A0A087Y4H3_POEFO Loading...

Phosphatidate cytidylyltransferase, mitochondrial

Catalyzes the conversion of phosphatidic acid (PA) to CDP-diacylglycerol (CDP-DAG), an essential intermediate in the synthesis of phosphatidylglycerol, cardiolipin and phosphatidylinositol.

AlphaFold DB , UniProt , Accession A0A087Y4H3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 386 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.7	Very low	28.8	Very low	240 Å²	240	160.8 Å²	160.8	100%	1.182	78%	0.779	S	S	*	*				0	92.4	0	-72.4	-175.5	-141.2	0	0	107.3
2	L	29.9	Very low	28.6	Very low	145 Å²	145	164.8 Å²	164.8	76%	0.759	78%	0.782	S	S	*	*				76.4	106.9	93.4	-114.6	101.3	0	0	0	115
3	K	30.9	Very low	28.4	Very low	165 Å²	165	165.9 Å²	165.9	72%	0.717	78%	0.783	S	S	*	*			trans	65.4	143	146.5	-52.8	-179.5	178.5	174.9	0	117.9
4	F	30	Very low	28.3	Very low	180 Å²	180	161.8 Å²	161.8	79%	0.789	77%	0.774	S	S	*	*			cis	-158.2	134.6	38.6	-102.2	-91	0	0	0	108.9
5	F	32.1	Very low	28.2	Very low	177 Å²	177	161 Å²	161	78%	0.776	78%	0.775	S	S	*	*				32.8	134	93.6	-90	-98.1	0	0	0	115
6	H	28.9	Very low	28	Very low	148 Å²	148	156.9 Å²	156.9	69%	0.685	77%	0.768	S	S	*	*			cis	-171.7	161.3	25.7	-155.4	27.9	0	0	0	111.6
7	M	27.3	Very low	28	Very low	142 Å²	142	158 Å²	158	70%	0.7	77%	0.771	S	S	*	*			trans	-13.8	146	164.6	-69.5	164.7	65	0	0	121.6
8	R	27	Very low	27.9	Very low	226 Å²	226	159.7 Å²	159.7	85%	0.853	77%	0.774	S	S	*	*				177.2	140.1	101.9	-97.1	-179.1	178	178.4	-0.4	115.5
9	C	24.7	Very low	27.8	Very low	103 Å²	103	156.1 Å²	156.1	70%	0.696	77%	0.766	S	S	*	*			trans	43	115.7	144.1	-59.7	0	0	0	0	120.7
10	I	27.2	Very low	27.6	Very low	153 Å²	153	156.9 Å²	156.9	79%	0.785	77%	0.765	S	S	*	*				73.7	115.1	73.6	-65.7	177.3	0	0	0	114.5
11	S	27.3	Very low	27.5	Very low	90 Å²	90	156.2 Å²	156.2	63%	0.629	76%	0.761	S	S	*	*			trans	67.7	137	156.2	-53.6	0	0	0	0	118.1
12	Y	25.9	Very low	27.2	Very low	208 Å²	208	150.7 Å²	150.7	82%	0.816	74%	0.735	S	S	*	*				-160.5	153.5	53.6	-92	-99.1	0	0	0	113.1
13	F	25.8	Very low	27	Very low	180 Å²	180	153.7 Å²	153.7	79%	0.789	74%	0.738	S	S	*	*			trans	23.6	136.7	137.5	-81.1	-114.1	0	0	0	117.8
14	T	27.3	Very low	26.8	Very low	108 Å²	108	153.4 Å²	153.4	66%	0.663	74%	0.744	S	S	*	*			cis	170.9	177.6	44.7	4	0	0	0	0	109.7
15	L	26.4	Very low	26.5	Very low	150 Å²	150	151.2 Å²	151.2	79%	0.785	75%	0.749	S	S	*	*			trans	89.3	103.6	161.8	-66.5	116.3	0	0	0	115.7
16	S	25.8	Very low	26.3	Very low	95 Å²	95	145.6 Å²	145.6	66%	0.664	74%	0.741	S	S	*	*				73.4	109.8	72.3	80.4	0	0	0	0	113.9
17	E	28.7	Very low	26.2	Very low	176 Å²	176	149.4 Å²	149.4	82%	0.822	75%	0.751	S	S	*	*			trans	35.6	126.1	148.5	-59	-153.9	159	0	0	121.4
18	F	25.7	Very low	26.3	Very low	189 Å²	189	152.8 Å²	152.8	83%	0.829	76%	0.762	S	S	*	*				-177.4	110.7	113.6	-114.6	-106.2	0	0	0	107.4
19	C	25.6	Very low	26.4	Very low	90 Å²	90	147.5 Å²	147.5	61%	0.608	76%	0.755	S	S	*	*				85.9	115.2	92.2	-152.2	0	0	0	0	113.1
20	F	24.3	Very low	26.6	Very low	172 Å²	172	151.7 Å²	151.7	75%	0.754	76%	0.764	S	S	*	*				171.6	107.4	123.3	-113.5	-102.5	0	0	0	112.8
21	Q	24.9	Very low	26.5	Very low	144 Å²	144	153.2 Å²	153.2	67%	0.673	77%	0.765	S	S	*	*				52.1	137.5	119.8	-129.7	153.2	-27.4	0	0	123.4
22	L	24.7	Very low	26.5	Very low	123 Å²	123	154.5 Å²	154.5	64%	0.644	77%	0.771	S	S	*	*			trans	84.3	111.5	155.2	-75.7	135.6	0	0	0	118.7
23	Y	25.7	Very low	26.5	Very low	208 Å²	208	150.8 Å²	150.8	82%	0.816	77%	0.769	S	S	*	*				-176.7	141.8	89.3	-111.8	-87	0	0	0	112.4
24	L	27.2	Very low	26.4	Very low	160 Å²	160	147.8 Å²	147.8	84%	0.838	77%	0.77	S	S	*	*			trans	-67	131.9	169.8	-72.8	132.4	0	0	0	111.5
25	C	24.9	Very low	26.4	Very low	133 Å²	133	148.1 Å²	148.1	90%	0.899	77%	0.772	S	S	*	*				-177.4	160.1	123.2	-144.5	0	0	0	0	110.3
26	G	26.4	Very low	26.4	Very low	60 Å²	60	148.4 Å²	148.4	62%	0.619	77%	0.773	S	S	*	*			trans	-55.1	153.5	-167	0	0	0	0	0	115.6
27	Y	26.6	Very low	26.4	Very low	227 Å²	227	149.8 Å²	149.8	89%	0.89	78%	0.778	S	S	*	*				-176.9	122.2	115.8	-104.5	-82.6	0	0	0	108.6	V29	Y27-V29 PolarHBondContact O-N 2.58Å
28	F	30.4	Very low	26.4	Very low	214 Å²	214	147.2 Å²	147.2	94%	0.939	77%	0.774	S	S	*	*			trans	-60.5	110.5	166.2	-119.5	-100.8	0	0	0	108.2
29	V	28.3	Very low	26.3	Very low	114 Å²	114	145.2 Å²	145.2	69%	0.691	77%	0.771	S	S	*	*			trans	-137.6	114.8	165.3	-177.6	0	0	0	0	108.4	Y27 K31	Y27-V29 PolarHBondContact O-N 2.58Å; V29-K31 PolarHBondContact O-N 2.9Å
30	H	30.6	Very low	26.3	Very low	192 Å²	192	146 Å²	146	89%	0.889	78%	0.777	S	S	*	*			trans	-47	118.6	167.1	-97.7	-62.9	0	0	0	110.7
31	K	25.1	Very low	26.8	Very low	184 Å²	184	143.7 Å²	143.7	80%	0.8	78%	0.779	S	S	*	*			trans	-115.3	138.1	157	-82.6	-171.3	177	179.2	0	109.5	V29 V33	V29-K31 PolarHBondContact O-N 2.9Å; K31-V33 PolarHBondContact O-N 3.06Å
32	P	25.6	Very low	27.1	Very low	117 Å²	117	143.9 Å²	143.9	76%	0.76	79%	0.785	S	S	*	*			trans	-70.8	130.3	176.7	30.3	-31.3	0	0	0	108.6	C34	P32-C34 PolarHBondContact O-N 3.4Å
33	V	27.4	Very low	27.6	Very low	130 Å²	130	147.2 Å²	147.2	79%	0.788	79%	0.794	S	S	*	*			trans	-71.5	101.8	169.3	177.8	0	0	0	0	107	K31 T35	K31-V33 PolarHBondContact O-N 3.06Å; V33-T35 VanDerWaalsContact C-N 3.29Å; V33-T35 PolarHBondContact O-N 3.11Å
34	C	23.4	Very low	27.9	Very low	117 Å²	117	145.5 Å²	145.5	79%	0.791	80%	0.796	S	S	*	*			trans	-64.3	93.4	158.9	-77.7	0	0	0	0	107.8	P32 L36	P32-C34 PolarHBondContact O-N 3.4Å; C34-L36 PolarHBondContact O-N 2.72Å; C34-L36 VanDerWaalsContact O-N 3.1Å
35	T	27.3	Very low	28.2	Very low	116 Å²	116	143.8 Å²	143.8	71%	0.712	79%	0.792	S	S	*	*			trans	-71.9	102.8	168.6	-45.4	0	0	0	0	107.6	V33 V37	V33-T35 VanDerWaalsContact C-N 3.29Å; V33-T35 PolarHBondContact O-N 3.11Å; T35-V37 PolarHBondContact O-N 3.01Å; T35-V37 VanDerWaalsContact O-N 3.08Å
36	L	26.1	Very low	28.6	Very low	156 Å²	156	142.9 Å²	142.9	82%	0.817	78%	0.778	S	S	*	*			trans	-54.3	111.4	165.4	-78.5	158	0	0	0	108.3	C34 V38	C34-L36 PolarHBondContact O-N 2.72Å; C34-L36 VanDerWaalsContact O-N 3.1Å; L36-V38 VanDerWaalsContact C-N 3.34Å; L36-V38 PolarHBondContact O-N 2.89Å
37	V	25.5	Very low	28.9	Very low	124 Å²	124	145.9 Å²	145.9	75%	0.752	79%	0.786	S	S	*	*			trans	-67	97.8	166.8	177.6	0	0	0	0	106.5	T35 D39	T35-V37 PolarHBondContact O-N 3.01Å; T35-V37 VanDerWaalsContact O-N 3.08Å; V37-D39 PolarHBondContact O-N 3.37Å
38	V	27.8	Very low	29.1	Very low	122 Å²	122	139.1 Å²	139.1	74%	0.739	78%	0.777	S	S	*	*			trans	-77.7	98.7	163.6	-176.9	0	0	0	0	106.2	L36 C40	L36-V38 VanDerWaalsContact C-N 3.34Å; L36-V38 PolarHBondContact O-N 2.89Å; V38-C40 PolarHBondContact O-N 3.45Å; V38-C40 VanDerWaalsContact O-N 3.13Å
39	D	25.2	Very low	29.3	Very low	146 Å²	146	135.3 Å²	135.3	78%	0.781	77%	0.766	S	S	*	*			trans	-58.2	110.2	167.6	-96.7	-32.7	0	0	0	109.2	V37 P41	V37-D39 PolarHBondContact O-N 3.37Å; D39-P41 WeakPolarHBondContact O-CD 3.19Å
40	C	25.9	Very low	29.8	Very low	108 Å²	108	138.3 Å²	138.3	73%	0.73	77%	0.772	S	S	*	*			trans	-102.1	105.5	171.2	-109.7	0	0	0	0	108.7	V38 N42	V38-C40 PolarHBondContact O-N 3.45Å; V38-C40 VanDerWaalsContact O-N 3.13Å; C40-N42 VanDerWaalsContact C-N 3.33Å; C40-N42 PolarHBondContact O-N 3.34Å; C40-N42 VanDerWaalsContact O-N 3.08Å
41	P	33.3	Very low	30.5	Very low	123 Å²	123	136.2 Å²	136.2	80%	0.799	77%	0.767	S	S	*	*			trans	-88.3	72.5	-180	36.2	-32.2	0	0	0	109.6	D39	D39-P41 WeakPolarHBondContact O-CD 3.19Å
42	N	32.4	Very low	31.9	Very low	148 Å²	148	129.8 Å²	129.8	79%	0.791	74%	0.744	S	S	*	*			trans	-107.9	84	166.3	-84.4	-23.5	0	0	0	109.5	C40 M44	C40-N42 VanDerWaalsContact C-N 3.33Å; C40-N42 PolarHBondContact O-N 3.34Å; C40-N42 VanDerWaalsContact O-N 3.08Å; N42-M44 PolarHBondContact O-N 3.26Å
43	K	34.9	Very low	34.2	Very low	192 Å²	192	125.3 Å²	125.3	84%	0.835	72%	0.719	S	S	*	*			trans	-52.3	111.1	159.3	-84.4	177.1	175.9	174.1	0	107.6	T45	K43-T45 VanDerWaalsContact C-N 3.25Å; K43-T45 PolarHBondContact O-N 3.49Å
44	M	31.2	Very low	37	Very low	173 Å²	173	122.5 Å²	122.5	85%	0.852	70%	0.702	S	S	*	*			trans	-63.5	89.2	165	-93.1	-174.6	-83.8	0	0	108.9	N42	N42-M44 PolarHBondContact O-N 3.26Å
45	T	32.9	Very low	40.2	Very low	123 Å²	123	118 Å²	118	76%	0.755	67%	0.67	S	S	*	*			trans	-98.7	98.8	162.5	41.6	0	0	0	0	108.3	K43	K43-T45 VanDerWaalsContact C-N 3.25Å; K43-T45 PolarHBondContact O-N 3.49Å
46	L	35.3	Very low	43.3	Very low	115 Å²	115	113.1 Å²	113.1	60%	0.602	64%	0.639	S	S	*	*			trans	-59.2	141.2	165.2	-80.7	149.8	0	0	0	109.3	A48 I258	L46-A48 PolarHBondContact O-N 3.44Å; L46-I258 HydrophobicContact CD2-CG2 4.33Å
47	P	30.7	Very low	46.4	Very low	123 Å²	123	114.9 Å²	114.9	80%	0.799	63%	0.634	S	S	*	*			trans	-59	115.5	-178	-19.3	29.5	0	0	0	111	L49	P47-L49 PolarHBondContact O-N 3.14Å; P47-L49 VanDerWaalsContact O-N 3.12Å
48	A	31.7	Very low	49.6	Very low	85 Å²	85	114.8 Å²	114.8	70%	0.702	62%	0.62	S	S	*	*			trans	-73.2	103.8	178.3	0	0	0	0	0	109.9	L46 Q50	L46-A48 PolarHBondContact O-N 3.44Å; A48-Q50 WeakPolarHBondContact O-CG 3.4Å; A48-Q50 PolarHBondContact O-N 3.34Å
49	L	34.1	Very low	52.8	Low	133 Å²	133	109 Å²	109	70%	0.696	59%	0.585	S	S	*	*			trans	-60.5	99	163	-103.8	133.7	0	0	0	109.2	P47 N51 T52	P47-L49 PolarHBondContact O-N 3.14Å; P47-L49 VanDerWaalsContact O-N 3.12Å; L49-N51 VanDerWaalsContact C-N 3.29Å; L49-N51 PolarHBondContact O-N 3.48Å; L49-N51 VanDerWaalsContact O-N 3.07Å; L49-T52 PolarHBondContact O-N 2.94Å; L49-T52 VanDerWaalsContact O-N 3.13Å; L49-T52 PolarHBondContact O-OG1 3.48Å
50	Q	38.9	Very low	56.1	Low	178 Å²	178	102.8 Å²	102.8	83%	0.832	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-20.7	-160.4	-75.4	178.6	-22.9	0	0	116.2	A48	A48-Q50 WeakPolarHBondContact O-CG 3.4Å; A48-Q50 PolarHBondContact O-N 3.34Å
51	N	44.9	Very low	59.4	Low	147 Å²	147	101.6 Å²	101.6	79%	0.786	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-29.4	174.9	-87.3	-18.2	0	0	0	114.7	L49 G53	L49-N51 VanDerWaalsContact C-N 3.29Å; L49-N51 PolarHBondContact O-N 3.48Å; L49-N51 VanDerWaalsContact O-N 3.07Å; N51-G53 VanDerWaalsContact C-N 3.26Å; N51-G53 PolarHBondContact O-N 2.85Å
52	T	56.2	Low	62.4	Low	50 Å²	50	98.9 Å²	98.9	31%	0.307	52%	0.522	S	S	.	.	H	α-helix	trans	-72.3	-22.4	-179.9	62.9	0	0	0	0	112.2	L49 V54 I55 Y56 K183	L49-T52 PolarHBondContact O-N 2.94Å; L49-T52 VanDerWaalsContact O-N 3.13Å; L49-T52 PolarHBondContact O-OG1 3.48Å; T52-V54 VanDerWaalsContact C-N 3.34Å; T52-I55 WeakPolarHBondContact O-CG2 3.48Å; T52-Y56 WeakPolarHBondContact O-CD2 3.18Å; T52-Y56 WeakPolarHBondContact O-CE2 3.28Å; T52-K183 PolarHBondContact OG1-NZ 3.28Å
53	G	73.1	Confident	65.4	Low	23 Å²	23	92 Å²	92	24%	0.237	49%	0.485	C	S	.	.	H	α-helix	trans	-65.3	-35.6	178.2	0	0	0	0	0	113.5	N51 Y56 R57	N51-G53 VanDerWaalsContact C-N 3.26Å; N51-G53 PolarHBondContact O-N 2.85Å; G53-Y56 PolarHBondContact O-N 3.26Å; G53-R57 WeakPolarHBondContact O-CG 3.48Å; G53-R57 PolarHBondContact O-N 3.3Å; G53-R57 VanDerWaalsContact O-N 3.13Å
54	V	85.9	Confident	68.3	Low	70 Å²	70	83.2 Å²	83.2	42%	0.424	45%	0.447	S	S	.	.	H	α-helix	trans	-66.1	-46.6	-172.9	-178.4	0	0	0	0	111.6	T52 Y56 R57 R58	T52-V54 VanDerWaalsContact C-N 3.34Å; V54-Y56 VanDerWaalsContact C-N 3.33Å; V54-Y56 PolarHBondContact O-N 3.05Å; V54-R57 PolarHBondContact O-N 3.12Å; V54-R57 VanDerWaalsContact O-N 3.17Å; V54-R58 HydrophobicContact CG1-CG 4.34Å; V54-R58 WeakPolarHBondContact O-CG 3.34Å; V54-R58 PolarHBondContact O-N 3.05Å
55	I	90.1	Very high	71.2	Confident	24 Å²	24	81.2 Å²	81.2	12%	0.123	44%	0.436	C	S	.	.	H	α-helix	trans	-59.7	-42.1	178.9	-175.4	165.1	0	0	0	112.1	T52 R57 R58 I59 D148 R150	T52-I55 WeakPolarHBondContact O-CG2 3.48Å; I55-R57 PolarHBondContact O-N 3.12Å; I55-R58 PolarHBondContact O-N 3.48Å; I55-I59 HydrophobicContact CG1-CD1 3.87Å; I55-I59 HydrophobicContact CG1-CG1 4.5Å; I55-I59 VanDerWaalsContact O-CG1 3.3Å; I55-I59 WeakPolarHBondContact O-CG1 3.45Å; I55-I59 PolarHBondContact O-N 3.46Å; I55-D148 WeakPolarHBondContact CG1-OD2 3.26Å; I55-R150 HydrophobicContact CD1-CG 3.69Å
56	Y	92.4	Very high	73.9	Confident	13 Å²	13	80.9 Å²	80.9	5%	0.051	43%	0.429	C	S	.	.	H	α-helix	trans	-66.1	-39	177.8	-62.7	-64.4	0	0	0	111.9	T52 G53 V54 I59 L60 A72 V77 L93 F95 K183 L185	T52-Y56 WeakPolarHBondContact O-CD2 3.18Å; T52-Y56 WeakPolarHBondContact O-CE2 3.28Å; G53-Y56 PolarHBondContact O-N 3.26Å; V54-Y56 VanDerWaalsContact C-N 3.33Å; V54-Y56 PolarHBondContact O-N 3.05Å; Y56-I59 PolarHBondContact O-N 2.94Å; Y56-L60 WeakPolarHBondContact O-CB 3.45Å; Y56-L60 WeakPolarHBondContact O-CG 3.42Å; Y56-L60 PolarHBondContact O-N 3.4Å; Y56-A72 HydrophobicContact CD1-CB 4.2Å; Y56-A72 HydrophobicContact CE1-CB 3.88Å; Y56-V77 HydrophobicContact CE1-CG2 4.31Å; Y56-L93 HydrophobicContact CE1-CD1 4.28Å; Y56-L93 HydrophobicContact CE1-CD2 4.16Å; Y56-F95 AromaticContact CD1-CE1 3.82Å; Y56-F95 HydrophobicContact CD1-CE1 3.82Å; Y56-F95 AromaticContact CD1-CZ 3.87Å; Y56-F95 HydrophobicContact CD1-CZ 3.87Å; Y56-F95 HydrophobicContact CE1-CE1 4.39Å; Y56-F95 HydrophobicContact CE1-CZ 4.24Å; Y56-K183 HydrophobicContact CD2-CD 3.9Å; Y56-K183 HydrophobicContact CE2-CD 3.57Å; Y56-K183 VanDerWaalsContact CE2-NZ 3.33Å; Y56-L185 HydrophobicContact CD1-CD1 4.21Å; Y56-L185 HydrophobicContact CD1-CD2 4.27Å; Y56-L185 HydrophobicContact CD2-CD2 4.16Å; Y56-L185 HydrophobicContact CG-CD1 4.38Å; Y56-L185 HydrophobicContact CG-CD2 3.8Å
57	R	91.7	Very high	76.8	Confident	192 Å²	192	75.8 Å²	75.8	73%	0.725	40%	0.402	S	S	*	.	H	α-helix	trans	-64.1	-45	176	-71	176.8	-176.8	178.5	0.4	111.9	G53 V54 I55 I59 L60 S61	G53-R57 WeakPolarHBondContact O-CG 3.48Å; G53-R57 PolarHBondContact O-N 3.3Å; G53-R57 VanDerWaalsContact O-N 3.13Å; V54-R57 PolarHBondContact O-N 3.12Å; V54-R57 VanDerWaalsContact O-N 3.17Å; I55-R57 PolarHBondContact O-N 3.12Å; R57-I59 VanDerWaalsContact C-N 3.33Å; R57-I59 PolarHBondContact O-N 3.48Å; R57-L60 PolarHBondContact O-N 3.01Å; R57-S61 PolarHBondContact O-N 3.25Å; R57-S61 PolarHBondContact O-OG 2.84Å
58	R	93.9	Very high	79.9	Confident	122 Å²	122	70.1 Å²	70.1	46%	0.46	37%	0.366	S	S	.	.	H	α-helix	trans	-65.2	-33.4	177.1	-68.7	-170.6	-53.4	-161.8	5.5	113.3	V54 I55 S61 Q62 D148	V54-R58 HydrophobicContact CG1-CG 4.34Å; V54-R58 WeakPolarHBondContact O-CG 3.34Å; V54-R58 PolarHBondContact O-N 3.05Å; I55-R58 PolarHBondContact O-N 3.48Å; R58-S61 PolarHBondContact O-OG 2.88Å; R58-Q62 PolarHBondContact O-NE2 3.33Å; R58-D148 IonicContact CZ-OD1 3.07Å; R58-D148 IonicContact CZ-OD2 2.69Å; R58-D148 IonicContact NE-OD1 2.92Å; R58-D148 PolarHBondContact NE-OD1 2.96Å; R58-D148 IonicContact NE-OD2 3.28Å; R58-D148 PolarHBondContact NE-OD2 2.94Å; R58-D148 IonicContact NH2-OD1 3.73Å; R58-D148 PolarHBondContact NH2-OD1 3.43Å; R58-D148 IonicContact NH2-OD2 3.69Å; R58-D148 PolarHBondContact NH2-OD2 3.38Å
59	I	94.9	Very high	83	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-71	-47.5	173.5	-69.5	168.8	0	0	0	109.8	I55 Y56 R57 S61 Q62 F63 L93 F95 A147 D148 I152	I55-I59 HydrophobicContact CG1-CD1 3.87Å; I55-I59 HydrophobicContact CG1-CG1 4.5Å; I55-I59 VanDerWaalsContact O-CG1 3.3Å; I55-I59 WeakPolarHBondContact O-CG1 3.45Å; I55-I59 PolarHBondContact O-N 3.46Å; Y56-I59 PolarHBondContact O-N 2.94Å; R57-I59 VanDerWaalsContact C-N 3.33Å; R57-I59 PolarHBondContact O-N 3.48Å; I59-S61 VanDerWaalsContact C-N 3.29Å; I59-S61 PolarHBondContact O-N 2.9Å; I59-Q62 WeakPolarHBondContact O-CB 3.37Å; I59-Q62 PolarHBondContact O-N 2.92Å; I59-Q62 VanDerWaalsContact O-N 3.12Å; I59-F63 HydrophobicContact CG2-CE2 4.06Å; I59-F63 VanDerWaalsContact O-CD2 3.24Å; I59-F63 WeakPolarHBondContact O-CD2 3.48Å; I59-F63 WeakPolarHBondContact O-CE2 3.44Å; I59-L93 HydrophobicContact CD1-CD1 3.73Å; I59-F95 HydrophobicContact CD1-CZ 4.2Å; I59-F95 HydrophobicContact CG2-CE2 4.24Å; I59-F95 HydrophobicContact CG2-CZ 3.95Å; I59-A147 HydrophobicContact CG1-CB 4.37Å; I59-A147 HydrophobicContact CG2-CB 4.47Å; I59-D148 HydrophobicContact CD1-CB 4.43Å; I59-D148 HydrophobicContact CG1-CB 3.75Å; I59-I152 HydrophobicContact CD1-CG2 4.24Å; I59-I152 HydrophobicContact CG2-CD1 4.04Å
60	L	94.6	Very high	86	Confident	17 Å²	17	59.8 Å²	59.8	9%	0.089	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-31.8	-179.8	-77	177	0	0	0	113.3	Y56 R57 Q62 F63 Q65 A70 F97 L185 V186	Y56-L60 WeakPolarHBondContact O-CB 3.45Å; Y56-L60 WeakPolarHBondContact O-CG 3.42Å; Y56-L60 PolarHBondContact O-N 3.4Å; R57-L60 PolarHBondContact O-N 3.01Å; L60-Q62 PolarHBondContact O-N 2.85Å; L60-Q62 VanDerWaalsContact O-N 3.14Å; L60-F63 PolarHBondContact O-N 3.18Å; L60-F63 VanDerWaalsContact O-N 3.17Å; L60-Q65 PolarHBondContact O-NE2 3.4Å; L60-Q65 VanDerWaalsContact O-NE2 3.11Å; L60-A70 HydrophobicContact CD2-CB 4.18Å; L60-F97 HydrophobicContact CD2-CD1 4.38Å; L60-F97 HydrophobicContact CD2-CE1 3.55Å; L60-F97 HydrophobicContact CD2-CZ 3.92Å; L60-L185 HydrophobicContact CD1-CB 3.66Å; L60-L185 HydrophobicContact CD1-CD1 3.87Å; L60-L185 HydrophobicContact CD1-CG 4.39Å; L60-L185 HydrophobicContact CG-CD1 4.34Å; L60-V186 HydrophobicContact CD1-CG2 3.98Å
61	S	94.7	Very high	88.8	Confident	83 Å²	83	51.3 Å²	51.3	58%	0.58	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-10.2	176.4	66.5	0	0	0	0	113.9	R57 R58 I59 F63	R57-S61 PolarHBondContact O-N 3.25Å; R57-S61 PolarHBondContact O-OG 2.84Å; R58-S61 PolarHBondContact O-OG 2.88Å; I59-S61 VanDerWaalsContact C-N 3.29Å; I59-S61 PolarHBondContact O-N 2.9Å; S61-F63 VanDerWaalsContact C-N 3.33Å
62	Q	95.3	Very high	91.3	Very high	66 Å²	66	44.3 Å²	44.3	31%	0.308	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-0.9	176.1	-62.7	167.5	42.8	0	0	113	R58 I59 L60 N113	R58-Q62 PolarHBondContact O-NE2 3.33Å; I59-Q62 WeakPolarHBondContact O-CB 3.37Å; I59-Q62 PolarHBondContact O-N 2.92Å; I59-Q62 VanDerWaalsContact O-N 3.12Å; L60-Q62 PolarHBondContact O-N 2.85Å; L60-Q62 VanDerWaalsContact O-N 3.14Å; Q62-N113 PolarHBondContact O-ND2 3.21Å
63	F	96.6	Very high	93.1	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.018	21%	0.213	C	C	.	.	S	Bend	trans	-115.1	162.6	-177.1	-67.9	-81.3	0	0	0	111.7	I59 L60 S61 Q65 F97 W105 I152 Y154	I59-F63 HydrophobicContact CG2-CE2 4.06Å; I59-F63 VanDerWaalsContact O-CD2 3.24Å; I59-F63 WeakPolarHBondContact O-CD2 3.48Å; I59-F63 WeakPolarHBondContact O-CE2 3.44Å; L60-F63 PolarHBondContact O-N 3.18Å; L60-F63 VanDerWaalsContact O-N 3.17Å; S61-F63 VanDerWaalsContact C-N 3.33Å; F63-Q65 PolarHBondContact O-N 3.33Å; F63-Q65 PolarHBondContact O-NE2 3.2Å; F63-F97 AromaticContact CD1-CE2 3.98Å; F63-F97 HydrophobicContact CD1-CE2 3.98Å; F63-F97 HydrophobicContact CD2-CE2 4.12Å; F63-F97 HydrophobicContact CD2-CZ 4.18Å; F63-F97 HydrophobicContact CE1-CE2 4.09Å; F63-F97 HydrophobicContact CE2-CE2 4.24Å; F63-F97 HydrophobicContact CE2-CZ 4.23Å; F63-F97 AromaticContact CG-CE2 4Å; F63-F97 HydrophobicContact CG-CE2 4Å; F63-F97 HydrophobicContact CG-CZ 4.47Å; F63-F97 HydrophobicContact CZ-CE2 4.22Å; F63-W105 HydrophobicContact CB-CZ2 4.26Å; F63-W105 AromaticContact CD1-CH2 3.99Å; F63-W105 HydrophobicContact CD1-CH2 3.99Å; F63-W105 HydrophobicContact CD1-CZ2 4.03Å; F63-I152 HydrophobicContact CE2-CD1 4.11Å; F63-I152 HydrophobicContact CZ-CD1 3.82Å; F63-Y154 AromaticContact CE1-CD1 3.98Å; F63-Y154 HydrophobicContact CE1-CD1 3.98Å; F63-Y154 HydrophobicContact CE1-CD2 4.2Å; F63-Y154 AromaticContact CE1-CE1 3.62Å; F63-Y154 HydrophobicContact CE1-CE1 3.62Å; F63-Y154 AromaticContact CE1-CE2 3.87Å; F63-Y154 HydrophobicContact CE1-CE2 3.87Å; F63-Y154 HydrophobicContact CE1-CG 4.25Å; F63-Y154 AromaticContact CE1-CZ 3.55Å; F63-Y154 AromaticContact CZ-CD1 3.82Å; F63-Y154 HydrophobicContact CZ-CD1 3.82Å; F63-Y154 AromaticContact CZ-CE1 3.75Å; F63-Y154 HydrophobicContact CZ-CE1 3.75Å; F63-Y154 HydrophobicContact CZ-CG 4.28Å
64	P	96.3	Very high	93.7	Very high	7 Å²	7	43.1 Å²	43.1	5%	0.045	21%	0.212	C	C	.	.			trans	-57.3	137.5	167.2	-20.7	31.9	0	0	0	110.9	I67 W105 M108 N109	P64-I67 WeakPolarHBondContact O-CD1 3.49Å; P64-I67 WeakPolarHBondContact O-CG1 3.47Å; P64-W105 HydrophobicContact CB-CG 4.43Å; P64-W105 HydrophobicContact CG-CD2 4.37Å; P64-W105 HydrophobicContact CG-CZ2 4.42Å; P64-W105 PolarHBondContact O-NE1 2.76Å; P64-M108 HydrophobicContact CB-CB 3.97Å; P64-M108 HydrophobicContact CG-CB 3.65Å; P64-N109 HydrophobicContact CG-CB 3.87Å
65	Q	90.9	Very high	93.5	Very high	130 Å²	130	40.5 Å²	40.5	61%	0.607	20%	0.196	S	C	*	.	S	Bend	trans	-85.1	-8.7	-169.1	-61.7	-59.6	-62.1	0	0	114.2	L60 F63 I67	L60-Q65 PolarHBondContact O-NE2 3.4Å; L60-Q65 VanDerWaalsContact O-NE2 3.11Å; F63-Q65 PolarHBondContact O-N 3.33Å; F63-Q65 PolarHBondContact O-NE2 3.2Å; Q65-I67 PolarHBondContact O-N 2.92Å
66	D	90.8	Very high	93.3	Very high	117 Å²	117	39.5 Å²	39.5	63%	0.626	19%	0.192	S	C	*	.			trans	-73.7	71	176.6	-57.4	-46.2	0	0	0	111
67	I	95.1	Very high	92.9	Very high	7 Å²	7	39.9 Å²	39.9	4%	0.036	20%	0.195	C	C	.	.			trans	-123.8	118.1	-177.3	-61.2	169.8	0	0	0	108.8	P64 Q65 L69 A70 F97 V99 N188	P64-I67 WeakPolarHBondContact O-CD1 3.49Å; P64-I67 WeakPolarHBondContact O-CG1 3.47Å; Q65-I67 PolarHBondContact O-N 2.92Å; I67-L69 VanDerWaalsContact CG2-C 3.45Å; I67-L69 WeakPolarHBondContact CG2-O 3.32Å; I67-A70 HydrophobicContact CG2-CB 3.99Å; I67-F97 HydrophobicContact CD1-CD1 4.44Å; I67-F97 HydrophobicContact CD1-CG 4.3Å; I67-F97 HydrophobicContact CG2-CB 4.32Å; I67-V99 HydrophobicContact CG1-CG1 4.28Å; I67-N188 PolarHBondContact O-ND2 2.79Å
68	S	95.6	Very high	92.5	Very high	4 Å²	4	32.1 Å²	32.1	3%	0.028	17%	0.167	C	C	.	.	S	Bend	trans	-78.1	-32.6	178.5	-59.3	0	0	0	0	112.2	A98 D100 T159 N188	S68-A98 PolarHBondContact N-O 2.78Å; S68-D100 PolarHBondContact OG-OD1 2.9Å; S68-D100 PolarHBondContact OG-OD2 3.16Å; S68-D100 VanDerWaalsContact OG-OD2 3.12Å; S68-T159 WeakPolarHBondContact CB-OG1 3.48Å; S68-T159 PolarHBondContact OG-OG1 3.28Å; S68-N188 PolarHBondContact O-N 3.37Å
69	L	97.4	Very high	91.5	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	132.6	175	-164.9	69.9	0	0	0	110.7	I67 F71 F97 A98 L162 M184 V186 Q187 L193	I67-L69 VanDerWaalsContact CG2-C 3.45Å; I67-L69 WeakPolarHBondContact CG2-O 3.32Å; L69-F71 HydrophobicContact CD2-CD1 4.03Å; L69-F71 HydrophobicContact CD2-CE1 4.28Å; L69-F71 HydrophobicContact CG-CD1 4.39Å; L69-F97 CarbonylContact O-C 3.09Å; L69-F97 WeakPolarHBondContact O-CA 3.22Å; L69-A98 HydrophobicContact CB-CB 3.72Å; L69-A98 PolarHBondContact N-O 3.49Å; L69-A98 PolarHBondContact O-N 2.65Å; L69-L162 HydrophobicContact CD2-CD2 3.7Å; L69-M184 HydrophobicContact CD1-CE 3.3Å; L69-M184 HydrophobicContact CD2-CE 4.35Å; L69-M184 HydrophobicContact CG-CE 4.1Å; L69-V186 CarbonylContact C-O 3.54Å; L69-V186 WeakPolarHBondContact CA-O 3.24Å; L69-V186 WeakPolarHBondContact CD1-O 3.26Å; L69-Q187 HydrophobicContact CD1-CB 3.77Å; L69-Q187 HydrophobicContact CD1-CG 3.76Å; L69-L193 HydrophobicContact CB-CD2 4Å; L69-L193 HydrophobicContact CD1-CD2 4.24Å; L69-L193 HydrophobicContact CD2-CD2 4.38Å; L69-L193 HydrophobicContact CG-CD2 4.44Å
70	A	97.6	Very high	90.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	131.3	166.6	0	0	0	0	0	109.9	L60 I67 V96 F97 L185 V186	L60-A70 HydrophobicContact CD2-CB 4.18Å; I67-A70 HydrophobicContact CG2-CB 3.99Å; A70-V96 WeakPolarHBondContact CA-O 3.33Å; A70-F97 HydrophobicContact CB-CD1 3.84Å; A70-F97 HydrophobicContact CB-CE1 4.21Å; A70-L185 HydrophobicContact CB-CB 4.18Å; A70-L185 WeakPolarHBondContact O-CA 3.37Å; A70-L185 WeakPolarHBondContact O-CB 3.06Å; A70-L185 PolarHBondContact O-N 2.77Å; A70-V186 HydrophobicContact CB-CB 3.79Å; A70-V186 HydrophobicContact CB-CG2 3.97Å; A70-V186 PolarHBondContact N-O 3.39Å; A70-V186 PolarHBondContact O-N 3.03Å; A70-V186 VanDerWaalsContact O-N 3.1Å
