContact O-CB 3.28Å; Y455-A459 WeakPolarHBondContact O-CB 3.06Å; Y455-A459 PolarHBondContact O-N 2.77Å; A459-R461 PolarHBondContact O-N 2.9Å; A459-T462 WeakPolarHBondContact O-CG2 3.48Å; A459-T462 PolarHBondContact O-N 2.84Å; A459-I471 HydrophobicContact CB-CD1 4.03Å
460	G	77.2	Confident	78.9	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.01	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	0.7	178.4	0	0	0	0	0	116.4	T114 A456 M458 R464	T114-G460 VanDerWaalsContact OG1-C 3.24Å; T114-G460 WeakPolarHBondContact OG1-CA 3.41Å; T114-G460 PolarHBondContact OG1-O 2.69Å; A456-G460 PolarHBondContact O-N 2.81Å; M458-G460 PolarHBondContact O-N 2.76Å; G460-R464 PolarHBondContact O-NE 2.97Å
461	R	81.7	Confident	79.7	Confident	9 Å²	9	26.9 Å²	26.9	3%	0.034	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-21.7	170.2	-59.8	-56.7	114.9	175.3	2.9	113.1	L375 F377 I435 L440 V443 H457 M458 A459	L375-R461 HydrophobicContact CD2-CB 4.06Å; L375-R461 HydrophobicContact CD2-CG 3.87Å; F377-R461 HydrophobicContact CE2-CG 4.04Å; F377-R461 HydrophobicContact CZ-CG 3.72Å; I435-R461 PolarHBondContact O-NH1 2.89Å; L440-R461 HydrophobicContact CD1-CB 3.97Å; V443-R461 HydrophobicContact CG2-CB 4.04Å; H457-R461 PolarHBondContact O-NE 2.84Å; H457-R461 VanDerWaalsContact O-NE 3.11Å; M458-R461 VanDerWaalsContact O-CB 3.3Å; M458-R461 WeakPolarHBondContact O-CB 3.11Å; M458-R461 WeakPolarHBondContact O-CG 3.47Å; M458-R461 PolarHBondContact O-N 2.88Å; A459-R461 PolarHBondContact O-N 2.9Å
462	T	85	Confident	80.7	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.134	C	C	.	.	B	Isolated β-bridge	trans	-114.5	178.7	173.9	-172.8	0	0	0	0	110.4	L346 L440 V443 A459 R464 G469	L346-T462 HydrophobicContact CD1-CG2 3.4Å; L440-T462 WeakPolarHBondContact O-CB 3.43Å; L440-T462 PolarHBondContact O-OG1 2.79Å; V443-T462 HydrophobicContact CB-CG2 4.43Å; V443-T462 HydrophobicContact CG2-CG2 3.83Å; A459-T462 WeakPolarHBondContact O-CG2 3.48Å; A459-T462 PolarHBondContact O-N 2.84Å; T462-R464 VanDerWaalsContact C-N 3.26Å; T462-R464 PolarHBondContact O-N 3.38Å; T462-G469 WeakPolarHBondContact OG1-CA 3.43Å
463	A	80.8	Confident	81.6	Confident	8 Å²	8	23 Å²	23	7%	0.066	13%	0.131	C	C	.	.	S	Bend	trans	53.2	39.3	-178.7	0	0	0	0	0	113.8	P343 L346 K467	P343-A463 HydrophobicContact CB-CB 3.64Å; P343-A463 HydrophobicContact CG-CB 4.32Å; L346-A463 HydrophobicContact CB-CB 4.22Å; L346-A463 HydrophobicContact CD1-CB 4.27Å; A463-K467 CarbonylContact C-O 3.09Å; A463-K467 WeakPolarHBondContact CA-O 3.3Å; A463-K467 WeakPolarHBondContact CB-O 3.48Å
464	R	77.9	Confident	82.6	Confident	36 Å²	36	20.4 Å²	20.4	14%	0.136	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-83.3	151.1	-177.5	-70.7	-176.8	166.9	-167.5	-4.9	111.2	S436 F437 G460 T462 G466 K467	S436-R464 PolarHBondContact OG-NH1 3.2Å; F437-R464 PolarHBondContact O-NH1 2.82Å; G460-R464 PolarHBondContact O-NE 2.97Å; T462-R464 VanDerWaalsContact C-N 3.26Å; T462-R464 PolarHBondContact O-N 3.38Å; R464-G466 PolarHBondContact O-N 3.16Å; R464-G466 VanDerWaalsContact O-N 3.11Å; R464-K467 WeakPolarHBondContact O-CB 3.3Å; R464-K467 PolarHBondContact O-N 3.01Å; R464-K467 VanDerWaalsContact O-N 3.08Å
465	A	71.7	Confident	83.2	Confident	43 Å²	43	18.8 Å²	18.8	36%	0.355	11%	0.111	S	C	.	.	G	3₁₀ helix	trans	52.2	35.2	175.4	0	0	0	0	0	114.3	F83 K467	F83-A465 HydrophobicContact CE2-CB 4.26Å; F83-A465 HydrophobicContact CZ-CB 3.71Å; A465-K467 VanDerWaalsContact C-N 3.32Å; A465-K467 PolarHBondContact O-N 3.45Å
466	G	71.7	Confident	83.4	Confident	16 Å²	16	19.2 Å²	19.2	17%	0.165	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	82.7	1	177	0	0	0	0	0	115.3	N345 R464	N345-G466 PolarHBondContact ND2-O 3.2Å; R464-G466 PolarHBondContact O-N 3.16Å; R464-G466 VanDerWaalsContact O-N 3.11Å
467	K	80.6	Confident	83.3	Confident	111 Å²	111	23.4 Å²	23.4	48%	0.483	13%	0.131	S	C	.	.			trans	-77.2	161.6	174.1	-62.2	-176.2	176.6	-176.2	0	111.8	D439 A463 R464 A465	D439-K467 HydrophobicContact CB-CD 4.33Å; D439-K467 VanDerWaalsContact CG-CD 3.48Å; D439-K467 WeakPolarHBondContact OD2-CD 3.13Å; D439-K467 IonicContact OD2-NZ 2.9Å; D439-K467 PolarHBondContact OD2-NZ 3Å; D439-K467 VanDerWaalsContact OD2-NZ 3.08Å; A463-K467 CarbonylContact C-O 3.09Å; A463-K467 WeakPolarHBondContact CA-O 3.3Å; A463-K467 WeakPolarHBondContact CB-O 3.48Å; R464-K467 WeakPolarHBondContact O-CB 3.3Å; R464-K467 PolarHBondContact O-N 3.01Å; R464-K467 VanDerWaalsContact O-N 3.08Å; A465-K467 VanDerWaalsContact C-N 3.32Å; A465-K467 PolarHBondContact O-N 3.45Å
468	S	85.2	Confident	83.2	Confident	89 Å²	89	29.3 Å²	29.3	62%	0.622	16%	0.159	S	C	*	.			trans	-80.2	149.8	175	-56.3	0	0	0	0	111.1	N345	N345-S468 CarbonylContact O-C 3.58Å; N345-S468 VanDerWaalsContact O-CA 3.31Å; N345-S468 WeakPolarHBondContact O-CA 3.35Å
469	G	88.1	Confident	82.7	Confident	2 Å²	2	31.3 Å²	31.3	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	151.3	-179.2	0	0	0	0	0	111.7	N345 L346 D347 T462	N345-G469 PolarHBondContact O-N 3.35Å; L346-G469 WeakPolarHBondContact CA-O 3.46Å; D347-G469 PolarHBondContact N-O 3.37Å; T462-G469 WeakPolarHBondContact OG1-CA 3.43Å