71	F	97.4	Very high	88.7	Confident	1 Å²	1	41 Å²	41	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	145.9	170.3	63.8	-93.3	0	0	0	111.4	L69 Y73 F95 V96 V174 R177 L178 V182 K183 M184	L69-F71 HydrophobicContact CD2-CD1 4.03Å; L69-F71 HydrophobicContact CD2-CE1 4.28Å; L69-F71 HydrophobicContact CG-CD1 4.39Å; F71-Y73 HydrophobicContact CD2-CD1 4.09Å; F71-Y73 AromaticContact CE2-CD1 3.88Å; F71-Y73 HydrophobicContact CE2-CD1 3.88Å; F71-Y73 HydrophobicContact CE2-CE1 4.37Å; F71-F95 WeakPolarHBondContact O-CA 3.13Å; F71-V96 HydrophobicContact CD1-CB 4.29Å; F71-V96 HydrophobicContact CD2-CB 4.48Å; F71-V96 HydrophobicContact CE1-CB 3.66Å; F71-V96 HydrophobicContact CE1-CG1 3.96Å; F71-V96 HydrophobicContact CE1-CG2 4.31Å; F71-V96 HydrophobicContact CE2-CB 3.88Å; F71-V96 HydrophobicContact CE2-CG2 3.76Å; F71-V96 HydrophobicContact CZ-CB 3.44Å; F71-V96 VanDerWaalsContact CZ-CB 3.44Å; F71-V96 HydrophobicContact CZ-CG1 3.97Å; F71-V96 HydrophobicContact CZ-CG2 3.57Å; F71-V96 PolarHBondContact N-O 3.38Å; F71-V96 VanDerWaalsContact N-O 3.14Å; F71-V96 PolarHBondContact O-N 3.29Å; F71-V174 HydrophobicContact CE1-CG1 4.45Å; F71-V174 HydrophobicContact CZ-CG1 4Å; F71-R177 HydrophobicContact CE2-CG 4.15Å; F71-L178 HydrophobicContact CD1-CD2 4.03Å; F71-L178 HydrophobicContact CD2-CD2 4.3Å; F71-L178 HydrophobicContact CE1-CD1 3.99Å; F71-L178 HydrophobicContact CE1-CD2 3.8Å; F71-L178 HydrophobicContact CE1-CG 4.16Å; F71-L178 HydrophobicContact CE2-CD2 4.09Å; F71-L178 HydrophobicContact CG-CD2 4.27Å; F71-L178 HydrophobicContact CZ-CD1 4.16Å; F71-L178 HydrophobicContact CZ-CD2 3.81Å; F71-L178 HydrophobicContact CZ-CG 3.96Å; F71-V182 HydrophobicContact CB-CB 4.27Å; F71-V182 HydrophobicContact CB-CG2 4.18Å; F71-V182 HydrophobicContact CD2-CB 3.96Å; F71-V182 HydrophobicContact CD2-CG1 3.82Å; F71-V182 HydrophobicContact CD2-CG2 4.32Å; F71-V182 HydrophobicContact CE2-CG1 4.17Å; F71-V182 HydrophobicContact CG-CB 4.39Å; F71-V182 HydrophobicContact CG-CG2 4.35Å; F71-K183 CarbonylContact C-O 3.55Å; F71-K183 VanDerWaalsContact CA-O 3.27Å; F71-K183 WeakPolarHBondContact CA-O 3.29Å; F71-M184 HydrophobicContact CB-SD 3.88Å
72	A	96.8	Very high	87.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	148	172.2	0	0	0	0	0	110.6	Y56 V77 D94 F95 K183 L185	Y56-A72 HydrophobicContact CD1-CB 4.2Å; Y56-A72 HydrophobicContact CE1-CB 3.88Å; A72-V77 HydrophobicContact CB-CG2 3.75Å; A72-D94 CarbonylContact C-O 3.59Å; A72-D94 VanDerWaalsContact CA-O 3.28Å; A72-D94 WeakPolarHBondContact CA-O 3.34Å; A72-F95 HydrophobicContact CB-CD1 3.83Å; A72-F95 HydrophobicContact CB-CE1 3.8Å; A72-F95 HydrophobicContact CB-CZ 4.46Å; A72-K183 PolarHBondContact N-O 2.84Å; A72-K183 PolarHBondContact O-N 3.05Å; A72-L185 HydrophobicContact CB-CD1 3.95Å; A72-L185 HydrophobicContact CB-CG 4.44Å
73	Y	93.8	Very high	85.6	Confident	28 Å²	28	39.1 Å²	39.1	11%	0.11	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	175.6	-177.1	73.1	-85.8	0	0	0	114	F71 V77 D94 V96 R177	F71-Y73 HydrophobicContact CD2-CD1 4.09Å; F71-Y73 AromaticContact CE2-CD1 3.88Å; F71-Y73 HydrophobicContact CE2-CD1 3.88Å; F71-Y73 HydrophobicContact CE2-CE1 4.37Å; Y73-V77 WeakPolarHBondContact O-CG2 3.26Å; Y73-D94 HydrophobicContact CD1-CB 3.92Å; Y73-D94 WeakPolarHBondContact CD1-O 3.27Å; Y73-D94 HydrophobicContact CD2-CB 4.04Å; Y73-D94 HydrophobicContact CE1-CB 3.6Å; Y73-D94 HydrophobicContact CE2-CB 3.78Å; Y73-D94 HydrophobicContact CG-CB 4.13Å; Y73-D94 PolarHBondContact N-O 3.27Å; Y73-V96 HydrophobicContact CD1-CG2 4.48Å; Y73-V96 HydrophobicContact CE1-CG2 3.79Å; Y73-R177 VanDerWaalsContact CD2-CD 3.42Å; Y73-R177 HydrophobicContact CD2-CG 4.22Å; Y73-R177 HydrophobicContact CE2-CG 4.31Å; Y73-R177 HydrophobicContact CG-CG 4.33Å; Y73-R177 VanDerWaalsContact CG-NE 3.35Å
74	G	87	Confident	84.3	Confident	20 Å²	20	42.1 Å²	42.1	21%	0.206	24%	0.237	C	C	.	.	S	Bend	trans	86.7	-169.1	172.8	0	0	0	0	0	114.2	G76 V77 F78	G74-G76 PolarHBondContact O-N 2.91Å; G74-V77 PolarHBondContact O-N 3.22Å; G74-F78 PolarHBondContact O-N 3Å; G74-F78 VanDerWaalsContact O-N 3.11Å
75	S	81.8	Confident	82.9	Confident	14 Å²	14	47.2 Å²	47.2	10%	0.098	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-10.3	-169.2	56.9	0	0	0	0	115.2	N91	S75-N91 PolarHBondContact O-ND2 3.14Å
76	G	84.1	Confident	81.8	Confident	3 Å²	3	43 Å²	43	3%	0.031	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-12.7	171.8	0	0	0	0	0	113.3	G74 L93	G74-G76 PolarHBondContact O-N 2.91Å; G76-L93 VanDerWaalsContact O-CD2 3.26Å; G76-L93 WeakPolarHBondContact O-CD2 3.29Å
77	V	85.8	Confident	80.9	Confident	21 Å²	21	42.3 Å²	42.3	13%	0.127	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-43.2	-177.3	-179.8	0	0	0	0	111.3	Y56 A72 Y73 G74 L93 K183	Y56-V77 HydrophobicContact CE1-CG2 4.31Å; A72-V77 HydrophobicContact CB-CG2 3.75Å; Y73-V77 WeakPolarHBondContact O-CG2 3.26Å; G74-V77 PolarHBondContact O-N 3.22Å; V77-L93 HydrophobicContact CG2-CD2 3.99Å; V77-K183 HydrophobicContact CG1-CB 3.73Å; V77-K183 HydrophobicContact CG1-CD 4.3Å
78	F	83.1	Confident	80	Confident	29 Å²	29	43.2 Å²	43.2	13%	0.127	25%	0.249	C	C	.	.	S	Bend	trans	-109.8	138	-179.7	-61.6	-84.5	0	0	0	110.1	G74 P181 N252	G74-F78 PolarHBondContact O-N 3Å; G74-F78 VanDerWaalsContact O-N 3.11Å; F78-P181 HydrophobicContact CE1-CB 4.25Å; F78-P181 WeakPolarHBondContact CE2-O 3.3Å; F78-P181 HydrophobicContact CZ-CB 4.16Å; F78-N252 WeakPolarHBondContact CB-OD1 3.19Å; F78-N252 WeakPolarHBondContact CD1-OD1 3.23Å
79	K	71.1	Confident	79.1	Confident	126 Å²	126	47.2 Å²	47.2	55%	0.548	27%	0.267	S	S	.	.			trans	-60.9	139.4	174.9	-72.1	-176.5	177.4	-177.2	0	109.2	M88	K79-M88 HydrophobicContact CB-SD 4.48Å; K79-M88 HydrophobicContact CG-SD 3.71Å
80	Q	68.9	Low	78.4	Confident	64 Å²	64	55.9 Å²	55.9	30%	0.299	31%	0.305	S	S	.	.			trans	-114.7	153	174.5	-58.9	-165.1	-64.9	0	0	110	G82 T83 D251	Q80-G82 PolarHBondContact O-N 3.08Å; Q80-T83 VanDerWaalsContact O-CB 3.3Å; Q80-T83 WeakPolarHBondContact O-CB 3.19Å; Q80-T83 PolarHBondContact O-N 3.46Å; Q80-T83 PolarHBondContact O-OG1 3.34Å; Q80-D251 VanDerWaalsContact CA-OD2 3.31Å; Q80-D251 WeakPolarHBondContact CA-OD2 3.24Å
81	H	62.9	Low	77.8	Confident	136 Å²	136	57.6 Å²	57.6	63%	0.63	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	127.1	-177.3	-156.2	74.1	0	0	0	111.3	T83 D251	H81-T83 PolarHBondContact O-N 3.04Å; H81-D251 WeakPolarHBondContact CA-OD1 3.45Å; H81-D251 WeakPolarHBondContact CB-OD1 3.36Å; H81-D251 IonicContact CG-OD1 2.76Å; H81-D251 PolarHBondContact N-OD1 2.92Å; H81-D251 PolarHBondContact N-OD2 3.26Å; H81-D251 IonicContact ND1-OD1 2.68Å
82	G	61.3	Low	77.5	Confident	73 Å²	73	59.1 Å²	59.1	75%	0.753	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	11.3	179.3	0	0	0	0	0	115.5	Q80	Q80-G82 PolarHBondContact O-N 3.08Å
83	T	63.1	Low	77.3	Confident	36 Å²	36	59.2 Å²	59.2	22%	0.221	32%	0.322	C	S	.	.			trans	-98.6	120	177.2	-49.6	0	0	0	0	110	Q80 H81 Q87	Q80-T83 VanDerWaalsContact O-CB 3.3Å; Q80-T83 WeakPolarHBondContact O-CB 3.19Å; Q80-T83 PolarHBondContact O-N 3.46Å; Q80-T83 PolarHBondContact O-OG1 3.34Å; H81-T83 PolarHBondContact O-N 3.04Å; T83-Q87 HydrophobicContact CG2-CB 3.49Å; T83-Q87 VanDerWaalsContact CG2-CB 3.49Å
84	S	69.4	Low	77.4	Confident	67 Å²	67	58.9 Å²	58.9	47%	0.469	32%	0.322	S	S	.	.			trans	-69.2	159	174.7	70.5	0	0	0	0	111.3	G86 Q87 M88	S84-G86 VanDerWaalsContact C-N 3.26Å; S84-G86 PolarHBondContact O-N 3.02Å; S84-Q87 WeakPolarHBondContact O-CB 3.38Å; S84-Q87 PolarHBondContact O-N 2.78Å; S84-Q87 WeakPolarHBondContact OG-CG 3.46Å; S84-Q87 PolarHBondContact OG-N 3.49Å; S84-M88 PolarHBondContact O-N 3.26Å
85	Q	66.8	Low	77.9	Confident	115 Å²	115	57.9 Å²	57.9	54%	0.537	31%	0.312	S	S	.	.	H	α-helix	trans	-56.2	-42.7	178.8	-168.5	153	-30.2	0	0	111.5	Q87 M88 E89	Q85-Q87 VanDerWaalsContact C-N 3.28Å; Q85-Q87 PolarHBondContact O-N 2.6Å; Q85-M88 WeakPolarHBondContact O-CB 3.27Å; Q85-M88 PolarHBondContact O-N 2.69Å; Q85-E89 WeakPolarHBondContact O-CG 3.45Å; Q85-E89 PolarHBondContact O-N 2.84Å; Q85-E89 VanDerWaalsContact O-N 3.07Å
86	G	69.1	Low	78.7	Confident	42 Å²	42	57.3 Å²	57.3	43%	0.433	31%	0.308	S	S	.	.	H	α-helix	trans	-64.7	-24.2	175.2	0	0	0	0	0	115	S84 K90	S84-G86 VanDerWaalsContact C-N 3.26Å; S84-G86 PolarHBondContact O-N 3.02Å; G86-K90 WeakPolarHBondContact O-CG 3.43Å
87	Q	71	Confident	79.3	Confident	102 Å²	102	57.1 Å²	57.1	48%	0.477	31%	0.306	S	S	.	.	H	α-helix	trans	-80.8	-36.8	172.2	-74.8	178.7	-16.6	0	0	112.2	T83 S84 Q85 E89 K90 N91	T83-Q87 HydrophobicContact CG2-CB 3.49Å; T83-Q87 VanDerWaalsContact CG2-CB 3.49Å; S84-Q87 WeakPolarHBondContact O-CB 3.38Å; S84-Q87 PolarHBondContact O-N 2.78Å; S84-Q87 WeakPolarHBondContact OG-CG 3.46Å; S84-Q87 PolarHBondContact OG-N 3.49Å; Q85-Q87 VanDerWaalsContact C-N 3.28Å; Q85-Q87 PolarHBondContact O-N 2.6Å; Q87-E89 PolarHBondContact O-N 2.79Å; Q87-K90 PolarHBondContact O-N 2.76Å; Q87-K90 VanDerWaalsContact O-N 3.11Å; Q87-N91 PolarHBondContact O-N 3.35Å
88	M	76	Confident	79.9	Confident	26 Å²	26	56.2 Å²	56.2	13%	0.128	30%	0.301	C	S	.	.	H	α-helix	trans	-59.2	-39.2	173.3	-171.6	-176.4	75.7	0	0	110.9	K79 S84 Q85 K90 N91	K79-M88 HydrophobicContact CB-SD 4.48Å; K79-M88 HydrophobicContact CG-SD 3.71Å; S84-M88 PolarHBondContact O-N 3.26Å; Q85-M88 WeakPolarHBondContact O-CB 3.27Å; Q85-M88 PolarHBondContact O-N 2.69Å; M88-K90 PolarHBondContact O-N 3.11Å; M88-N91 WeakPolarHBondContact O-CB 3.43Å; M88-N91 PolarHBondContact O-N 3.12Å
89	E	76.5	Confident	80.6	Confident	88 Å²	88	54.9 Å²	54.9	41%	0.411	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-24	176.6	-73.9	-158.1	-160.3	0	0	114.8	Q85 Q87 R150	Q85-E89 WeakPolarHBondContact O-CG 3.45Å; Q85-E89 PolarHBondContact O-N 2.84Å; Q85-E89 VanDerWaalsContact O-N 3.07Å; Q87-E89 PolarHBondContact O-N 2.79Å; E89-R150 VanDerWaalsContact O-CD 3.25Å; E89-R150 WeakPolarHBondContact O-CD 3.42Å; E89-R150 VanDerWaalsContact O-CZ 3.29Å; E89-R150 PolarHBondContact O-NE 2.76Å; E89-R150 PolarHBondContact O-NH1 2.87Å; E89-R150 VanDerWaalsContact O-NH1 3.15Å; E89-R150 IonicContact OE2-NH1 3.11Å; E89-R150 PolarHBondContact OE2-NH1 3.23Å; E89-R150 VanDerWaalsContact OE2-NH1 3.1Å
90	K	82.1	Confident	81.8	Confident	183 Å²	183	53.9 Å²	53.9	80%	0.796	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-15.4	173.8	-67.2	176.9	-177.4	-177.1	0	112.5	G86 Q87 M88	G86-K90 WeakPolarHBondContact O-CG 3.43Å; Q87-K90 PolarHBondContact O-N 2.76Å; Q87-K90 VanDerWaalsContact O-N 3.11Å; M88-K90 PolarHBondContact O-N 3.11Å
91	N	86.7	Confident	83.1	Confident	36 Å²	36	54.5 Å²	54.5	19%	0.193	30%	0.301	C	S	.	.	S	Bend	trans	-71.2	144.8	177.9	-72.5	-29.3	0	0	0	110.5	S75 Q87 M88	S75-N91 PolarHBondContact O-ND2 3.14Å; Q87-N91 PolarHBondContact O-N 3.35Å; M88-N91 WeakPolarHBondContact O-CB 3.43Å; M88-N91 PolarHBondContact O-N 3.12Å
92	M	89.6	Confident	84.7	Confident	33 Å²	33	48.4 Å²	48.4	16%	0.163	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-63.1	136.8	174.6	-171.4	168.9	72.2	0	0	110.2	D94 L144 I151 K153 Y364	M92-D94 WeakPolarHBondContact CE-OD1 3.42Å; M92-L144 HydrophobicContact SD-CD2 4.32Å; M92-I151 VanDerWaalsContact CA-O 3.26Å; M92-I151 WeakPolarHBondContact CA-O 3.24Å; M92-I151 HydrophobicContact CG-CG2 4.05Å; M92-I151 WeakPolarHBondContact CG-O 3.33Å; M92-I151 HydrophobicContact SD-CG2 4.04Å; M92-K153 HydrophobicContact CE-CB 3.52Å; M92-K153 HydrophobicContact CE-CD 3.91Å; M92-K153 HydrophobicContact CE-CG 4.35Å; M92-K153 HydrophobicContact CG-CB 4.32Å; M92-K153 HydrophobicContact SD-CB 3.77Å; M92-Y364 HydrophobicContact CE-CD2 4.45Å; M92-Y364 HydrophobicContact CE-CE2 3.81Å
93	L	93.4	Very high	86.4	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	124.5	171.2	-64.8	173.4	0	0	0	109.2	Y56 I59 G76 V77 F95 R150 I151 I152 K153	Y56-L93 HydrophobicContact CE1-CD1 4.28Å; Y56-L93 HydrophobicContact CE1-CD2 4.16Å; I59-L93 HydrophobicContact CD1-CD1 3.73Å; G76-L93 VanDerWaalsContact O-CD2 3.26Å; G76-L93 WeakPolarHBondContact O-CD2 3.29Å; V77-L93 HydrophobicContact CG2-CD2 3.99Å; L93-F95 HydrophobicContact CB-CD2 4.26Å; L93-F95 HydrophobicContact CB-CE2 3.46Å; L93-F95 VanDerWaalsContact CB-CE2 3.46Å; L93-F95 HydrophobicContact CB-CZ 4.07Å; L93-F95 HydrophobicContact CD1-CE2 4.31Å; L93-F95 HydrophobicContact CD1-CZ 4.24Å; L93-R150 HydrophobicContact CD1-CB 4.28Å; L93-R150 HydrophobicContact CD1-CG 4.1Å; L93-I151 PolarHBondContact N-O 2.91Å; L93-I152 HydrophobicContact CB-CG2 4.11Å; L93-I152 CarbonylContact O-C 3.33Å; L93-I152 VanDerWaalsContact O-CA 3.27Å; L93-I152 WeakPolarHBondContact O-CA 3.47Å; L93-K153 PolarHBondContact O-N 3.41Å
94	D	95.5	Very high	88	Confident	20 Å²	20	48.5 Å²	48.5	11%	0.107	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	130	177.3	-61.5	-73.7	0	0	0	109.9	A72 Y73 M92 K153	A72-D94 CarbonylContact C-O 3.59Å; A72-D94 VanDerWaalsContact CA-O 3.28Å; A72-D94 WeakPolarHBondContact CA-O 3.34Å; Y73-D94 HydrophobicContact CD1-CB 3.92Å; Y73-D94 WeakPolarHBondContact CD1-O 3.27Å; Y73-D94 HydrophobicContact CD2-CB 4.04Å; Y73-D94 HydrophobicContact CE1-CB 3.6Å; Y73-D94 HydrophobicContact CE2-CB 3.78Å; Y73-D94 HydrophobicContact CG-CB 4.13Å; Y73-D94 PolarHBondContact N-O 3.27Å; M92-D94 WeakPolarHBondContact CE-OD1 3.42Å; D94-K153 CarbonylContact C-O 3.53Å; D94-K153 WeakPolarHBondContact CA-O 3.39Å
95	F	97.7	Very high	89.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	154.7	179.5	-62.3	-98	0	0	0	111.4	Y56 I59 F71 A72 L93 F97 I152 K153 Y154 G155 L185	Y56-F95 AromaticContact CD1-CE1 3.82Å; Y56-F95 HydrophobicContact CD1-CE1 3.82Å; Y56-F95 AromaticContact CD1-CZ 3.87Å; Y56-F95 HydrophobicContact CD1-CZ 3.87Å; Y56-F95 HydrophobicContact CE1-CE1 4.39Å; Y56-F95 HydrophobicContact CE1-CZ 4.24Å; I59-F95 HydrophobicContact CD1-CZ 4.2Å; I59-F95 HydrophobicContact CG2-CE2 4.24Å; I59-F95 HydrophobicContact CG2-CZ 3.95Å; F71-F95 WeakPolarHBondContact O-CA 3.13Å; A72-F95 HydrophobicContact CB-CD1 3.83Å; A72-F95 HydrophobicContact CB-CE1 3.8Å; A72-F95 HydrophobicContact CB-CZ 4.46Å; L93-F95 HydrophobicContact CB-CD2 4.26Å; L93-F95 HydrophobicContact CB-CE2 3.46Å; L93-F95 VanDerWaalsContact CB-CE2 3.46Å; L93-F95 HydrophobicContact CB-CZ 4.07Å; L93-F95 HydrophobicContact CD1-CE2 4.31Å; L93-F95 HydrophobicContact CD1-CZ 4.24Å; F95-F97 HydrophobicContact CB-CE1 3.77Å; F95-F97 HydrophobicContact CB-CZ 3.98Å; F95-F97 HydrophobicContact CD1-CE1 4.07Å; F95-F97 HydrophobicContact CD1-CZ 4.43Å; F95-F97 HydrophobicContact CG-CE1 4.22Å; F95-F97 HydrophobicContact CG-CZ 4.32Å; F95-I152 HydrophobicContact CD2-CB 4.28Å; F95-I152 HydrophobicContact CE2-CB 4.04Å; F95-I152 HydrophobicContact CE2-CG2 3.92Å; F95-K153 PolarHBondContact N-O 3.39Å; F95-Y154 CarbonylContact O-C 3.57Å; F95-Y154 WeakPolarHBondContact O-CA 3.28Å; F95-G155 PolarHBondContact O-N 3.08Å; F95-L185 HydrophobicContact CD1-CD1 3.8Å; F95-L185 HydrophobicContact CE1-CD1 3.57Å
96	V	98.3	Very high	90.8	Very high	1 Å²	1	40 Å²	40	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	134	161.5	-179.5	0	0	0	0	108.5	A70 F71 Y73 G155 I157 V174	A70-V96 WeakPolarHBondContact CA-O 3.33Å; F71-V96 HydrophobicContact CD1-CB 4.29Å; F71-V96 HydrophobicContact CD2-CB 4.48Å; F71-V96 HydrophobicContact CE1-CB 3.66Å; F71-V96 HydrophobicContact CE1-CG1 3.96Å; F71-V96 HydrophobicContact CE1-CG2 4.31Å; F71-V96 HydrophobicContact CE2-CB 3.88Å; F71-V96 HydrophobicContact CE2-CG2 3.76Å; F71-V96 HydrophobicContact CZ-CB 3.44Å; F71-V96 VanDerWaalsContact CZ-CB 3.44Å; F71-V96 HydrophobicContact CZ-CG1 3.97Å; F71-V96 HydrophobicContact CZ-CG2 3.57Å; F71-V96 PolarHBondContact N-O 3.38Å; F71-V96 VanDerWaalsContact N-O 3.14Å; F71-V96 PolarHBondContact O-N 3.29Å; Y73-V96 HydrophobicContact CD1-CG2 4.48Å; Y73-V96 HydrophobicContact CE1-CG2 3.79Å; V96-G155 CarbonylContact C-O 3.57Å; V96-G155 WeakPolarHBondContact CA-O 3.41Å; V96-I157 HydrophobicContact CG1-CG2 3.87Å; V96-V174 HydrophobicContact CG1-CG1 4.49Å
97	F	98.1	Very high	92.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	120	173.9	-51.4	-34.3	0	0	0	108.5	L60 F63 I67 L69 A70 F95 V99 W105 Y154 G155 V156 I157	L60-F97 HydrophobicContact CD2-CD1 4.38Å; L60-F97 HydrophobicContact CD2-CE1 3.55Å; L60-F97 HydrophobicContact CD2-CZ 3.92Å; F63-F97 AromaticContact CD1-CE2 3.98Å; F63-F97 HydrophobicContact CD1-CE2 3.98Å; F63-F97 HydrophobicContact CD2-CE2 4.12Å; F63-F97 HydrophobicContact CD2-CZ 4.18Å; F63-F97 HydrophobicContact CE1-CE2 4.09Å; F63-F97 HydrophobicContact CE2-CE2 4.24Å; F63-F97 HydrophobicContact CE2-CZ 4.23Å; F63-F97 AromaticContact CG-CE2 4Å; F63-F97 HydrophobicContact CG-CE2 4Å; F63-F97 HydrophobicContact CG-CZ 4.47Å; F63-F97 HydrophobicContact CZ-CE2 4.22Å; I67-F97 HydrophobicContact CD1-CD1 4.44Å; I67-F97 HydrophobicContact CD1-CG 4.3Å; I67-F97 HydrophobicContact CG2-CB 4.32Å; L69-F97 CarbonylContact O-C 3.09Å; L69-F97 WeakPolarHBondContact O-CA 3.22Å; A70-F97 HydrophobicContact CB-CD1 3.84Å; A70-F97 HydrophobicContact CB-CE1 4.21Å; F95-F97 HydrophobicContact CB-CE1 3.77Å; F95-F97 HydrophobicContact CB-CZ 3.98Å; F95-F97 HydrophobicContact CD1-CE1 4.07Å; F95-F97 HydrophobicContact CD1-CZ 4.43Å; F95-F97 HydrophobicContact CG-CE1 4.22Å; F95-F97 HydrophobicContact CG-CZ 4.32Å; F97-V99 HydrophobicContact CB-CG1 4.39Å; F97-W105 HydrophobicContact CD2-CH2 4.14Å; F97-W105 AromaticContact CD2-CZ2 3.82Å; F97-W105 HydrophobicContact CD2-CZ2 3.82Å; F97-W105 HydrophobicContact CE2-CZ2 4.4Å; F97-Y154 HydrophobicContact CD2-CD2 4.12Å; F97-Y154 AromaticContact CE2-CD2 3.88Å; F97-Y154 HydrophobicContact CE2-CD2 3.88Å; F97-Y154 AromaticContact CE2-CG 3.97Å; F97-Y154 HydrophobicContact CE2-CG 3.97Å; F97-G155 PolarHBondContact N-O 3.28Å; F97-V156 WeakPolarHBondContact O-CA 3.35Å; F97-I157 PolarHBondContact O-N 2.94Å
98	A	98	Very high	93.4	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	126.5	167.6	0	0	0	0	0	108.6	S68 L69 I157 L162	S68-A98 PolarHBondContact N-O 2.78Å; L69-A98 HydrophobicContact CB-CB 3.72Å; L69-A98 PolarHBondContact N-O 3.49Å; L69-A98 PolarHBondContact O-N 2.65Å; A98-I157 VanDerWaalsContact CA-O 3.31Å; A98-I157 WeakPolarHBondContact CA-O 3.37Å; A98-I157 HydrophobicContact CB-CG2 4.07Å; A98-L162 HydrophobicContact CB-CD2 3.6Å
99	V	97.1	Very high	94.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	142.5	-173.7	-56.4	0	0	0	0	109.2	I67 F97 P102 W105 V156 I157 S158 T159	I67-V99 HydrophobicContact CG1-CG1 4.28Å; F97-V99 HydrophobicContact CB-CG1 4.39Å; V99-P102 HydrophobicContact CG2-CB 4.06Å; V99-P102 HydrophobicContact CG2-CG 3.93Å; V99-W105 HydrophobicContact CB-CB 4.25Å; V99-W105 HydrophobicContact CB-CG 4.16Å; V99-W105 HydrophobicContact CG1-CB 4.35Å; V99-W105 VanDerWaalsContact CG1-CD1 3.44Å; V99-W105 HydrophobicContact CG1-CD2 4.16Å; V99-W105 HydrophobicContact CG1-CG 3.73Å; V99-W105 HydrophobicContact CG2-CB 4.11Å; V99-W105 HydrophobicContact CG2-CG 4.28Å; V99-V156 HydrophobicContact CG1-CG1 4.31Å; V99-V156 HydrophobicContact CG2-CG1 3.69Å; V99-I157 PolarHBondContact N-O 3.11Å; V99-S158 CarbonylContact O-C 3.53Å; V99-S158 VanDerWaalsContact O-CA 3.24Å; V99-S158 WeakPolarHBondContact O-CA 3.18Å; V99-T159 PolarHBondContact O-N 3.21Å; V99-T159 PolarHBondContact O-OG1 3.1Å
100	D	95.9	Very high	95.4	Very high	105 Å²	105	33.7 Å²	33.7	56%	0.561	18%	0.175	S	C	*	.	S	Bend	trans	-74.5	-41.1	-176.3	-65.2	-17.1	0	0	0	111.3	S68 P102 T159	S68-D100 PolarHBondContact OG-OD1 2.9Å; S68-D100 PolarHBondContact OG-OD2 3.16Å; S68-D100 VanDerWaalsContact OG-OD2 3.12Å; D100-P102 WeakPolarHBondContact O-CD 3.5Å; D100-T159 WeakPolarHBondContact OD1-CB 3.39Å; D100-T159 PolarHBondContact OD1-OG1 2.96Å
101	D	96.5	Very high	96	Very high	78 Å²	78	31.4 Å²	31.4	42%	0.417	17%	0.171	S	C	.	.			trans	-118.7	95.6	174	-177.9	-6.4	0	0	0	111.1	V103 T104 W105	D101-V103 VanDerWaalsContact C-N 3.27Å; D101-V103 PolarHBondContact O-N 2.99Å; D101-V103 WeakPolarHBondContact OD1-CA 3.35Å; D101-V103 WeakPolarHBondContact OD1-CB 3.31Å; D101-V103 PolarHBondContact OD1-N 3.33Å; D101-T104 PolarHBondContact O-N 2.82Å; D101-T104 PolarHBondContact OD1-N 2.74Å; D101-T104 WeakPolarHBondContact OD2-CB 3.24Å; D101-T104 PolarHBondContact OD2-OG1 2.95Å; D101-W105 WeakPolarHBondContact O-CB 3.49Å; D101-W105 PolarHBondContact O-N 2.87Å
102	P	96.8	Very high	96.4	Very high	8 Å²	8	35.1 Å²	35.1	5%	0.052	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-26.9	177.4	-20.2	30.2	0	0	0	114.4	V99 D100 H106 Q132	V99-P102 HydrophobicContact CG2-CB 4.06Å; V99-P102 HydrophobicContact CG2-CG 3.93Å; D100-P102 WeakPolarHBondContact O-CD 3.5Å; P102-H106 WeakPolarHBondContact O-CB 3.38Å; P102-H106 PolarHBondContact O-CD2 2.78Å; P102-H106 VanDerWaalsContact O-CD2 3.25Å; P102-H106 VanDerWaalsContact O-CG 3.27Å; P102-H106 PolarHBondContact O-N 3.1Å; P102-Q132 VanDerWaalsContact CB-NE2 3.35Å
103	V	97.1	Very high	96.8	Very high	46 Å²	46	34.7 Å²	34.7	28%	0.279	19%	0.186	S	C	.	.	H	α-helix	trans	-69	-52.3	178.8	178.1	0	0	0	0	108.8	D101 W105 H106 T107 S129	D101-V103 VanDerWaalsContact C-N 3.27Å; D101-V103 PolarHBondContact O-N 2.99Å; D101-V103 WeakPolarHBondContact OD1-CA 3.35Å; D101-V103 WeakPolarHBondContact OD1-CB 3.31Å; D101-V103 PolarHBondContact OD1-N 3.33Å; V103-W105 PolarHBondContact O-N 3Å; V103-H106 PolarHBondContact O-N 3.07Å; V103-T107 WeakPolarHBondContact O-CB 3.47Å; V103-T107 PolarHBondContact O-N 2.88Å; V103-T107 PolarHBondContact O-OG1 2.92Å; V103-S129 WeakPolarHBondContact CG2-OG 3.03Å
104	T	97.3	Very high	96.8	Very high	65 Å²	65	41 Å²	41	40%	0.399	21%	0.21	S	C	.	.	H	α-helix	trans	-61	-45.9	176.8	-66.4	0	0	0	0	110.8	D101 H106 T107 M108	D101-T104 PolarHBondContact O-N 2.82Å; D101-T104 PolarHBondContact OD1-N 2.74Å; D101-T104 WeakPolarHBondContact OD2-CB 3.24Å; D101-T104 PolarHBondContact OD2-OG1 2.95Å; T104-H106 PolarHBondContact O-N 2.88Å; T104-T107 WeakPolarHBondContact O-CB 3.28Å; T104-T107 PolarHBondContact O-N 3.13Å; T104-T107 VanDerWaalsContact O-N 3.11Å; T104-M108 PolarHBondContact O-N 3.22Å
105	W	97.6	Very high	96.7	Very high	4 Å²	4	51 Å²	51	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-60.1	-45.8	178.7	-167.9	96.9	0	0	0	112.1	F63 P64 F97 V99 D101 V103 T107 M108 N109 Y154 V156	F63-W105 HydrophobicContact CB-CZ2 4.26Å; F63-W105 AromaticContact CD1-CH2 3.99Å; F63-W105 HydrophobicContact CD1-CH2 3.99Å; F63-W105 HydrophobicContact CD1-CZ2 4.03Å; P64-W105 HydrophobicContact CB-CG 4.43Å; P64-W105 HydrophobicContact CG-CD2 4.37Å; P64-W105 HydrophobicContact CG-CZ2 4.42Å; P64-W105 PolarHBondContact O-NE1 2.76Å; F97-W105 HydrophobicContact CD2-CH2 4.14Å; F97-W105 AromaticContact CD2-CZ2 3.82Å; F97-W105 HydrophobicContact CD2-CZ2 3.82Å; F97-W105 HydrophobicContact CE2-CZ2 4.4Å; V99-W105 HydrophobicContact CB-CB 4.25Å; V99-W105 HydrophobicContact CB-CG 4.16Å; V99-W105 HydrophobicContact CG1-CB 4.35Å; V99-W105 VanDerWaalsContact CG1-CD1 3.44Å; V99-W105 HydrophobicContact CG1-CD2 4.16Å; V99-W105 HydrophobicContact CG1-CG 3.73Å; V99-W105 HydrophobicContact CG2-CB 4.11Å; V99-W105 HydrophobicContact CG2-CG 4.28Å; D101-W105 WeakPolarHBondContact O-CB 3.49Å; D101-W105 PolarHBondContact O-N 2.87Å; V103-W105 PolarHBondContact O-N 3Å; W105-T107 VanDerWaalsContact C-N 3.31Å; W105-T107 PolarHBondContact O-N 3.26Å; W105-M108 PolarHBondContact O-N 2.94Å; W105-N109 HydrophobicContact CE3-CB 3.89Å; W105-N109 HydrophobicContact CH2-CB 3.91Å; W105-N109 HydrophobicContact CZ3-CB 3.53Å; W105-N109 WeakPolarHBondContact CZ3-ND2 3.28Å; W105-N109 WeakPolarHBondContact O-CB 3.41Å; W105-N109 PolarHBondContact O-N 3.49Å; W105-Y154 HydrophobicContact CH2-CE2 4.06Å; W105-V156 HydrophobicContact CD2-CG1 4.48Å; W105-V156 HydrophobicContact CE3-CG1 4.07Å; W105-V156 HydrophobicContact CE3-CG2 4.04Å; W105-V156 HydrophobicContact CH2-CG2 3.76Å; W105-V156 HydrophobicContact CZ3-CG1 4.38Å; W105-V156 HydrophobicContact CZ3-CG2 3.49Å; W105-V156 VanDerWaalsContact CZ3-CG2 3.49Å