470	I	92.8	Very high	82	Confident	40 Å²	40	32.9 Å²	32.9	21%	0.205	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.4	-179.6	-54.7	174.5	0	0	0	108.7	D347 L349 F369 G441 L442 V443 I472	D347-I470 HydrophobicContact CB-CG1 4.34Å; L349-I470 HydrophobicContact CD1-CG2 3.8Å; F369-I470 HydrophobicContact CE1-CD1 3.95Å; F369-I470 HydrophobicContact CZ-CD1 4.41Å; G441-I470 PolarHBondContact O-N 3.48Å; L442-I470 CarbonylContact C-O 3.59Å; L442-I470 WeakPolarHBondContact CA-O 3.05Å; L442-I470 HydrophobicContact CD1-CB 3.92Å; L442-I470 HydrophobicContact CD1-CG2 3.72Å; V443-I470 PolarHBondContact N-O 3.03Å; I470-I472 HydrophobicContact CG2-CD1 4.42Å; I470-I472 HydrophobicContact CG2-CG1 4Å
471	I	92.3	Very high	81.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125.9	167.2	-173.9	161.5	0	0	0	109.5	L346 D347 E348 L349 V443 Y455 M458 A459	L346-I471 HydrophobicContact CD1-CB 4.29Å; L346-I471 HydrophobicContact CD1-CG2 3.91Å; L346-I471 HydrophobicContact CD2-CG2 4.08Å; L346-I471 HydrophobicContact CG-CG2 4.04Å; D347-I471 PolarHBondContact O-N 2.99Å; E348-I471 HydrophobicContact CB-CG2 4.24Å; E348-I471 HydrophobicContact CG-CG2 4.04Å; L349-I471 PolarHBondContact N-O 3.39Å; V443-I471 HydrophobicContact CB-CB 4.33Å; V443-I471 HydrophobicContact CB-CD1 4.33Å; V443-I471 HydrophobicContact CB-CG1 4.11Å; V443-I471 HydrophobicContact CG1-CD1 3.91Å; V443-I471 HydrophobicContact CG1-CG1 4.03Å; V443-I471 CarbonylContact O-C 3.59Å; V443-I471 VanDerWaalsContact O-CA 3.29Å; V443-I471 WeakPolarHBondContact O-CA 3.41Å; Y455-I471 HydrophobicContact CD2-CD1 4.47Å; Y455-I471 HydrophobicContact CE2-CD1 3.87Å; Y455-I471 HydrophobicContact CE2-CG1 4.4Å; Y455-I471 WeakPolarHBondContact OH-CG2 3.43Å; M458-I471 HydrophobicContact CB-CD1 4.27Å; A459-I471 HydrophobicContact CB-CD1 4.03Å
472	I	94.1	Very high	80	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.1	177.4	-62.3	175.4	0	0	0	108.4	L349 I351 L365 F369 L442 V443 I444 C445 I470 L474 F499	L349-I472 HydrophobicContact CB-CG1 4.15Å; L349-I472 HydrophobicContact CD1-CG1 4.36Å; L349-I472 WeakPolarHBondContact O-CA 3.49Å; I351-I472 HydrophobicContact CD1-CG2 3.68Å; I351-I472 HydrophobicContact CG1-CG2 3.82Å; L365-I472 HydrophobicContact CD1-CD1 4.27Å; L365-I472 HydrophobicContact CD1-CG2 4.2Å; L365-I472 HydrophobicContact CD2-CD1 3.82Å; F369-I472 HydrophobicContact CE2-CD1 4.26Å; L442-I472 HydrophobicContact CD1-CB 4.34Å; L442-I472 HydrophobicContact CD1-CD1 3.7Å; L442-I472 HydrophobicContact CD1-CG1 3.75Å; L442-I472 HydrophobicContact CD2-CD1 4.46Å; V443-I472 PolarHBondContact O-N 3.12Å; I444-I472 CarbonylContact C-O 3.59Å; I444-I472 WeakPolarHBondContact CA-O 3.47Å; C445-I472 PolarHBondContact N-O 3.5Å; I470-I472 HydrophobicContact CG2-CD1 4.42Å; I470-I472 HydrophobicContact CG2-CG1 4Å; I472-L474 HydrophobicContact CG2-CD2 4.25Å; I472-F499 HydrophobicContact CD1-CD1 4.39Å; I472-F499 HydrophobicContact CD1-CD2 4.47Å; I472-F499 HydrophobicContact CD1-CE1 4.4Å; I472-F499 HydrophobicContact CD1-CE2 4.47Å; I472-F499 HydrophobicContact CD1-CG 4.41Å; I472-F499 HydrophobicContact CD1-CZ 4.43Å
473	T	92.8	Very high	78.4	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.5	175.5	-55.6	0	0	0	0	110.7	L349 F350 I351 C445 P448 M475	L349-T473 PolarHBondContact O-N 3.49Å; F350-T473 CarbonylContact C-O 3.56Å; F350-T473 VanDerWaalsContact CA-O 3.23Å; F350-T473 WeakPolarHBondContact CA-O 3.3Å; I351-T473 PolarHBondContact N-O 2.85Å; C445-T473 HydrophobicContact CB-CG2 4.01Å; P448-T473 HydrophobicContact CB-CG2 4.1Å; T473-M475 HydrophobicContact CG2-CE 3.71Å
474	L	92.2	Very high	76.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	122.8	173.3	-53.7	-171.9	0	0	0	109.2	I351 K358 V361 V362 L365 I444 C445 Y446 I472	I351-L474 HydrophobicContact CB-CD2 3.88Å; I351-L474 HydrophobicContact CD1-CD2 4.1Å; I351-L474 HydrophobicContact CG1-CD2 4.43Å; K358-L474 HydrophobicContact CB-CD1 4.06Å; K358-L474 HydrophobicContact CD-CB 4.21Å; K358-L474 HydrophobicContact CG-CB 4.22Å; K358-L474 HydrophobicContact CG-CD1 4.28Å; K358-L474 PolarHBondContact NZ-O 3.21Å; V361-L474 HydrophobicContact CG1-CD1 4.42Å; V361-L474 HydrophobicContact CG1-CD2 3.73Å; V362-L474 HydrophobicContact CG2-CD1 3.7Å; L365-L474 HydrophobicContact CD1-CD2 4.49Å; I444-L474 HydrophobicContact CG2-CD1 4.42Å; I444-L474 HydrophobicContact CG2-CG 4.34Å; C445-L474 PolarHBondContact O-N 3.26Å; Y446-L474 HydrophobicContact CD2-CD1 4.13Å; I472-L474 HydrophobicContact CG2-CD2 4.25Å
475	M	87.8	Confident	75	Confident	8 Å²	8	57 Å²	57	4%	0.039	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	150.4	-179.4	53.2	-175.2	63.7	0	0	110.1	F350 I351 D352 C353 T473 E479 K480 L496	F350-M475 HydrophobicContact CB-CE 3.76Å; F350-M475 HydrophobicContact CB-CG 4.36Å; F350-M475 HydrophobicContact CB-SD 3.89Å; F350-M475 HydrophobicContact CD2-CG 4.01Å; F350-M475 HydrophobicContact CD2-SD 3.64Å; F350-M475 HydrophobicContact CE2-SD 4.42Å; F350-M475 HydrophobicContact CG-CE 4.38Å; F350-M475 HydrophobicContact CG-SD 3.92Å; I351-M475 PolarHBondContact O-N 3.29Å; I351-M475 VanDerWaalsContact O-N 3.1Å; D352-M475 CarbonylContact C-O 3.53Å; D352-M475 VanDerWaalsContact CA-O 3.29Å; D352-M475 WeakPolarHBondContact CA-O 3.33Å; C353-M475 PolarHBondContact N-O 3Å; T473-M475 HydrophobicContact CG2-CE 3.71Å; M475-E479 WeakPolarHBondContact CA-OE2 3.37Å; M475-E479 HydrophobicContact CB-CB 4.44Å; M475-K480 HydrophobicContact CG-CG 4.23Å; M475-K480 HydrophobicContact SD-CD 4.49Å; M475-K480 HydrophobicContact SD-CG 3.79Å; M475-L496 HydrophobicContact CE-CD1 3.4Å; M475-L496 VanDerWaalsContact CE-CD1 3.4Å
476	S	84	Confident	74	Confident	10 Å²	10	58.7 Å²	58.7	7%	0.07	29%	0.292	C	S	.	.			trans	-99.1	163.1	168.8	55.6	0	0	0	0	110.4	C353 E478 E479 K480	C353-S476 WeakPolarHBondContact O-CA 3.36Å; S476-E478 VanDerWaalsContact C-N 3.27Å; S476-E478 PolarHBondContact O-N 3.23Å; S476-E479 PolarHBondContact N-OE2 2.95Å; S476-E479 CarbonylContact O-C 3.6Å; S476-E479 WeakPolarHBondContact O-CA 3.37Å; S476-E479 WeakPolarHBondContact O-CB 3.33Å; S476-E479 PolarHBondContact O-N 3.5Å; S476-E479 VanDerWaalsContact OG-CD 3.28Å; S476-E479 VanDerWaalsContact OG-CG 3.27Å; S476-E479 WeakPolarHBondContact OG-CG 3.45Å; S476-E479 PolarHBondContact OG-N 2.87Å; S476-E479 PolarHBondContact OG-OE2 3.28Å; S476-K480 PolarHBondContact O-N 2.68Å
477	E	76.3	Confident	73.1	Confident	100 Å²	100	64.8 Å²	64.8	47%	0.467	32%	0.321	S	S	.	.	H	α-helix	trans	-52.2	-42.7	174.4	-77.6	-62.6	157.6	0	0	113.1	E479 K480 I481	E477-E479 VanDerWaalsContact C-N 3.33Å; E477-E479 PolarHBondContact O-N 2.72Å; E477-K480 WeakPolarHBondContact O-CB 3.48Å; E477-K480 PolarHBondContact O-N 3.35Å; E477-K480 VanDerWaalsContact O-N 3.09Å; E477-K480 IonicContact OE1-NZ 3.66Å; E477-K480 PolarHBondContact OE1-NZ 3.32Å; E477-K480 IonicContact OE2-NZ 3.15Å; E477-I481 WeakPolarHBondContact O-CG1 3.34Å; E477-I481 PolarHBondContact O-N 2.94Å; E477-I481 VanDerWaalsContact O-N 3.13Å
478	E	71.9	Confident	71.6	Confident	138 Å²	138	68.1 Å²	68.1	65%	0.645	33%	0.331	S	S	*	.	H	α-helix	trans	-62.3	-40	175.7	-64.8	-179.2	-168.7	0	0	112.5	S476 K480 I481 R482	S476-E478 VanDerWaalsContact C-N 3.27Å; S476-E478 PolarHBondContact O-N 3.23Å; E478-K480 VanDerWaalsContact C-N 3.26Å; E478-K480 PolarHBondContact O-N 3.43Å; E478-I481 PolarHBondContact O-N 2.82Å; E478-R482 WeakPolarHBondContact O-CG 3.27Å; E478-R482 PolarHBondContact O-N 3.34Å
479	E	71.9	Confident	70	Confident	46 Å²	46	66.4 Å²	66.4	22%	0.215	31%	0.313	C	S	.	.	H	α-helix	trans	-71.8	-19	176.4	-70	167.2	140.6	0	0	112.5	K358 P448 M475 S476 E477 P483	K358-E479 VanDerWaalsContact NZ-CD 3.34Å; K358-E479 IonicContact NZ-OE1 2.78Å; K358-E479 PolarHBondContact NZ-OE1 2.94Å; K358-E479 IonicContact NZ-OE2 2.98Å; K358-E479 PolarHBondContact NZ-OE2 3.32Å; P448-E479 HydrophobicContact CG-CG 4.48Å; M475-E479 WeakPolarHBondContact CA-OE2 3.37Å; M475-E479 HydrophobicContact CB-CB 4.44Å; S476-E479 PolarHBondContact N-OE2 2.95Å; S476-E479 CarbonylContact O-C 3.6Å; S476-E479 WeakPolarHBondContact O-CA 3.37Å; S476-E479 WeakPolarHBondContact O-CB 3.33Å; S476-E479 PolarHBondContact O-N 3.5Å; S476-E479 VanDerWaalsContact OG-CD 3.28Å; S476-E479 VanDerWaalsContact OG-CG 3.27Å; S476-E479 WeakPolarHBondContact OG-CG 3.45Å; S476-E479 PolarHBondContact OG-N 2.87Å; S476-E479 PolarHBondContact OG-OE2 3.28Å; E477-E479 VanDerWaalsContact C-N 3.33Å; E477-E479 PolarHBondContact O-N 2.72Å; E479-P483 WeakPolarHBondContact O-CD 3.39Å; E479-P483 WeakPolarHBondContact O-CG 3.4Å
480	K	66.4	Low	68.3	Low	33 Å²	33	67.1 Å²	67.1	14%	0.143	32%	0.318	C	S	.	.	H	α-helix	trans	-76.9	-36.1	169.9	-65.6	179	-164.4	167.2	0	112	D352 M475 S476 E477 E478 I493	D352-K480 VanDerWaalsContact CG-CE 3.45Å; D352-K480 IonicContact OD1-NZ 3.88Å; D352-K480 IonicContact OD2-NZ 2.8Å; D352-K480 PolarHBondContact OD2-NZ 3.25Å; M475-K480 HydrophobicContact CG-CG 4.23Å; M475-K480 HydrophobicContact SD-CD 4.49Å; M475-K480 HydrophobicContact SD-CG 3.79Å; S476-K480 PolarHBondContact O-N 2.68Å; E477-K480 WeakPolarHBondContact O-CB 3.48Å; E477-K480 PolarHBondContact O-N 3.35Å; E477-K480 VanDerWaalsContact O-N 3.09Å; E477-K480 IonicContact OE1-NZ 3.66Å; E477-K480 PolarHBondContact OE1-NZ 3.32Å; E477-K480 IonicContact OE2-NZ 3.15Å; E478-K480 VanDerWaalsContact C-N 3.26Å; E478-K480 PolarHBondContact O-N 3.43Å; K480-I493 HydrophobicContact CB-CD1 4.16Å; K480-I493 WeakPolarHBondContact O-CD1 3.21Å
481	I	58.4	Low	66.8	Low	94 Å²	94	68.1 Å²	68.1	48%	0.482	32%	0.32	S	S	.	.	H	α-helix	trans	-78.5	-35.7	-176.2	-61.4	164.6	0	0	0	111.4	E477 E478 L484	E477-I481 WeakPolarHBondContact O-CG1 3.34Å; E477-I481 PolarHBondContact O-N 2.94Å; E477-I481 VanDerWaalsContact O-N 3.13Å; E478-I481 PolarHBondContact O-N 2.82Å; I481-L484 WeakPolarHBondContact O-CB 3.25Å; I481-L484 PolarHBondContact O-N 3.11Å
482	R	57.3	Low	65.4	Low	167 Å²	167	68.9 Å²	68.9	63%	0.63	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-52.3	-48.1	178.6	-79.9	177.7	-169.2	-164	4.6	113	E478 L484 M485	E478-R482 WeakPolarHBondContact O-CG 3.27Å; E478-R482 PolarHBondContact O-N 3.34Å; R482-L484 VanDerWaalsContact C-N 3.27Å; R482-L484 PolarHBondContact O-N 3.15Å; R482-M485 PolarHBondContact O-N 2.67Å