106	H	97.3	Very high	96.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-67.3	-31.2	176.2	-77.2	-34.6	0	0	0	113	P102 V103 T104 L110 Y117 P125 Q132	P102-H106 WeakPolarHBondContact O-CB 3.38Å; P102-H106 PolarHBondContact O-CD2 2.78Å; P102-H106 VanDerWaalsContact O-CD2 3.25Å; P102-H106 VanDerWaalsContact O-CG 3.27Å; P102-H106 PolarHBondContact O-N 3.1Å; V103-H106 PolarHBondContact O-N 3.07Å; T104-H106 PolarHBondContact O-N 2.88Å; H106-L110 VanDerWaalsContact O-CB 3.24Å; H106-L110 WeakPolarHBondContact O-CB 3.4Å; H106-L110 VanDerWaalsContact O-CG 3.23Å; H106-L110 WeakPolarHBondContact O-CG 3.1Å; H106-L110 PolarHBondContact O-N 2.86Å; H106-Y117 AromaticContact ND1-CZ 3.89Å; H106-Y117 PolarHBondContact ND1-OH 2.97Å; H106-P125 HydrophobicContact CB-CB 4.04Å; H106-Q132 PolarHBondContact NE2-OE1 2.89Å; H106-Q132 VanDerWaalsContact NE2-OE1 3.13Å
107	T	97.2	Very high	96.3	Very high	47 Å²	47	52 Å²	52	29%	0.288	25%	0.25	S	S	.	.	H	α-helix	trans	-60.7	-51.2	173.3	-54.2	0	0	0	0	109.6	V103 T104 W105 N109 L110 L111 P125	V103-T107 WeakPolarHBondContact O-CB 3.47Å; V103-T107 PolarHBondContact O-N 2.88Å; V103-T107 PolarHBondContact O-OG1 2.92Å; T104-T107 WeakPolarHBondContact O-CB 3.28Å; T104-T107 PolarHBondContact O-N 3.13Å; T104-T107 VanDerWaalsContact O-N 3.11Å; W105-T107 VanDerWaalsContact C-N 3.31Å; W105-T107 PolarHBondContact O-N 3.26Å; T107-N109 PolarHBondContact O-N 3.12Å; T107-L110 PolarHBondContact O-N 3.28Å; T107-L111 WeakPolarHBondContact O-CG 3.49Å; T107-L111 PolarHBondContact O-N 3.26Å; T107-L111 VanDerWaalsContact O-N 3.14Å; T107-P125 HydrophobicContact CG2-CG 4.39Å; T107-P125 VanDerWaalsContact OG1-CB 3.28Å; T107-P125 WeakPolarHBondContact OG1-CB 3.25Å; T107-P125 WeakPolarHBondContact OG1-CG 3.28Å
108	M	97.3	Very high	95.8	Very high	66 Å²	66	53 Å²	53	33%	0.325	26%	0.257	S	S	.	.	H	α-helix	trans	-65.8	-41.9	-179.9	-62.5	-52.9	93.6	0	0	111.9	P64 T104 W105 L110 L111 Q112	P64-M108 HydrophobicContact CB-CB 3.97Å; P64-M108 HydrophobicContact CG-CB 3.65Å; T104-M108 PolarHBondContact O-N 3.22Å; W105-M108 PolarHBondContact O-N 2.94Å; M108-L110 VanDerWaalsContact C-N 3.3Å; M108-L110 PolarHBondContact O-N 3.4Å; M108-L111 HydrophobicContact CE-CD1 3.7Å; M108-L111 WeakPolarHBondContact O-CB 3.49Å; M108-L111 PolarHBondContact O-N 2.7Å; M108-L111 HydrophobicContact SD-CD1 4.27Å; M108-Q112 WeakPolarHBondContact O-CG 3.37Å; M108-Q112 PolarHBondContact O-N 3.48Å
109	N	97.5	Very high	95.3	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-69.1	-27.5	178	-165.6	50.7	0	0	0	112.5	P64 W105 T107 N113 Y117 Y154	P64-N109 HydrophobicContact CG-CB 3.87Å; W105-N109 HydrophobicContact CE3-CB 3.89Å; W105-N109 HydrophobicContact CH2-CB 3.91Å; W105-N109 HydrophobicContact CZ3-CB 3.53Å; W105-N109 WeakPolarHBondContact CZ3-ND2 3.28Å; W105-N109 WeakPolarHBondContact O-CB 3.41Å; W105-N109 PolarHBondContact O-N 3.49Å; T107-N109 PolarHBondContact O-N 3.12Å; N109-N113 CarbonylContact O-C 3.28Å; N109-N113 VanDerWaalsContact O-C 3.28Å; N109-N113 WeakPolarHBondContact O-CA 3.41Å; N109-N113 VanDerWaalsContact O-CB 3.26Å; N109-N113 WeakPolarHBondContact O-CB 3.31Å; N109-N113 PolarHBondContact O-N 2.65Å; N109-N113 WeakPolarHBondContact OD1-CB 3.45Å; N109-N113 PolarHBondContact OD1-ND2 3.01Å; N109-Y117 HydrophobicContact CB-CE2 4.43Å; N109-Y117 VanDerWaalsContact ND2-CE2 3.25Å; N109-Y117 WeakPolarHBondContact ND2-CE2 3.04Å; N109-Y117 PolarHBondContact ND2-OH 2.99Å; N109-Y154 PolarHBondContact ND2-OH 3.18Å
110	L	96.3	Very high	94.8	Very high	11 Å²	11	60.4 Å²	60.4	6%	0.058	30%	0.295	C	S	.	.	H	α-helix	trans	-72.5	-32.1	172	-82.4	169.4	0	0	0	112.4	H106 T107 M108 R114 Y117 K121 P125 I128	H106-L110 VanDerWaalsContact O-CB 3.24Å; H106-L110 WeakPolarHBondContact O-CB 3.4Å; H106-L110 VanDerWaalsContact O-CG 3.23Å; H106-L110 WeakPolarHBondContact O-CG 3.1Å; H106-L110 PolarHBondContact O-N 2.86Å; T107-L110 PolarHBondContact O-N 3.28Å; M108-L110 VanDerWaalsContact C-N 3.3Å; M108-L110 PolarHBondContact O-N 3.4Å; L110-R114 WeakPolarHBondContact O-CA 3.4Å; L110-R114 WeakPolarHBondContact O-CB 3.32Å; L110-R114 PolarHBondContact O-N 3.05Å; L110-Y117 HydrophobicContact CD2-CD1 4.26Å; L110-Y117 HydrophobicContact CD2-CD2 3.48Å; L110-Y117 VanDerWaalsContact CD2-CD2 3.48Å; L110-Y117 HydrophobicContact CD2-CE1 4.48Å; L110-Y117 HydrophobicContact CD2-CE2 3.74Å; L110-Y117 HydrophobicContact CD2-CG 3.76Å; L110-Y117 HydrophobicContact CG-CD2 4.21Å; L110-Y117 HydrophobicContact CG-CE2 3.94Å; L110-K121 HydrophobicContact CD2-CB 3.68Å; L110-P125 HydrophobicContact CD1-CB 4.21Å; L110-I128 HydrophobicContact CD1-CD1 4.01Å
111	L	95.8	Very high	94.5	Very high	135 Å²	135	58.3 Å²	58.3	71%	0.707	28%	0.281	S	S	*	.	H	α-helix	trans	-68.8	-48.1	174	-67.3	174.1	0	0	0	110.9	T107 M108	T107-L111 WeakPolarHBondContact O-CG 3.49Å; T107-L111 PolarHBondContact O-N 3.26Å; T107-L111 VanDerWaalsContact O-N 3.14Å; M108-L111 HydrophobicContact CE-CD1 3.7Å; M108-L111 WeakPolarHBondContact O-CB 3.49Å; M108-L111 PolarHBondContact O-N 2.7Å; M108-L111 HydrophobicContact SD-CD1 4.27Å
112	Q	95.4	Very high	94.1	Very high	115 Å²	115	60.3 Å²	60.3	54%	0.537	29%	0.29	S	S	.	.	H	α-helix	trans	-77.6	-42.5	-177.3	-65	174.6	-0.6	0	0	112.3	M108	M108-Q112 WeakPolarHBondContact O-CG 3.37Å; M108-Q112 PolarHBondContact O-N 3.48Å
113	N	96	Very high	93.9	Very high	24 Å²	24	64.8 Å²	64.8	13%	0.128	31%	0.313	C	S	.	.	H	α-helix	trans	-130.8	40.4	-163.8	-62.7	-54.6	0	0	0	113.3	Q62 N109 R115 H116	Q62-N113 PolarHBondContact O-ND2 3.21Å; N109-N113 CarbonylContact O-C 3.28Å; N109-N113 VanDerWaalsContact O-C 3.28Å; N109-N113 WeakPolarHBondContact O-CA 3.41Å; N109-N113 VanDerWaalsContact O-CB 3.26Å; N109-N113 WeakPolarHBondContact O-CB 3.31Å; N109-N113 PolarHBondContact O-N 2.65Å; N109-N113 WeakPolarHBondContact OD1-CB 3.45Å; N109-N113 PolarHBondContact OD1-ND2 3.01Å; N113-R115 PolarHBondContact O-N 3.5Å; N113-H116 VanDerWaalsContact CB-CE1 3.49Å; N113-H116 WeakPolarHBondContact CB-CE1 3.36Å; N113-H116 WeakPolarHBondContact CB-ND1 3.4Å; N113-H116 VanDerWaalsContact CG-CE1 3.47Å; N113-H116 WeakPolarHBondContact O-CB 3.41Å; N113-H116 PolarHBondContact O-N 3.33Å; N113-H116 PolarHBondContact OD1-CE1 3.49Å
114	R	94.4	Very high	93.6	Very high	134 Å²	134	63.4 Å²	63.4	51%	0.506	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-48.4	-32.5	-178.1	-162.4	171.8	176.6	87.9	-0.8	114.5	L110 H116 K121	L110-R114 WeakPolarHBondContact O-CA 3.4Å; L110-R114 WeakPolarHBondContact O-CB 3.32Å; L110-R114 PolarHBondContact O-N 3.05Å; R114-H116 VanDerWaalsContact C-N 3.32Å; R114-H116 PolarHBondContact O-N 2.99Å; R114-K121 HydrophobicContact CG-CD 4.1Å; R114-K121 WeakPolarHBondContact O-CD 3.1Å
115	R	93.4	Very high	93.4	Very high	229 Å²	229	61.8 Å²	61.8	86%	0.864	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-75	-15.7	-178	-65.4	-178.1	178.5	173.9	-0.2	114	N113 Y117	N113-R115 PolarHBondContact O-N 3.5Å; R115-Y117 VanDerWaalsContact C-N 3.29Å
116	H	94.2	Very high	93.2	Very high	20 Å²	20	66.3 Å²	66.3	9%	0.093	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-68.1	-35.1	177.5	-65.7	179.3	0	0	0	111.5	N113 R114 N142 V145 Y154	N113-H116 VanDerWaalsContact CB-CE1 3.49Å; N113-H116 WeakPolarHBondContact CB-CE1 3.36Å; N113-H116 WeakPolarHBondContact CB-ND1 3.4Å; N113-H116 VanDerWaalsContact CG-CE1 3.47Å; N113-H116 WeakPolarHBondContact O-CB 3.41Å; N113-H116 PolarHBondContact O-N 3.33Å; N113-H116 PolarHBondContact OD1-CE1 3.49Å; R114-H116 VanDerWaalsContact C-N 3.32Å; R114-H116 PolarHBondContact O-N 2.99Å; H116-N142 HydrophobicContact CB-CB 4.45Å; H116-N142 PolarHBondContact O-OD1 2.93Å; H116-V145 HydrophobicContact CB-CG2 4.02Å; H116-V145 VanDerWaalsContact CD2-CG1 3.41Å; H116-V145 WeakPolarHBondContact CD2-CG1 3.41Å; H116-V145 VanDerWaalsContact NE2-CG1 3.28Å; H116-V145 WeakPolarHBondContact NE2-CG1 3.41Å; H116-Y154 HydrophobicContact CB-CE1 4.37Å; H116-Y154 WeakPolarHBondContact CB-OH 3.3Å; H116-Y154 AromaticContact ND1-CE1 3.66Å; H116-Y154 AromaticContact ND1-CZ 3.71Å; H116-Y154 PolarHBondContact ND1-OH 3.36Å
117	Y	92.6	Very high	93	Very high	4 Å²	4	71.1 Å²	71.1	2%	0.016	35%	0.348	C	S	.	.	S	Bend	trans	-78.4	147	-179.2	-63.9	-95.9	0	0	0	111.8	H106 N109 L110 R115 I128 Y140	H106-Y117 AromaticContact ND1-CZ 3.89Å; H106-Y117 PolarHBondContact ND1-OH 2.97Å; N109-Y117 HydrophobicContact CB-CE2 4.43Å; N109-Y117 VanDerWaalsContact ND2-CE2 3.25Å; N109-Y117 WeakPolarHBondContact ND2-CE2 3.04Å; N109-Y117 PolarHBondContact ND2-OH 2.99Å; L110-Y117 HydrophobicContact CD2-CD1 4.26Å; L110-Y117 HydrophobicContact CD2-CD2 3.48Å; L110-Y117 VanDerWaalsContact CD2-CD2 3.48Å; L110-Y117 HydrophobicContact CD2-CE1 4.48Å; L110-Y117 HydrophobicContact CD2-CE2 3.74Å; L110-Y117 HydrophobicContact CD2-CG 3.76Å; L110-Y117 HydrophobicContact CG-CD2 4.21Å; L110-Y117 HydrophobicContact CG-CE2 3.94Å; R115-Y117 VanDerWaalsContact C-N 3.29Å; Y117-I128 HydrophobicContact CD1-CD1 3.88Å; Y117-I128 HydrophobicContact CE1-CD1 3.99Å; Y117-I128 HydrophobicContact CE1-CG2 4.16Å; Y117-Y140 AromaticContact CD1-CE1 3.94Å; Y117-Y140 HydrophobicContact CD1-CE1 3.94Å; Y117-Y140 AromaticContact CE1-CE1 3.96Å; Y117-Y140 HydrophobicContact CE1-CE1 3.96Å
118	S	88.9	Confident	92.7	Very high	20 Å²	20	68.9 Å²	68.9	14%	0.14	34%	0.335	C	S	.	.			trans	-69.8	-162	169	68.3	0	0	0	0	111.1	L120 K121 T355	S118-L120 PolarHBondContact O-N 3.49Å; S118-L120 VanDerWaalsContact O-N 3.08Å; S118-L120 PolarHBondContact OG-N 3.27Å; S118-K121 WeakPolarHBondContact O-CD 3.42Å; S118-K121 VanDerWaalsContact O-CG 3.27Å; S118-K121 WeakPolarHBondContact O-CG 3.39Å; S118-K121 PolarHBondContact O-N 2.94Å; S118-T355 WeakPolarHBondContact CB-O 3.4Å; S118-T355 PolarHBondContact OG-O 2.81Å
119	I	87.6	Confident	92.5	Very high	131 Å²	131	66.1 Å²	66.1	67%	0.672	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-58.4	-20.6	176.1	-161.9	161.7	0	0	0	113.1	K121 I122	I119-K121 PolarHBondContact O-N 3.25Å; I119-I122 HydrophobicContact CG1-CD1 3.8Å; I119-I122 WeakPolarHBondContact O-CG1 3.32Å; I119-I122 PolarHBondContact O-N 2.9Å
120	L	86.9	Confident	92.2	Very high	26 Å²	26	67.7 Å²	67.7	14%	0.136	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-58.4	-17.9	177	-63.7	-178.7	0	0	0	114.1	S118 I122 L123 I131 Y140 T355	S118-L120 PolarHBondContact O-N 3.49Å; S118-L120 VanDerWaalsContact O-N 3.08Å; S118-L120 PolarHBondContact OG-N 3.27Å; L120-I122 PolarHBondContact O-N 2.95Å; L120-I122 VanDerWaalsContact O-N 3.12Å; L120-L123 HydrophobicContact CD2-CD1 3.69Å; L120-L123 WeakPolarHBondContact O-CB 3.38Å; L120-L123 PolarHBondContact O-N 2.85Å; L120-I131 HydrophobicContact CD1-CD1 4.32Å; L120-I131 HydrophobicContact CD2-CD1 4.45Å; L120-Y140 HydrophobicContact CD1-CE2 4.17Å; L120-T355 HydrophobicContact CD1-CG2 3.67Å
121	K	88.9	Confident	91.9	Very high	62 Å²	62	68.5 Å²	68.5	27%	0.27	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-56.4	-23.3	171.4	69	-163.5	173.1	-161.2	0	114.5	L110 R114 S118 I119 L123	L110-K121 HydrophobicContact CD2-CB 3.68Å; R114-K121 HydrophobicContact CG-CD 4.1Å; R114-K121 WeakPolarHBondContact O-CD 3.1Å; S118-K121 WeakPolarHBondContact O-CD 3.42Å; S118-K121 VanDerWaalsContact O-CG 3.27Å; S118-K121 WeakPolarHBondContact O-CG 3.39Å; S118-K121 PolarHBondContact O-N 2.94Å; I119-K121 PolarHBondContact O-N 3.25Å; K121-L123 VanDerWaalsContact C-N 3.35Å
122	I	88.9	Confident	91.8	Very high	120 Å²	120	62 Å²	62	62%	0.615	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-75.1	-28.6	179.4	-57.8	174.6	0	0	0	110.7	I119 L120 G124	I119-I122 HydrophobicContact CG1-CD1 3.8Å; I119-I122 WeakPolarHBondContact O-CG1 3.32Å; I119-I122 PolarHBondContact O-N 2.9Å; L120-I122 PolarHBondContact O-N 2.95Å; L120-I122 VanDerWaalsContact O-N 3.12Å; I122-G124 PolarHBondContact O-N 2.79Å
123	L	91.1	Very high	91.7	Very high	101 Å²	101	58.8 Å²	58.8	53%	0.529	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-75.2	-9.4	179.7	-55.7	-179.8	0	0	0	113.4	L120 K121 K127	L120-L123 HydrophobicContact CD2-CD1 3.69Å; L120-L123 WeakPolarHBondContact O-CB 3.38Å; L120-L123 PolarHBondContact O-N 2.85Å; K121-L123 VanDerWaalsContact C-N 3.35Å; L123-K127 HydrophobicContact CB-CB 3.93Å; L123-K127 HydrophobicContact CB-CG 4.07Å; L123-K127 HydrophobicContact CD1-CG 4.08Å
124	G	90.9	Very high	91.4	Very high	18 Å²	18	62.9 Å²	62.9	19%	0.186	31%	0.311	C	S	.	.	H	α-helix	trans	80.9	169.6	178.8	0	0	0	0	0	115	I122 T126 K127 I128	I122-G124 PolarHBondContact O-N 2.79Å; G124-T126 PolarHBondContact O-N 3.3Å; G124-K127 PolarHBondContact O-N 2.93Å; G124-I128 WeakPolarHBondContact O-CG1 3.35Å; G124-I128 PolarHBondContact O-N 3.26Å
125	P	92.4	Very high	91.1	Very high	30 Å²	30	63 Å²	63	20%	0.195	31%	0.312	C	S	.	.	H	α-helix	trans	-65.5	-37.9	-171.9	24.9	-33.8	0	0	0	113.5	H106 T107 L110 K127 I128 S129	H106-P125 HydrophobicContact CB-CB 4.04Å; T107-P125 HydrophobicContact CG2-CG 4.39Å; T107-P125 VanDerWaalsContact OG1-CB 3.28Å; T107-P125 WeakPolarHBondContact OG1-CB 3.25Å; T107-P125 WeakPolarHBondContact OG1-CG 3.28Å; L110-P125 HydrophobicContact CD1-CB 4.21Å; P125-K127 PolarHBondContact O-N 3.35Å; P125-I128 PolarHBondContact O-N 3.17Å; P125-S129 WeakPolarHBondContact O-CB 3.39Å; P125-S129 PolarHBondContact O-N 2.91Å
126	T	93.4	Very high	91	Very high	99 Å²	99	53.2 Å²	53.2	61%	0.607	28%	0.283	S	S	*	.	H	α-helix	trans	-60.2	-45.3	179.4	-48.3	0	0	0	0	111.8	G124 S129 S130	G124-T126 PolarHBondContact O-N 3.3Å; T126-S129 PolarHBondContact O-N 2.94Å; T126-S130 PolarHBondContact O-N 3.48Å
127	K	93.4	Very high	90.9	Very high	102 Å²	102	52.4 Å²	52.4	44%	0.443	28%	0.28	S	S	.	.	H	α-helix	trans	-70.3	-37	179.2	-167.7	58	169.7	178.8	0	111.9	L123 G124 P125 S129 S130 I131	L123-K127 HydrophobicContact CB-CB 3.93Å; L123-K127 HydrophobicContact CB-CG 4.07Å; L123-K127 HydrophobicContact CD1-CG 4.08Å; G124-K127 PolarHBondContact O-N 2.93Å; P125-K127 PolarHBondContact O-N 3.35Å; K127-S129 VanDerWaalsContact C-N 3.34Å; K127-S130 PolarHBondContact O-N 3.28Å; K127-I131 HydrophobicContact CG-CD1 4.31Å; K127-I131 VanDerWaalsContact O-CG1 3.29Å; K127-I131 WeakPolarHBondContact O-CG1 3.36Å; K127-I131 PolarHBondContact O-N 2.91Å
128	I	92.4	Very high	91.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.2	-43.3	173.7	-67.2	168	0	0	0	110.5	L110 Y117 G124 P125 I131 Q132 Y140	L110-I128 HydrophobicContact CD1-CD1 4.01Å; Y117-I128 HydrophobicContact CD1-CD1 3.88Å; Y117-I128 HydrophobicContact CE1-CD1 3.99Å; Y117-I128 HydrophobicContact CE1-CG2 4.16Å; G124-I128 WeakPolarHBondContact O-CG1 3.35Å; G124-I128 PolarHBondContact O-N 3.26Å; P125-I128 PolarHBondContact O-N 3.17Å; I128-I131 CarbonylContact O-C 3.6Å; I128-I131 PolarHBondContact O-N 3.46Å; I128-Q132 WeakPolarHBondContact O-CB 3.19Å; I128-Q132 PolarHBondContact O-N 2.98Å; I128-Y140 HydrophobicContact CG2-CD1 4.39Å; I128-Y140 HydrophobicContact CG2-CD2 3.98Å; I128-Y140 HydrophobicContact CG2-CE1 4.37Å; I128-Y140 HydrophobicContact CG2-CE2 3.95Å; I128-Y140 HydrophobicContact CG2-CG 4.21Å
129	S	91.3	Very high	91.4	Very high	7 Å²	7	52 Å²	52	5%	0.049	28%	0.277	C	S	.	.	H	α-helix	trans	-65.7	-39.5	177	-179	0	0	0	0	112.5	V103 P125 T126 K127 Q132 N133	V103-S129 WeakPolarHBondContact CG2-OG 3.03Å; P125-S129 WeakPolarHBondContact O-CB 3.39Å; P125-S129 PolarHBondContact O-N 2.91Å; T126-S129 PolarHBondContact O-N 2.94Å; K127-S129 VanDerWaalsContact C-N 3.34Å; S129-Q132 VanDerWaalsContact O-CB 3.27Å; S129-Q132 WeakPolarHBondContact O-CB 3.37Å; S129-Q132 PolarHBondContact O-N 3.44Å; S129-N133 PolarHBondContact O-N 2.94Å
130	S	92.4	Very high	91.8	Very high	34 Å²	34	45.8 Å²	45.8	24%	0.238	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-47.1	170.2	165.5	0	0	0	0	111.3	T126 K127 Q132 N133 D134	T126-S130 PolarHBondContact O-N 3.48Å; K127-S130 PolarHBondContact O-N 3.28Å; S130-Q132 PolarHBondContact O-N 3.48Å; S130-N133 PolarHBondContact O-N 3.31Å; S130-D134 WeakPolarHBondContact CA-OD2 3.4Å; S130-D134 WeakPolarHBondContact CB-OD2 3.24Å; S130-D134 VanDerWaalsContact O-CB 3.24Å; S130-D134 WeakPolarHBondContact O-CB 3.45Å; S130-D134 PolarHBondContact O-N 2.99Å; S130-D134 VanDerWaalsContact O-OD2 3.1Å; S130-D134 PolarHBondContact OG-OD2 2.79Å
131	I	90.5	Very high	92.2	Very high	27 Å²	27	45.5 Å²	45.5	14%	0.138	24%	0.243	C	C	.	.	H	α-helix	trans	-59.7	-37.2	174.3	-67.8	165.7	0	0	0	111.7	L120 K127 I128 Y140 K351 T355	L120-I131 HydrophobicContact CD1-CD1 4.32Å; L120-I131 HydrophobicContact CD2-CD1 4.45Å; K127-I131 HydrophobicContact CG-CD1 4.31Å; K127-I131 VanDerWaalsContact O-CG1 3.29Å; K127-I131 WeakPolarHBondContact O-CG1 3.36Å; K127-I131 PolarHBondContact O-N 2.91Å; I128-I131 CarbonylContact O-C 3.6Å; I128-I131 PolarHBondContact O-N 3.46Å; I131-Y140 HydrophobicContact CG2-CD2 4.35Å; I131-K351 HydrophobicContact CG2-CD 4.2Å; I131-K351 HydrophobicContact CG2-CG 4.47Å; I131-K351 PolarHBondContact O-NZ 2.94Å; I131-T355 HydrophobicContact CG2-CG2 3.94Å
132	Q	92.9	Very high	92.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-60.9	175	179	-177.4	-73.6	0	0	109.6	P102 H106 I128 S129 S130 S138 V156 K351	P102-Q132 VanDerWaalsContact CB-NE2 3.35Å; H106-Q132 PolarHBondContact NE2-OE1 2.89Å; H106-Q132 VanDerWaalsContact NE2-OE1 3.13Å; I128-Q132 WeakPolarHBondContact O-CB 3.19Å; I128-Q132 PolarHBondContact O-N 2.98Å; S129-Q132 VanDerWaalsContact O-CB 3.27Å; S129-Q132 WeakPolarHBondContact O-CB 3.37Å; S129-Q132 PolarHBondContact O-N 3.44Å; S130-Q132 PolarHBondContact O-N 3.48Å; Q132-S138 VanDerWaalsContact CG-O 3.31Å; Q132-S138 WeakPolarHBondContact CG-O 3.47Å; Q132-S138 CarbonylContact O-C 3.5Å; Q132-S138 WeakPolarHBondContact O-CA 3.37Å; Q132-V156 VanDerWaalsContact CD-O 3.25Å; Q132-V156 PolarHBondContact OE1-O 3.47Å; Q132-V156 VanDerWaalsContact OE1-O 3.07Å; Q132-K351 PolarHBondContact O-NZ 3.45Å; Q132-K351 VanDerWaalsContact O-NZ 3.12Å
133	N	92.3	Very high	92.6	Very high	47 Å²	47	37.7 Å²	37.7	25%	0.251	21%	0.206	S	C	.	.	H	α-helix	trans	-78.8	-38.3	-165.5	-66.6	-17.8	0	0	0	113.5	S129 S130 S138	S129-N133 PolarHBondContact O-N 2.94Å; S130-N133 PolarHBondContact O-N 3.31Å; N133-S138 PolarHBondContact O-OG 2.84Å
134	D	89.7	Confident	92.6	Very high	109 Å²	109	34.6 Å²	34.6	58%	0.583	19%	0.189	S	C	*	.	H	α-helix	trans	-88	-13.6	-166.7	-54.7	-29.1	0	0	0	113.2	S130	S130-D134 WeakPolarHBondContact CA-OD2 3.4Å; S130-D134 WeakPolarHBondContact CB-OD2 3.24Å; S130-D134 VanDerWaalsContact O-CB 3.24Å; S130-D134 WeakPolarHBondContact O-CB 3.45Å; S130-D134 PolarHBondContact O-N 2.99Å; S130-D134 VanDerWaalsContact O-OD2 3.1Å; S130-D134 PolarHBondContact OG-OD2 2.79Å
135	Y	88.9	Confident	92.7	Very high	137 Å²	137	33.9 Å²	33.9	54%	0.537	18%	0.181	S	C	.	.	S	Bend	trans	-128	150.8	-173.2	-60.8	-88.1	0	0	0	112.9	A137 S138 K351	Y135-A137 PolarHBondContact O-N 3.14Å; Y135-S138 PolarHBondContact O-N 2.98Å; Y135-K351 PolarHBondContact O-NZ 2.92Å
136	G	91.1	Very high	92.8	Very high	24 Å²	24	37 Å²	37	25%	0.247	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	-130.8	175.2	0	0	0	0	0	112.3	S138	G136-S138 VanDerWaalsContact C-N 3.34Å
137	A	92.6	Very high	92.7	Very high	3 Å²	3	32.5 Å²	32.5	3%	0.025	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	24.9	-178	0	0	0	0	0	114	Y135 V139 Y173 Q348	Y135-A137 PolarHBondContact O-N 3.14Å; A137-V139 VanDerWaalsContact O-CG2 3.26Å; A137-V139 WeakPolarHBondContact O-CG2 3.39Å; A137-V139 PolarHBondContact O-N 2.88Å; A137-Y173 VanDerWaalsContact CB-CB 3.42Å; A137-Y173 HydrophobicContact CB-CD1 3.67Å; A137-Y173 HydrophobicContact CB-CD2 3.95Å; A137-Y173 HydrophobicContact CB-CE1 4.43Å; A137-Y173 HydrophobicContact CB-CG 3.39Å; A137-Q348 HydrophobicContact CB-CB 4.36Å; A137-Q348 HydrophobicContact CB-CG 4.26Å
138	S	96.1	Very high	92.5	Very high	14 Å²	14	30.1 Å²	30.1	10%	0.098	17%	0.166	C	C	.	.	S	Bend	trans	58	16.9	-174.9	-56.1	0	0	0	0	115.1	Q132 N133 Y135 G136	Q132-S138 VanDerWaalsContact CG-O 3.31Å; Q132-S138 WeakPolarHBondContact CG-O 3.47Å; Q132-S138 CarbonylContact O-C 3.5Å; Q132-S138 WeakPolarHBondContact O-CA 3.37Å; N133-S138 PolarHBondContact O-OG 2.84Å; Y135-S138 PolarHBondContact O-N 2.98Å; G136-S138 VanDerWaalsContact C-N 3.34Å
139	V	96	Very high	92.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.2	-179.9	-172	0	0	0	0	111.9	A137 Y141 V156 I157 V174 Q348 K351	A137-V139 VanDerWaalsContact O-CG2 3.26Å; A137-V139 WeakPolarHBondContact O-CG2 3.39Å; A137-V139 PolarHBondContact O-N 2.88Å; V139-Y141 HydrophobicContact CB-CE2 4.03Å; V139-Y141 HydrophobicContact CG1-CD2 3.99Å; V139-Y141 HydrophobicContact CG1-CE1 4.27Å; V139-Y141 HydrophobicContact CG1-CE2 3.57Å; V139-V156 CarbonylContact C-O 3.5Å; V139-V156 VanDerWaalsContact CA-O 3.28Å; V139-V156 WeakPolarHBondContact CA-O 3.42Å; V139-V156 WeakPolarHBondContact CG1-O 3.32Å; V139-I157 HydrophobicContact CG2-CB 3.93Å; V139-I157 HydrophobicContact CG2-CD1 3.84Å; V139-I157 HydrophobicContact CG2-CG1 4.09Å; V139-V174 HydrophobicContact CG2-CG2 3.47Å; V139-V174 VanDerWaalsContact CG2-CG2 3.47Å; V139-Q348 PolarHBondContact O-NE2 3.25Å; V139-K351 WeakPolarHBondContact O-CE 3.3Å; V139-K351 PolarHBondContact O-NZ 2.94Å
140	Y	95.9	Very high	92.3	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.5	172.4	-173.5	-83.6	0	0	0	110.5	Y117 L120 I128 I131 N142 G155 V156 T355	Y117-Y140 AromaticContact CD1-CE1 3.94Å; Y117-Y140 HydrophobicContact CD1-CE1 3.94Å; Y117-Y140 AromaticContact CE1-CE1 3.96Å; Y117-Y140 HydrophobicContact CE1-CE1 3.96Å; L120-Y140 HydrophobicContact CD1-CE2 4.17Å; I128-Y140 HydrophobicContact CG2-CD1 4.39Å; I128-Y140 HydrophobicContact CG2-CD2 3.98Å; I128-Y140 HydrophobicContact CG2-CE1 4.37Å; I128-Y140 HydrophobicContact CG2-CE2 3.95Å; I128-Y140 HydrophobicContact CG2-CG 4.21Å; I131-Y140 HydrophobicContact CG2-CD2 4.35Å; Y140-N142 WeakPolarHBondContact CE1-OD1 3.37Å; Y140-G155 CarbonylContact O-C 3.55Å; Y140-G155 VanDerWaalsContact O-CA 3.3Å; Y140-G155 WeakPolarHBondContact O-CA 3.49Å; Y140-V156 PolarHBondContact N-O 3.03Å; Y140-V156 PolarHBondContact O-N 3.22Å; Y140-T355 HydrophobicContact CD2-CG2 4.34Å; Y140-T355 HydrophobicContact CE2-CG2 3.79Å
141	Y	95.4	Very high	92.3	Very high	21 Å²	21	37.8 Å²	37.8	8%	0.082	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	130.8	-179.7	-76.8	-77.6	0	0	0	112.5	V139 K153 Y154 G155 Y173	V139-Y141 HydrophobicContact CB-CE2 4.03Å; V139-Y141 HydrophobicContact CG1-CD2 3.99Å; V139-Y141 HydrophobicContact CG1-CE1 4.27Å; V139-Y141 HydrophobicContact CG1-CE2 3.57Å; Y141-K153 HydrophobicContact CD1-CD 4.2Å; Y141-K153 HydrophobicContact CD1-CG 3.94Å; Y141-Y154 WeakPolarHBondContact CA-O 3.48Å; Y141-G155 VanDerWaalsContact CE1-CA 3.42Å; Y141-Y173 HydrophobicContact CE2-CE1 4.05Å
142	N	94.6	Very high	92.5	Very high	5 Å²	5	36.5 Å²	36.5	3%	0.027	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	133.4	157.7	-74.3	-47.6	0	0	0	108.8	H116 Y140 V145 K153 Y154	H116-N142 HydrophobicContact CB-CB 4.45Å; H116-N142 PolarHBondContact O-OD1 2.93Å; Y140-N142 WeakPolarHBondContact CE1-OD1 3.37Å; N142-V145 HydrophobicContact CB-CG2 4.31Å; N142-K153 CarbonylContact O-C 3.54Å; N142-K153 VanDerWaalsContact O-CA 3.3Å; N142-K153 WeakPolarHBondContact O-CA 3.45Å; N142-Y154 HydrophobicContact CB-CD1 4.18Å; N142-Y154 HydrophobicContact CB-CD2 4.41Å; N142-Y154 HydrophobicContact CB-CE1 3.61Å; N142-Y154 HydrophobicContact CB-CE2 3.87Å; N142-Y154 VanDerWaalsContact CB-CZ 3.43Å; N142-Y154 PolarHBondContact N-O 2.95Å; N142-Y154 WeakPolarHBondContact ND2-CE2 3.5Å; N142-Y154 PolarHBondContact ND2-OH 3.5Å; N142-Y154 PolarHBondContact O-N 3.18Å