483	P	52.1	Low	64	Low	13 Å²	13	70.5 Å²	70.5	8%	0.084	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-59.5	-27	173.7	-37.5	43.9	0	0	0	116.8	E479 M485 D486 E489 A490 I493	E479-P483 WeakPolarHBondContact O-CD 3.39Å; E479-P483 WeakPolarHBondContact O-CG 3.4Å; P483-M485 PolarHBondContact O-N 2.78Å; P483-D486 CarbonylContact O-C 3.53Å; P483-D486 PolarHBondContact O-N 2.71Å; P483-E489 WeakPolarHBondContact CA-OE2 3.04Å; P483-E489 HydrophobicContact CB-CB 3.37Å; P483-E489 HydrophobicContact CG-CB 3.82Å; P483-E489 WeakPolarHBondContact CG-OE2 3.32Å; P483-A490 WeakPolarHBondContact O-CB 3.04Å; P483-A490 PolarHBondContact O-N 3.48Å; P483-A490 VanDerWaalsContact O-N 3.15Å; P483-I493 HydrophobicContact CB-CD1 3.58Å; P483-I493 HydrophobicContact CB-CG1 4.28Å; P483-I493 HydrophobicContact CG-CD1 3.66Å; P483-I493 HydrophobicContact CG-CG1 4.35Å
484	L	45.9	Very low	62.8	Low	112 Å²	112	76.6 Å²	76.6	59%	0.586	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-71.4	-13.3	180	-76.8	154.2	0	0	0	112.2	I481 R482 A490	I481-L484 WeakPolarHBondContact O-CB 3.25Å; I481-L484 PolarHBondContact O-N 3.11Å; R482-L484 VanDerWaalsContact C-N 3.27Å; R482-L484 PolarHBondContact O-N 3.15Å; L484-A490 HydrophobicContact CD2-CB 4.42Å
485	M	42.5	Very low	61.8	Low	173 Å²	173	79.4 Å²	79.4	85%	0.852	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-91.6	-16.2	174.9	-62.5	-142.1	161.4	0	0	113.8	R482 P483	R482-M485 PolarHBondContact O-N 2.67Å; P483-M485 PolarHBondContact O-N 2.78Å
486	D	50.5	Low	61.5	Low	79 Å²	79	79.5 Å²	79.5	42%	0.422	38%	0.376	S	S	.	.	S	Bend	trans	-120.5	105.8	172.1	-169.7	-13	0	0	0	108.5	P483 R488 E489	P483-D486 CarbonylContact O-C 3.53Å; P483-D486 PolarHBondContact O-N 2.71Å; D486-R488 PolarHBondContact O-N 2.95Å; D486-R488 PolarHBondContact OD1-N 3.2Å; D486-E489 PolarHBondContact O-N 2.68Å
487	D	51.2	Low	61.6	Low	145 Å²	145	85.5 Å²	85.5	78%	0.775	40%	0.397	S	S	*	.	H	α-helix	trans	-43.8	-25	-177.6	-79.6	-28.8	0	0	0	114.3
488	R	49.6	Very low	62.1	Low	181 Å²	181	85.4 Å²	85.4	68%	0.683	41%	0.406	S	S	*	.	H	α-helix	trans	-69.7	-35.8	178.6	-63.1	177.5	177.5	-166	0.4	113.9	D486	D486-R488 PolarHBondContact O-N 2.95Å; D486-R488 PolarHBondContact OD1-N 3.2Å
489	E	51.8	Low	62.9	Low	53 Å²	53	80.6 Å²	80.6	25%	0.248	38%	0.382	C	S	.	.	H	α-helix	trans	-91.8	-31.6	-175.7	-65.7	-173.4	160.2	0	0	111.7	P483 D486 Y491 L492	P483-E489 WeakPolarHBondContact CA-OE2 3.04Å; P483-E489 HydrophobicContact CB-CB 3.37Å; P483-E489 HydrophobicContact CG-CB 3.82Å; P483-E489 WeakPolarHBondContact CG-OE2 3.32Å; D486-E489 PolarHBondContact O-N 2.68Å; E489-Y491 PolarHBondContact O-N 2.91Å; E489-L492 WeakPolarHBondContact O-CB 3.49Å; E489-L492 PolarHBondContact O-N 2.87Å
490	A	53.5	Low	63.4	Low	16 Å²	16	85 Å²	85	13%	0.132	41%	0.407	C	S	.	.	H	α-helix	trans	-52.3	-33.4	179.2	0	0	0	0	0	113.1	P483 L484 L492 I493 N494	P483-A490 WeakPolarHBondContact O-CB 3.04Å; P483-A490 PolarHBondContact O-N 3.48Å; P483-A490 VanDerWaalsContact O-N 3.15Å; L484-A490 HydrophobicContact CD2-CB 4.42Å; A490-L492 VanDerWaalsContact C-N 3.32Å; A490-L492 PolarHBondContact O-N 3.47Å; A490-I493 PolarHBondContact O-N 2.87Å; A490-N494 PolarHBondContact O-N 3.32Å; A490-N494 PolarHBondContact O-ND2 3.14Å
491	Y	60	Low	64.1	Low	61 Å²	61	84.6 Å²	84.6	24%	0.239	41%	0.406	C	S	.	.	H	α-helix	trans	-65.4	-32.3	178	-177.3	-104.1	0	0	0	113.4	A331 L452 E489 R495	A331-Y491 HydrophobicContact CB-CE2 3.77Å; A331-Y491 WeakPolarHBondContact CB-OH 3.48Å; L452-Y491 HydrophobicContact CD1-CD1 4.4Å; L452-Y491 HydrophobicContact CD2-CD1 3.91Å; L452-Y491 HydrophobicContact CD2-CE1 4.16Å; E489-Y491 PolarHBondContact O-N 2.91Å; Y491-R495 HydrophobicContact CE1-CG 4.19Å; Y491-R495 WeakPolarHBondContact O-CG 3.22Å; Y491-R495 PolarHBondContact O-N 3.13Å; Y491-R495 PolarHBondContact OH-NH1 3.46Å
492	L	64.3	Low	65	Low	17 Å²	17	83.6 Å²	83.6	9%	0.089	40%	0.401	C	S	.	.	H	α-helix	trans	-65	-48.6	178.6	-178.9	64.5	0	0	0	110.2	L452 Y455 E489 A490 N494 R495 L496	L452-L492 HydrophobicContact CD1-CD1 3.97Å; Y455-L492 HydrophobicContact CD1-CD1 3.37Å; Y455-L492 HydrophobicContact CD2-CD1 3.79Å; Y455-L492 HydrophobicContact CD2-CD2 4.17Å; Y455-L492 HydrophobicContact CE1-CD1 3.6Å; Y455-L492 HydrophobicContact CE2-CD1 3.99Å; Y455-L492 HydrophobicContact CG-CD1 3.47Å; Y455-L492 VanDerWaalsContact CG-CD1 3.47Å; Y455-L492 HydrophobicContact CG-CD2 4.22Å; E489-L492 WeakPolarHBondContact O-CB 3.49Å; E489-L492 PolarHBondContact O-N 2.87Å; A490-L492 VanDerWaalsContact C-N 3.32Å; A490-L492 PolarHBondContact O-N 3.47Å; L492-N494 PolarHBondContact O-N 2.74Å; L492-R495 PolarHBondContact O-N 2.88Å; L492-L496 WeakPolarHBondContact O-CG 3.45Å
493	I	64.6	Low	65.6	Low	33 Å²	33	80.7 Å²	80.7	17%	0.169	40%	0.398	C	S	.	.	H	α-helix	trans	-60.2	-46.5	-178.3	-62.8	179.1	0	0	0	110.9	K480 P483 A490 R495 L496	K480-I493 HydrophobicContact CB-CD1 4.16Å; K480-I493 WeakPolarHBondContact O-CD1 3.21Å; P483-I493 HydrophobicContact CB-CD1 3.58Å; P483-I493 HydrophobicContact CB-CG1 4.28Å; P483-I493 HydrophobicContact CG-CD1 3.66Å; P483-I493 HydrophobicContact CG-CG1 4.35Å; A490-I493 PolarHBondContact O-N 2.87Å; I493-R495 PolarHBondContact O-N 3.13Å; I493-L496 PolarHBondContact O-N 2.81Å