143	T	92.3	Very high	92.6	Very high	13 Å²	13	37.6 Å²	37.6	8%	0.08	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	160.4	-174.1	-167.6	0	0	0	0	111.5	V145 A356 K360	T143-V145 VanDerWaalsContact C-N 3.27Å; T143-V145 PolarHBondContact O-N 3Å; T143-A356 HydrophobicContact CG2-CB 4.15Å; T143-K360 HydrophobicContact CG2-CB 4.41Å; T143-K360 HydrophobicContact CG2-CD 4.28Å; T143-K360 PolarHBondContact O-NZ 3.35Å
144	L	90.4	Very high	92.8	Very high	36 Å²	36	35.3 Å²	35.3	19%	0.188	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	55.2	44	-178.5	-56.7	175.4	0	0	0	111.8	M92 I151 I152 K360	M92-L144 HydrophobicContact SD-CD2 4.32Å; L144-I151 HydrophobicContact CD2-CG2 4.16Å; L144-I152 PolarHBondContact N-O 2.98Å; L144-K360 HydrophobicContact CB-CD 4.48Å; L144-K360 HydrophobicContact CD1-CB 4.03Å; L144-K360 HydrophobicContact CD1-CG 4.1Å
145	V	93.5	Very high	93.2	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	121	-179.7	171	0	0	0	0	108.9	H116 N142 T143 I151 I152 Y154	H116-V145 HydrophobicContact CB-CG2 4.02Å; H116-V145 VanDerWaalsContact CD2-CG1 3.41Å; H116-V145 WeakPolarHBondContact CD2-CG1 3.41Å; H116-V145 VanDerWaalsContact NE2-CG1 3.28Å; H116-V145 WeakPolarHBondContact NE2-CG1 3.41Å; N142-V145 HydrophobicContact CB-CG2 4.31Å; T143-V145 VanDerWaalsContact C-N 3.27Å; T143-V145 PolarHBondContact O-N 3Å; V145-I151 CarbonylContact O-C 3.42Å; V145-I151 WeakPolarHBondContact O-CA 3.13Å; V145-I152 HydrophobicContact CB-CG1 3.78Å; V145-I152 HydrophobicContact CG1-CD1 4.25Å; V145-I152 HydrophobicContact CG1-CG1 3.94Å; V145-I152 PolarHBondContact N-O 3.07Å; V145-I152 WeakPolarHBondContact O-CG1 3.4Å; V145-I152 PolarHBondContact O-N 3.39Å; V145-Y154 HydrophobicContact CB-CE1 4.44Å; V145-Y154 HydrophobicContact CG1-CE1 4.37Å; V145-Y154 HydrophobicContact CG2-CE1 4.02Å
146	P	93.6	Very high	93.6	Very high	96 Å²	96	23.6 Å²	23.6	62%	0.623	15%	0.154	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	126.9	171	-15.5	30.9	0	0	0	110.5	R150 I151	P146-R150 CarbonylContact C-O 3.58Å; P146-R150 WeakPolarHBondContact CA-O 3.03Å; P146-I151 HydrophobicContact CB-CD1 4.3Å; P146-I151 HydrophobicContact CG-CD1 4.23Å
147	A	92.3	Very high	94	Very high	4 Å²	4	22.5 Å²	22.5	3%	0.033	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	126.7	175	0	0	0	0	0	110.1	I59 G149 R150 I152	I59-A147 HydrophobicContact CG1-CB 4.37Å; I59-A147 HydrophobicContact CG2-CB 4.47Å; A147-G149 VanDerWaalsContact C-N 3.32Å; A147-G149 PolarHBondContact O-N 2.99Å; A147-R150 PolarHBondContact N-O 3.26Å; A147-R150 WeakPolarHBondContact O-CB 3.27Å; A147-R150 PolarHBondContact O-N 2.79Å; A147-I152 HydrophobicContact CB-CD1 3.79Å; A147-I152 HydrophobicContact CB-CG1 4.18Å; A147-I152 HydrophobicContact CB-CG2 4.13Å
148	D	89.3	Confident	94.2	Very high	52 Å²	52	23 Å²	23	28%	0.278	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	46.7	176.9	-161.8	38.9	0	0	0	113.9	I55 R58 I59 R150	I55-D148 WeakPolarHBondContact CG1-OD2 3.26Å; R58-D148 IonicContact CZ-OD1 3.07Å; R58-D148 IonicContact CZ-OD2 2.69Å; R58-D148 IonicContact NE-OD1 2.92Å; R58-D148 PolarHBondContact NE-OD1 2.96Å; R58-D148 IonicContact NE-OD2 3.28Å; R58-D148 PolarHBondContact NE-OD2 2.94Å; R58-D148 IonicContact NH2-OD1 3.73Å; R58-D148 PolarHBondContact NH2-OD1 3.43Å; R58-D148 IonicContact NH2-OD2 3.69Å; R58-D148 PolarHBondContact NH2-OD2 3.38Å; I59-D148 HydrophobicContact CD1-CB 4.43Å; I59-D148 HydrophobicContact CG1-CB 3.75Å; D148-R150 PolarHBondContact O-N 3.42Å
149	G	87.3	Confident	94.3	Very high	88 Å²	88	22.4 Å²	22.4	91%	0.907	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.5	5.2	-179.1	0	0	0	0	0	115.1	A147	A147-G149 VanDerWaalsContact C-N 3.32Å; A147-G149 PolarHBondContact O-N 2.99Å
150	R	90.5	Very high	94.4	Very high	46 Å²	46	28.3 Å²	28.3	17%	0.174	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	161.9	176.8	-64.5	-70.4	-141.1	-119.4	-6.2	111.1	I55 E89 L93 P146 A147 D148 I152	I55-R150 HydrophobicContact CD1-CG 3.69Å; E89-R150 VanDerWaalsContact O-CD 3.25Å; E89-R150 WeakPolarHBondContact O-CD 3.42Å; E89-R150 VanDerWaalsContact O-CZ 3.29Å; E89-R150 PolarHBondContact O-NE 2.76Å; E89-R150 PolarHBondContact O-NH1 2.87Å; E89-R150 VanDerWaalsContact O-NH1 3.15Å; E89-R150 IonicContact OE2-NH1 3.11Å; E89-R150 PolarHBondContact OE2-NH1 3.23Å; E89-R150 VanDerWaalsContact OE2-NH1 3.1Å; L93-R150 HydrophobicContact CD1-CB 4.28Å; L93-R150 HydrophobicContact CD1-CG 4.1Å; P146-R150 CarbonylContact C-O 3.58Å; P146-R150 WeakPolarHBondContact CA-O 3.03Å; A147-R150 PolarHBondContact N-O 3.26Å; A147-R150 WeakPolarHBondContact O-CB 3.27Å; A147-R150 PolarHBondContact O-N 2.79Å; D148-R150 PolarHBondContact O-N 3.42Å; R150-I152 HydrophobicContact CB-CG2 4.41Å
151	I	92.4	Very high	94.5	Very high	69 Å²	69	29.4 Å²	29.4	35%	0.354	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	132.4	162.2	-57.9	-59	0	0	0	107.9	M92 L93 L144 V145 P146	M92-I151 VanDerWaalsContact CA-O 3.26Å; M92-I151 WeakPolarHBondContact CA-O 3.24Å; M92-I151 HydrophobicContact CG-CG2 4.05Å; M92-I151 WeakPolarHBondContact CG-O 3.33Å; M92-I151 HydrophobicContact SD-CG2 4.04Å; L93-I151 PolarHBondContact N-O 2.91Å; L144-I151 HydrophobicContact CD2-CG2 4.16Å; V145-I151 CarbonylContact O-C 3.42Å; V145-I151 WeakPolarHBondContact O-CA 3.13Å; P146-I151 HydrophobicContact CB-CD1 4.3Å; P146-I151 HydrophobicContact CG-CD1 4.23Å
152	I	95.1	Very high	94.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	156.7	179.3	75.7	171.3	0	0	0	111.5	I59 F63 L93 F95 L144 V145 A147 R150 Y154	I59-I152 HydrophobicContact CD1-CG2 4.24Å; I59-I152 HydrophobicContact CG2-CD1 4.04Å; F63-I152 HydrophobicContact CE2-CD1 4.11Å; F63-I152 HydrophobicContact CZ-CD1 3.82Å; L93-I152 HydrophobicContact CB-CG2 4.11Å; L93-I152 CarbonylContact O-C 3.33Å; L93-I152 VanDerWaalsContact O-CA 3.27Å; L93-I152 WeakPolarHBondContact O-CA 3.47Å; F95-I152 HydrophobicContact CD2-CB 4.28Å; F95-I152 HydrophobicContact CE2-CB 4.04Å; F95-I152 HydrophobicContact CE2-CG2 3.92Å; L144-I152 PolarHBondContact N-O 2.98Å; V145-I152 HydrophobicContact CB-CG1 3.78Å; V145-I152 HydrophobicContact CG1-CD1 4.25Å; V145-I152 HydrophobicContact CG1-CG1 3.94Å; V145-I152 PolarHBondContact N-O 3.07Å; V145-I152 WeakPolarHBondContact O-CG1 3.4Å; V145-I152 PolarHBondContact O-N 3.39Å; A147-I152 HydrophobicContact CB-CD1 3.79Å; A147-I152 HydrophobicContact CB-CG1 4.18Å; A147-I152 HydrophobicContact CB-CG2 4.13Å; R150-I152 HydrophobicContact CB-CG2 4.41Å; I152-Y154 HydrophobicContact CD1-CD1 3.97Å; I152-Y154 HydrophobicContact CG1-CD1 4.31Å
153	K	95.2	Very high	94.8	Very high	22 Å²	22	29.5 Å²	29.5	10%	0.096	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132.4	162.7	170.9	-179.2	171.4	-172.6	0	107.1	M92 L93 D94 F95 Y141 N142	M92-K153 HydrophobicContact CE-CB 3.52Å; M92-K153 HydrophobicContact CE-CD 3.91Å; M92-K153 HydrophobicContact CE-CG 4.35Å; M92-K153 HydrophobicContact CG-CB 4.32Å; M92-K153 HydrophobicContact SD-CB 3.77Å; L93-K153 PolarHBondContact O-N 3.41Å; D94-K153 CarbonylContact C-O 3.53Å; D94-K153 WeakPolarHBondContact CA-O 3.39Å; F95-K153 PolarHBondContact N-O 3.39Å; Y141-K153 HydrophobicContact CD1-CD 4.2Å; Y141-K153 HydrophobicContact CD1-CG 3.94Å; N142-K153 CarbonylContact O-C 3.54Å; N142-K153 VanDerWaalsContact O-CA 3.3Å; N142-K153 WeakPolarHBondContact O-CA 3.45Å
154	Y	97.3	Very high	95.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	136.1	176.6	64.2	-90	0	0	0	110.4	F63 F95 F97 W105 N109 H116 Y141 N142 V145 I152 V156	F63-Y154 AromaticContact CE1-CD1 3.98Å; F63-Y154 HydrophobicContact CE1-CD1 3.98Å; F63-Y154 HydrophobicContact CE1-CD2 4.2Å; F63-Y154 AromaticContact CE1-CE1 3.62Å; F63-Y154 HydrophobicContact CE1-CE1 3.62Å; F63-Y154 AromaticContact CE1-CE2 3.87Å; F63-Y154 HydrophobicContact CE1-CE2 3.87Å; F63-Y154 HydrophobicContact CE1-CG 4.25Å; F63-Y154 AromaticContact CE1-CZ 3.55Å; F63-Y154 AromaticContact CZ-CD1 3.82Å; F63-Y154 HydrophobicContact CZ-CD1 3.82Å; F63-Y154 AromaticContact CZ-CE1 3.75Å; F63-Y154 HydrophobicContact CZ-CE1 3.75Å; F63-Y154 HydrophobicContact CZ-CG 4.28Å; F95-Y154 CarbonylContact O-C 3.57Å; F95-Y154 WeakPolarHBondContact O-CA 3.28Å; F97-Y154 HydrophobicContact CD2-CD2 4.12Å; F97-Y154 AromaticContact CE2-CD2 3.88Å; F97-Y154 HydrophobicContact CE2-CD2 3.88Å; F97-Y154 AromaticContact CE2-CG 3.97Å; F97-Y154 HydrophobicContact CE2-CG 3.97Å; W105-Y154 HydrophobicContact CH2-CE2 4.06Å; N109-Y154 PolarHBondContact ND2-OH 3.18Å; H116-Y154 HydrophobicContact CB-CE1 4.37Å; H116-Y154 WeakPolarHBondContact CB-OH 3.3Å; H116-Y154 AromaticContact ND1-CE1 3.66Å; H116-Y154 AromaticContact ND1-CZ 3.71Å; H116-Y154 PolarHBondContact ND1-OH 3.36Å; Y141-Y154 WeakPolarHBondContact CA-O 3.48Å; N142-Y154 HydrophobicContact CB-CD1 4.18Å; N142-Y154 HydrophobicContact CB-CD2 4.41Å; N142-Y154 HydrophobicContact CB-CE1 3.61Å; N142-Y154 HydrophobicContact CB-CE2 3.87Å; N142-Y154 VanDerWaalsContact CB-CZ 3.43Å; N142-Y154 PolarHBondContact N-O 2.95Å; N142-Y154 WeakPolarHBondContact ND2-CE2 3.5Å; N142-Y154 PolarHBondContact ND2-OH 3.5Å; N142-Y154 PolarHBondContact O-N 3.18Å; V145-Y154 HydrophobicContact CB-CE1 4.44Å; V145-Y154 HydrophobicContact CG1-CE1 4.37Å; V145-Y154 HydrophobicContact CG2-CE1 4.02Å; I152-Y154 HydrophobicContact CD1-CD1 3.97Å; I152-Y154 HydrophobicContact CG1-CD1 4.31Å; Y154-V156 HydrophobicContact CD2-CG2 4.16Å; Y154-V156 HydrophobicContact CE2-CG2 4.32Å
155	G	97.6	Very high	95.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	141.8	172.8	0	0	0	0	0	110.5	F95 V96 F97 Y140 Y141	F95-G155 PolarHBondContact O-N 3.08Å; V96-G155 CarbonylContact C-O 3.57Å; V96-G155 WeakPolarHBondContact CA-O 3.41Å; F97-G155 PolarHBondContact N-O 3.28Å; Y140-G155 CarbonylContact O-C 3.55Å; Y140-G155 VanDerWaalsContact O-CA 3.3Å; Y140-G155 WeakPolarHBondContact O-CA 3.49Å; Y141-G155 VanDerWaalsContact CE1-CA 3.42Å
156	V	98.2	Very high	95.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	131.3	171.8	-172.8	0	0	0	0	108.1	F97 V99 W105 Q132 V139 Y140 Y154	F97-V156 WeakPolarHBondContact O-CA 3.35Å; V99-V156 HydrophobicContact CG1-CG1 4.31Å; V99-V156 HydrophobicContact CG2-CG1 3.69Å; W105-V156 HydrophobicContact CD2-CG1 4.48Å; W105-V156 HydrophobicContact CE3-CG1 4.07Å; W105-V156 HydrophobicContact CE3-CG2 4.04Å; W105-V156 HydrophobicContact CH2-CG2 3.76Å; W105-V156 HydrophobicContact CZ3-CG1 4.38Å; W105-V156 HydrophobicContact CZ3-CG2 3.49Å; W105-V156 VanDerWaalsContact CZ3-CG2 3.49Å; Q132-V156 VanDerWaalsContact CD-O 3.25Å; Q132-V156 PolarHBondContact OE1-O 3.47Å; Q132-V156 VanDerWaalsContact OE1-O 3.07Å; V139-V156 CarbonylContact C-O 3.5Å; V139-V156 VanDerWaalsContact CA-O 3.28Å; V139-V156 WeakPolarHBondContact CA-O 3.42Å; V139-V156 WeakPolarHBondContact CG1-O 3.32Å; Y140-V156 PolarHBondContact N-O 3.03Å; Y140-V156 PolarHBondContact O-N 3.22Å; Y154-V156 HydrophobicContact CD2-CG2 4.16Å; Y154-V156 HydrophobicContact CE2-CG2 4.32Å
157	I	98.3	Very high	96	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	146.2	178.7	-174	172.6	0	0	0	108.4	V96 F97 A98 V99 V139 L162 V174	V96-I157 HydrophobicContact CG1-CG2 3.87Å; F97-I157 PolarHBondContact O-N 2.94Å; A98-I157 VanDerWaalsContact CA-O 3.31Å; A98-I157 WeakPolarHBondContact CA-O 3.37Å; A98-I157 HydrophobicContact CB-CG2 4.07Å; V99-I157 PolarHBondContact N-O 3.11Å; V139-I157 HydrophobicContact CG2-CB 3.93Å; V139-I157 HydrophobicContact CG2-CD1 3.84Å; V139-I157 HydrophobicContact CG2-CG1 4.09Å; I157-L162 HydrophobicContact CD1-CB 3.92Å; I157-L162 HydrophobicContact CD1-CD1 4.43Å; I157-L162 HydrophobicContact CG1-CB 4.37Å; I157-L162 HydrophobicContact CG2-CB 4.28Å; I157-V174 HydrophobicContact CD1-CG2 3.98Å
158	S	98.1	Very high	96.3	Very high	12 Å²	12	31.2 Å²	31.2	8%	0.084	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	144.7	170.6	75.8	0	0	0	0	110.8	V99 D160 S161 L162	V99-S158 CarbonylContact O-C 3.53Å; V99-S158 VanDerWaalsContact O-CA 3.24Å; V99-S158 WeakPolarHBondContact O-CA 3.18Å; S158-D160 PolarHBondContact O-N 3.08Å; S158-S161 PolarHBondContact O-N 3.11Å; S158-S161 VanDerWaalsContact O-N 3.16Å; S158-S161 VanDerWaalsContact OG-CB 3.28Å; S158-S161 WeakPolarHBondContact OG-CB 3.42Å; S158-S161 PolarHBondContact OG-N 3.4Å; S158-S161 VanDerWaalsContact OG-N 3.1Å; S158-S161 PolarHBondContact OG-OG 3.13Å; S158-L162 PolarHBondContact O-N 3.28Å
159	T	97.8	Very high	96.7	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.018	17%	0.168	C	C	.	.	H	α-helix	trans	-55.7	-40.7	176.9	-59.5	0	0	0	0	111.6	S68 V99 D100 L162 I163	S68-T159 WeakPolarHBondContact CB-OG1 3.48Å; S68-T159 PolarHBondContact OG-OG1 3.28Å; V99-T159 PolarHBondContact O-N 3.21Å; V99-T159 PolarHBondContact O-OG1 3.1Å; D100-T159 WeakPolarHBondContact OD1-CB 3.39Å; D100-T159 PolarHBondContact OD1-OG1 2.96Å; T159-L162 WeakPolarHBondContact O-CB 3.28Å; T159-L162 PolarHBondContact O-N 3.17Å; T159-I163 HydrophobicContact CG2-CD1 3.99Å; T159-I163 WeakPolarHBondContact O-CG1 3.39Å; T159-I163 PolarHBondContact O-N 3.48Å
160	D	97.3	Very high	97.2	Very high	123 Å²	123	30 Å²	30	66%	0.658	15%	0.149	S	C	*	.	H	α-helix	trans	-63.6	-44.8	176.9	-68.3	-25.6	0	0	0	112.5	S158 L162 I163 D164	S158-D160 PolarHBondContact O-N 3.08Å; D160-L162 VanDerWaalsContact C-N 3.27Å; D160-L162 PolarHBondContact O-N 3Å; D160-I163 PolarHBondContact O-N 3.23Å; D160-D164 WeakPolarHBondContact O-CB 3.45Å; D160-D164 PolarHBondContact O-N 3.23Å
161	S	98.2	Very high	97.5	Very high	24 Å²	24	28.7 Å²	28.7	17%	0.168	15%	0.146	C	C	.	.	H	α-helix	trans	-64.5	-35.1	177.2	-61	0	0	0	0	111.6	S158 D165	S158-S161 PolarHBondContact O-N 3.11Å; S158-S161 VanDerWaalsContact O-N 3.16Å; S158-S161 VanDerWaalsContact OG-CB 3.28Å; S158-S161 WeakPolarHBondContact OG-CB 3.42Å; S158-S161 PolarHBondContact OG-N 3.4Å; S158-S161 VanDerWaalsContact OG-N 3.1Å; S158-S161 PolarHBondContact OG-OG 3.13Å; S161-D165 WeakPolarHBondContact O-CB 3.07Å; S161-D165 PolarHBondContact O-N 3.41Å
162	L	98.4	Very high	97.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.5	-47.7	174.8	176.3	60.1	0	0	0	111.1	L69 A98 I157 S158 T159 D160 D164 D165 L166 V174 L178 L193	L69-L162 HydrophobicContact CD2-CD2 3.7Å; A98-L162 HydrophobicContact CB-CD2 3.6Å; I157-L162 HydrophobicContact CD1-CB 3.92Å; I157-L162 HydrophobicContact CD1-CD1 4.43Å; I157-L162 HydrophobicContact CG1-CB 4.37Å; I157-L162 HydrophobicContact CG2-CB 4.28Å; S158-L162 PolarHBondContact O-N 3.28Å; T159-L162 WeakPolarHBondContact O-CB 3.28Å; T159-L162 PolarHBondContact O-N 3.17Å; D160-L162 VanDerWaalsContact C-N 3.27Å; D160-L162 PolarHBondContact O-N 3Å; L162-D164 VanDerWaalsContact C-N 3.3Å; L162-D164 PolarHBondContact O-N 3.38Å; L162-D165 PolarHBondContact O-N 3.41Å; L162-L166 HydrophobicContact CD1-CD1 3.94Å; L162-L166 HydrophobicContact CD1-CG 4Å; L162-L166 HydrophobicContact CD2-CD1 4.5Å; L162-L166 HydrophobicContact CG-CD1 3.81Å; L162-L166 HydrophobicContact CG-CG 4.32Å; L162-L166 WeakPolarHBondContact O-CB 3.47Å; L162-L166 WeakPolarHBondContact O-CG 3.42Å; L162-L166 PolarHBondContact O-N 3.47Å; L162-V174 HydrophobicContact CD1-CB 4.11Å; L162-V174 HydrophobicContact CD1-CG1 3.57Å; L162-L178 HydrophobicContact CD1-CD1 4.09Å; L162-L193 HydrophobicContact CD2-CD1 3.92Å; L162-L193 HydrophobicContact CG-CD1 4.28Å
163	I	98.4	Very high	97.8	Very high	29 Å²	29	27.3 Å²	27.3	15%	0.149	14%	0.137	C	C	.	.	H	α-helix	trans	-59.9	-43.7	177.9	-70.3	170.1	0	0	0	110.3	T159 D160 L166 M167 K192 L193 A196	T159-I163 HydrophobicContact CG2-CD1 3.99Å; T159-I163 WeakPolarHBondContact O-CG1 3.39Å; T159-I163 PolarHBondContact O-N 3.48Å; D160-I163 PolarHBondContact O-N 3.23Å; I163-L166 PolarHBondContact O-N 3.41Å; I163-M167 HydrophobicContact CG2-CG 4.21Å; I163-M167 WeakPolarHBondContact O-CB 3.36Å; I163-M167 WeakPolarHBondContact O-CG 3.47Å; I163-M167 PolarHBondContact O-N 2.93Å; I163-K192 HydrophobicContact CD1-CB 4.26Å; I163-L193 HydrophobicContact CD1-CB 4.22Å; I163-L193 HydrophobicContact CG1-CB 4.33Å; I163-L193 HydrophobicContact CG1-CD1 3.91Å; I163-A196 HydrophobicContact CG1-CB 4.46Å; I163-A196 HydrophobicContact CG2-CB 4.16Å
164	D	98.3	Very high	97.9	Very high	48 Å²	48	26.3 Å²	26.3	26%	0.257	13%	0.132	S	C	.	.	H	α-helix	trans	-61.8	-44.9	177.7	-170.2	38.7	0	0	0	111.9	D160 L162 L166 H168 K170	D160-D164 WeakPolarHBondContact O-CB 3.45Å; D160-D164 PolarHBondContact O-N 3.23Å; L162-D164 VanDerWaalsContact C-N 3.3Å; L162-D164 PolarHBondContact O-N 3.38Å; D164-L166 PolarHBondContact O-N 2.71Å; D164-H168 WeakPolarHBondContact O-CB 3.35Å; D164-H168 PolarHBondContact O-N 2.78Å; D164-H168 IonicContact OD1-CE1 3.33Å; D164-H168 IonicContact OD1-CG 2.79Å; D164-H168 IonicContact OD1-ND1 3.39Å; D164-H168 PolarHBondContact OD1-ND1 3.17Å; D164-K170 WeakPolarHBondContact OD2-CD 3.24Å; D164-K170 IonicContact OD2-NZ 3.1Å; D164-K170 PolarHBondContact OD2-NZ 2.84Å
165	D	98.6	Very high	98	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-65.1	-38.5	175.9	-161.6	49	0	0	0	111.7	S161 L162 W169 T171 L172 Y173 V174 A175	S161-D165 WeakPolarHBondContact O-CB 3.07Å; S161-D165 PolarHBondContact O-N 3.41Å; L162-D165 PolarHBondContact O-N 3.41Å; D165-W169 VanDerWaalsContact O-CA 3.24Å; D165-W169 WeakPolarHBondContact O-CA 3.45Å; D165-W169 PolarHBondContact O-N 2.93Å; D165-T171 VanDerWaalsContact CG-OG1 3.32Å; D165-T171 WeakPolarHBondContact OD1-CA 3.47Å; D165-T171 PolarHBondContact OD1-N 3.27Å; D165-T171 PolarHBondContact OD1-OG1 3.47Å; D165-T171 PolarHBondContact OD2-OG1 2.9Å; D165-L172 PolarHBondContact OD1-N 3.48Å; D165-Y173 PolarHBondContact OD2-N 3.1Å; D165-V174 PolarHBondContact OD2-N 2.81Å; D165-A175 HydrophobicContact CB-CB 4.46Å; D165-A175 VanDerWaalsContact O-CB 3.26Å; D165-A175 WeakPolarHBondContact O-CB 3.42Å; D165-A175 WeakPolarHBondContact OD2-CB 3.2Å; D165-A175 PolarHBondContact OD2-N 3.47Å
166	L	98.7	Very high	98	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-68	-42.5	178.8	-74.2	171.2	0	0	0	113.1	L162 I163 D164 A175 L178 L193 A196 L197 N200	L162-L166 HydrophobicContact CD1-CD1 3.94Å; L162-L166 HydrophobicContact CD1-CG 4Å; L162-L166 HydrophobicContact CD2-CD1 4.5Å; L162-L166 HydrophobicContact CG-CD1 3.81Å; L162-L166 HydrophobicContact CG-CG 4.32Å; L162-L166 WeakPolarHBondContact O-CB 3.47Å; L162-L166 WeakPolarHBondContact O-CG 3.42Å; L162-L166 PolarHBondContact O-N 3.47Å; I163-L166 PolarHBondContact O-N 3.41Å; D164-L166 PolarHBondContact O-N 2.71Å; L166-A175 HydrophobicContact CD2-CB 4.19Å; L166-L178 HydrophobicContact CD2-CB 4.37Å; L166-L178 HydrophobicContact CD2-CD1 3.84Å; L166-L193 HydrophobicContact CD1-CD1 4.01Å; L166-A196 HydrophobicContact CB-CB 3.89Å; L166-A196 HydrophobicContact CD1-CB 4Å; L166-L197 HydrophobicContact CD1-CD2 3.82Å; L166-L197 HydrophobicContact CD1-CG 4.11Å; L166-L197 HydrophobicContact CD2-CD2 4.18Å; L166-N200 HydrophobicContact CB-CB 4.18Å; L166-N200 HydrophobicContact CD2-CB 3.62Å; L166-N200 VanDerWaalsContact CD2-ND2 3.32Å; L166-N200 WeakPolarHBondContact CD2-ND2 3.4Å; L166-N200 WeakPolarHBondContact O-CB 3.26Å
167	M	98.4	Very high	98	Very high	66 Å²	66	28 Å²	28	33%	0.325	14%	0.139	S	C	.	.	H	α-helix	trans	-81.5	-39.2	-176.7	-70.8	-62.2	-65.5	0	0	112.5	I163 A196	I163-M167 HydrophobicContact CG2-CG 4.21Å; I163-M167 WeakPolarHBondContact O-CB 3.36Å; I163-M167 WeakPolarHBondContact O-CG 3.47Å; I163-M167 PolarHBondContact O-N 2.93Å; M167-A196 HydrophobicContact CG-CB 3.8Å; M167-A196 VanDerWaalsContact SD-CA 3.55Å; M167-A196 HydrophobicContact SD-CB 3.82Å
168	H	98.3	Very high	98	Very high	69 Å²	69	28.5 Å²	28.5	32%	0.319	14%	0.141	S	C	.	.	H	α-helix	trans	-113.7	-10.4	-167.4	-52	121.3	0	0	0	113.8	D164 K170 P296 T298	D164-H168 WeakPolarHBondContact O-CB 3.35Å; D164-H168 PolarHBondContact O-N 2.78Å; D164-H168 IonicContact OD1-CE1 3.33Å; D164-H168 IonicContact OD1-CG 2.79Å; D164-H168 IonicContact OD1-ND1 3.39Å; D164-H168 PolarHBondContact OD1-ND1 3.17Å; H168-K170 VanDerWaalsContact C-N 3.28Å; H168-K170 PolarHBondContact O-N 3.38Å; H168-P296 WeakPolarHBondContact O-CB 3.5Å; H168-T298 WeakPolarHBondContact O-CB 3.3Å; H168-T298 PolarHBondContact O-N 3.22Å; H168-T298 VanDerWaalsContact O-N 3.15Å; H168-T298 PolarHBondContact O-OG1 3.31Å
169	W	98.5	Very high	98	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.			trans	54.5	43.6	-173.2	-67.7	-0.2	0	0	0	112.6	D165 T171 L172 H179 N200 S203 A204 A207 L228 P296 L299 I337 I340	D165-W169 VanDerWaalsContact O-CA 3.24Å; D165-W169 WeakPolarHBondContact O-CA 3.45Å; D165-W169 PolarHBondContact O-N 2.93Å; W169-T171 PolarHBondContact O-N 3.02Å; W169-L172 HydrophobicContact CB-CB 4.38Å; W169-L172 HydrophobicContact CB-CD1 4.38Å; W169-L172 HydrophobicContact CD2-CD1 3.69Å; W169-L172 HydrophobicContact CD2-CD2 4.33Å; W169-L172 HydrophobicContact CE3-CD1 4.28Å; W169-L172 HydrophobicContact CE3-CD2 4.12Å; W169-L172 HydrophobicContact CG-CD1 3.74Å; W169-L172 HydrophobicContact CZ2-CD1 4.48Å; W169-H179 AromaticContact CE2-CE1 3.83Å; W169-H179 AromaticContact CE2-NE2 3.85Å; W169-H179 AromaticContact CZ2-CE1 3.48Å; W169-H179 VanDerWaalsContact CZ2-CE1 3.48Å; W169-H179 WeakPolarHBondContact CZ2-CE1 3.27Å; W169-H179 AromaticContact CZ2-NE2 3.6Å; W169-H179 AromaticContact NE1-NE2 3.72Å; W169-N200 PolarHBondContact NE1-OD1 3.33Å; W169-S203 WeakPolarHBondContact CH2-O 3.43Å; W169-A204 HydrophobicContact CZ2-CB 4.39Å; W169-A207 HydrophobicContact CH2-CB 3.77Å; W169-A207 HydrophobicContact CZ3-CB 4.01Å; W169-L228 HydrophobicContact CH2-CD1 4.24Å; W169-P296 HydrophobicContact CB-CB 3.97Å; W169-P296 HydrophobicContact CB-CG 4.43Å; W169-P296 HydrophobicContact CD2-CB 4.01Å; W169-P296 HydrophobicContact CD2-CG 3.52Å; W169-P296 HydrophobicContact CE3-CB 4.37Å; W169-P296 HydrophobicContact CE3-CG 3.92Å; W169-P296 HydrophobicContact CG-CB 3.81Å; W169-P296 HydrophobicContact CG-CG 3.74Å; W169-P296 HydrophobicContact CZ2-CG 4.19Å; W169-P296 HydrophobicContact CZ3-CG 4.4Å; W169-L299 HydrophobicContact CE3-CB 4.3Å; W169-L299 HydrophobicContact CE3-CD2 3.92Å; W169-L299 HydrophobicContact CZ3-CD2 3.6Å; W169-I337 HydrophobicContact CZ3-CD1 4.28Å; W169-I337 HydrophobicContact CZ3-CG1 4.49Å; W169-I340 WeakPolarHBondContact O-CG2 3.49Å
170	K	97.2	Very high	98	Very high	114 Å²	114	27.9 Å²	27.9	50%	0.496	14%	0.137	S	C	.	.	S	Bend	trans	-51.7	-41.9	178.3	-179.4	169.6	177.2	-178.5	0	112.4	D164 H168	D164-K170 WeakPolarHBondContact OD2-CD 3.24Å; D164-K170 IonicContact OD2-NZ 3.1Å; D164-K170 PolarHBondContact OD2-NZ 2.84Å; H168-K170 VanDerWaalsContact C-N 3.28Å; H168-K170 PolarHBondContact O-N 3.38Å
171	T	96.6	Very high	97.9	Very high	18 Å²	18	22.6 Å²	22.6	11%	0.11	11%	0.109	C	C	.	.	S	Bend	trans	-126.6	-19.5	178.8	73.8	0	0	0	0	112.9	D165 W169 Y173 S344	D165-T171 VanDerWaalsContact CG-OG1 3.32Å; D165-T171 WeakPolarHBondContact OD1-CA 3.47Å; D165-T171 PolarHBondContact OD1-N 3.27Å; D165-T171 PolarHBondContact OD1-OG1 3.47Å; D165-T171 PolarHBondContact OD2-OG1 2.9Å; W169-T171 PolarHBondContact O-N 3.02Å; T171-Y173 PolarHBondContact O-N 2.93Å; T171-Y173 VanDerWaalsContact O-N 3.08Å; T171-Y173 WeakPolarHBondContact OG1-CB 3.38Å; T171-Y173 PolarHBondContact OG1-N 3.27Å; T171-S344 WeakPolarHBondContact O-CB 3.46Å; T171-S344 PolarHBondContact O-OG 2.83Å
172	L	97.8	Very high	97.8	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.01	11%	0.11	C	C	.	.			trans	56.3	19	-174.6	-169.8	52	0	0	0	112.8	D165 W169 A175 G176 I337 I340 V341	D165-L172 PolarHBondContact OD1-N 3.48Å; W169-L172 HydrophobicContact CB-CB 4.38Å; W169-L172 HydrophobicContact CB-CD1 4.38Å; W169-L172 HydrophobicContact CD2-CD1 3.69Å; W169-L172 HydrophobicContact CD2-CD2 4.33Å; W169-L172 HydrophobicContact CE3-CD1 4.28Å; W169-L172 HydrophobicContact CE3-CD2 4.12Å; W169-L172 HydrophobicContact CG-CD1 3.74Å; W169-L172 HydrophobicContact CZ2-CD1 4.48Å; L172-A175 HydrophobicContact CD1-CB 4.17Å; L172-G176 WeakPolarHBondContact O-CA 3.49Å; L172-G176 PolarHBondContact O-N 2.82Å; L172-G176 VanDerWaalsContact O-N 3.12Å; L172-I337 HydrophobicContact CD2-CG2 3.84Å; L172-I340 HydrophobicContact CB-CG2 3.82Å; L172-V341 HydrophobicContact CB-CG2 4.18Å; L172-V341 HydrophobicContact CD2-CG2 3.81Å; L172-V341 HydrophobicContact CG-CG2 4.11Å
173	Y	96.7	Very high	97.6	Very high	39 Å²	39	25.6 Å²	25.6	15%	0.153	12%	0.121	C	C	.	.	S	Bend	trans	-83.8	-55.8	-172.4	-167.8	-88.4	0	0	0	111.3	A137 Y141 D165 T171 R177 Q348	A137-Y173 VanDerWaalsContact CB-CB 3.42Å; A137-Y173 HydrophobicContact CB-CD1 3.67Å; A137-Y173 HydrophobicContact CB-CD2 3.95Å; A137-Y173 HydrophobicContact CB-CE1 4.43Å; A137-Y173 HydrophobicContact CB-CG 3.39Å; Y141-Y173 HydrophobicContact CE2-CE1 4.05Å; D165-Y173 PolarHBondContact OD2-N 3.1Å; T171-Y173 PolarHBondContact O-N 2.93Å; T171-Y173 VanDerWaalsContact O-N 3.08Å; T171-Y173 WeakPolarHBondContact OG1-CB 3.38Å; T171-Y173 PolarHBondContact OG1-N 3.27Å; Y173-R177 PolarHBondContact O-N 3.17Å; Y173-Q348 HydrophobicContact CD2-CB 4.38Å; Y173-Q348 HydrophobicContact CD2-CG 4.4Å; Y173-Q348 HydrophobicContact CE1-CG 4.1Å; Y173-Q348 HydrophobicContact CE2-CB 3.88Å; Y173-Q348 HydrophobicContact CE2-CG 3.7Å; Y173-Q348 WeakPolarHBondContact OH-CG 3.48Å
174	V	98.1	Very high	97.4	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-84.7	-38.7	177.1	-172.6	0	0	0	0	109.6	F71 V96 V139 I157 L162 D165 G176 R177 L178	F71-V174 HydrophobicContact CE1-CG1 4.45Å; F71-V174 HydrophobicContact CZ-CG1 4Å; V96-V174 HydrophobicContact CG1-CG1 4.49Å; V139-V174 HydrophobicContact CG2-CG2 3.47Å; V139-V174 VanDerWaalsContact CG2-CG2 3.47Å; I157-V174 HydrophobicContact CD1-CG2 3.98Å; L162-V174 HydrophobicContact CD1-CB 4.11Å; L162-V174 HydrophobicContact CD1-CG1 3.57Å; D165-V174 PolarHBondContact OD2-N 2.81Å; V174-G176 VanDerWaalsContact C-N 3.31Å; V174-G176 PolarHBondContact O-N 3.14Å; V174-R177 WeakPolarHBondContact O-CA 3.26Å; V174-R177 WeakPolarHBondContact O-CB 3.47Å; V174-R177 PolarHBondContact O-N 3.2Å; V174-L178 HydrophobicContact CG1-CD1 4.09Å; V174-L178 PolarHBondContact O-N 3.13Å
175	A	98.5	Very high	97.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-55.8	-46.1	172.5	0	0	0	0	0	111.9	D165 L166 L172 R177 L178 H179 N200	D165-A175 HydrophobicContact CB-CB 4.46Å; D165-A175 VanDerWaalsContact O-CB 3.26Å; D165-A175 WeakPolarHBondContact O-CB 3.42Å; D165-A175 WeakPolarHBondContact OD2-CB 3.2Å; D165-A175 PolarHBondContact OD2-N 3.47Å; L166-A175 HydrophobicContact CD2-CB 4.19Å; L172-A175 HydrophobicContact CD1-CB 4.17Å; A175-R177 VanDerWaalsContact C-N 3.28Å; A175-R177 PolarHBondContact O-N 3.43Å; A175-L178 CarbonylContact O-C 3.07Å; A175-L178 PolarHBondContact O-N 2.88Å; A175-H179 PolarHBondContact O-CD2 3.45Å; A175-H179 VanDerWaalsContact O-CD2 3.23Å; A175-H179 PolarHBondContact O-N 3.02Å; A175-H179 VanDerWaalsContact O-N 3.08Å; A175-N200 PolarHBondContact O-ND2 3.2Å
176	G	97.9	Very high	97	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.4	-30.3	176.2	0	0	0	0	0	113	L172 V174 K180	L172-G176 WeakPolarHBondContact O-CA 3.49Å; L172-G176 PolarHBondContact O-N 2.82Å; L172-G176 VanDerWaalsContact O-N 3.12Å; V174-G176 VanDerWaalsContact C-N 3.31Å; V174-G176 PolarHBondContact O-N 3.14Å; G176-K180 PolarHBondContact O-NZ 3.12Å
177	R	97.4	Very high	96.6	Very high	35 Å²	35	33.5 Å²	33.5	13%	0.132	16%	0.161	C	C	.	.	H	α-helix	trans	-66.9	-38.9	171.5	175.9	61.6	-140	158.7	6.6	111.4	F71 Y73 Y173 V174 A175 H179 K180 P181	F71-R177 HydrophobicContact CE2-CG 4.15Å; Y73-R177 VanDerWaalsContact CD2-CD 3.42Å; Y73-R177 HydrophobicContact CD2-CG 4.22Å; Y73-R177 HydrophobicContact CE2-CG 4.31Å; Y73-R177 HydrophobicContact CG-CG 4.33Å; Y73-R177 VanDerWaalsContact CG-NE 3.35Å; Y173-R177 PolarHBondContact O-N 3.17Å; V174-R177 WeakPolarHBondContact O-CA 3.26Å; V174-R177 WeakPolarHBondContact O-CB 3.47Å; V174-R177 PolarHBondContact O-N 3.2Å; A175-R177 VanDerWaalsContact C-N 3.28Å; A175-R177 PolarHBondContact O-N 3.43Å; R177-H179 VanDerWaalsContact C-N 3.31Å; R177-K180 PolarHBondContact O-N 3.15Å; R177-P181 PolarHBondContact NH2-O 3.44Å
178	L	98.3	Very high	95.9	Very high	11 Å²	11	34.4 Å²	34.4	6%	0.058	17%	0.167	C	C	.	.	H	α-helix	trans	-80	-5.9	-178.9	-72	167	0	0	0	114.2	F71 L162 L166 V174 A175 K180 V182 L197 L201	F71-L178 HydrophobicContact CD1-CD2 4.03Å; F71-L178 HydrophobicContact CD2-CD2 4.3Å; F71-L178 HydrophobicContact CE1-CD1 3.99Å; F71-L178 HydrophobicContact CE1-CD2 3.8Å; F71-L178 HydrophobicContact CE1-CG 4.16Å; F71-L178 HydrophobicContact CE2-CD2 4.09Å; F71-L178 HydrophobicContact CG-CD2 4.27Å; F71-L178 HydrophobicContact CZ-CD1 4.16Å; F71-L178 HydrophobicContact CZ-CD2 3.81Å; F71-L178 HydrophobicContact CZ-CG 3.96Å; L162-L178 HydrophobicContact CD1-CD1 4.09Å; L166-L178 HydrophobicContact CD2-CB 4.37Å; L166-L178 HydrophobicContact CD2-CD1 3.84Å; V174-L178 HydrophobicContact CG1-CD1 4.09Å; V174-L178 PolarHBondContact O-N 3.13Å; A175-L178 CarbonylContact O-C 3.07Å; A175-L178 PolarHBondContact O-N 2.88Å; L178-K180 PolarHBondContact O-N 3Å; L178-V182 HydrophobicContact CD2-CG1 4.21Å; L178-V182 HydrophobicContact CD2-CG2 3.78Å; L178-L197 HydrophobicContact CD1-CD2 3.89Å; L178-L201 WeakPolarHBondContact O-CD2 3.37Å
179	H	98.5	Very high	95	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-15.2	163.2	-61.6	166.9	0	0	0	113.4	W169 A175 R177 N200 A204 I225 Y260	W169-H179 AromaticContact CE2-CE1 3.83Å; W169-H179 AromaticContact CE2-NE2 3.85Å; W169-H179 AromaticContact CZ2-CE1 3.48Å; W169-H179 VanDerWaalsContact CZ2-CE1 3.48Å; W169-H179 WeakPolarHBondContact CZ2-CE1 3.27Å; W169-H179 AromaticContact CZ2-NE2 3.6Å; W169-H179 AromaticContact NE1-NE2 3.72Å; A175-H179 PolarHBondContact O-CD2 3.45Å; A175-H179 VanDerWaalsContact O-CD2 3.23Å; A175-H179 PolarHBondContact O-N 3.02Å; A175-H179 VanDerWaalsContact O-N 3.08Å; R177-H179 VanDerWaalsContact C-N 3.31Å; H179-N200 PolarHBondContact CD2-ND2 3.11Å; H179-N200 PolarHBondContact CD2-OD1 3.25Å; H179-N200 PolarHBondContact NE2-ND2 3.28Å; H179-N200 PolarHBondContact NE2-O 3.11Å; H179-N200 PolarHBondContact NE2-OD1 3.42Å; H179-A204 HydrophobicContact CB-CB 4.47Å; H179-I225 HydrophobicContact CB-CG2 3.96Å; H179-Y260 PolarHBondContact O-OH 3.39Å
180	K	96.9	Very high	94.5	Very high	3 Å²	3	43.2 Å²	43.2	1%	0.013	21%	0.21	C	C	.	.	S	Bend	trans	-111.9	156.2	-176.8	-65.8	173.4	-86	-68.9	0	109.9	G176 R177 L178 V182 A226 S229 I248 F256	G176-K180 PolarHBondContact O-NZ 3.12Å; R177-K180 PolarHBondContact O-N 3.15Å; L178-K180 PolarHBondContact O-N 3Å; K180-V182 PolarHBondContact O-N 2.94Å; K180-A226 HydrophobicContact CD-CB 4.16Å; K180-A226 HydrophobicContact CG-CB 4.19Å; K180-A226 PolarHBondContact NZ-O 3.39Å; K180-S229 PolarHBondContact NZ-OG 3.29Å; K180-I248 HydrophobicContact CD-CG2 4.07Å; K180-F256 HydrophobicContact CB-CZ 4.15Å; K180-F256 HydrophobicContact CG-CE1 4.24Å; K180-F256 HydrophobicContact CG-CZ 3.89Å
181	P	95.9	Very high	94.3	Very high	12 Å²	12	40 Å²	40	8%	0.078	21%	0.209	C	C	.	.			trans	-50.6	131.6	175	-29.7	36.3	0	0	0	113.1	F78 R177 H255 F256	F78-P181 HydrophobicContact CE1-CB 4.25Å; F78-P181 WeakPolarHBondContact CE2-O 3.3Å; F78-P181 HydrophobicContact CZ-CB 4.16Å; R177-P181 PolarHBondContact NH2-O 3.44Å; P181-H255 HydrophobicContact CB-CB 3.71Å; P181-H255 HydrophobicContact CG-CB 3.53Å; P181-F256 VanDerWaalsContact CD-CE2 3.42Å; P181-F256 VanDerWaalsContact CD-CZ 3.44Å; P181-F256 HydrophobicContact CG-CD2 3.77Å; P181-F256 HydrophobicContact CG-CE2 3.89Å; P181-F256 HydrophobicContact CG-CG 4.15Å; P181-F256 HydrophobicContact CG-CZ 4.37Å
182	V	95.8	Very high	94.2	Very high	29 Å²	29	47 Å²	47	18%	0.176	24%	0.238	C	C	.	.			trans	-133.4	156.2	173.8	-64.7	0	0	0	0	109.3	F71 L178 K180 M184	F71-V182 HydrophobicContact CB-CB 4.27Å; F71-V182 HydrophobicContact CB-CG2 4.18Å; F71-V182 HydrophobicContact CD2-CB 3.96Å; F71-V182 HydrophobicContact CD2-CG1 3.82Å; F71-V182 HydrophobicContact CD2-CG2 4.32Å; F71-V182 HydrophobicContact CE2-CG1 4.17Å; F71-V182 HydrophobicContact CG-CB 4.39Å; F71-V182 HydrophobicContact CG-CG2 4.35Å; L178-V182 HydrophobicContact CD2-CG1 4.21Å; L178-V182 HydrophobicContact CD2-CG2 3.78Å; K180-V182 PolarHBondContact O-N 2.94Å; V182-M184 HydrophobicContact CG2-SD 3.67Å
183	K	94.6	Very high	94.1	Very high	57 Å²	57	47 Å²	47	25%	0.248	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	104.7	171.7	-172.3	171.4	-174.8	166.7	0	108.6	T52 Y56 F71 A72 V77 L185	T52-K183 PolarHBondContact OG1-NZ 3.28Å; Y56-K183 HydrophobicContact CD2-CD 3.9Å; Y56-K183 HydrophobicContact CE2-CD 3.57Å; Y56-K183 VanDerWaalsContact CE2-NZ 3.33Å; F71-K183 CarbonylContact C-O 3.55Å; F71-K183 VanDerWaalsContact CA-O 3.27Å; F71-K183 WeakPolarHBondContact CA-O 3.29Å; A72-K183 PolarHBondContact N-O 2.84Å; A72-K183 PolarHBondContact O-N 3.05Å; V77-K183 HydrophobicContact CG1-CB 3.73Å; V77-K183 HydrophobicContact CG1-CD 4.3Å; K183-L185 HydrophobicContact CD-CD2 4.16Å; K183-L185 HydrophobicContact CG-CD2 3.91Å; K183-L185 PolarHBondContact O-N 2.81Å
184	M	94.8	Very high	94.1	Very high	70 Å²	70	52.7 Å²	52.7	35%	0.345	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	128.3	173	-57.9	-56.4	-76.2	0	0	109.1	L69 F71 V182 Q187	L69-M184 HydrophobicContact CD1-CE 3.3Å; L69-M184 HydrophobicContact CD2-CE 4.35Å; L69-M184 HydrophobicContact CG-CE 4.1Å; F71-M184 HydrophobicContact CB-SD 3.88Å; V182-M184 HydrophobicContact CG2-SD 3.67Å; M184-Q187 HydrophobicContact CE-CB 4.47Å
185	L	94.8	Very high	94	Very high	43 Å²	43	55.4 Å²	55.4	23%	0.225	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-42.2	-177.8	-54.9	179.4	0	0	0	111.7	Y56 L60 A70 A72 F95 K183	Y56-L185 HydrophobicContact CD1-CD1 4.21Å; Y56-L185 HydrophobicContact CD1-CD2 4.27Å; Y56-L185 HydrophobicContact CD2-CD2 4.16Å; Y56-L185 HydrophobicContact CG-CD1 4.38Å; Y56-L185 HydrophobicContact CG-CD2 3.8Å; L60-L185 HydrophobicContact CD1-CB 3.66Å; L60-L185 HydrophobicContact CD1-CD1 3.87Å; L60-L185 HydrophobicContact CD1-CG 4.39Å; L60-L185 HydrophobicContact CG-CD1 4.34Å; A70-L185 HydrophobicContact CB-CB 4.18Å; A70-L185 WeakPolarHBondContact O-CA 3.37Å; A70-L185 WeakPolarHBondContact O-CB 3.06Å; A70-L185 PolarHBondContact O-N 2.77Å; A72-L185 HydrophobicContact CB-CD1 3.95Å; A72-L185 HydrophobicContact CB-CG 4.44Å; F95-L185 HydrophobicContact CD1-CD1 3.8Å; F95-L185 HydrophobicContact CE1-CD1 3.57Å; K183-L185 HydrophobicContact CD-CD2 4.16Å; K183-L185 HydrophobicContact CG-CD2 3.91Å; K183-L185 PolarHBondContact O-N 2.81Å
186	V	93	Very high	94	Very high	45 Å²	45	55.4 Å²	55.4	27%	0.273	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	136.8	175.6	-179.7	0	0	0	0	107.5	L60 L69 A70	L60-V186 HydrophobicContact CD1-CG2 3.98Å; L69-V186 CarbonylContact C-O 3.54Å; L69-V186 WeakPolarHBondContact CA-O 3.24Å; L69-V186 WeakPolarHBondContact CD1-O 3.26Å; A70-V186 HydrophobicContact CB-CB 3.79Å; A70-V186 HydrophobicContact CB-CG2 3.97Å; A70-V186 PolarHBondContact N-O 3.39Å; A70-V186 PolarHBondContact O-N 3.03Å; A70-V186 VanDerWaalsContact O-N 3.1Å
187	Q	90.4	Very high	94	Very high	90 Å²	90	56.7 Å²	56.7	42%	0.421	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	103.8	172.1	-179.5	174.3	-18.8	0	0	108	L69 M184	L69-Q187 HydrophobicContact CD1-CB 3.77Å; L69-Q187 HydrophobicContact CD1-CG 3.76Å; M184-Q187 HydrophobicContact CE-CB 4.47Å
188	N	83.7	Confident	94	Very high	84 Å²	84	58.1 Å²	58.1	45%	0.449	30%	0.301	S	S	.	.			trans	-68.5	160.4	176	-73	-3.9	0	0	0	110.6	I67 S68 N190	I67-N188 PolarHBondContact O-ND2 2.79Å; S68-N188 PolarHBondContact O-N 3.37Å; N188-N190 PolarHBondContact O-N 2.85Å
189	E	79.4	Confident	94	Very high	208 Å²	208	59.3 Å²	59.3	97%	0.972	31%	0.31	S	S	*	.			trans	-73.7	56.8	179.1	-62.4	-170.2	166.9	0	0	112.4
190	N	88.4	Confident	94	Very high	47 Å²	47	59.4 Å²	59.4	25%	0.251	31%	0.311	S	S	.	.			trans	-95.5	104.6	174	-176.1	-31.9	0	0	0	109.5	N188 K192 L193 R194	N188-N190 PolarHBondContact O-N 2.85Å; N190-K192 VanDerWaalsContact C-N 3.3Å; N190-K192 PolarHBondContact O-N 3.16Å; N190-K192 WeakPolarHBondContact OD1-CB 3.48Å; N190-K192 PolarHBondContact OD1-N 2.89Å; N190-L193 HydrophobicContact CB-CB 3.92Å; N190-L193 PolarHBondContact O-N 2.78Å; N190-L193 PolarHBondContact OD1-N 2.85Å; N190-R194 PolarHBondContact O-N 3.11Å
191	G	92.6	Very high	94.1	Very high	45 Å²	45	60.1 Å²	60.1	46%	0.464	32%	0.315	S	S	.	.	H	α-helix	trans	-58.3	-37.9	-179.7	0	0	0	0	0	113.7	R194 A195	G191-R194 PolarHBondContact O-N 3.34Å; G191-A195 WeakPolarHBondContact O-CB 3.39Å; G191-A195 PolarHBondContact O-N 3.2Å
192	K	95.6	Very high	94.2	Very high	167 Å²	167	65 Å²	65	73%	0.726	34%	0.335	S	S	*	.	H	α-helix	trans	-66.4	-46.2	177.8	-64.9	-178.4	179.5	177.6	0	111.2	I163 N190 R194 A195 A196	I163-K192 HydrophobicContact CD1-CB 4.26Å; N190-K192 VanDerWaalsContact C-N 3.3Å; N190-K192 PolarHBondContact O-N 3.16Å; N190-K192 WeakPolarHBondContact OD1-CB 3.48Å; N190-K192 PolarHBondContact OD1-N 2.89Å; K192-R194 PolarHBondContact O-N 3.49Å; K192-A195 PolarHBondContact O-N 3.32Å; K192-A196 WeakPolarHBondContact O-CB 3.43Å; K192-A196 PolarHBondContact O-N 3.4Å
193	L	95.7	Very high	94.3	Very high	1 Å²	1	64 Å²	64	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-43.3	177.5	178.5	61	0	0	0	111.7	L69 L162 I163 L166 N190 A195 A196 L197	L69-L193 HydrophobicContact CB-CD2 4Å; L69-L193 HydrophobicContact CD1-CD2 4.24Å; L69-L193 HydrophobicContact CD2-CD2 4.38Å; L69-L193 HydrophobicContact CG-CD2 4.44Å; L162-L193 HydrophobicContact CD2-CD1 3.92Å; L162-L193 HydrophobicContact CG-CD1 4.28Å; I163-L193 HydrophobicContact CD1-CB 4.22Å; I163-L193 HydrophobicContact CG1-CB 4.33Å; I163-L193 HydrophobicContact CG1-CD1 3.91Å; L166-L193 HydrophobicContact CD1-CD1 4.01Å; N190-L193 HydrophobicContact CB-CB 3.92Å; N190-L193 PolarHBondContact O-N 2.78Å; N190-L193 PolarHBondContact OD1-N 2.85Å; L193-A195 PolarHBondContact O-N 3.03Å; L193-A196 PolarHBondContact O-N 3.19Å; L193-L197 HydrophobicContact CG-CD1 4.44Å; L193-L197 WeakPolarHBondContact O-CG 3.27Å; L193-L197 PolarHBondContact O-N 3.34Å
194	R	95.3	Very high	94.5	Very high	158 Å²	158	61.3 Å²	61.3	60%	0.596	32%	0.317	S	S	*	.	H	α-helix	trans	-61.7	-44.2	176.8	-175.2	175.4	62	91.7	-0.8	111.6	N190 G191 K192 A196 L197 V198	N190-R194 PolarHBondContact O-N 3.11Å; G191-R194 PolarHBondContact O-N 3.34Å; K192-R194 PolarHBondContact O-N 3.49Å; R194-A196 VanDerWaalsContact C-N 3.33Å; R194-L197 PolarHBondContact O-N 3Å; R194-V198 PolarHBondContact O-N 2.86Å
195	A	96.7	Very high	94.7	Very high	58 Å²	58	58 Å²	58	48%	0.479	30%	0.301	S	S	.	.	H	α-helix	trans	-61.5	-42.6	175.2	0	0	0	0	0	111.4	G191 K192 L193 L197 V198 S199	G191-A195 WeakPolarHBondContact O-CB 3.39Å; G191-A195 PolarHBondContact O-N 3.2Å; K192-A195 PolarHBondContact O-N 3.32Å; L193-A195 PolarHBondContact O-N 3.03Å; A195-L197 PolarHBondContact O-N 3.05Å; A195-V198 PolarHBondContact O-N 3.37Å; A195-S199 WeakPolarHBondContact O-CB 3.36Å; A195-S199 PolarHBondContact O-N 3.1Å
196	A	98.3	Very high	94.9	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-63.2	-40.3	178.1	0	0	0	0	0	113.1	I163 L166 M167 K192 L193 R194 V198 S199 N200	I163-A196 HydrophobicContact CG1-CB 4.46Å; I163-A196 HydrophobicContact CG2-CB 4.16Å; L166-A196 HydrophobicContact CB-CB 3.89Å; L166-A196 HydrophobicContact CD1-CB 4Å; M167-A196 HydrophobicContact CG-CB 3.8Å; M167-A196 VanDerWaalsContact SD-CA 3.55Å; M167-A196 HydrophobicContact SD-CB 3.82Å; K192-A196 WeakPolarHBondContact O-CB 3.43Å; K192-A196 PolarHBondContact O-N 3.4Å; L193-A196 PolarHBondContact O-N 3.19Å; R194-A196 VanDerWaalsContact C-N 3.33Å; A196-V198 PolarHBondContact O-N 2.76Å; A196-S199 PolarHBondContact O-N 2.79Å; A196-N200 VanDerWaalsContact O-CB 3.28Å; A196-N200 WeakPolarHBondContact O-CB 3.38Å; A196-N200 PolarHBondContact O-N 3.29Å
197	L	97.8	Very high	95.1	Very high	27 Å²	27	54.3 Å²	54.3	14%	0.141	28%	0.28	C	S	.	.	H	α-helix	trans	-60	-45.4	174.5	-72.6	168.3	0	0	0	111.7	L166 L178 L193 R194 A195 L201	L166-L197 HydrophobicContact CD1-CD2 3.82Å; L166-L197 HydrophobicContact CD1-CG 4.11Å; L166-L197 HydrophobicContact CD2-CD2 4.18Å; L178-L197 HydrophobicContact CD1-CD2 3.89Å; L193-L197 HydrophobicContact CG-CD1 4.44Å; L193-L197 WeakPolarHBondContact O-CG 3.27Å; L193-L197 PolarHBondContact O-N 3.34Å; R194-L197 PolarHBondContact O-N 3Å; A195-L197 PolarHBondContact O-N 3.05Å; L197-L201 WeakPolarHBondContact O-CG 3.34Å; L197-L201 PolarHBondContact O-N 3.08Å
198	V	96.9	Very high	95.5	Very high	65 Å²	65	50 Å²	50	39%	0.394	26%	0.26	S	S	.	.	H	α-helix	trans	-67.6	-44.7	178.1	176	0	0	0	0	111	R194 A195 A196 N200 L201 K202	R194-V198 PolarHBondContact O-N 2.86Å; A195-V198 PolarHBondContact O-N 3.37Å; A196-V198 PolarHBondContact O-N 2.76Å; V198-N200 VanDerWaalsContact C-N 3.29Å; V198-N200 PolarHBondContact O-N 3.3Å; V198-L201 PolarHBondContact O-N 2.99Å; V198-K202 HydrophobicContact CG1-CD 4.36Å; V198-K202 PolarHBondContact O-N 3.26Å
199	S	98.1	Very high	96.2	Very high	36 Å²	36	46 Å²	46	25%	0.252	24%	0.238	S	C	.	.	H	α-helix	trans	-57.4	-44.5	177.3	-166.6	0	0	0	0	111	A195 A196 L201 K202 S203	A195-S199 WeakPolarHBondContact O-CB 3.36Å; A195-S199 PolarHBondContact O-N 3.1Å; A196-S199 PolarHBondContact O-N 2.79Å; S199-L201 VanDerWaalsContact C-N 3.33Å; S199-L201 PolarHBondContact O-N 2.83Å; S199-K202 PolarHBondContact O-N 3.04Å; S199-S203 WeakPolarHBondContact O-CB 3.35Å; S199-S203 PolarHBondContact O-N 3.46Å; S199-S203 PolarHBondContact O-OG 2.73Å; S199-S203 VanDerWaalsContact O-OG 3.1Å
200	N	98.8	Very high	97.1	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-59.3	-41.1	179	-178	46	0	0	0	113	L166 W169 A175 H179 A196 V198 A204	L166-N200 HydrophobicContact CB-CB 4.18Å; L166-N200 HydrophobicContact CD2-CB 3.62Å; L166-N200 VanDerWaalsContact CD2-ND2 3.32Å; L166-N200 WeakPolarHBondContact CD2-ND2 3.4Å; L166-N200 WeakPolarHBondContact O-CB 3.26Å; W169-N200 PolarHBondContact NE1-OD1 3.33Å; A175-N200 PolarHBondContact O-ND2 3.2Å; H179-N200 PolarHBondContact CD2-ND2 3.11Å; H179-N200 PolarHBondContact CD2-OD1 3.25Å; H179-N200 PolarHBondContact NE2-ND2 3.28Å; H179-N200 PolarHBondContact NE2-O 3.11Å; H179-N200 PolarHBondContact NE2-OD1 3.42Å; A196-N200 VanDerWaalsContact O-CB 3.28Å; A196-N200 WeakPolarHBondContact O-CB 3.38Å; A196-N200 PolarHBondContact O-N 3.29Å; V198-N200 VanDerWaalsContact C-N 3.29Å; V198-N200 PolarHBondContact O-N 3.3Å; N200-A204 PolarHBondContact O-N 2.99Å; N200-A204 VanDerWaalsContact O-N 3.07Å
201	L	98.7	Very high	97.5	Very high	19 Å²	19	35.7 Å²	35.7	10%	0.099	19%	0.189	C	C	.	.	H	α-helix	trans	-68.1	-42.3	176.3	-63.8	175.3	0	0	0	111.5	L178 L197 V198 S199 A204 V205 L259 Y260 I263	L178-L201 WeakPolarHBondContact O-CD2 3.37Å; L197-L201 WeakPolarHBondContact O-CG 3.34Å; L197-L201 PolarHBondContact O-N 3.08Å; V198-L201 PolarHBondContact O-N 2.99Å; S199-L201 VanDerWaalsContact C-N 3.33Å; S199-L201 PolarHBondContact O-N 2.83Å; L201-A204 WeakPolarHBondContact O-CB 3.17Å; L201-A204 PolarHBondContact O-N 2.82Å; L201-V205 WeakPolarHBondContact O-CG2 3.43Å; L201-V205 PolarHBondContact O-N 3.18Å; L201-V205 VanDerWaalsContact O-N 3.15Å; L201-L259 HydrophobicContact CD1-CD1 3.62Å; L201-L259 HydrophobicContact CD1-CG 4.1Å; L201-L259 HydrophobicContact CD2-CD1 4.23Å; L201-L259 HydrophobicContact CD2-CD2 4.05Å; L201-L259 HydrophobicContact CD2-CG 4.11Å; L201-Y260 HydrophobicContact CB-CE1 3.97Å; L201-Y260 HydrophobicContact CD2-CE1 3.99Å; L201-Y260 WeakPolarHBondContact CD2-OH 3.47Å; L201-I263 HydrophobicContact CB-CD1 3.34Å; L201-I263 HydrophobicContact CD1-CD1 3.99Å; L201-I263 HydrophobicContact CG-CD1 4.32Å
202	K	98.5	Very high	97.8	Very high	114 Å²	114	34.4 Å²	34.4	50%	0.496	17%	0.171	S	C	.	.	H	α-helix	trans	-59.9	-47.1	174.9	-71.2	-177.2	174.8	-170.7	0	111.1	V198 S199 A204 V205 M206 I263	V198-K202 HydrophobicContact CG1-CD 4.36Å; V198-K202 PolarHBondContact O-N 3.26Å; S199-K202 PolarHBondContact O-N 3.04Å; K202-A204 VanDerWaalsContact C-N 3.28Å; K202-A204 PolarHBondContact O-N 3.14Å; K202-V205 WeakPolarHBondContact O-CB 3.21Å; K202-V205 PolarHBondContact O-N 2.96Å; K202-V205 VanDerWaalsContact O-N 3.13Å; K202-M206 WeakPolarHBondContact O-CG 3.49Å; K202-M206 PolarHBondContact O-N 3.33Å; K202-I263 HydrophobicContact CG-CD1 4.43Å; K202-I263 HydrophobicContact CG-CG1 4.42Å; K202-I263 HydrophobicContact CG-CG2 4.01Å
203	S	98.7	Very high	97.9	Very high	8 Å²	8	30 Å²	30	6%	0.056	16%	0.16	C	C	.	.	H	α-helix	trans	-59.5	-36.7	176.4	-63.7	0	0	0	0	112.8	W169 S199 M206 A207 P296	W169-S203 WeakPolarHBondContact CH2-O 3.43Å; S199-S203 WeakPolarHBondContact O-CB 3.35Å; S199-S203 PolarHBondContact O-N 3.46Å; S199-S203 PolarHBondContact O-OG 2.73Å; S199-S203 VanDerWaalsContact O-OG 3.1Å; S203-M206 PolarHBondContact O-N 3.48Å; S203-A207 WeakPolarHBondContact O-CB 3.47Å; S203-A207 PolarHBondContact O-N 3.25Å; S203-P296 WeakPolarHBondContact OG-CG 3.27Å
204	A	98.8	Very high	97.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.3	-39.5	176.1	0	0	0	0	0	112.3	W169 H179 N200 L201 K202 S208 I225 L228	W169-A204 HydrophobicContact CZ2-CB 4.39Å; H179-A204 HydrophobicContact CB-CB 4.47Å; N200-A204 PolarHBondContact O-N 2.99Å; N200-A204 VanDerWaalsContact O-N 3.07Å; L201-A204 WeakPolarHBondContact O-CB 3.17Å; L201-A204 PolarHBondContact O-N 2.82Å; K202-A204 VanDerWaalsContact C-N 3.28Å; K202-A204 PolarHBondContact O-N 3.14Å; A204-S208 WeakPolarHBondContact O-CB 2.84Å; A204-S208 PolarHBondContact O-N 3.49Å; A204-S208 VanDerWaalsContact O-N 3.08Å; A204-S208 PolarHBondContact O-OG 3.14Å; A204-I225 HydrophobicContact CB-CG2 4.27Å; A204-L228 HydrophobicContact CB-CD1 4.23Å
205	V	98.4	Very high	98	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-49	174.8	175.4	0	0	0	0	110.2	L201 K202 A207 S208 F209 I225 Y260 I263 L264	L201-V205 WeakPolarHBondContact O-CG2 3.43Å; L201-V205 PolarHBondContact O-N 3.18Å; L201-V205 VanDerWaalsContact O-N 3.15Å; K202-V205 WeakPolarHBondContact O-CB 3.21Å; K202-V205 PolarHBondContact O-N 2.96Å; K202-V205 VanDerWaalsContact O-N 3.13Å; V205-A207 PolarHBondContact O-N 3.1Å; V205-S208 WeakPolarHBondContact O-CB 3.35Å; V205-S208 PolarHBondContact O-N 3.43Å; V205-S208 VanDerWaalsContact O-N 3.07Å; V205-F209 HydrophobicContact CG1-CD1 4.12Å; V205-F209 HydrophobicContact CG1-CD2 4.07Å; V205-F209 HydrophobicContact CG1-CE1 3.52Å; V205-F209 HydrophobicContact CG1-CE2 3.46Å; V205-F209 VanDerWaalsContact CG1-CE2 3.46Å; V205-F209 HydrophobicContact CG1-CG 4.38Å; V205-F209 HydrophobicContact CG1-CZ 3.16Å; V205-F209 WeakPolarHBondContact O-CD1 3.4Å; V205-F209 WeakPolarHBondContact O-CG 3.44Å; V205-F209 PolarHBondContact O-N 2.93Å; V205-I225 HydrophobicContact CG2-CD1 4.01Å; V205-Y260 HydrophobicContact CG2-CD1 3.54Å; V205-Y260 HydrophobicContact CG2-CE1 3.71Å; V205-I263 HydrophobicContact CG2-CG2 4.07Å; V205-L264 HydrophobicContact CG1-CD2 3.96Å