494	N	67.7	Low	66.6	Low	129 Å²	129	84.2 Å²	84.2	69%	0.69	42%	0.416	S	S	*	.	H	α-helix	trans	-63.7	-15.4	-177.6	-72.2	-26.2	0	0	0	114	A490 L492	A490-N494 PolarHBondContact O-N 3.32Å; A490-N494 PolarHBondContact O-ND2 3.14Å; L492-N494 PolarHBondContact O-N 2.74Å
495	R	70.1	Confident	68	Low	59 Å²	59	81.5 Å²	81.5	22%	0.223	40%	0.402	C	S	.	.	H	α-helix	trans	-85.7	-27.7	174.4	-74	179.6	68.4	94.3	2.6	113.7	E348 Y491 L492 I493	E348-R495 IonicContact OE1-CZ 3.73Å; E348-R495 IonicContact OE1-NE 3.08Å; E348-R495 PolarHBondContact OE1-NE 2.74Å; E348-R495 IonicContact OE1-NH2 2.67Å; E348-R495 PolarHBondContact OE1-NH2 2.92Å; E348-R495 IonicContact OE2-NE 3.7Å; Y491-R495 HydrophobicContact CE1-CG 4.19Å; Y491-R495 WeakPolarHBondContact O-CG 3.22Å; Y491-R495 PolarHBondContact O-N 3.13Å; Y491-R495 PolarHBondContact OH-NH1 3.46Å; L492-R495 PolarHBondContact O-N 2.88Å; I493-R495 PolarHBondContact O-N 3.13Å
496	L	81.6	Confident	69.7	Low	11 Å²	11	73.7 Å²	73.7	6%	0.058	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-78.5	131.4	-170.2	-58.1	172.6	0	0	0	109.4	E348 F350 Y455 M475 L492 I493	E348-L496 HydrophobicContact CB-CD2 3.9Å; F350-L496 HydrophobicContact CB-CB 4.01Å; F350-L496 HydrophobicContact CB-CD1 3.99Å; F350-L496 HydrophobicContact CD1-CB 3.55Å; F350-L496 HydrophobicContact CE1-CB 4.46Å; F350-L496 WeakPolarHBondContact CE1-O 3.34Å; F350-L496 HydrophobicContact CG-CB 4.18Å; Y455-L496 HydrophobicContact CE2-CD2 4.44Å; Y455-L496 WeakPolarHBondContact OH-CD2 3.06Å; M475-L496 HydrophobicContact CE-CD1 3.4Å; M475-L496 VanDerWaalsContact CE-CD1 3.4Å; L492-L496 WeakPolarHBondContact O-CG 3.45Å; I493-L496 PolarHBondContact O-N 2.81Å
497	R	86.7	Confident	71.2	Confident	135 Å²	135	76.6 Å²	76.6	51%	0.509	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	145.5	170.9	-65.1	179.7	-65	171.1	-1.8	109.9	D347 E348 L349 F350 F499	D347-R497 IonicContact OD1-CZ 3.99Å; D347-R497 IonicContact OD1-NH2 2.9Å; D347-R497 PolarHBondContact OD1-NH2 2.86Å; E348-R497 PolarHBondContact O-N 2.86Å; E348-R497 VanDerWaalsContact O-N 3.1Å; L349-R497 CarbonylContact C-O 3.6Å; L349-R497 WeakPolarHBondContact CA-O 3.43Å; L349-R497 HydrophobicContact CD2-CB 3.93Å; F350-R497 VanDerWaalsContact CD1-C 3.48Å; F350-R497 VanDerWaalsContact CD1-O 3.3Å; F350-R497 WeakPolarHBondContact CD1-O 3.45Å; F350-R497 PolarHBondContact N-O 3.43Å; R497-F499 PolarHBondContact O-N 3.48Å
498	P	86.7	Confident	72.7	Confident	99 Å²	99	76.8 Å²	76.8	64%	0.643	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	135.4	173.7	26.7	-33.1	0	0	0	109.6	F350	F350-P498 HydrophobicContact CE1-CB 3.97Å; F350-P498 HydrophobicContact CZ-CB 3.99Å
499	F	88.7	Confident	74.3	Confident	36 Å²	36	69.1 Å²	69.1	16%	0.158	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-90.3	124.9	169.4	-174.8	-110.2	0	0	0	109.5	L349 F350 I351 L365 F369 I472 R497 F501	L349-F499 HydrophobicContact CB-CB 4.18Å; L349-F499 HydrophobicContact CD1-CD2 3.52Å; L349-F499 HydrophobicContact CD1-CE2 4.15Å; L349-F499 HydrophobicContact CD1-CG 4.38Å; F350-F499 WeakPolarHBondContact O-CB 3.46Å; F350-F499 PolarHBondContact O-N 3.16Å; I351-F499 HydrophobicContact CD1-CB 4.49Å; I351-F499 HydrophobicContact CD1-CD1 3.69Å; I351-F499 HydrophobicContact CD1-CE1 4.43Å; I351-F499 HydrophobicContact CD1-CG 4.47Å; I351-F499 HydrophobicContact CG1-CB 3.8Å; I351-F499 HydrophobicContact CG1-CD1 3.9Å; I351-F499 HydrophobicContact CG1-CG 4.29Å; L365-F499 HydrophobicContact CD2-CE1 3.94Å; F369-F499 HydrophobicContact CE2-CZ 4.09Å; F369-F499 HydrophobicContact CZ-CE2 4.44Å; F369-F499 HydrophobicContact CZ-CZ 4.14Å; I472-F499 HydrophobicContact CD1-CD1 4.39Å; I472-F499 HydrophobicContact CD1-CD2 4.47Å; I472-F499 HydrophobicContact CD1-CE1 4.4Å; I472-F499 HydrophobicContact CD1-CE2 4.47Å; I472-F499 HydrophobicContact CD1-CG 4.41Å; I472-F499 HydrophobicContact CD1-CZ 4.43Å; R497-F499 PolarHBondContact O-N 3.48Å; F499-F501 HydrophobicContact CD1-CB 4.02Å; F499-F501 HydrophobicContact CD1-CD2 4.27Å; F499-F501 HydrophobicContact CE1-CB 4.44Å; F499-F501 HydrophobicContact CE1-CD2 4.08Å; F499-F501 PolarHBondContact O-N 3.19Å
500	D	82.2	Confident	76	Confident	138 Å²	138	70.7 Å²	70.7	74%	0.738	35%	0.351	S	S	*	.			trans	-71.7	103.1	177.6	-171.1	18.9	0	0	0	110.4	R368	R368-D500 PolarHBondContact NH1-O 3.12Å
501	F	80.6	Confident	77.7	Confident	25 Å²	25	75.3 Å²	75.3	11%	0.11	38%	0.378	C	S	.	.			trans	-123.8	112.6	-174.3	-171.8	-88.9	0	0	0	109.9	I351 V361 C364 L365 F499 L503 L506	I351-F501 HydrophobicContact CD1-CB 4.32Å; I351-F501 HydrophobicContact CD1-CD2 3.98Å; I351-F501 HydrophobicContact CD1-CG 4.23Å; I351-F501 HydrophobicContact CG1-CB 4.49Å; V361-F501 HydrophobicContact CG1-CE2 4.34Å; V361-F501 HydrophobicContact CG1-CZ 4.25Å; V361-F501 HydrophobicContact CG2-CE1 4.39Å; C364-F501 HydrophobicContact CB-CE2 3.85Å; C364-F501 HydrophobicContact CB-CZ 3.47Å; C364-F501 VanDerWaalsContact CB-CZ 3.47Å; L365-F501 HydrophobicContact CD2-CD2 4.27Å; L365-F501 HydrophobicContact CD2-CE2 4.2Å; L365-F501 HydrophobicContact CG-CE2 4.37Å; F499-F501 HydrophobicContact CD1-CB 4.02Å; F499-F501 HydrophobicContact CD1-CD2 4.27Å; F499-F501 HydrophobicContact CE1-CB 4.44Å; F499-F501 HydrophobicContact CE1-CD2 4.08Å; F499-F501 PolarHBondContact O-N 3.19Å; F501-L503 PolarHBondContact O-N 3.01Å; F501-L506 HydrophobicContact CE1-CD1 4.07Å; F501-L506 HydrophobicContact CE1-CD2 3.73Å; F501-L506 HydrophobicContact CE1-CG 3.76Å; F501-L506 HydrophobicContact CZ-CD2 3.97Å; F501-L506 HydrophobicContact CZ-CG 4.4Å