206	M	98.3	Very high	98.1	Very high	12 Å²	12	27.8 Å²	27.8	6%	0.059	15%	0.151	C	C	.	.	H	α-helix	trans	-58	-48.8	178.6	-65.9	-58	99.7	0	0	112.7	K202 S203 S208 F209 L210 C267 Q269 Q291 A294 L295	K202-M206 WeakPolarHBondContact O-CG 3.49Å; K202-M206 PolarHBondContact O-N 3.33Å; S203-M206 PolarHBondContact O-N 3.48Å; M206-S208 PolarHBondContact O-N 3.06Å; M206-F209 HydrophobicContact CE-CD2 3.56Å; M206-F209 HydrophobicContact CE-CE2 3.59Å; M206-F209 PolarHBondContact O-N 3.48Å; M206-L210 PolarHBondContact O-N 3.43Å; M206-C267 VanDerWaalsContact CE-SG 3.52Å; M206-Q269 PolarHBondContact SD-OE1 3.28Å; M206-Q291 HydrophobicContact SD-CG 4.16Å; M206-A294 HydrophobicContact CG-CB 4.3Å; M206-L295 HydrophobicContact CB-CD2 4.12Å
207	A	98.6	Very high	98	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.7	-37.9	176.3	0	0	0	0	0	111.9	W169 S203 V205 M211 L228 L295 I337	W169-A207 HydrophobicContact CH2-CB 3.77Å; W169-A207 HydrophobicContact CZ3-CB 4.01Å; S203-A207 WeakPolarHBondContact O-CB 3.47Å; S203-A207 PolarHBondContact O-N 3.25Å; V205-A207 PolarHBondContact O-N 3.1Å; A207-M211 WeakPolarHBondContact O-CG 3.38Å; A207-M211 PolarHBondContact O-N 3.48Å; A207-M211 VanDerWaalsContact O-SD 3.34Å; A207-L228 HydrophobicContact CB-CD1 4.19Å; A207-L295 HydrophobicContact CB-CD2 3.87Å; A207-I337 HydrophobicContact CB-CD1 4.07Å
208	S	98.6	Very high	97.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-71.1	-38.3	179.8	-58.4	0	0	0	0	112.3	A204 V205 M206 L210 M211 L212 I225	A204-S208 WeakPolarHBondContact O-CB 2.84Å; A204-S208 PolarHBondContact O-N 3.49Å; A204-S208 VanDerWaalsContact O-N 3.08Å; A204-S208 PolarHBondContact O-OG 3.14Å; V205-S208 WeakPolarHBondContact O-CB 3.35Å; V205-S208 PolarHBondContact O-N 3.43Å; V205-S208 VanDerWaalsContact O-N 3.07Å; M206-S208 PolarHBondContact O-N 3.06Å; S208-L210 VanDerWaalsContact C-N 3.32Å; S208-L210 PolarHBondContact O-N 2.94Å; S208-M211 PolarHBondContact O-N 3.17Å; S208-M211 VanDerWaalsContact O-N 3.12Å; S208-L212 WeakPolarHBondContact O-CB 3.26Å; S208-L212 VanDerWaalsContact O-CG 3.29Å; S208-L212 WeakPolarHBondContact O-CG 3.25Å; S208-L212 PolarHBondContact O-N 2.85Å; S208-I225 WeakPolarHBondContact OG-CG1 3.09Å
209	F	98.2	Very high	97.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.6	-39.4	175.8	-68.3	-8.5	0	0	0	112.4	V205 M206 M211 F216 L221 L264 V270 V281 K283	V205-F209 HydrophobicContact CG1-CD1 4.12Å; V205-F209 HydrophobicContact CG1-CD2 4.07Å; V205-F209 HydrophobicContact CG1-CE1 3.52Å; V205-F209 HydrophobicContact CG1-CE2 3.46Å; V205-F209 VanDerWaalsContact CG1-CE2 3.46Å; V205-F209 HydrophobicContact CG1-CG 4.38Å; V205-F209 HydrophobicContact CG1-CZ 3.16Å; V205-F209 WeakPolarHBondContact O-CD1 3.4Å; V205-F209 WeakPolarHBondContact O-CG 3.44Å; V205-F209 PolarHBondContact O-N 2.93Å; M206-F209 HydrophobicContact CE-CD2 3.56Å; M206-F209 HydrophobicContact CE-CE2 3.59Å; M206-F209 PolarHBondContact O-N 3.48Å; F209-M211 PolarHBondContact O-N 3.13Å; F209-F216 HydrophobicContact CD1-CE1 4.4Å; F209-F216 HydrophobicContact CD1-CE2 4.34Å; F209-F216 AromaticContact CD1-CZ 3.57Å; F209-F216 HydrophobicContact CD1-CZ 3.57Å; F209-F216 HydrophobicContact CE1-CE2 4.13Å; F209-F216 AromaticContact CE1-CZ 3.62Å; F209-F216 HydrophobicContact CE1-CZ 3.62Å; F209-L221 HydrophobicContact CD1-CD1 4.07Å; F209-L221 HydrophobicContact CE1-CD1 3.83Å; F209-L221 HydrophobicContact CE1-CD2 4.32Å; F209-L264 HydrophobicContact CE1-CD2 4.43Å; F209-L264 HydrophobicContact CZ-CD2 3.95Å; F209-V270 HydrophobicContact CE1-CG2 4.45Å; F209-V270 HydrophobicContact CE2-CB 3.64Å; F209-V270 HydrophobicContact CE2-CG1 3.94Å; F209-V270 HydrophobicContact CE2-CG2 4.27Å; F209-V270 HydrophobicContact CZ-CB 3.64Å; F209-V270 HydrophobicContact CZ-CG1 3.82Å; F209-V270 HydrophobicContact CZ-CG2 3.81Å; F209-V281 HydrophobicContact CB-CG1 4.15Å; F209-V281 HydrophobicContact CD1-CG1 3.79Å; F209-V281 HydrophobicContact CD2-CG1 3.8Å; F209-V281 HydrophobicContact CE1-CG1 4.02Å; F209-V281 HydrophobicContact CE2-CG1 4.04Å; F209-V281 HydrophobicContact CG-CG1 3.67Å; F209-V281 HydrophobicContact CZ-CG1 4.13Å; F209-K283 PolarHBondContact O-NZ 2.89Å
210	L	98.2	Very high	97.8	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-62.8	-32.8	174.8	-71.1	167.8	0	0	0	112.4	M206 S208 K283 Q288 Q291 L292 L295 G330 V333	M206-L210 PolarHBondContact O-N 3.43Å; S208-L210 VanDerWaalsContact C-N 3.32Å; S208-L210 PolarHBondContact O-N 2.94Å; L210-K283 PolarHBondContact O-NZ 3.33Å; L210-Q288 HydrophobicContact CD2-CB 4.13Å; L210-Q288 HydrophobicContact CD2-CG 4.23Å; L210-Q291 HydrophobicContact CD1-CB 4.06Å; L210-Q291 HydrophobicContact CD2-CB 3.77Å; L210-Q291 HydrophobicContact CG-CB 3.87Å; L210-L292 HydrophobicContact CD1-CD2 3.79Å; L210-L292 HydrophobicContact CD1-CG 4.02Å; L210-L292 HydrophobicContact CD2-CG 4.19Å; L210-L295 HydrophobicContact CD1-CD1 3.76Å; L210-L295 HydrophobicContact CD1-CD2 4.15Å; L210-L295 HydrophobicContact CD1-CG 4.14Å; L210-G330 VanDerWaalsContact O-CA 3.28Å; L210-G330 WeakPolarHBondContact O-CA 3.47Å; L210-V333 HydrophobicContact CB-CG2 4.07Å; L210-V333 HydrophobicContact CD1-CG2 3.9Å
211	M	97.9	Very high	97.8	Very high	36 Å²	36	32.1 Å²	32.1	18%	0.177	17%	0.165	C	C	.	.	H	α-helix	trans	-92.5	-17.3	-175.7	-61.2	164.6	79.2	0	0	114.4	A207 S208 F209 Q224 L228 V333 H334 I337	A207-M211 WeakPolarHBondContact O-CG 3.38Å; A207-M211 PolarHBondContact O-N 3.48Å; A207-M211 VanDerWaalsContact O-SD 3.34Å; S208-M211 PolarHBondContact O-N 3.17Å; S208-M211 VanDerWaalsContact O-N 3.12Å; F209-M211 PolarHBondContact O-N 3.13Å; M211-Q224 HydrophobicContact CB-CG 4.49Å; M211-Q224 PolarHBondContact SD-NE2 3.08Å; M211-L228 HydrophobicContact CE-CD2 4.22Å; M211-L228 HydrophobicContact SD-CD2 3.77Å; M211-V333 HydrophobicContact CG-CB 4.24Å; M211-V333 HydrophobicContact CG-CG1 3.96Å; M211-V333 HydrophobicContact SD-CG1 4.04Å; M211-H334 HydrophobicContact CE-CB 3.52Å; M211-H334 WeakPolarHBondContact CE-CD2 3.45Å; M211-I337 HydrophobicContact SD-CD1 4.05Å
212	L	98	Very high	97.8	Very high	18 Å²	18	31.2 Å²	31.2	9%	0.094	16%	0.16	C	C	.	.	S	Bend	trans	-92.2	159.6	178.7	-74.3	166.3	0	0	0	111.2	S208 F216 E220 L221 Q224 K283	S208-L212 WeakPolarHBondContact O-CB 3.26Å; S208-L212 VanDerWaalsContact O-CG 3.29Å; S208-L212 WeakPolarHBondContact O-CG 3.25Å; S208-L212 PolarHBondContact O-N 2.85Å; L212-F216 HydrophobicContact CB-CD1 3.73Å; L212-F216 HydrophobicContact CB-CE1 3.93Å; L212-F216 HydrophobicContact CB-CG 4.2Å; L212-F216 HydrophobicContact CD1-CD1 4.22Å; L212-F216 HydrophobicContact CD1-CD2 3.82Å; L212-F216 HydrophobicContact CD1-CE1 4.24Å; L212-F216 HydrophobicContact CD1-CE2 3.85Å; L212-F216 HydrophobicContact CD1-CG 4.01Å; L212-F216 HydrophobicContact CD1-CZ 4.08Å; L212-F216 HydrophobicContact CG-CD1 4.5Å; L212-E220 HydrophobicContact CD2-CB 4.4Å; L212-L221 HydrophobicContact CD1-CB 4.45Å; L212-L221 HydrophobicContact CD1-CD1 4.02Å; L212-Q224 HydrophobicContact CD1-CB 3.98Å; L212-Q224 HydrophobicContact CD1-CG 4.15Å; L212-Q224 HydrophobicContact CD2-CB 4.28Å; L212-Q224 HydrophobicContact CD2-CG 4.4Å; L212-Q224 HydrophobicContact CG-CB 4.22Å; L212-Q224 HydrophobicContact CG-CG 4.04Å; L212-K283 PolarHBondContact O-NZ 2.89Å
213	P	96.8	Very high	97.7	Very high	76 Å²	76	28.1 Å²	28.1	49%	0.494	15%	0.149	S	C	.	.			trans	-64.5	174.9	171.3	29.6	-36.6	0	0	0	111.7	S215 F216	P213-S215 PolarHBondContact O-N 3.03Å; P213-F216 HydrophobicContact CG-CB 4.46Å; P213-F216 VanDerWaalsContact O-CD1 3.23Å; P213-F216 WeakPolarHBondContact O-CD1 3.46Å
214	E	96.4	Very high	97.7	Very high	133 Å²	133	30 Å²	30	62%	0.621	16%	0.156	S	C	*	.	S	Bend	trans	-58.5	-34.2	179.2	-169.1	-177.1	165.3	0	0	113	E280 V281 K283	E214-E280 CarbonylContact O-C 3.56Å; E214-E280 VanDerWaalsContact O-CA 3.29Å; E214-E280 WeakPolarHBondContact O-CA 3.42Å; E214-V281 WeakPolarHBondContact CG-O 3.44Å; E214-V281 PolarHBondContact O-N 3.38Å; E214-K283 HydrophobicContact CB-CG 3.97Å; E214-K283 HydrophobicContact CG-CG 4.25Å
215	S	97.4	Very high	97.7	Very high	37 Å²	37	30 Å²	30	26%	0.259	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	129.5	178.8	-163.6	0	0	0	0	111.8	P213 R278 L279 E280	P213-S215 PolarHBondContact O-N 3.03Å; S215-R278 PolarHBondContact OG-NH2 3.37Å; S215-L279 WeakPolarHBondContact CA-O 3.46Å; S215-L279 PolarHBondContact OG-O 3.11Å; S215-E280 WeakPolarHBondContact OG-CG 3.42Å
216	F	98	Very high	97.7	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	169.8	-175.9	53.3	-89.8	0	0	0	111.6	F209 L212 P213 E220 L221 R278 L279 V281	F209-F216 HydrophobicContact CD1-CE1 4.4Å; F209-F216 HydrophobicContact CD1-CE2 4.34Å; F209-F216 AromaticContact CD1-CZ 3.57Å; F209-F216 HydrophobicContact CD1-CZ 3.57Å; F209-F216 HydrophobicContact CE1-CE2 4.13Å; F209-F216 AromaticContact CE1-CZ 3.62Å; F209-F216 HydrophobicContact CE1-CZ 3.62Å; L212-F216 HydrophobicContact CB-CD1 3.73Å; L212-F216 HydrophobicContact CB-CE1 3.93Å; L212-F216 HydrophobicContact CB-CG 4.2Å; L212-F216 HydrophobicContact CD1-CD1 4.22Å; L212-F216 HydrophobicContact CD1-CD2 3.82Å; L212-F216 HydrophobicContact CD1-CE1 4.24Å; L212-F216 HydrophobicContact CD1-CE2 3.85Å; L212-F216 HydrophobicContact CD1-CG 4.01Å; L212-F216 HydrophobicContact CD1-CZ 4.08Å; L212-F216 HydrophobicContact CG-CD1 4.5Å; P213-F216 HydrophobicContact CG-CB 4.46Å; P213-F216 VanDerWaalsContact O-CD1 3.23Å; P213-F216 WeakPolarHBondContact O-CD1 3.46Å; F216-E220 WeakPolarHBondContact CA-OE2 3.48Å; F216-E220 HydrophobicContact CB-CB 4.25Å; F216-E220 WeakPolarHBondContact CB-OE2 3.26Å; F216-L221 HydrophobicContact CD2-CB 4.07Å; F216-L221 HydrophobicContact CE2-CB 3.87Å; F216-L221 HydrophobicContact CE2-CD1 4.07Å; F216-L221 HydrophobicContact CE2-CD2 4.41Å; F216-L221 HydrophobicContact CE2-CG 4.32Å; F216-R278 WeakPolarHBondContact O-CA 3.35Å; F216-L279 HydrophobicContact CD2-CB 4.04Å; F216-L279 HydrophobicContact CD2-CD1 4.05Å; F216-L279 HydrophobicContact CE2-CB 3.55Å; F216-L279 HydrophobicContact CE2-CD1 3.89Å; F216-L279 HydrophobicContact CE2-CD2 4.17Å; F216-L279 HydrophobicContact CE2-CG 4.06Å; F216-L279 HydrophobicContact CZ-CB 3.81Å; F216-L279 PolarHBondContact N-O 3.21Å; F216-L279 PolarHBondContact O-N 2.83Å; F216-V281 HydrophobicContact CE1-CB 4.41Å; F216-V281 HydrophobicContact CE1-CG1 3.72Å; F216-V281 HydrophobicContact CE1-CG2 3.8Å; F216-V281 HydrophobicContact CZ-CG1 3.72Å
217	T	97.2	Very high	97.6	Very high	47 Å²	47	30.3 Å²	30.3	29%	0.288	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	161.2	178.6	63.5	0	0	0	0	112.3	E219 E220 L221 G277	T217-E219 PolarHBondContact O-N 3.05Å; T217-E220 WeakPolarHBondContact CB-OE2 3.33Å; T217-E220 PolarHBondContact N-OE2 2.9Å; T217-E220 PolarHBondContact O-N 3.18Å; T217-E220 VanDerWaalsContact OG1-CG 3.32Å; T217-E220 WeakPolarHBondContact OG1-CG 3.47Å; T217-E220 PolarHBondContact OG1-N 3.32Å; T217-E220 PolarHBondContact OG1-OE2 3.4Å; T217-L221 PolarHBondContact O-N 3.39Å; T217-G277 CarbonylContact C-O 3.57Å; T217-G277 VanDerWaalsContact CA-O 3.31Å; T217-G277 WeakPolarHBondContact CA-O 3.24Å
218	E	95.6	Very high	97.6	Very high	9 Å²	9	30.4 Å²	30.4	4%	0.042	16%	0.164	C	C	.	.	H	α-helix	trans	-55.7	-38.8	170.9	-67.2	-175.8	123.2	0	0	112.8	L221 F222 R257 Y272 G277 L279	E218-L221 WeakPolarHBondContact O-CB 3.26Å; E218-L221 PolarHBondContact O-N 3.23Å; E218-F222 HydrophobicContact CB-CD2 4.43Å; E218-F222 HydrophobicContact CB-CE2 3.88Å; E218-F222 HydrophobicContact CB-CZ 4.27Å; E218-F222 WeakPolarHBondContact O-CD2 3.39Å; E218-F222 WeakPolarHBondContact O-CG 3.39Å; E218-F222 PolarHBondContact O-N 3.48Å; E218-R257 IonicContact OE1-NE 3.77Å; E218-R257 IonicContact OE2-CZ 3.65Å; E218-R257 VanDerWaalsContact OE2-CZ 3.27Å; E218-R257 IonicContact OE2-NE 3.56Å; E218-R257 PolarHBondContact OE2-NE 3.23Å; E218-R257 IonicContact OE2-NH2 2.81Å; E218-R257 PolarHBondContact OE2-NH2 3.33Å; E218-Y272 HydrophobicContact CG-CE2 4.11Å; E218-Y272 PolarHBondContact OE1-OH 3.21Å; E218-G277 PolarHBondContact N-O 3.08Å; E218-L279 HydrophobicContact CG-CD1 4.08Å
219	E	95.8	Very high	97.4	Very high	78 Å²	78	31.2 Å²	31.2	36%	0.364	17%	0.169	S	C	.	.	H	α-helix	trans	-64.2	-44.8	-180	-174.6	175.1	176.5	0	0	110.8	T217 L221 F222 L223 K250 I253	T217-E219 PolarHBondContact O-N 3.05Å; E219-L221 VanDerWaalsContact C-N 3.33Å; E219-L221 PolarHBondContact O-N 2.92Å; E219-F222 PolarHBondContact O-N 3.36Å; E219-L223 HydrophobicContact CG-CD1 4.01Å; E219-L223 HydrophobicContact CG-CG 4.36Å; E219-L223 WeakPolarHBondContact O-CB 3.3Å; E219-L223 WeakPolarHBondContact O-CG 3.44Å; E219-L223 PolarHBondContact O-N 2.88Å; E219-K250 WeakPolarHBondContact OE1-CE 3.32Å; E219-I253 HydrophobicContact CB-CD1 4.43Å; E219-I253 HydrophobicContact CG-CD1 4.4Å
220	E	97.9	Very high	97.1	Very high	86 Å²	86	32.8 Å²	32.8	40%	0.402	18%	0.176	S	C	.	.	H	α-helix	trans	-60.6	-42.6	175.5	-72.8	164.1	140.6	0	0	111.6	L212 F216 T217 F222 L223 Q224	L212-E220 HydrophobicContact CD2-CB 4.4Å; F216-E220 WeakPolarHBondContact CA-OE2 3.48Å; F216-E220 HydrophobicContact CB-CB 4.25Å; F216-E220 WeakPolarHBondContact CB-OE2 3.26Å; T217-E220 WeakPolarHBondContact CB-OE2 3.33Å; T217-E220 PolarHBondContact N-OE2 2.9Å; T217-E220 PolarHBondContact O-N 3.18Å; T217-E220 VanDerWaalsContact OG1-CG 3.32Å; T217-E220 WeakPolarHBondContact OG1-CG 3.47Å; T217-E220 PolarHBondContact OG1-N 3.32Å; T217-E220 PolarHBondContact OG1-OE2 3.4Å; E220-F222 PolarHBondContact O-N 3.09Å; E220-L223 PolarHBondContact O-N 3.07Å; E220-Q224 WeakPolarHBondContact O-CB 3.48Å; E220-Q224 PolarHBondContact O-N 3.33Å
221	L	98.2	Very high	96.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.5	-48.9	174.1	179.4	62.3	0	0	0	111.9	F209 L212 F216 T217 E218 E219 L223 Q224 I225 L264 L279	F209-L221 HydrophobicContact CD1-CD1 4.07Å; F209-L221 HydrophobicContact CE1-CD1 3.83Å; F209-L221 HydrophobicContact CE1-CD2 4.32Å; L212-L221 HydrophobicContact CD1-CB 4.45Å; L212-L221 HydrophobicContact CD1-CD1 4.02Å; F216-L221 HydrophobicContact CD2-CB 4.07Å; F216-L221 HydrophobicContact CE2-CB 3.87Å; F216-L221 HydrophobicContact CE2-CD1 4.07Å; F216-L221 HydrophobicContact CE2-CD2 4.41Å; F216-L221 HydrophobicContact CE2-CG 4.32Å; T217-L221 PolarHBondContact O-N 3.39Å; E218-L221 WeakPolarHBondContact O-CB 3.26Å; E218-L221 PolarHBondContact O-N 3.23Å; E219-L221 VanDerWaalsContact C-N 3.33Å; E219-L221 PolarHBondContact O-N 2.92Å; L221-L223 PolarHBondContact O-N 3.22Å; L221-Q224 WeakPolarHBondContact O-CB 3.34Å; L221-Q224 PolarHBondContact O-N 3.15Å; L221-I225 HydrophobicContact CD1-CD1 3.89Å; L221-I225 HydrophobicContact CD1-CG1 4.19Å; L221-I225 HydrophobicContact CD2-CD1 4.46Å; L221-I225 HydrophobicContact CG-CD1 3.85Å; L221-I225 HydrophobicContact CG-CG1 4.47Å; L221-I225 WeakPolarHBondContact O-CB 3.38Å; L221-I225 WeakPolarHBondContact O-CG1 3.08Å; L221-I225 PolarHBondContact O-N 3.32Å; L221-L264 HydrophobicContact CD2-CD1 3.93Å; L221-L264 HydrophobicContact CD2-CD2 3.82Å; L221-L264 HydrophobicContact CD2-CG 4.5Å; L221-L279 HydrophobicContact CD2-CD2 3.92Å
222	F	97.9	Very high	96.2	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-70.1	-33.4	-177.8	-58.8	-32.1	0	0	0	112.5	E218 E219 E220 A226 V249 I253 F256 R257 Y260	E218-F222 HydrophobicContact CB-CD2 4.43Å; E218-F222 HydrophobicContact CB-CE2 3.88Å; E218-F222 HydrophobicContact CB-CZ 4.27Å; E218-F222 WeakPolarHBondContact O-CD2 3.39Å; E218-F222 WeakPolarHBondContact O-CG 3.39Å; E218-F222 PolarHBondContact O-N 3.48Å; E219-F222 PolarHBondContact O-N 3.36Å; E220-F222 PolarHBondContact O-N 3.09Å; F222-A226 WeakPolarHBondContact O-CB 3.3Å; F222-A226 PolarHBondContact O-N 2.97Å; F222-V249 HydrophobicContact CB-CG1 3.67Å; F222-V249 HydrophobicContact CB-CG2 4.32Å; F222-V249 WeakPolarHBondContact O-CG2 3.44Å; F222-I253 HydrophobicContact CD2-CD1 3.64Å; F222-I253 HydrophobicContact CD2-CG1 4.35Å; F222-I253 HydrophobicContact CE2-CD1 4.25Å; F222-F256 HydrophobicContact CB-CB 4.32Å; F222-F256 HydrophobicContact CB-CD1 3.95Å; F222-F256 HydrophobicContact CB-CE1 4.42Å; F222-F256 HydrophobicContact CB-CG 4.12Å; F222-F256 HydrophobicContact CD1-CB 3.85Å; F222-F256 AromaticContact CD1-CD1 3.96Å; F222-F256 HydrophobicContact CD1-CD1 3.96Å; F222-F256 HydrophobicContact CD1-CG 4.27Å; F222-F256 HydrophobicContact CD2-CB 3.64Å; F222-F256 HydrophobicContact CD2-CG 4.32Å; F222-F256 HydrophobicContact CE1-CB 4.03Å; F222-F256 HydrophobicContact CE2-CB 3.82Å; F222-F256 HydrophobicContact CG-CB 3.66Å; F222-F256 AromaticContact CG-CD1 3.97Å; F222-F256 HydrophobicContact CG-CD1 3.97Å; F222-F256 AromaticContact CG-CG 3.98Å; F222-F256 HydrophobicContact CG-CG 3.98Å; F222-F256 HydrophobicContact CZ-CB 4.01Å; F222-R257 HydrophobicContact CE2-CG 3.82Å; F222-R257 HydrophobicContact CZ-CG 4.01Å; F222-Y260 HydrophobicContact CD1-CD2 4.16Å; F222-Y260 AromaticContact CE1-CD2 3.93Å; F222-Y260 HydrophobicContact CE1-CD2 3.93Å; F222-Y260 HydrophobicContact CE1-CG 4.28Å
223	L	97.9	Very high	95.8	Very high	49 Å²	49	32.3 Å²	32.3	26%	0.257	18%	0.182	S	C	.	.	H	α-helix	trans	-61.7	-45.3	170	-72.6	170.1	0	0	0	110.8	E219 E220 L221 G227 V245 V249	E219-L223 HydrophobicContact CG-CD1 4.01Å; E219-L223 HydrophobicContact CG-CG 4.36Å; E219-L223 WeakPolarHBondContact O-CB 3.3Å; E219-L223 WeakPolarHBondContact O-CG 3.44Å; E219-L223 PolarHBondContact O-N 2.88Å; E220-L223 PolarHBondContact O-N 3.07Å; L221-L223 PolarHBondContact O-N 3.22Å; L223-G227 PolarHBondContact O-N 2.77Å; L223-V245 HydrophobicContact CD2-CG1 4.3Å; L223-V249 HydrophobicContact CD2-CB 3.91Å; L223-V249 HydrophobicContact CD2-CG1 4.26Å; L223-V249 HydrophobicContact CD2-CG2 3.99Å; L223-V249 HydrophobicContact CG-CB 4.42Å; L223-V249 HydrophobicContact CG-CG1 4.26Å; L223-V249 HydrophobicContact CG-CG2 4.46Å
224	Q	98.4	Very high	95.3	Very high	47 Å²	47	31.9 Å²	31.9	22%	0.22	17%	0.173	C	C	.	.	H	α-helix	trans	-61.7	-53.1	178.3	-169.4	60	29.9	0	0	111.4	M211 L212 E220 L221 A226 G227 L228	M211-Q224 HydrophobicContact CB-CG 4.49Å; M211-Q224 PolarHBondContact SD-NE2 3.08Å; L212-Q224 HydrophobicContact CD1-CB 3.98Å; L212-Q224 HydrophobicContact CD1-CG 4.15Å; L212-Q224 HydrophobicContact CD2-CB 4.28Å; L212-Q224 HydrophobicContact CD2-CG 4.4Å; L212-Q224 HydrophobicContact CG-CB 4.22Å; L212-Q224 HydrophobicContact CG-CG 4.04Å; E220-Q224 WeakPolarHBondContact O-CB 3.48Å; E220-Q224 PolarHBondContact O-N 3.33Å; L221-Q224 WeakPolarHBondContact O-CB 3.34Å; L221-Q224 PolarHBondContact O-N 3.15Å; Q224-A226 PolarHBondContact O-N 2.85Å; Q224-G227 WeakPolarHBondContact O-CA 3.38Å; Q224-G227 PolarHBondContact O-N 3.42Å; Q224-G227 VanDerWaalsContact O-N 3.12Å; Q224-L228 WeakPolarHBondContact O-CG 3.35Å; Q224-L228 PolarHBondContact O-N 3.24Å; Q224-L228 VanDerWaalsContact O-N 3.1Å
225	I	98.5	Very high	94.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.7	-49.6	177.3	-72.7	175.2	0	0	0	111.2	H179 A204 V205 S208 L221 G227 L228 Y260	H179-I225 HydrophobicContact CB-CG2 3.96Å; A204-I225 HydrophobicContact CB-CG2 4.27Å; V205-I225 HydrophobicContact CG2-CD1 4.01Å; S208-I225 WeakPolarHBondContact OG-CG1 3.09Å; L221-I225 HydrophobicContact CD1-CD1 3.89Å; L221-I225 HydrophobicContact CD1-CG1 4.19Å; L221-I225 HydrophobicContact CD2-CD1 4.46Å; L221-I225 HydrophobicContact CG-CD1 3.85Å; L221-I225 HydrophobicContact CG-CG1 4.47Å; L221-I225 WeakPolarHBondContact O-CB 3.38Å; L221-I225 WeakPolarHBondContact O-CG1 3.08Å; L221-I225 PolarHBondContact O-N 3.32Å; I225-G227 PolarHBondContact O-N 3.1Å; I225-L228 WeakPolarHBondContact O-CG 3.47Å; I225-L228 PolarHBondContact O-N 3.43Å; I225-Y260 HydrophobicContact CD1-CD1 4.25Å; I225-Y260 HydrophobicContact CD1-CD2 4.43Å; I225-Y260 HydrophobicContact CD1-CE1 3.89Å; I225-Y260 HydrophobicContact CD1-CE2 4.1Å; I225-Y260 HydrophobicContact CG2-CE2 4.08Å; I225-Y260 WeakPolarHBondContact CG2-OH 3.48Å
226	A	97.2	Very high	93.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.1	-34.3	-179.6	0	0	0	0	0	111.6	K180 F222 Q224 S229 Y230 V245 V249 F256	K180-A226 HydrophobicContact CD-CB 4.16Å; K180-A226 HydrophobicContact CG-CB 4.19Å; K180-A226 PolarHBondContact NZ-O 3.39Å; F222-A226 WeakPolarHBondContact O-CB 3.3Å; F222-A226 PolarHBondContact O-N 2.97Å; Q224-A226 PolarHBondContact O-N 2.85Å; A226-S229 PolarHBondContact O-OG 3.35Å; A226-Y230 VanDerWaalsContact O-CD2 3.27Å; A226-Y230 WeakPolarHBondContact O-CD2 3.13Å; A226-V245 HydrophobicContact CB-CG1 3.91Å; A226-V249 HydrophobicContact CB-CG2 3.68Å; A226-F256 HydrophobicContact CB-CE1 4.44Å; A226-F256 HydrophobicContact CB-CZ 4.16Å
227	G	97.2	Very high	92.9	Very high	20 Å²	20	37 Å²	37	21%	0.206	19%	0.188	C	C	.	.	H	α-helix	trans	-69.2	-26.3	178.9	0	0	0	0	0	114.6	L223 Q224 I225 S229 Y230 A231	L223-G227 PolarHBondContact O-N 2.77Å; Q224-G227 WeakPolarHBondContact O-CA 3.38Å; Q224-G227 PolarHBondContact O-N 3.42Å; Q224-G227 VanDerWaalsContact O-N 3.12Å; I225-G227 PolarHBondContact O-N 3.1Å; G227-S229 VanDerWaalsContact C-N 3.29Å; G227-S229 PolarHBondContact O-N 3.18Å; G227-Y230 CarbonylContact O-C 3.54Å; G227-Y230 WeakPolarHBondContact O-CA 3.06Å; G227-Y230 WeakPolarHBondContact O-CB 3.37Å; G227-Y230 PolarHBondContact O-N 2.99Å; G227-A231 PolarHBondContact O-N 2.83Å
228	L	97.9	Very high	91.8	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-52.3	-46.5	-179.2	-58.9	-174.6	0	0	0	112.2	W169 A204 A207 M211 Q224 I225 Y230 A231 I337	W169-L228 HydrophobicContact CH2-CD1 4.24Å; A204-L228 HydrophobicContact CB-CD1 4.23Å; A207-L228 HydrophobicContact CB-CD1 4.19Å; M211-L228 HydrophobicContact CE-CD2 4.22Å; M211-L228 HydrophobicContact SD-CD2 3.77Å; Q224-L228 WeakPolarHBondContact O-CG 3.35Å; Q224-L228 PolarHBondContact O-N 3.24Å; Q224-L228 VanDerWaalsContact O-N 3.1Å; I225-L228 WeakPolarHBondContact O-CG 3.47Å; I225-L228 PolarHBondContact O-N 3.43Å; L228-Y230 PolarHBondContact O-N 3.23Å; L228-Y230 VanDerWaalsContact O-N 3.11Å; L228-A231 PolarHBondContact O-N 3.43Å; L228-I337 HydrophobicContact CB-CG2 4.48Å; L228-I337 HydrophobicContact CD2-CD1 3.84Å
229	S	94.4	Very high	90.4	Very high	17 Å²	17	39.9 Å²	39.9	12%	0.119	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-3.2	179.9	71	0	0	0	0	114.9	K180 A226 G227	K180-S229 PolarHBondContact NZ-OG 3.29Å; A226-S229 PolarHBondContact O-OG 3.35Å; G227-S229 VanDerWaalsContact C-N 3.29Å; G227-S229 PolarHBondContact O-N 3.18Å
230	Y	93.2	Very high	89.5	Confident	34 Å²	34	36.9 Å²	36.9	13%	0.133	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-12.9	179	-67.2	-71.7	0	0	0	112.4	A226 G227 L228 G232 D233 M236 K244 V245 I248	A226-Y230 VanDerWaalsContact O-CD2 3.27Å; A226-Y230 WeakPolarHBondContact O-CD2 3.13Å; G227-Y230 CarbonylContact O-C 3.54Å; G227-Y230 WeakPolarHBondContact O-CA 3.06Å; G227-Y230 WeakPolarHBondContact O-CB 3.37Å; G227-Y230 PolarHBondContact O-N 2.99Å; L228-Y230 PolarHBondContact O-N 3.23Å; L228-Y230 VanDerWaalsContact O-N 3.11Å; Y230-G232 PolarHBondContact O-N 3.08Å; Y230-D233 WeakPolarHBondContact O-CB 3.4Å; Y230-D233 PolarHBondContact O-N 2.98Å; Y230-M236 HydrophobicContact CD1-CG 3.78Å; Y230-M236 HydrophobicContact CD1-SD 3.44Å; Y230-M236 WeakPolarHBondContact CD1-SD 3.31Å; Y230-M236 HydrophobicContact CE1-SD 3.97Å; Y230-M236 HydrophobicContact CG-CG 4.3Å; Y230-M236 HydrophobicContact CG-SD 4.08Å; Y230-K244 HydrophobicContact CE1-CD 4.33Å; Y230-K244 WeakPolarHBondContact OH-CE 3.33Å; Y230-V245 HydrophobicContact CD2-CG2 3.51Å; Y230-V245 HydrophobicContact CE2-CG2 4.01Å; Y230-V245 HydrophobicContact CG-CG2 4.07Å; Y230-I248 HydrophobicContact CE2-CD1 4.23Å
231	A	90.9	Very high	88.6	Confident	11 Å²	11	33.8 Å²	33.8	9%	0.091	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	118.8	175.3	0	0	0	0	0	109.1	G227 L228 D233 I337 V341	G227-A231 PolarHBondContact O-N 2.83Å; L228-A231 PolarHBondContact O-N 3.43Å; A231-D233 PolarHBondContact O-N 3.05Å; A231-I337 HydrophobicContact CB-CG2 4.07Å; A231-V341 WeakPolarHBondContact O-CB 3.39Å; A231-V341 WeakPolarHBondContact O-CG1 3.45Å
232	G	86.4	Confident	87.7	Confident	30 Å²	30	41.9 Å²	41.9	31%	0.309	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	0.4	-176.8	0	0	0	0	0	115.8	Y230 F234 S338 K342	Y230-G232 PolarHBondContact O-N 3.08Å; G232-F234 PolarHBondContact O-N 3.36Å; G232-F234 VanDerWaalsContact O-N 3.15Å; G232-S338 VanDerWaalsContact CA-OG 3.29Å; G232-S338 WeakPolarHBondContact CA-OG 3.33Å; G232-S338 PolarHBondContact N-OG 3.45Å; G232-K342 WeakPolarHBondContact O-CA 3.48Å; G232-K342 WeakPolarHBondContact O-CB 3.33Å
233	D	89.3	Confident	87.1	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.021	23%	0.227	C	C	.	.			trans	-70.3	109.1	174.9	-174	-6.4	0	0	0	110.4	Y230 A231 R235 M236 V341 S345	Y230-D233 WeakPolarHBondContact O-CB 3.4Å; Y230-D233 PolarHBondContact O-N 2.98Å; A231-D233 PolarHBondContact O-N 3.05Å; D233-R235 PolarHBondContact O-N 2.88Å; D233-R235 VanDerWaalsContact OD1-CB 3.31Å; D233-R235 WeakPolarHBondContact OD1-CB 3.28Å; D233-R235 WeakPolarHBondContact OD1-CG 3.46Å; D233-R235 IonicContact OD1-CZ 3.33Å; D233-R235 PolarHBondContact OD1-N 3.29Å; D233-R235 IonicContact OD1-NE 2.84Å; D233-R235 PolarHBondContact OD1-NE 3.25Å; D233-R235 IonicContact OD1-NH2 3.64Å; D233-R235 IonicContact OD2-CZ 2.67Å; D233-R235 VanDerWaalsContact OD2-CZ 3.28Å; D233-R235 IonicContact OD2-NE 2.65Å; D233-R235 PolarHBondContact OD2-NE 3.4Å; D233-R235 IonicContact OD2-NH2 3.74Å; D233-R235 PolarHBondContact OD2-NH2 3.49Å; D233-M236 HydrophobicContact CB-CG 4.15Å; D233-M236 WeakPolarHBondContact O-CB 3.49Å; D233-M236 PolarHBondContact O-N 3.36Å; D233-V341 HydrophobicContact CB-CG1 4.01Å; D233-S345 WeakPolarHBondContact OD1-CB 3.35Å; D233-S345 PolarHBondContact OD1-OG 3.13Å
234	F	85.1	Confident	86.5	Confident	66 Å²	66	43.8 Å²	43.8	29%	0.289	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-58.5	-25.1	-179	82	-84.6	0	0	0	113	G232 M236 K237 I238 S345 I346 S349	G232-F234 PolarHBondContact O-N 3.36Å; G232-F234 VanDerWaalsContact O-N 3.15Å; F234-M236 PolarHBondContact O-N 3.12Å; F234-K237 WeakPolarHBondContact O-CB 3.36Å; F234-K237 PolarHBondContact O-N 3.36Å; F234-I238 HydrophobicContact CD2-CD1 3.89Å; F234-I238 HydrophobicContact CD2-CG1 3.88Å; F234-I238 HydrophobicContact CE2-CD1 4.03Å; F234-I238 HydrophobicContact CE2-CG1 4.25Å; F234-I238 WeakPolarHBondContact O-CG1 3.39Å; F234-I238 PolarHBondContact O-N 3.26Å; F234-I238 VanDerWaalsContact O-N 3.17Å; F234-S345 WeakPolarHBondContact CD1-OG 3.44Å; F234-S345 WeakPolarHBondContact CE1-OG 3.22Å; F234-I346 HydrophobicContact CD1-CG1 3.74Å; F234-I346 HydrophobicContact CE1-CG1 4.19Å; F234-I346 HydrophobicContact CG-CG1 4.42Å; F234-S349 WeakPolarHBondContact CE1-OG 3.47Å; F234-S349 WeakPolarHBondContact CZ-OG 3.1Å
235	R	81.8	Confident	86.1	Confident	62 Å²	62	42.7 Å²	42.7	23%	0.234	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-67.8	-22.1	178.7	-57.9	171.3	-63.3	-175.6	1.1	112.5	D233 K237 I238 E240 S345	D233-R235 PolarHBondContact O-N 2.88Å; D233-R235 VanDerWaalsContact OD1-CB 3.31Å; D233-R235 WeakPolarHBondContact OD1-CB 3.28Å; D233-R235 WeakPolarHBondContact OD1-CG 3.46Å; D233-R235 IonicContact OD1-CZ 3.33Å; D233-R235 PolarHBondContact OD1-N 3.29Å; D233-R235 IonicContact OD1-NE 2.84Å; D233-R235 PolarHBondContact OD1-NE 3.25Å; D233-R235 IonicContact OD1-NH2 3.64Å; D233-R235 IonicContact OD2-CZ 2.67Å; D233-R235 VanDerWaalsContact OD2-CZ 3.28Å; D233-R235 IonicContact OD2-NE 2.65Å; D233-R235 PolarHBondContact OD2-NE 3.4Å; D233-R235 IonicContact OD2-NH2 3.74Å; D233-R235 PolarHBondContact OD2-NH2 3.49Å; R235-K237 PolarHBondContact O-N 2.71Å; R235-I238 CarbonylContact C-O 3.59Å; R235-I238 VanDerWaalsContact CA-O 3.25Å; R235-I238 WeakPolarHBondContact CA-O 3.48Å; R235-I238 CarbonylContact O-C 3.59Å; R235-I238 PolarHBondContact O-N 3.04Å; R235-E240 HydrophobicContact CB-CG 4.04Å; R235-E240 WeakPolarHBondContact O-CB 3.45Å; R235-E240 PolarHBondContact O-N 2.91Å; R235-S345 PolarHBondContact NE-OG 2.85Å
236	M	80.8	Confident	85.8	Confident	36 Å²	36	44.4 Å²	44.4	18%	0.177	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-69.6	-23.3	172	-67.1	-62	-65.1	0	0	112.4	Y230 D233 F234 E240	Y230-M236 HydrophobicContact CD1-CG 3.78Å; Y230-M236 HydrophobicContact CD1-SD 3.44Å; Y230-M236 WeakPolarHBondContact CD1-SD 3.31Å; Y230-M236 HydrophobicContact CE1-SD 3.97Å; Y230-M236 HydrophobicContact CG-CG 4.3Å; Y230-M236 HydrophobicContact CG-SD 4.08Å; D233-M236 HydrophobicContact CB-CG 4.15Å; D233-M236 WeakPolarHBondContact O-CB 3.49Å; D233-M236 PolarHBondContact O-N 3.36Å; F234-M236 PolarHBondContact O-N 3.12Å; M236-E240 HydrophobicContact SD-CB 3.99Å
237	K	79.2	Confident	85.4	Confident	180 Å²	180	46.6 Å²	46.6	78%	0.783	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-35.9	169.9	-58.5	-175.2	179.9	-175.1	0	111.1	F234 R235	F234-K237 WeakPolarHBondContact O-CB 3.36Å; F234-K237 PolarHBondContact O-N 3.36Å; R235-K237 PolarHBondContact O-N 2.71Å
238	I	73.3	Confident	85.1	Confident	107 Å²	107	46.5 Å²	46.5	55%	0.549	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.2	114.4	-177.3	55.3	164.4	0	0	0	113	F234 R235	F234-I238 HydrophobicContact CD2-CD1 3.89Å; F234-I238 HydrophobicContact CD2-CG1 3.88Å; F234-I238 HydrophobicContact CE2-CD1 4.03Å; F234-I238 HydrophobicContact CE2-CG1 4.25Å; F234-I238 WeakPolarHBondContact O-CG1 3.39Å; F234-I238 PolarHBondContact O-N 3.26Å; F234-I238 VanDerWaalsContact O-N 3.17Å; R235-I238 CarbonylContact C-O 3.59Å; R235-I238 VanDerWaalsContact CA-O 3.25Å; R235-I238 WeakPolarHBondContact CA-O 3.48Å; R235-I238 CarbonylContact O-C 3.59Å; R235-I238 PolarHBondContact O-N 3.04Å
239	G	66.6	Low	84.9	Confident	9 Å²	9	46.5 Å²	46.5	9%	0.093	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.4	-1.3	170	0	0	0	0	0	116.5	K368 M372	G239-K368 CarbonylContact O-C 3.5Å; G239-K368 VanDerWaalsContact O-CB 3.27Å; G239-K368 WeakPolarHBondContact O-CB 3.46Å; G239-M372 PolarHBondContact N-SD 3.02Å
240	E	78.3	Confident	84.7	Confident	15 Å²	15	51.5 Å²	51.5	7%	0.07	26%	0.257	C	S	.	.	S	Bend	trans	-118.4	157.6	168.5	-66.8	-75	-162.4	0	0	112	R235 M236 K244 K368 M372	R235-E240 HydrophobicContact CB-CG 4.04Å; R235-E240 WeakPolarHBondContact O-CB 3.45Å; R235-E240 PolarHBondContact O-N 2.91Å; M236-E240 HydrophobicContact SD-CB 3.99Å; E240-K244 HydrophobicContact CB-CD 4.35Å; E240-K244 IonicContact OE1-NZ 2.71Å; E240-K244 PolarHBondContact OE1-NZ 3.29Å; E240-K244 IonicContact OE2-NZ 2.78Å; E240-K244 PolarHBondContact OE2-NZ 2.92Å; E240-K368 IonicContact OE1-NZ 3.27Å; E240-K368 PolarHBondContact OE1-NZ 3.25Å; E240-K368 IonicContact OE2-NZ 3.42Å; E240-K368 PolarHBondContact OE2-NZ 3.38Å; E240-M372 WeakPolarHBondContact O-CG 3.09Å
241	D	77.6	Confident	84.4	Confident	22 Å²	22	52 Å²	52	12%	0.118	26%	0.262	C	S	.	.			trans	-68.6	129.2	173.2	179.8	1.4	0	0	0	110.2	S243 K244 N247	D241-S243 PolarHBondContact O-N 2.92Å; D241-S243 PolarHBondContact OD1-N 3.39Å; D241-K244 HydrophobicContact CB-CB 4.24Å; D241-K244 WeakPolarHBondContact O-CB 3.48Å; D241-K244 PolarHBondContact O-N 3.35Å; D241-N247 PolarHBondContact OD2-ND2 2.88Å
242	K	80.1	Confident	84.3	Confident	169 Å²	169	52.3 Å²	52.3	74%	0.735	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-28.2	179.3	-67.6	-171.6	178	-177	0	112.5	K244	K242-K244 VanDerWaalsContact C-N 3.26Å; K242-K244 PolarHBondContact O-N 2.96Å
243	S	84	Confident	84.6	Confident	50 Å²	50	52.7 Å²	52.7	35%	0.35	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	8.6	176.9	-60.1	0	0	0	0	112.9	D241 V245 S246 N247	D241-S243 PolarHBondContact O-N 2.92Å; D241-S243 PolarHBondContact OD1-N 3.39Å; S243-V245 VanDerWaalsContact C-N 3.35Å; S243-V245 PolarHBondContact O-N 2.98Å; S243-S246 PolarHBondContact O-N 2.68Å; S243-N247 PolarHBondContact O-N 3.25Å; S243-N247 PolarHBondContact O-ND2 2.96Å; S243-N247 PolarHBondContact O-OD1 2.86Å
244	K	86.6	Confident	84.8	Confident	39 Å²	39	58 Å²	58	17%	0.17	28%	0.281	C	S	.	.	H	α-helix	trans	-56.9	-42.6	-171.4	-179.2	165.5	-169.7	170.7	0	114.1	Y230 E240 D241 K242 N247 I248	Y230-K244 HydrophobicContact CE1-CD 4.33Å; Y230-K244 WeakPolarHBondContact OH-CE 3.33Å; E240-K244 HydrophobicContact CB-CD 4.35Å; E240-K244 IonicContact OE1-NZ 2.71Å; E240-K244 PolarHBondContact OE1-NZ 3.29Å; E240-K244 IonicContact OE2-NZ 2.78Å; E240-K244 PolarHBondContact OE2-NZ 2.92Å; D241-K244 HydrophobicContact CB-CB 4.24Å; D241-K244 WeakPolarHBondContact O-CB 3.48Å; D241-K244 PolarHBondContact O-N 3.35Å; K242-K244 VanDerWaalsContact C-N 3.26Å; K242-K244 PolarHBondContact O-N 2.96Å; K244-N247 PolarHBondContact O-N 3.27Å; K244-I248 HydrophobicContact CG-CD1 3.89Å; K244-I248 WeakPolarHBondContact O-CD1 3.49Å; K244-I248 VanDerWaalsContact O-CG1 3.22Å; K244-I248 WeakPolarHBondContact O-CG1 3.41Å; K244-I248 PolarHBondContact O-N 3.05Å
245	V	90.4	Very high	85.2	Confident	25 Å²	25	58.8 Å²	58.8	15%	0.152	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-49.3	179.2	179.3	0	0	0	0	110.2	L223 A226 Y230 S243 N247 I248 V249	L223-V245 HydrophobicContact CD2-CG1 4.3Å; A226-V245 HydrophobicContact CB-CG1 3.91Å; Y230-V245 HydrophobicContact CD2-CG2 3.51Å; Y230-V245 HydrophobicContact CE2-CG2 4.01Å; Y230-V245 HydrophobicContact CG-CG2 4.07Å; S243-V245 VanDerWaalsContact C-N 3.35Å; S243-V245 PolarHBondContact O-N 2.98Å; V245-N247 PolarHBondContact O-N 3.4Å; V245-I248 PolarHBondContact O-N 3.08Å; V245-V249 PolarHBondContact O-N 3.36Å; V245-V249 VanDerWaalsContact O-N 3.08Å
246	S	91.1	Very high	85.9	Confident	36 Å²	36	55.9 Å²	55.9	25%	0.252	28%	0.275	S	S	.	.	H	α-helix	trans	-60	-44.8	178.1	-172.5	0	0	0	0	112	S243 I248 V249 K250	S243-S246 PolarHBondContact O-N 2.68Å; S246-I248 VanDerWaalsContact C-N 3.34Å; S246-I248 PolarHBondContact O-N 3.47Å; S246-V249 PolarHBondContact O-N 2.58Å; S246-K250 WeakPolarHBondContact O-CB 3.3Å; S246-K250 WeakPolarHBondContact O-CG 3.41Å; S246-K250 PolarHBondContact O-N 2.69Å; S246-K250 WeakPolarHBondContact OG-CE 3.46Å
247	N	89.1	Confident	86.6	Confident	45 Å²	45	58.5 Å²	58.5	24%	0.241	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-43.5	177.1	-64.2	-17.9	0	0	0	111.3	D241 S243 K244 V245 V249 D251	D241-N247 PolarHBondContact OD2-ND2 2.88Å; S243-N247 PolarHBondContact O-N 3.25Å; S243-N247 PolarHBondContact O-ND2 2.96Å; S243-N247 PolarHBondContact O-OD1 2.86Å; K244-N247 PolarHBondContact O-N 3.27Å; V245-N247 PolarHBondContact O-N 3.4Å; N247-V249 PolarHBondContact O-N 3.25Å; N247-D251 VanDerWaalsContact O-CB 3.27Å; N247-D251 WeakPolarHBondContact O-CB 3.37Å; N247-D251 PolarHBondContact O-N 3.07Å
248	I	90.5	Very high	87.4	Confident	19 Å²	19	54.7 Å²	54.7	10%	0.097	27%	0.27	C	S	.	.	H	α-helix	trans	-59	-47.3	177.5	-72.1	163.5	0	0	0	111.1	K180 Y230 K244 V245 S246 N252 F256	K180-I248 HydrophobicContact CD-CG2 4.07Å; Y230-I248 HydrophobicContact CE2-CD1 4.23Å; K244-I248 HydrophobicContact CG-CD1 3.89Å; K244-I248 WeakPolarHBondContact O-CD1 3.49Å; K244-I248 VanDerWaalsContact O-CG1 3.22Å; K244-I248 WeakPolarHBondContact O-CG1 3.41Å; K244-I248 PolarHBondContact O-N 3.05Å; V245-I248 PolarHBondContact O-N 3.08Å; S246-I248 VanDerWaalsContact C-N 3.34Å; S246-I248 PolarHBondContact O-N 3.47Å; I248-N252 WeakPolarHBondContact O-CB 3.49Å; I248-N252 PolarHBondContact O-N 3.36Å; I248-N252 PolarHBondContact O-ND2 3.46Å; I248-F256 HydrophobicContact CG2-CE2 4.2Å; I248-F256 HydrophobicContact CG2-CZ 4.24Å
249	V	93.1	Very high	88.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-72.1	-51.8	-174.5	174.1	0	0	0	0	111.2	F222 L223 A226 V245 S246 N247 D251 N252 I253 F256	F222-V249 HydrophobicContact CB-CG1 3.67Å; F222-V249 HydrophobicContact CB-CG2 4.32Å; F222-V249 WeakPolarHBondContact O-CG2 3.44Å; L223-V249 HydrophobicContact CD2-CB 3.91Å; L223-V249 HydrophobicContact CD2-CG1 4.26Å; L223-V249 HydrophobicContact CD2-CG2 3.99Å; L223-V249 HydrophobicContact CG-CB 4.42Å; L223-V249 HydrophobicContact CG-CG1 4.26Å; L223-V249 HydrophobicContact CG-CG2 4.46Å; A226-V249 HydrophobicContact CB-CG2 3.68Å; V245-V249 PolarHBondContact O-N 3.36Å; V245-V249 VanDerWaalsContact O-N 3.08Å; S246-V249 PolarHBondContact O-N 2.58Å; N247-V249 PolarHBondContact O-N 3.25Å; V249-D251 VanDerWaalsContact C-N 3.28Å; V249-D251 PolarHBondContact O-N 2.99Å; V249-N252 CarbonylContact O-C 3.57Å; V249-N252 PolarHBondContact O-N 3.45Å; V249-I253 HydrophobicContact CG1-CD1 3.75Å; V249-I253 WeakPolarHBondContact O-CA 3.36Å; V249-I253 PolarHBondContact O-N 3.46Å; V249-F256 HydrophobicContact CG2-CE2 4.14Å; V249-F256 HydrophobicContact CG2-CZ 4.07Å
250	K	90.8	Very high	89.9	Confident	123 Å²	123	51.8 Å²	51.8	54%	0.535	25%	0.253	S	S	.	.	H	α-helix	trans	-58.7	-40.6	-177.4	-71	-174.7	173.2	-173.7	0	112.2	E219 S246 N252	E219-K250 WeakPolarHBondContact OE1-CE 3.32Å; S246-K250 WeakPolarHBondContact O-CB 3.3Å; S246-K250 WeakPolarHBondContact O-CG 3.41Å; S246-K250 PolarHBondContact O-N 2.69Å; S246-K250 WeakPolarHBondContact OG-CE 3.46Å; K250-N252 VanDerWaalsContact C-N 3.28Å; K250-N252 PolarHBondContact O-N 3.15Å
251	D	87.3	Confident	90.7	Very high	44 Å²	44	52.1 Å²	52.1	24%	0.235	26%	0.257	C	S	.	.	H	α-helix	trans	-74.5	-17.2	180	-65.6	-31.8	0	0	0	113.8	Q80 H81 N247 V249	Q80-D251 VanDerWaalsContact CA-OD2 3.31Å; Q80-D251 WeakPolarHBondContact CA-OD2 3.24Å; H81-D251 WeakPolarHBondContact CA-OD1 3.45Å; H81-D251 WeakPolarHBondContact CB-OD1 3.36Å; H81-D251 IonicContact CG-OD1 2.76Å; H81-D251 PolarHBondContact N-OD1 2.92Å; H81-D251 PolarHBondContact N-OD2 3.26Å; H81-D251 IonicContact ND1-OD1 2.68Å; N247-D251 VanDerWaalsContact O-CB 3.27Å; N247-D251 WeakPolarHBondContact O-CB 3.37Å; N247-D251 PolarHBondContact O-N 3.07Å; V249-D251 VanDerWaalsContact C-N 3.28Å; V249-D251 PolarHBondContact O-N 2.99Å
252	N	89.8	Confident	91.5	Very high	18 Å²	18	55.2 Å²	55.2	10%	0.096	27%	0.274	C	S	.	.	H	α-helix	trans	-129.2	19.8	-172.3	-61.6	-84.7	0	0	0	113.2	F78 I248 V249 K250 Q254 H255 F256	F78-N252 WeakPolarHBondContact CB-OD1 3.19Å; F78-N252 WeakPolarHBondContact CD1-OD1 3.23Å; I248-N252 WeakPolarHBondContact O-CB 3.49Å; I248-N252 PolarHBondContact O-N 3.36Å; I248-N252 PolarHBondContact O-ND2 3.46Å; V249-N252 CarbonylContact O-C 3.57Å; V249-N252 PolarHBondContact O-N 3.45Å; K250-N252 VanDerWaalsContact C-N 3.28Å; K250-N252 PolarHBondContact O-N 3.15Å; N252-Q254 PolarHBondContact O-N 3.07Å; N252-Q254 VanDerWaalsContact O-N 3.11Å; N252-H255 HydrophobicContact CB-CB 4.47Å; N252-H255 WeakPolarHBondContact O-CA 3.46Å; N252-H255 WeakPolarHBondContact O-CB 3.2Å; N252-H255 PolarHBondContact O-N 3.34Å; N252-F256 HydrophobicContact CB-CD2 4.26Å; N252-F256 HydrophobicContact CB-CE2 4.28Å; N252-F256 WeakPolarHBondContact O-CD2 3.45Å; N252-F256 PolarHBondContact O-N 3.12Å; N252-F256 VanDerWaalsContact O-N 3.09Å
253	I	92.3	Very high	92.2	Very high	37 Å²	37	48.1 Å²	48.1	19%	0.19	24%	0.243	C	C	.	.	H	α-helix	trans	-53	-40.3	-172	-160.9	80.6	0	0	0	112.4	E219 F222 V249 H255 F256 R257	E219-I253 HydrophobicContact CB-CD1 4.43Å; E219-I253 HydrophobicContact CG-CD1 4.4Å; F222-I253 HydrophobicContact CD2-CD1 3.64Å; F222-I253 HydrophobicContact CD2-CG1 4.35Å; F222-I253 HydrophobicContact CE2-CD1 4.25Å; V249-I253 HydrophobicContact CG1-CD1 3.75Å; V249-I253 WeakPolarHBondContact O-CA 3.36Å; V249-I253 PolarHBondContact O-N 3.46Å; I253-H255 PolarHBondContact O-N 3.06Å; I253-F256 WeakPolarHBondContact O-CB 3.46Å; I253-F256 PolarHBondContact O-N 2.97Å; I253-R257 PolarHBondContact O-N 3.11Å
254	Q	93.2	Very high	92.8	Very high	115 Å²	115	45.9 Å²	45.9	54%	0.537	23%	0.228	S	C	.	.	H	α-helix	trans	-67.7	-35.1	178.9	-59.3	-62.9	23.1	0	0	112.6	N252 R257 I258	N252-Q254 PolarHBondContact O-N 3.07Å; N252-Q254 VanDerWaalsContact O-N 3.11Å; Q254-R257 PolarHBondContact O-N 2.96Å; Q254-I258 WeakPolarHBondContact O-CG1 3.43Å; Q254-I258 PolarHBondContact O-N 3.05Å
255	H	94.3	Very high	93.1	Very high	84 Å²	84	51.7 Å²	51.7	39%	0.389	25%	0.248	S	C	.	.	H	α-helix	trans	-70	-34.3	174.9	-66.7	-57.5	0	0	0	112	P181 N252 I253 L259	P181-H255 HydrophobicContact CB-CB 3.71Å; P181-H255 HydrophobicContact CG-CB 3.53Å; N252-H255 HydrophobicContact CB-CB 4.47Å; N252-H255 WeakPolarHBondContact O-CA 3.46Å; N252-H255 WeakPolarHBondContact O-CB 3.2Å; N252-H255 PolarHBondContact O-N 3.34Å; I253-H255 PolarHBondContact O-N 3.06Å; H255-L259 VanDerWaalsContact O-CB 3.3Å; H255-L259 WeakPolarHBondContact O-CB 3.43Å; H255-L259 PolarHBondContact O-N 3.12Å
256	F	96.1	Very high	93.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.4	-44.9	171	-82.6	-89.5	0	0	0	111.7	K180 P181 F222 A226 I248 V249 N252 I253 I258 L259 Y260	K180-F256 HydrophobicContact CB-CZ 4.15Å; K180-F256 HydrophobicContact CG-CE1 4.24Å; K180-F256 HydrophobicContact CG-CZ 3.89Å; P181-F256 VanDerWaalsContact CD-CE2 3.42Å; P181-F256 VanDerWaalsContact CD-CZ 3.44Å; P181-F256 HydrophobicContact CG-CD2 3.77Å; P181-F256 HydrophobicContact CG-CE2 3.89Å; P181-F256 HydrophobicContact CG-CG 4.15Å; P181-F256 HydrophobicContact CG-CZ 4.37Å; F222-F256 HydrophobicContact CB-CB 4.32Å; F222-F256 HydrophobicContact CB-CD1 3.95Å; F222-F256 HydrophobicContact CB-CE1 4.42Å; F222-F256 HydrophobicContact CB-CG 4.12Å; F222-F256 HydrophobicContact CD1-CB 3.85Å; F222-F256 AromaticContact CD1-CD1 3.96Å; F222-F256 HydrophobicContact CD1-CD1 3.96Å; F222-F256 HydrophobicContact CD1-CG 4.27Å; F222-F256 HydrophobicContact CD2-CB 3.64Å; F222-F256 HydrophobicContact CD2-CG 4.32Å; F222-F256 HydrophobicContact CE1-CB 4.03Å; F222-F256 HydrophobicContact CE2-CB 3.82Å; F222-F256 HydrophobicContact CG-CB 3.66Å; F222-F256 AromaticContact CG-CD1 3.97Å; F222-F256 HydrophobicContact CG-CD1 3.97Å; F222-F256 AromaticContact CG-CG 3.98Å; F222-F256 HydrophobicContact CG-CG 3.98Å; F222-F256 HydrophobicContact CZ-CB 4.01Å; A226-F256 HydrophobicContact CB-CE1 4.44Å; A226-F256 HydrophobicContact CB-CZ 4.16Å; I248-F256 HydrophobicContact CG2-CE2 4.2Å; I248-F256 HydrophobicContact CG2-CZ 4.24Å; V249-F256 HydrophobicContact CG2-CE2 4.14Å; V249-F256 HydrophobicContact CG2-CZ 4.07Å; N252-F256 HydrophobicContact CB-CD2 4.26Å; N252-F256 HydrophobicContact CB-CE2 4.28Å; N252-F256 WeakPolarHBondContact O-CD2 3.45Å; N252-F256 PolarHBondContact O-N 3.12Å; N252-F256 VanDerWaalsContact O-N 3.09Å; I253-F256 WeakPolarHBondContact O-CB 3.46Å; I253-F256 PolarHBondContact O-N 2.97Å; F256-I258 VanDerWaalsContact C-N 3.34Å; F256-I258 PolarHBondContact O-N 3.35Å; F256-L259 WeakPolarHBondContact O-CB 3.35Å; F256-L259 PolarHBondContact O-N 3Å; F256-L259 VanDerWaalsContact O-N 3.12Å; F256-Y260 HydrophobicContact CD1-CD2 4.19Å; F256-Y260 AromaticContact CD1-CE2 3.87Å; F256-Y260 HydrophobicContact CD1-CE2 3.87Å; F256-Y260 HydrophobicContact CE1-CE2 4.43Å; F256-Y260 WeakPolarHBondContact O-CD2 3.35Å; F256-Y260 PolarHBondContact O-N 3.2Å
257	R	95.4	Very high	93.5	Very high	92 Å²	92	55.8 Å²	55.8	35%	0.347	27%	0.267	S	S	.	.	H	α-helix	trans	-56.5	-46.8	174.7	-74.4	-179.2	176.5	140.8	-2.7	112.1	E218 F222 I253 Q254 L259 Y260 S261	E218-R257 IonicContact OE1-NE 3.77Å; E218-R257 IonicContact OE2-CZ 3.65Å; E218-R257 VanDerWaalsContact OE2-CZ 3.27Å; E218-R257 IonicContact OE2-NE 3.56Å; E218-R257 PolarHBondContact OE2-NE 3.23Å; E218-R257 IonicContact OE2-NH2 2.81Å; E218-R257 PolarHBondContact OE2-NH2 3.33Å; F222-R257 HydrophobicContact CE2-CG 3.82Å; F222-R257 HydrophobicContact CZ-CG 4.01Å; I253-R257 PolarHBondContact O-N 3.11Å; Q254-R257 PolarHBondContact O-N 2.96Å; R257-L259 VanDerWaalsContact C-N 3.32Å; R257-L259 PolarHBondContact O-N 3.43Å; R257-Y260 PolarHBondContact O-N 3Å; R257-S261 WeakPolarHBondContact O-CA 3.41Å; R257-S261 WeakPolarHBondContact O-CB 3.22Å; R257-S261 PolarHBondContact O-N 3.03Å; R257-S261 PolarHBondContact O-OG 2.93Å
258	I	94.9	Very high	93.7	Very high	99 Å²	99	59.5 Å²	59.5	51%	0.508	29%	0.294	S	S	.	.	H	α-helix	trans	-59	-47.3	175.9	-67.2	164	0	0	0	110.4	L46 Q254 F256 Y260 S261	L46-I258 HydrophobicContact CD2-CG2 4.33Å; Q254-I258 WeakPolarHBondContact O-CG1 3.43Å; Q254-I258 PolarHBondContact O-N 3.05Å; F256-I258 VanDerWaalsContact C-N 3.34Å; F256-I258 PolarHBondContact O-N 3.35Å; I258-Y260 VanDerWaalsContact C-N 3.35Å; I258-Y260 PolarHBondContact O-N 3.4Å; I258-S261 PolarHBondContact O-OG 3.29Å
259	L	96.6	Very high	93.8	Very high	55 Å²	55	60.4 Å²	60.4	29%	0.288	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-37.7	-176.7	-173.6	60	0	0	0	113.4	L201 H255 F256 R257	L201-L259 HydrophobicContact CD1-CD1 3.62Å; L201-L259 HydrophobicContact CD1-CG 4.1Å; L201-L259 HydrophobicContact CD2-CD1 4.23Å; L201-L259 HydrophobicContact CD2-CD2 4.05Å; L201-L259 HydrophobicContact CD2-CG 4.11Å; H255-L259 VanDerWaalsContact O-CB 3.3Å; H255-L259 WeakPolarHBondContact O-CB 3.43Å; H255-L259 PolarHBondContact O-N 3.12Å; F256-L259 WeakPolarHBondContact O-CB 3.35Å; F256-L259 PolarHBondContact O-N 3Å; F256-L259 VanDerWaalsContact O-N 3.12Å; R257-L259 VanDerWaalsContact C-N 3.32Å; R257-L259 PolarHBondContact O-N 3.43Å
260	Y	97.2	Very high	93.9	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-107.1	-12.8	-172.8	-71.5	-74.7	0	0	0	114.9	H179 L201 V205 F222 I225 F256 R257 I258 N262 I263 L264	H179-Y260 PolarHBondContact O-OH 3.39Å; L201-Y260 HydrophobicContact CB-CE1 3.97Å; L201-Y260 HydrophobicContact CD2-CE1 3.99Å; L201-Y260 WeakPolarHBondContact CD2-OH 3.47Å; V205-Y260 HydrophobicContact CG2-CD1 3.54Å; V205-Y260 HydrophobicContact CG2-CE1 3.71Å; F222-Y260 HydrophobicContact CD1-CD2 4.16Å; F222-Y260 AromaticContact CE1-CD2 3.93Å; F222-Y260 HydrophobicContact CE1-CD2 3.93Å; F222-Y260 HydrophobicContact CE1-CG 4.28Å; I225-Y260 HydrophobicContact CD1-CD1 4.25Å; I225-Y260 HydrophobicContact CD1-CD2 4.43Å; I225-Y260 HydrophobicContact CD1-CE1 3.89Å; I225-Y260 HydrophobicContact CD1-CE2 4.1Å; I225-Y260 HydrophobicContact CG2-CE2 4.08Å; I225-Y260 WeakPolarHBondContact CG2-OH 3.48Å; F256-Y260 HydrophobicContact CD1-CD2 4.19Å; F256-Y260 AromaticContact CD1-CE2 3.87Å; F256-Y260 HydrophobicContact CD1-CE2 3.87Å; F256-Y260 HydrophobicContact CE1-CE2 4.43Å; F256-Y260 WeakPolarHBondContact O-CD2 3.35Å; F256-Y260 PolarHBondContact O-N 3.2Å; R257-Y260 PolarHBondContact O-N 3Å; I258-Y260 VanDerWaalsContact C-N 3.35Å; I258-Y260 PolarHBondContact O-N 3.4Å; Y260-N262 PolarHBondContact O-N 3.13Å; Y260-I263 HydrophobicContact CD1-CD1 4.17Å; Y260-I263 WeakPolarHBondContact O-CB 3.29Å; Y260-I263 PolarHBondContact O-N 2.94Å; Y260-L264 WeakPolarHBondContact O-CG 3.43Å; Y260-L264 PolarHBondContact O-N 3.08Å
261	S	93.7	Very high	94.1	Very high	22 Å²	22	59.2 Å²	59.2	15%	0.154	30%	0.301	C	S	.	.	H	α-helix	trans	-51.6	-50.7	-174	53.3	0	0	0	0	114.1	R257 I258 L264 R265	R257-S261 WeakPolarHBondContact O-CA 3.41Å; R257-S261 WeakPolarHBondContact O-CB 3.22Å; R257-S261 PolarHBondContact O-N 3.03Å; R257-S261 PolarHBondContact O-OG 2.93Å; I258-S261 PolarHBondContact O-OG 3.29Å; S261-L264 PolarHBondContact O-N 3.49Å; S261-R265 VanDerWaalsContact O-CG 3.3Å; S261-R265 WeakPolarHBondContact O-CG 3.22Å; S261-R265 PolarHBondContact O-N 3.14Å