502	D	76.7	Confident	79.1	Confident	73 Å²	73	76.4 Å²	76.4	39%	0.39	39%	0.386	S	S	.	.			trans	-72.2	117.1	-178.4	-171.2	-4.7	0	0	0	111	N504 D505	D502-N504 PolarHBondContact O-N 3.35Å; D502-N504 VanDerWaalsContact OD1-CB 3.26Å; D502-N504 WeakPolarHBondContact OD1-CB 3.48Å; D502-N504 VanDerWaalsContact OD1-CG 3.25Å; D502-N504 PolarHBondContact OD1-N 2.9Å; D502-N504 PolarHBondContact OD1-ND2 2.82Å; D502-N504 PolarHBondContact OD2-ND2 3.32Å; D502-D505 PolarHBondContact O-N 3Å; D502-D505 VanDerWaalsContact O-N 3.16Å
503	L	71.2	Confident	80.4	Confident	106 Å²	106	76.7 Å²	76.7	56%	0.555	39%	0.386	S	S	*	.	H	α-helix	trans	-61.9	-22.8	175.8	-67.6	173.3	0	0	0	112.5	F501 D505 L506 Q507	F501-L503 PolarHBondContact O-N 3.01Å; L503-D505 PolarHBondContact O-N 3.42Å; L503-L506 HydrophobicContact CD2-CD1 3.61Å; L503-L506 VanDerWaalsContact O-CB 3.31Å; L503-L506 WeakPolarHBondContact O-CB 3.37Å; L503-L506 PolarHBondContact O-N 3.44Å; L503-L506 VanDerWaalsContact O-N 3.12Å; L503-Q507 PolarHBondContact O-N 2.76Å
504	N	73.6	Confident	81.6	Confident	87 Å²	87	77.5 Å²	77.5	47%	0.465	40%	0.398	S	S	.	.	H	α-helix	trans	-64.8	-29.4	176.6	-62	-42.2	0	0	0	112.2	D502 L506 Q507 K508	D502-N504 PolarHBondContact O-N 3.35Å; D502-N504 VanDerWaalsContact OD1-CB 3.26Å; D502-N504 WeakPolarHBondContact OD1-CB 3.48Å; D502-N504 VanDerWaalsContact OD1-CG 3.25Å; D502-N504 PolarHBondContact OD1-N 2.9Å; D502-N504 PolarHBondContact OD1-ND2 2.82Å; D502-N504 PolarHBondContact OD2-ND2 3.32Å; N504-L506 PolarHBondContact O-N 3.31Å; N504-Q507 PolarHBondContact O-N 3.27Å; N504-K508 PolarHBondContact O-N 2.87Å
505	D	74.3	Confident	82.8	Confident	56 Å²	56	78.7 Å²	78.7	30%	0.299	40%	0.397	S	S	.	.	H	α-helix	trans	-68.4	-27.1	175.8	-75.2	-23.6	0	0	0	112.2	D502 L503 K508	D502-D505 PolarHBondContact O-N 3Å; D502-D505 VanDerWaalsContact O-N 3.16Å; L503-D505 PolarHBondContact O-N 3.42Å; D505-K508 IonicContact OD1-NZ 3.86Å; D505-K508 PolarHBondContact OD1-NZ 3.23Å
506	L	78.9	Confident	83.9	Confident	9 Å²	9	76.1 Å²	76.1	5%	0.047	39%	0.388	C	S	.	.	H	α-helix	trans	-66.6	-46.2	172	-59.6	171	0	0	0	110.4	L360 V361 F501 L503 N504 K508 S509 M510	L360-L506 HydrophobicContact CB-CD2 4.21Å; L360-L506 HydrophobicContact CD2-CB 3.92Å; L360-L506 HydrophobicContact CD2-CD2 3.86Å; L360-L506 HydrophobicContact CD2-CG 4.46Å; L360-L506 HydrophobicContact CG-CD2 3.64Å; V361-L506 HydrophobicContact CG2-CD2 4.05Å; F501-L506 HydrophobicContact CE1-CD1 4.07Å; F501-L506 HydrophobicContact CE1-CD2 3.73Å; F501-L506 HydrophobicContact CE1-CG 3.76Å; F501-L506 HydrophobicContact CZ-CD2 3.97Å; F501-L506 HydrophobicContact CZ-CG 4.4Å; L503-L506 HydrophobicContact CD2-CD1 3.61Å; L503-L506 VanDerWaalsContact O-CB 3.31Å; L503-L506 WeakPolarHBondContact O-CB 3.37Å; L503-L506 PolarHBondContact O-N 3.44Å; L503-L506 VanDerWaalsContact O-N 3.12Å; N504-L506 PolarHBondContact O-N 3.31Å; L506-K508 VanDerWaalsContact C-N 3.27Å; L506-K508 PolarHBondContact O-N 3.16Å; L506-S509 CarbonylContact O-C 3.43Å; L506-S509 WeakPolarHBondContact O-CA 3.09Å; L506-S509 PolarHBondContact O-N 3.39Å; L506-M510 WeakPolarHBondContact O-CG 3.36Å; L506-M510 PolarHBondContact O-N 2.83Å
507	Q	80.4	Confident	84.4	Confident	139 Å²	139	79.5 Å²	79.5	65%	0.65	41%	0.406	S	S	*	.	H	α-helix	trans	-57.1	-40	-174.8	-67.8	-171.9	-10.2	0	0	112.6	L503 N504 S509 M510	L503-Q507 PolarHBondContact O-N 2.76Å; N504-Q507 PolarHBondContact O-N 3.27Å; Q507-S509 PolarHBondContact O-N 3.11Å; Q507-M510 PolarHBondContact O-N 3.36Å
508	K	82.6	Confident	84.6	Confident	150 Å²	150	80.5 Å²	80.5	65%	0.652	41%	0.414	S	S	*	.	H	α-helix	trans	-58.2	-32.3	176.3	-64	171.3	-169.4	156.2	0	112.7	N504 D505 L506	N504-K508 PolarHBondContact O-N 2.87Å; D505-K508 IonicContact OD1-NZ 3.86Å; D505-K508 PolarHBondContact OD1-NZ 3.23Å; L506-K508 VanDerWaalsContact C-N 3.27Å; L506-K508 PolarHBondContact O-N 3.16Å
509	S	85.1	Confident	84.9	Confident	19 Å²	19	79.8 Å²	79.8	13%	0.133	40%	0.402	C	S	.	.	H	α-helix	trans	-102.5	-6.4	-174.2	-55.1	0	0	0	0	113.4	Y363 L506 Q507 T511 M512 Y513	Y363-S509 WeakPolarHBondContact CE1-OG 3.42Å; L506-S509 CarbonylContact O-C 3.43Å; L506-S509 WeakPolarHBondContact O-CA 3.09Å; L506-S509 PolarHBondContact O-N 3.39Å; Q507-S509 PolarHBondContact O-N 3.11Å; S509-T511 VanDerWaalsContact C-N 3.33Å; S509-T511 PolarHBondContact O-N 3.35Å; S509-M512 PolarHBondContact O-N 2.9Å; S509-Y513 WeakPolarHBondContact O-CB 3.47Å; S509-Y513 PolarHBondContact O-N 3.43Å
510	M	86.2	Confident	85	Confident	87 Å²	87	79 Å²	79	43%	0.429	40%	0.4	S	S	.	.	H	α-helix	trans	-60.7	-37.7	-176.5	-82.4	-65.7	-75.3	0	0	113.3	L360 L506 Q507 Y513 A514	L360-M510 HydrophobicContact CD2-CG 4.02Å; L360-M510 HydrophobicContact CD2-SD 3.31Å; L360-M510 WeakPolarHBondContact CD2-SD 3.47Å; L506-M510 WeakPolarHBondContact O-CG 3.36Å; L506-M510 PolarHBondContact O-N 2.83Å; Q507-M510 PolarHBondContact O-N 3.36Å; M510-Y513 WeakPolarHBondContact O-CB 3.43Å; M510-Y513 PolarHBondContact O-N 3.43Å; M510-Y513 HydrophobicContact SD-CD1 4.42Å; M510-A514 WeakPolarHBondContact O-CB 3.43Å; M510-A514 PolarHBondContact O-N 3.3Å
511	T	88.9	Confident	85.3	Confident	112 Å²	112	79.1 Å²	79.1	69%	0.687	39%	0.394	S	S	*	.	H	α-helix	trans	-66.5	-46	-179.8	53.1	0	0	0	0	111.3	S509 A514 K515	S509-T511 VanDerWaalsContact C-N 3.33Å; S509-T511 PolarHBondContact O-N 3.35Å; T511-A514 PolarHBondContact O-N 3.18Å; T511-K515 PolarHBondContact O-N 3.33Å; T511-K515 VanDerWaalsContact O-N 3.15Å
512	M	89.9	Confident	85.8	Confident	85 Å²	85	81.6 Å²	81.6	42%	0.419	41%	0.411	S	S	.	.	H	α-helix	trans	-62.5	-44	174	-175.9	-172.5	-67.2	0	0	111	M394 S509 K515 A516	M394-M512 HydrophobicContact CB-SD 4.15Å; S509-M512 PolarHBondContact O-N 2.9Å; M512-K515 PolarHBondContact O-N 3.48Å; M512-A516 WeakPolarHBondContact O-CB 3.28Å; M512-A516 PolarHBondContact O-N 2.96Å
513	Y	91.3	Very high	86.3	Confident	23 Å²	23	81.8 Å²	81.8	9%	0.09	41%	0.408	C	S	.	.	H	α-helix	trans	-57.9	-49.7	177.5	-178.9	-119.4	0	0	0	112.2	T356 P359 L360 L390 M394 S509 M510 K515 A516 L517	T356-Y513 PolarHBondContact O-OH 3.45Å; P359-Y513 HydrophobicContact CB-CE2 3.99Å; L360-Y513 HydrophobicContact CB-CD1 4.45Å; L360-Y513 HydrophobicContact CB-CD2 4.25Å; L360-Y513 HydrophobicContact CB-CE1 4.49Å; L360-Y513 HydrophobicContact CB-CE2 4.3Å; L360-Y513 HydrophobicContact CB-CG 4.32Å; L360-Y513 HydrophobicContact CD1-CD2 4.16Å; L360-Y513 HydrophobicContact CD1-CG 3.98Å; L360-Y513 HydrophobicContact CD2-CD1 4.3Å; L360-Y513 HydrophobicContact CD2-CG 4.4Å; L360-Y513 HydrophobicContact CG-CG 4.48Å; L390-Y513 HydrophobicContact CD2-CD2 4.43Å; L390-Y513 HydrophobicContact CD2-CE2 3.67Å; L390-Y513 HydrophobicContact CG-CE2 4.46Å; M394-Y513 HydrophobicContact CE-CD2 4.09Å; M394-Y513 HydrophobicContact SD-CD2 3.83Å; S509-Y513 WeakPolarHBondContact O-CB 3.47Å; S509-Y513 PolarHBondContact O-N 3.43Å; M510-Y513 WeakPolarHBondContact O-CB 3.43Å; M510-Y513 PolarHBondContact O-N 3.43Å; M510-Y513 HydrophobicContact SD-CD1 4.42Å; Y513-K515 VanDerWaalsContact C-N 3.29Å; Y513-K515 PolarHBondContact O-N 2.65Å; Y513-A516 PolarHBondContact O-N 2.89Å; Y513-L517 HydrophobicContact CE1-CD1 4.28Å; Y513-L517 HydrophobicContact CE2-CD1 4.31Å; Y513-L517 WeakPolarHBondContact O-CB 3.44Å; Y513-L517 PolarHBondContact O-N 2.73Å
514	A	91.2	Very high	86.8	Confident	50 Å²	50	78.5 Å²	78.5	41%	0.413	39%	0.392	S	S	.	.	H	α-helix	trans	-61.8	-37.3	178.9	0	0	0	0	0	112.2	M510 T511 K518	M510-A514 WeakPolarHBondContact O-CB 3.43Å; M510-A514 PolarHBondContact O-N 3.3Å; T511-A514 PolarHBondContact O-N 3.18Å; A514-K518 WeakPolarHBondContact O-CG 3.26Å; A514-K518 PolarHBondContact O-N 2.71Å
515	K	92.9	Very high	87.2	Confident	153 Å²	153	78.2 Å²	78.2	67%	0.665	39%	0.391	S	S	*	.	H	α-helix	trans	-65.2	-49.9	174.3	-175.5	-177.1	176.3	-175.1	0	111.4	T511 M512 Y513 L517 K518 E519	T511-K515 PolarHBondContact O-N 3.33Å; T511-K515 VanDerWaalsContact O-N 3.15Å; M512-K515 PolarHBondContact O-N 3.48Å; Y513-K515 VanDerWaalsContact C-N 3.29Å; Y513-K515 PolarHBondContact O-N 2.65Å; K515-L517 VanDerWaalsContact C-N 3.28Å; K515-L517 PolarHBondContact O-N 3.1Å; K515-K518 PolarHBondContact O-N 2.7Å; K515-E519 PolarHBondContact O-N 3.37Å
516	A	92.5	Very high	87.5	Confident	5 Å²	5	83.6 Å²	83.6	4%	0.041	41%	0.412	C	S	.	.	H	α-helix	trans	-62.2	-36.2	179.8	0	0	0	0	0	112.1	L390 L393 M394 M512 Y513 E519 L520	L390-A516 HydrophobicContact CD1-CB 3.81Å; L393-A516 HydrophobicContact CB-CB 3.98Å; M394-A516 HydrophobicContact CG-CB 3.64Å; M512-A516 WeakPolarHBondContact O-CB 3.28Å; M512-A516 PolarHBondContact O-N 2.96Å; Y513-A516 PolarHBondContact O-N 2.89Å; A516-E519 PolarHBondContact O-N 2.7Å; A516-L520 WeakPolarHBondContact O-CB 3.28Å; A516-L520 PolarHBondContact O-N 2.92Å
517	L	91.1	Very high	87.2	Confident	82 Å²	82	89.7 Å²	89.7	43%	0.429	44%	0.444	S	S	.	.	H	α-helix	trans	-68.2	-37.6	178	-163.1	128.1	0	0	0	112.3	L390 Y513 K515 K521	L390-L517 HydrophobicContact CD1-CB 4.47Å; Y513-L517 HydrophobicContact CE1-CD1 4.28Å; Y513-L517 HydrophobicContact CE2-CD1 4.31Å; Y513-L517 WeakPolarHBondContact O-CB 3.44Å; Y513-L517 PolarHBondContact O-N 2.73Å; K515-L517 VanDerWaalsContact C-N 3.28Å; K515-L517 PolarHBondContact O-N 3.1Å; L517-K521 WeakPolarHBondContact O-CB 3.45Å; L517-K521 PolarHBondContact O-N 3.45Å
518	K	92.1	Very high	86.4	Confident	157 Å²	157	92.9 Å²	92.9	68%	0.683	46%	0.456	S	S	*	.	H	α-helix	trans	-63.2	-45.9	171.4	-73.8	178.1	-178.7	-178.6	0	111.2	A514 K515 K521 T522	A514-K518 WeakPolarHBondContact O-CG 3.26Å; A514-K518 PolarHBondContact O-N 2.71Å; K515-K518 PolarHBondContact O-N 2.7Å; K518-K521 WeakPolarHBondContact O-CB 3.4Å; K518-K521 PolarHBondContact O-N 2.84Å; K518-T522 WeakPolarHBondContact O-CG2 3.28Å; K518-T522 PolarHBondContact O-N 3.09Å; K518-T522 VanDerWaalsContact O-N 3.09Å
519	E	92.2	Very high	86.6	Confident	83 Å²	83	90 Å²	90	39%	0.388	45%	0.446	S	S	.	.	H	α-helix	trans	-63.8	-43.4	178.5	-173.6	175.5	166.9	0	0	112	L393 K515 A516 K521 T522 K523	L393-E519 HydrophobicContact CD1-CB 4.17Å; L393-E519 HydrophobicContact CD1-CG 4.11Å; L393-E519 VanDerWaalsContact CD2-CD 3.47Å; L393-E519 HydrophobicContact CD2-CG 4.16Å; L393-E519 WeakPolarHBondContact CD2-OE1 3.43Å; K515-E519 PolarHBondContact O-N 3.37Å; A516-E519 PolarHBondContact O-N 2.7Å; E519-K521 VanDerWaalsContact C-N 3.31Å; E519-K521 PolarHBondContact O-N 3.25Å; E519-T522 PolarHBondContact O-N 3.47Å; E519-T522 VanDerWaalsContact O-N 3.14Å; E519-T522 PolarHBondContact O-OG1 3.03Å; E519-K523 PolarHBondContact O-N 3.4Å
520	L	90.6	Very high	86.7	Confident	21 Å²	21	93.7 Å²	93.7	11%	0.11	46%	0.463	C	S	.	.	H	α-helix	trans	-59.2	-43.2	174.9	-177	66.6	0	0	0	111.5	E389 L390 L393 A516 T522 K523 V524	E389-L520 HydrophobicContact CB-CD1 3.71Å; L390-L520 HydrophobicContact CB-CD2 4.08Å; L390-L520 HydrophobicContact CD1-CB 4.37Å; L390-L520 HydrophobicContact CD1-CD2 4.11Å; L393-L520 HydrophobicContact CD1-CB 4.06Å; A516-L520 WeakPolarHBondContact O-CB 3.28Å; A516-L520 PolarHBondContact O-N 2.92Å; L520-T522 VanDerWaalsContact C-N 3.31Å; L520-T522 PolarHBondContact O-N 3.03Å; L520-K523 PolarHBondContact O-N 3.31Å; L520-V524 HydrophobicContact CD1-CG2 4.35Å; L520-V524 HydrophobicContact CG-CG2 4.36Å; L520-V524 WeakPolarHBondContact O-CG2 3.27Å; L520-V524 PolarHBondContact O-N 3.34Å
521	K	90	Very high	86.7	Confident	140 Å²	140	94.1 Å²	94.1	61%	0.609	46%	0.464	S	S	*	.	H	α-helix	trans	-58.1	-45.4	176	-171.2	179.1	179.4	-177.1	0	111	L517 K518 E519 K523 V524 D525	L517-K521 WeakPolarHBondContact O-CB 3.45Å; L517-K521 PolarHBondContact O-N 3.45Å; K518-K521 WeakPolarHBondContact O-CB 3.4Å; K518-K521 PolarHBondContact O-N 2.84Å; E519-K521 VanDerWaalsContact C-N 3.31Å; E519-K521 PolarHBondContact O-N 3.25Å; K521-K523 VanDerWaalsContact C-N 3.33Å; K521-K523 PolarHBondContact O-N 3.01Å; K521-V524 PolarHBondContact O-N 3.33Å; K521-D525 WeakPolarHBondContact O-CB 3.44Å; K521-D525 PolarHBondContact O-N 2.67Å
522	T	90.5	Very high	86.6	Confident	77 Å²	77	93.1 Å²	93.1	47%	0.472	45%	0.451	S	S	.	.	H	α-helix	trans	-64.7	-32.9	177.3	62.7	0	0	0	0	113.8	K518 E519 L520 K526	K518-T522 WeakPolarHBondContact O-CG2 3.28Å; K518-T522 PolarHBondContact O-N 3.09Å; K518-T522 VanDerWaalsContact O-N 3.09Å; E519-T522 PolarHBondContact O-N 3.47Å; E519-T522 VanDerWaalsContact O-N 3.14Å; E519-T522 PolarHBondContact O-OG1 3.03Å; L520-T522 VanDerWaalsContact C-N 3.31Å; L520-T522 PolarHBondContact O-N 3.03Å; T522-K526 VanDerWaalsContact O-CG 3.32Å; T522-K526 WeakPolarHBondContact O-CG 3.32Å; T522-K526 PolarHBondContact O-N 3.32Å
523	K	86.1	Confident	86.4	Confident	76 Å²	76	93.6 Å²	93.6	33%	0.33	45%	0.453	S	S	.	.	H	α-helix	trans	-68.1	-49.5	173.1	-78.3	-177.5	172.6	-179.1	0	111.3	E389 E519 L520 K521 D525 K526 D527	E389-K523 IonicContact OE2-NZ 3.36Å; E389-K523 PolarHBondContact OE2-NZ 3.1Å; E519-K523 PolarHBondContact O-N 3.4Å; L520-K523 PolarHBondContact O-N 3.31Å; K521-K523 VanDerWaalsContact C-N 3.33Å; K521-K523 PolarHBondContact O-N 3.01Å; K523-D525 VanDerWaalsContact C-N 3.26Å; K523-D525 PolarHBondContact O-N 2.96Å; K523-K526 WeakPolarHBondContact O-CB 3.35Å; K523-K526 PolarHBondContact O-N 3.5Å; K523-D527 PolarHBondContact O-N 3.39Å; K523-D527 VanDerWaalsContact O-N 3.12Å
524	V	82.4	Confident	86	Confident	38 Å²	38	98.3 Å²	98.3	23%	0.23	48%	0.478	C	S	.	.	H	α-helix	trans	-61.8	-35	-179.1	172.4	0	0	0	0	112	L520 K521 K526 K528	L520-V524 HydrophobicContact CD1-CG2 4.35Å; L520-V524 HydrophobicContact CG-CG2 4.36Å; L520-V524 WeakPolarHBondContact O-CG2 3.27Å; L520-V524 PolarHBondContact O-N 3.34Å; K521-V524 PolarHBondContact O-N 3.33Å; V524-K526 VanDerWaalsContact C-N 3.32Å; V524-K528 PolarHBondContact O-N 2.93Å
525	D	82.6	Confident	85.7	Confident	81 Å²	81	101.7 Å²	101.7	43%	0.433	48%	0.482	S	S	.	.	H	α-helix	trans	-75.7	-18.9	177	-70.1	-25.3	0	0	0	113.1	K521 K523 K528	K521-D525 WeakPolarHBondContact O-CB 3.44Å; K521-D525 PolarHBondContact O-N 2.67Å; K523-D525 VanDerWaalsContact C-N 3.26Å; K523-D525 PolarHBondContact O-N 2.96Å; D525-K528 IonicContact OD1-NZ 3.79Å
526	K	80.4	Confident	85.1	Confident	169 Å²	169	97.8 Å²	97.8	74%	0.735	47%	0.468	S	S	*	.	H	α-helix	trans	-83.3	-27.8	171.9	-75.7	175.8	179.3	-176.7	0	113.5	T522 K523 V524 K528	T522-K526 VanDerWaalsContact O-CG 3.32Å; T522-K526 WeakPolarHBondContact O-CG 3.32Å; T522-K526 PolarHBondContact O-N 3.32Å; K523-K526 WeakPolarHBondContact O-CB 3.35Å; K523-K526 PolarHBondContact O-N 3.5Å; V524-K526 VanDerWaalsContact C-N 3.32Å; K526-K528 VanDerWaalsContact C-N 3.34Å
527	D	72.4	Confident	84.5	Confident	137 Å²	137	105.5 Å²	105.5	73%	0.733	50%	0.504	S	S	*	.			trans	-82.8	-12.2	-179.9	-69.2	-19.4	0	0	0	113.1	K523	K523-D527 PolarHBondContact O-N 3.39Å; K523-D527 VanDerWaalsContact O-N 3.12Å
528	K	63.8	Low	83.9	Confident	205 Å²	205	107.6 Å²	107.6	89%	0.891	51%	0.51	S	S	*	.			trans	-83.6	0	170.3	-74.4	176.4	-177	166.5	0	110.4	V524 D525 K526	V524-K528 PolarHBondContact O-N 2.93Å; D525-K528 IonicContact OD1-NZ 3.79Å; K526-K528 VanDerWaalsContact C-N 3.34Å

Retrieved 528 of 528 residues in 2205.5 ms (Link to these results)

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