262	N	94.4	Very high	94.4	Very high	88 Å²	88	59 Å²	59	47%	0.471	30%	0.297	S	S	.	.	H	α-helix	trans	-66.5	-40.1	179.4	-65	-17.1	0	0	0	111.3	Y260 L264 R265 D266	Y260-N262 PolarHBondContact O-N 3.13Å; N262-L264 VanDerWaalsContact C-N 3.32Å; N262-L264 PolarHBondContact O-N 3.07Å; N262-R265 PolarHBondContact O-N 2.87Å; N262-D266 WeakPolarHBondContact O-CB 3.41Å; N262-D266 PolarHBondContact O-N 3.46Å
263	I	96.3	Very high	94.5	Very high	20 Å²	20	61.3 Å²	61.3	10%	0.103	31%	0.306	C	S	.	.	H	α-helix	trans	-61.2	-43.5	178	-64.2	171.5	0	0	0	110.6	L201 K202 V205 Y260 C267	L201-I263 HydrophobicContact CB-CD1 3.34Å; L201-I263 HydrophobicContact CD1-CD1 3.99Å; L201-I263 HydrophobicContact CG-CD1 4.32Å; K202-I263 HydrophobicContact CG-CD1 4.43Å; K202-I263 HydrophobicContact CG-CG1 4.42Å; K202-I263 HydrophobicContact CG-CG2 4.01Å; V205-I263 HydrophobicContact CG2-CG2 4.07Å; Y260-I263 HydrophobicContact CD1-CD1 4.17Å; Y260-I263 WeakPolarHBondContact O-CB 3.29Å; Y260-I263 PolarHBondContact O-N 2.94Å; I263-C267 WeakPolarHBondContact O-CB 3.5Å; I263-C267 PolarHBondContact O-N 3.3Å; I263-C267 VanDerWaalsContact O-N 3.11Å
264	L	96.2	Very high	94.1	Very high	3 Å²	3	62.6 Å²	62.6	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-72.8	-32.1	-178.5	-65.4	172.7	0	0	0	113	V205 F209 L221 Y260 S261 N262 Y272 L279	V205-L264 HydrophobicContact CG1-CD2 3.96Å; F209-L264 HydrophobicContact CE1-CD2 4.43Å; F209-L264 HydrophobicContact CZ-CD2 3.95Å; L221-L264 HydrophobicContact CD2-CD1 3.93Å; L221-L264 HydrophobicContact CD2-CD2 3.82Å; L221-L264 HydrophobicContact CD2-CG 4.5Å; Y260-L264 WeakPolarHBondContact O-CG 3.43Å; Y260-L264 PolarHBondContact O-N 3.08Å; S261-L264 PolarHBondContact O-N 3.49Å; N262-L264 VanDerWaalsContact C-N 3.32Å; N262-L264 PolarHBondContact O-N 3.07Å; L264-Y272 HydrophobicContact CB-CD1 3.82Å; L264-Y272 HydrophobicContact CB-CE1 4.2Å; L264-Y272 HydrophobicContact CB-CG 4.33Å; L264-L279 HydrophobicContact CD1-CD2 4.11Å; L264-L279 HydrophobicContact CD2-CD2 3.82Å; L264-L279 HydrophobicContact CG-CD2 4.46Å
265	R	93.6	Very high	93.7	Very high	161 Å²	161	63.4 Å²	63.4	61%	0.608	33%	0.332	S	S	*	.	H	α-helix	trans	-71.8	-36.5	175	-72	174.5	-167.8	155.6	1.3	112.5	S261 N262 Y272	S261-R265 VanDerWaalsContact O-CG 3.3Å; S261-R265 WeakPolarHBondContact O-CG 3.22Å; S261-R265 PolarHBondContact O-N 3.14Å; N262-R265 PolarHBondContact O-N 2.87Å; R265-Y272 HydrophobicContact CG-CD1 4.37Å
266	D	94.3	Very high	93.4	Very high	130 Å²	130	65.5 Å²	65.5	70%	0.695	34%	0.342	S	S	*	.	S	Bend	trans	-92.4	-1.6	-175.2	-57.6	-17.3	0	0	0	112.6	N262 P268	N262-D266 WeakPolarHBondContact O-CB 3.41Å; N262-D266 PolarHBondContact O-N 3.46Å; D266-P268 WeakPolarHBondContact O-CD 3.27Å
267	C	94.1	Very high	93	Very high	16 Å²	16	66.1 Å²	66.1	11%	0.108	35%	0.348	C	S	.	.			trans	-87.3	118	-175.9	179.2	0	0	0	0	111	M206 I263 Q269 V270	M206-C267 VanDerWaalsContact CE-SG 3.52Å; I263-C267 WeakPolarHBondContact O-CB 3.5Å; I263-C267 PolarHBondContact O-N 3.3Å; I263-C267 VanDerWaalsContact O-N 3.11Å; C267-Q269 PolarHBondContact O-N 3.22Å; C267-V270 HydrophobicContact CB-CG1 3.83Å
268	P	93	Very high	93	Very high	124 Å²	124	66.4 Å²	66.4	81%	0.805	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.6	-178.2	29.6	-35.7	0	0	0	113.7	D266 V270	D266-P268 WeakPolarHBondContact O-CD 3.27Å; P268-V270 VanDerWaalsContact C-N 3.33Å
269	Q	92.3	Very high	93.1	Very high	37 Å²	37	61.7 Å²	61.7	17%	0.173	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	3.9	-176	-69.9	161.9	-55.6	0	0	113.3	M206 C267 Q291	M206-Q269 PolarHBondContact SD-OE1 3.28Å; C267-Q269 PolarHBondContact O-N 3.22Å; Q269-Q291 HydrophobicContact CG-CG 4.44Å
270	V	95.6	Very high	93.1	Very high	14 Å²	14	62.3 Å²	62.3	9%	0.085	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	135.2	-179.4	65	0	0	0	0	111.5	F209 C267 P268 L279 E280 V281	F209-V270 HydrophobicContact CE1-CG2 4.45Å; F209-V270 HydrophobicContact CE2-CB 3.64Å; F209-V270 HydrophobicContact CE2-CG1 3.94Å; F209-V270 HydrophobicContact CE2-CG2 4.27Å; F209-V270 HydrophobicContact CZ-CB 3.64Å; F209-V270 HydrophobicContact CZ-CG1 3.82Å; F209-V270 HydrophobicContact CZ-CG2 3.81Å; C267-V270 HydrophobicContact CB-CG1 3.83Å; P268-V270 VanDerWaalsContact C-N 3.33Å; V270-L279 HydrophobicContact CG2-CB 3.83Å; V270-L279 HydrophobicContact CG2-CD2 3.81Å; V270-L279 HydrophobicContact CG2-CG 4.34Å; V270-E280 CarbonylContact C-O 3.4Å; V270-E280 WeakPolarHBondContact CA-O 3.45Å; V270-E280 WeakPolarHBondContact CG2-O 3.48Å; V270-V281 HydrophobicContact CB-CG1 4.07Å; V270-V281 HydrophobicContact CG2-CG1 3.79Å
271	V	95.9	Very high	93.1	Very high	85 Å²	85	62.5 Å²	62.5	52%	0.515	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	99.5	164.7	-178.6	0	0	0	0	107.3	K273 E280	V271-K273 HydrophobicContact CG1-CG 4.43Å; V271-E280 HydrophobicContact CB-CB 4.33Å; V271-E280 PolarHBondContact N-O 3.07Å; V271-E280 PolarHBondContact O-N 3.05Å
272	Y	94.3	Very high	93.1	Very high	40 Å²	40	65.3 Å²	65.3	16%	0.157	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.6	176.9	-179.6	-149.9	0	0	0	110.4	E218 L264 R265 P274 L279	E218-Y272 HydrophobicContact CG-CE2 4.11Å; E218-Y272 PolarHBondContact OE1-OH 3.21Å; L264-Y272 HydrophobicContact CB-CD1 3.82Å; L264-Y272 HydrophobicContact CB-CE1 4.2Å; L264-Y272 HydrophobicContact CB-CG 4.33Å; R265-Y272 HydrophobicContact CG-CD1 4.37Å; Y272-P274 HydrophobicContact CD1-CG 3.92Å; Y272-P274 HydrophobicContact CD2-CG 4.45Å; Y272-P274 HydrophobicContact CE1-CB 4.22Å; Y272-P274 HydrophobicContact CE1-CG 3.72Å; Y272-P274 HydrophobicContact CE2-CB 4.35Å; Y272-P274 HydrophobicContact CE2-CG 4.3Å; Y272-P274 HydrophobicContact CG-CG 4.28Å; Y272-P274 WeakPolarHBondContact O-CD 3.33Å; Y272-L279 HydrophobicContact CD2-CD1 4.48Å; Y272-L279 HydrophobicContact CD2-CD2 4.06Å; Y272-L279 HydrophobicContact CD2-CG 3.85Å; Y272-L279 HydrophobicContact CE2-CG 4.44Å; Y272-L279 HydrophobicContact CG-CD2 4.47Å
273	K	91.8	Very high	93.1	Very high	66 Å²	66	63.6 Å²	63.6	29%	0.287	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	79.9	176.5	-60.3	176.3	-171.5	166.9	0	109.7	V271 P275 Q276 G277 R278 E280	V271-K273 HydrophobicContact CG1-CG 4.43Å; K273-P275 VanDerWaalsContact C-CD 3.45Å; K273-Q276 HydrophobicContact CB-CB 4.39Å; K273-Q276 VanDerWaalsContact CD-OE1 3.31Å; K273-Q276 PolarHBondContact O-N 3.13Å; K273-Q276 VanDerWaalsContact O-N 3.08Å; K273-G277 PolarHBondContact O-N 2.97Å; K273-G277 VanDerWaalsContact O-N 3.1Å; K273-R278 PolarHBondContact N-O 3.31Å; K273-R278 PolarHBondContact O-N 2.91Å; K273-E280 WeakPolarHBondContact CE-OE2 3.48Å; K273-E280 IonicContact NZ-OE1 3.38Å; K273-E280 PolarHBondContact NZ-OE1 3.45Å; K273-E280 IonicContact NZ-OE2 3.31Å; K273-E280 PolarHBondContact NZ-OE2 3.07Å
274	P	83.7	Confident	93.1	Very high	64 Å²	64	64.2 Å²	64.2	42%	0.416	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-54	-42.4	-172.9	-20.2	24.5	0	0	0	115.6	Y272 Q276 G277	Y272-P274 HydrophobicContact CD1-CG 3.92Å; Y272-P274 HydrophobicContact CD2-CG 4.45Å; Y272-P274 HydrophobicContact CE1-CB 4.22Å; Y272-P274 HydrophobicContact CE1-CG 3.72Å; Y272-P274 HydrophobicContact CE2-CB 4.35Å; Y272-P274 HydrophobicContact CE2-CG 4.3Å; Y272-P274 HydrophobicContact CG-CG 4.28Å; Y272-P274 WeakPolarHBondContact O-CD 3.33Å; P274-Q276 PolarHBondContact O-N 3.15Å; P274-Q276 VanDerWaalsContact O-N 3.15Å; P274-G277 PolarHBondContact O-N 2.73Å
275	P	84.4	Confident	93.1	Very high	131 Å²	131	66.5 Å²	66.5	85%	0.851	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-60.7	-27.6	-179.5	-24.2	34.9	0	0	0	113.5	K273	K273-P275 VanDerWaalsContact C-CD 3.45Å
276	Q	87.3	Confident	93.2	Very high	128 Å²	128	64.8 Å²	64.8	60%	0.598	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-97	-11.1	-179.3	-63.8	167.5	-5.2	0	0	112.1	K273 P274 R278	K273-Q276 HydrophobicContact CB-CB 4.39Å; K273-Q276 VanDerWaalsContact CD-OE1 3.31Å; K273-Q276 PolarHBondContact O-N 3.13Å; K273-Q276 VanDerWaalsContact O-N 3.08Å; P274-Q276 PolarHBondContact O-N 3.15Å; P274-Q276 VanDerWaalsContact O-N 3.15Å; Q276-R278 HydrophobicContact CB-CB 4.33Å; Q276-R278 HydrophobicContact CB-CG 4.27Å; Q276-R278 PolarHBondContact O-N 2.67Å
277	G	88.3	Confident	93.3	Very high	13 Å²	13	58.9 Å²	58.9	13%	0.134	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	26.6	-172.6	0	0	0	0	0	113.3	T217 E218 K273 P274	T217-G277 CarbonylContact C-O 3.57Å; T217-G277 VanDerWaalsContact CA-O 3.31Å; T217-G277 WeakPolarHBondContact CA-O 3.24Å; E218-G277 PolarHBondContact N-O 3.08Å; K273-G277 PolarHBondContact O-N 2.97Å; K273-G277 VanDerWaalsContact O-N 3.1Å; P274-G277 PolarHBondContact O-N 2.73Å
278	R	94.8	Very high	93.4	Very high	99 Å²	99	59.1 Å²	59.1	37%	0.374	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	147.8	-177.8	-70.2	-169.3	73.1	88.6	-0.6	111.8	S215 F216 K273 Q276	S215-R278 PolarHBondContact OG-NH2 3.37Å; F216-R278 WeakPolarHBondContact O-CA 3.35Å; K273-R278 PolarHBondContact N-O 3.31Å; K273-R278 PolarHBondContact O-N 2.91Å; Q276-R278 HydrophobicContact CB-CB 4.33Å; Q276-R278 HydrophobicContact CB-CG 4.27Å; Q276-R278 PolarHBondContact O-N 2.67Å
279	L	97.1	Very high	93.6	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	140.3	175.8	-58.8	98.3	0	0	0	108.8	S215 F216 E218 L221 L264 V270 Y272	S215-L279 WeakPolarHBondContact CA-O 3.46Å; S215-L279 PolarHBondContact OG-O 3.11Å; F216-L279 HydrophobicContact CD2-CB 4.04Å; F216-L279 HydrophobicContact CD2-CD1 4.05Å; F216-L279 HydrophobicContact CE2-CB 3.55Å; F216-L279 HydrophobicContact CE2-CD1 3.89Å; F216-L279 HydrophobicContact CE2-CD2 4.17Å; F216-L279 HydrophobicContact CE2-CG 4.06Å; F216-L279 HydrophobicContact CZ-CB 3.81Å; F216-L279 PolarHBondContact N-O 3.21Å; F216-L279 PolarHBondContact O-N 2.83Å; E218-L279 HydrophobicContact CG-CD1 4.08Å; L221-L279 HydrophobicContact CD2-CD2 3.92Å; L264-L279 HydrophobicContact CD1-CD2 4.11Å; L264-L279 HydrophobicContact CD2-CD2 3.82Å; L264-L279 HydrophobicContact CG-CD2 4.46Å; V270-L279 HydrophobicContact CG2-CB 3.83Å; V270-L279 HydrophobicContact CG2-CD2 3.81Å; V270-L279 HydrophobicContact CG2-CG 4.34Å; Y272-L279 HydrophobicContact CD2-CD1 4.48Å; Y272-L279 HydrophobicContact CD2-CD2 4.06Å; Y272-L279 HydrophobicContact CD2-CG 3.85Å; Y272-L279 HydrophobicContact CE2-CG 4.44Å; Y272-L279 HydrophobicContact CG-CD2 4.47Å
280	E	97.1	Very high	93.8	Very high	67 Å²	67	58.2 Å²	58.2	31%	0.313	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.7	173.9	-76.7	159.1	-154	0	0	108.5	E214 S215 V270 V271 K273	E214-E280 CarbonylContact O-C 3.56Å; E214-E280 VanDerWaalsContact O-CA 3.29Å; E214-E280 WeakPolarHBondContact O-CA 3.42Å; S215-E280 WeakPolarHBondContact OG-CG 3.42Å; V270-E280 CarbonylContact C-O 3.4Å; V270-E280 WeakPolarHBondContact CA-O 3.45Å; V270-E280 WeakPolarHBondContact CG2-O 3.48Å; V271-E280 HydrophobicContact CB-CB 4.33Å; V271-E280 PolarHBondContact N-O 3.07Å; V271-E280 PolarHBondContact O-N 3.05Å; K273-E280 WeakPolarHBondContact CE-OE2 3.48Å; K273-E280 IonicContact NZ-OE1 3.38Å; K273-E280 PolarHBondContact NZ-OE1 3.45Å; K273-E280 IonicContact NZ-OE2 3.31Å; K273-E280 PolarHBondContact NZ-OE2 3.07Å
281	V	96.8	Very high	93.8	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.024	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	143	-177	-61.3	0	0	0	0	110	F209 E214 F216 V270 K283	F209-V281 HydrophobicContact CB-CG1 4.15Å; F209-V281 HydrophobicContact CD1-CG1 3.79Å; F209-V281 HydrophobicContact CD2-CG1 3.8Å; F209-V281 HydrophobicContact CE1-CG1 4.02Å; F209-V281 HydrophobicContact CE2-CG1 4.04Å; F209-V281 HydrophobicContact CG-CG1 3.67Å; F209-V281 HydrophobicContact CZ-CG1 4.13Å; E214-V281 WeakPolarHBondContact CG-O 3.44Å; E214-V281 PolarHBondContact O-N 3.38Å; F216-V281 HydrophobicContact CE1-CB 4.41Å; F216-V281 HydrophobicContact CE1-CG1 3.72Å; F216-V281 HydrophobicContact CE1-CG2 3.8Å; F216-V281 HydrophobicContact CZ-CG1 3.72Å; V270-V281 HydrophobicContact CB-CG1 4.07Å; V270-V281 HydrophobicContact CG2-CG1 3.79Å; V281-K283 HydrophobicContact CG2-CD 3.82Å; V281-K283 HydrophobicContact CG2-CG 4.33Å; V281-K283 PolarHBondContact O-N 3.15Å
282	D	93.4	Very high	93.9	Very high	82 Å²	82	53.5 Å²	53.5	44%	0.439	28%	0.277	S	S	.	.			trans	-70.4	121.9	174.8	-176.7	12.4	0	0	0	110.5	S284 Q291	D282-S284 WeakPolarHBondContact OD1-CB 3.48Å; D282-S284 PolarHBondContact OD1-N 2.84Å; D282-S284 PolarHBondContact OD1-OG 3.4Å; D282-S284 PolarHBondContact OD2-OG 3.1Å; D282-Q291 PolarHBondContact O-NE2 3.16Å
283	K	95.3	Very high	94.1	Very high	52 Å²	52	55.1 Å²	55.1	23%	0.226	29%	0.287	C	S	.	.			trans	-106.3	10	176	-57.8	-63.5	-64.9	-157.3	0	112.4	F209 L210 L212 E214 V281 Q288	F209-K283 PolarHBondContact O-NZ 2.89Å; L210-K283 PolarHBondContact O-NZ 3.33Å; L212-K283 PolarHBondContact O-NZ 2.89Å; E214-K283 HydrophobicContact CB-CG 3.97Å; E214-K283 HydrophobicContact CG-CG 4.25Å; V281-K283 HydrophobicContact CG2-CD 3.82Å; V281-K283 HydrophobicContact CG2-CG 4.33Å; V281-K283 PolarHBondContact O-N 3.15Å; K283-Q288 PolarHBondContact O-NE2 3.3Å
284	S	96.2	Very high	94.3	Very high	33 Å²	33	54.3 Å²	54.3	23%	0.231	29%	0.293	C	S	.	.	S	Bend	trans	-56.5	152.8	168.4	70	0	0	0	0	111	D282 E286 G287 Q288	D282-S284 WeakPolarHBondContact OD1-CB 3.48Å; D282-S284 PolarHBondContact OD1-N 2.84Å; D282-S284 PolarHBondContact OD1-OG 3.4Å; D282-S284 PolarHBondContact OD2-OG 3.1Å; S284-E286 PolarHBondContact O-N 3.35Å; S284-G287 PolarHBondContact O-N 3.37Å; S284-G287 PolarHBondContact OG-N 2.68Å; S284-Q288 WeakPolarHBondContact O-CB 3.46Å; S284-Q288 WeakPolarHBondContact O-CG 3.45Å; S284-Q288 PolarHBondContact O-N 3.05Å
285	P	96.6	Very high	95	Very high	51 Å²	51	51.5 Å²	51.5	33%	0.331	27%	0.274	S	S	.	.	H	α-helix	trans	-53	-37.3	173.7	-27.3	36.2	0	0	0	112.7	F289 A324 Q325	P285-F289 WeakPolarHBondContact O-CB 3.23Å; P285-F289 PolarHBondContact O-N 3.11Å; P285-A324 WeakPolarHBondContact O-CB 3.18Å; P285-Q325 HydrophobicContact CB-CG 4.02Å; P285-Q325 HydrophobicContact CG-CG 4.5Å
286	E	95.4	Very high	95.6	Very high	125 Å²	125	45.5 Å²	45.5	58%	0.584	24%	0.235	S	C	*	.	H	α-helix	trans	-65.7	-49.4	177.6	-63.3	69.6	-151.6	0	0	111.2	S284 Q288 F289 I290	S284-E286 PolarHBondContact O-N 3.35Å; E286-Q288 PolarHBondContact O-N 3.32Å; E286-F289 PolarHBondContact O-N 3.38Å; E286-I290 WeakPolarHBondContact O-CG1 3.35Å; E286-I290 PolarHBondContact O-N 3.4Å; E286-I290 VanDerWaalsContact O-N 3.08Å
287	G	95.2	Very high	96.1	Very high	5 Å²	5	47.3 Å²	47.3	5%	0.052	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-42.8	177.6	0	0	0	0	0	112.3	S284 Q291	S284-G287 PolarHBondContact O-N 3.37Å; S284-G287 PolarHBondContact OG-N 2.68Å; G287-Q291 VanDerWaalsContact O-CG 3.32Å; G287-Q291 WeakPolarHBondContact O-CG 3.29Å; G287-Q291 PolarHBondContact O-N 2.97Å; G287-Q291 VanDerWaalsContact O-N 3.14Å
288	Q	97.1	Very high	96.6	Very high	22 Å²	22	47.8 Å²	47.8	10%	0.103	24%	0.237	C	C	.	.	H	α-helix	trans	-65.9	-41.2	176.5	-70.1	-166.1	55	0	0	112.1	L210 K283 S284 E286 I290 Q291 L292 A324 C329	L210-Q288 HydrophobicContact CD2-CB 4.13Å; L210-Q288 HydrophobicContact CD2-CG 4.23Å; K283-Q288 PolarHBondContact O-NE2 3.3Å; S284-Q288 WeakPolarHBondContact O-CB 3.46Å; S284-Q288 WeakPolarHBondContact O-CG 3.45Å; S284-Q288 PolarHBondContact O-N 3.05Å; E286-Q288 PolarHBondContact O-N 3.32Å; Q288-I290 PolarHBondContact O-N 3.29Å; Q288-Q291 PolarHBondContact O-N 3.27Å; Q288-L292 WeakPolarHBondContact O-CB 3.36Å; Q288-L292 VanDerWaalsContact O-CG 3.29Å; Q288-L292 WeakPolarHBondContact O-CG 3.42Å; Q288-L292 PolarHBondContact O-N 3.33Å; Q288-A324 HydrophobicContact CB-CB 4.05Å; Q288-C329 PolarHBondContact OE1-SG 3.3Å
289	F	97.4	Very high	96.7	Very high	39 Å²	39	43 Å²	43	17%	0.171	22%	0.219	C	C	.	.	H	α-helix	trans	-61.7	-44.7	177.7	177	-115.4	0	0	0	111.9	P285 E286 Q291 L292 M293 E317 L320 L321 A324	P285-F289 WeakPolarHBondContact O-CB 3.23Å; P285-F289 PolarHBondContact O-N 3.11Å; E286-F289 PolarHBondContact O-N 3.38Å; F289-Q291 VanDerWaalsContact C-N 3.31Å; F289-Q291 PolarHBondContact O-N 3.38Å; F289-L292 PolarHBondContact O-N 3.24Å; F289-M293 HydrophobicContact CD2-CG 4.15Å; F289-M293 HydrophobicContact CE1-CG 4.23Å; F289-M293 HydrophobicContact CE2-CG 3.76Å; F289-M293 HydrophobicContact CE2-SD 4.05Å; F289-M293 HydrophobicContact CZ-CG 3.82Å; F289-M293 HydrophobicContact CZ-SD 4.21Å; F289-M293 WeakPolarHBondContact O-CG 3.47Å; F289-M293 PolarHBondContact O-N 3.43Å; F289-E317 HydrophobicContact CE2-CG 4.02Å; F289-E317 WeakPolarHBondContact CE2-O 3.48Å; F289-E317 HydrophobicContact CZ-CG 3.53Å; F289-L320 HydrophobicContact CD2-CB 4.31Å; F289-L320 HydrophobicContact CE2-CB 4.19Å; F289-L321 HydrophobicContact CB-CD1 4.4Å; F289-L321 HydrophobicContact CD1-CD1 4.36Å; F289-L321 HydrophobicContact CD2-CB 3.96Å; F289-L321 HydrophobicContact CD2-CD1 4.07Å; F289-L321 HydrophobicContact CE2-CB 3.84Å; F289-L321 HydrophobicContact CE2-CD1 4.42Å; F289-L321 HydrophobicContact CG-CD1 4.02Å; F289-A324 HydrophobicContact CB-CB 3.72Å
290	I	96.1	Very high	96.7	Very high	102 Å²	102	44.5 Å²	44.5	52%	0.523	23%	0.226	S	C	.	.	H	α-helix	trans	-60.7	-42.7	175.6	-61	165.9	0	0	0	110.6	E286 Q288 M293 A294	E286-I290 WeakPolarHBondContact O-CG1 3.35Å; E286-I290 PolarHBondContact O-N 3.4Å; E286-I290 VanDerWaalsContact O-N 3.08Å; Q288-I290 PolarHBondContact O-N 3.29Å; I290-M293 PolarHBondContact O-N 3.02Å; I290-A294 PolarHBondContact O-N 3.25Å; I290-A294 VanDerWaalsContact O-N 3.15Å
291	Q	96.7	Very high	96.6	Very high	1 Å²	1	45 Å²	45	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-64.1	-42.4	177.1	-70	172	40	0	0	111.8	M206 L210 Q269 D282 G287 Q288 F289 A294 L295	M206-Q291 HydrophobicContact SD-CG 4.16Å; L210-Q291 HydrophobicContact CD1-CB 4.06Å; L210-Q291 HydrophobicContact CD2-CB 3.77Å; L210-Q291 HydrophobicContact CG-CB 3.87Å; Q269-Q291 HydrophobicContact CG-CG 4.44Å; D282-Q291 PolarHBondContact O-NE2 3.16Å; G287-Q291 VanDerWaalsContact O-CG 3.32Å; G287-Q291 WeakPolarHBondContact O-CG 3.29Å; G287-Q291 PolarHBondContact O-N 2.97Å; G287-Q291 VanDerWaalsContact O-N 3.14Å; Q288-Q291 PolarHBondContact O-N 3.27Å; F289-Q291 VanDerWaalsContact C-N 3.31Å; F289-Q291 PolarHBondContact O-N 3.38Å; Q291-A294 PolarHBondContact O-N 3.42Å; Q291-L295 PolarHBondContact O-N 3.02Å
292	L	97.8	Very high	96.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.2	-44.1	177.1	-75.8	165.4	0	0	0	111.8	L210 Q288 F289 A294 L295 Q300 I303 L320 V323 A324 V333	L210-L292 HydrophobicContact CD1-CD2 3.79Å; L210-L292 HydrophobicContact CD1-CG 4.02Å; L210-L292 HydrophobicContact CD2-CG 4.19Å; Q288-L292 WeakPolarHBondContact O-CB 3.36Å; Q288-L292 VanDerWaalsContact O-CG 3.29Å; Q288-L292 WeakPolarHBondContact O-CG 3.42Å; Q288-L292 PolarHBondContact O-N 3.33Å; F289-L292 PolarHBondContact O-N 3.24Å; L292-A294 PolarHBondContact O-N 3.25Å; L292-L295 HydrophobicContact CD2-CD1 3.92Å; L292-L295 VanDerWaalsContact O-CB 3.3Å; L292-L295 WeakPolarHBondContact O-CB 3.39Å; L292-L295 WeakPolarHBondContact O-CG 3.27Å; L292-L295 PolarHBondContact O-N 3.3Å; L292-L295 VanDerWaalsContact O-N 3.09Å; L292-Q300 PolarHBondContact O-NE2 3.48Å; L292-I303 HydrophobicContact CD2-CD1 4.15Å; L292-L320 HydrophobicContact CB-CB 4.36Å; L292-L320 HydrophobicContact CB-CD1 4.44Å; L292-L320 HydrophobicContact CB-CD2 4.29Å; L292-L320 WeakPolarHBondContact CD1-O 3.35Å; L292-L320 HydrophobicContact CD2-CD2 4.33Å; L292-V323 HydrophobicContact CD1-CB 4.2Å; L292-V323 HydrophobicContact CD1-CG1 3.95Å; L292-V323 HydrophobicContact CD2-CG1 4.31Å; L292-A324 HydrophobicContact CD1-CB 3.87Å; L292-V333 HydrophobicContact CD2-CG2 3.88Å
293	M	97	Very high	96.6	Very high	74 Å²	74	45.3 Å²	45.3	37%	0.365	22%	0.222	S	C	.	.	H	α-helix	trans	-65.5	-25.1	176.8	-71.3	-63	-74.5	0	0	112.8	F289 I290 L295 Q300 E317 L320	F289-M293 HydrophobicContact CD2-CG 4.15Å; F289-M293 HydrophobicContact CE1-CG 4.23Å; F289-M293 HydrophobicContact CE2-CG 3.76Å; F289-M293 HydrophobicContact CE2-SD 4.05Å; F289-M293 HydrophobicContact CZ-CG 3.82Å; F289-M293 HydrophobicContact CZ-SD 4.21Å; F289-M293 WeakPolarHBondContact O-CG 3.47Å; F289-M293 PolarHBondContact O-N 3.43Å; I290-M293 PolarHBondContact O-N 3.02Å; M293-L295 VanDerWaalsContact C-N 3.35Å; M293-Q300 PolarHBondContact O-NE2 2.99Å; M293-E317 HydrophobicContact CE-CB 4.41Å; M293-E317 HydrophobicContact CE-CG 4.03Å; M293-E317 HydrophobicContact SD-CG 4.21Å; M293-L320 HydrophobicContact SD-CB 4.49Å; M293-L320 HydrophobicContact SD-CD1 3.66Å
294	A	96.1	Very high	96.5	Very high	49 Å²	49	43.6 Å²	43.6	41%	0.405	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-7.2	174.8	0	0	0	0	0	114	M206 I290 Q291 L292	M206-A294 HydrophobicContact CG-CB 4.3Å; I290-A294 PolarHBondContact O-N 3.25Å; I290-A294 VanDerWaalsContact O-N 3.15Å; Q291-A294 PolarHBondContact O-N 3.42Å; L292-A294 PolarHBondContact O-N 3.25Å
295	L	98.2	Very high	96.2	Very high	5 Å²	5	49 Å²	49	3%	0.026	24%	0.236	C	C	.	.	S	Bend	trans	-69.8	153.3	178.4	-64.9	178.8	0	0	0	111.8	M206 A207 L210 Q291 L292 M293 L299 Q300 I303 V333	M206-L295 HydrophobicContact CB-CD2 4.12Å; A207-L295 HydrophobicContact CB-CD2 3.87Å; L210-L295 HydrophobicContact CD1-CD1 3.76Å; L210-L295 HydrophobicContact CD1-CD2 4.15Å; L210-L295 HydrophobicContact CD1-CG 4.14Å; Q291-L295 PolarHBondContact O-N 3.02Å; L292-L295 HydrophobicContact CD2-CD1 3.92Å; L292-L295 VanDerWaalsContact O-CB 3.3Å; L292-L295 WeakPolarHBondContact O-CB 3.39Å; L292-L295 WeakPolarHBondContact O-CG 3.27Å; L292-L295 PolarHBondContact O-N 3.3Å; L292-L295 VanDerWaalsContact O-N 3.09Å; M293-L295 VanDerWaalsContact C-N 3.35Å; L295-L299 HydrophobicContact CB-CD2 4.33Å; L295-L299 HydrophobicContact CD1-CD2 3.82Å; L295-L299 HydrophobicContact CD1-CG 4.13Å; L295-L299 HydrophobicContact CD2-CD2 4.18Å; L295-L299 HydrophobicContact CG-CD2 4.34Å; L295-Q300 HydrophobicContact CB-CG 4.12Å; L295-Q300 PolarHBondContact O-NE2 3.26Å; L295-I303 HydrophobicContact CD1-CD1 3.9Å; L295-V333 HydrophobicContact CD1-CG2 4.41Å
296	P	98.4	Very high	95.9	Very high	5 Å²	5	49.8 Å²	49.8	3%	0.032	24%	0.237	C	C	.	.			trans	-59.8	143.1	175.4	-30.6	42.2	0	0	0	112.7	H168 W169 S203 T298 L299 Q300	H168-P296 WeakPolarHBondContact O-CB 3.5Å; W169-P296 HydrophobicContact CB-CB 3.97Å; W169-P296 HydrophobicContact CB-CG 4.43Å; W169-P296 HydrophobicContact CD2-CB 4.01Å; W169-P296 HydrophobicContact CD2-CG 3.52Å; W169-P296 HydrophobicContact CE3-CB 4.37Å; W169-P296 HydrophobicContact CE3-CG 3.92Å; W169-P296 HydrophobicContact CG-CB 3.81Å; W169-P296 HydrophobicContact CG-CG 3.74Å; W169-P296 HydrophobicContact CZ2-CG 4.19Å; W169-P296 HydrophobicContact CZ3-CG 4.4Å; S203-P296 WeakPolarHBondContact OG-CG 3.27Å; P296-T298 VanDerWaalsContact C-N 3.28Å; P296-T298 PolarHBondContact O-N 3.28Å; P296-T298 VanDerWaalsContact O-N 3.12Å; P296-L299 WeakPolarHBondContact O-CA 3.39Å; P296-L299 WeakPolarHBondContact O-CB 3.48Å; P296-L299 PolarHBondContact O-N 3.11Å; P296-Q300 PolarHBondContact O-N 2.87Å; P296-Q300 VanDerWaalsContact O-N 3.13Å
297	R	97.3	Very high	95.4	Very high	165 Å²	165	45.2 Å²	45.2	62%	0.623	22%	0.217	S	C	*	.	H	α-helix	trans	-50.6	-42.7	-173.3	-176.1	-177.5	-179.8	-171.8	2.6	113.7	L299 Q300 Q301	R297-L299 VanDerWaalsContact C-N 3.28Å; R297-L299 PolarHBondContact O-N 3.02Å; R297-Q300 PolarHBondContact O-N 2.67Å; R297-Q301 HydrophobicContact CG-CG 4.45Å; R297-Q301 VanDerWaalsContact O-CG 3.27Å; R297-Q301 WeakPolarHBondContact O-CG 3.49Å; R297-Q301 PolarHBondContact O-N 3Å
298	T	97.8	Very high	94.7	Very high	23 Å²	23	47 Å²	47	14%	0.141	23%	0.225	C	C	.	.	H	α-helix	trans	-63.9	-36.8	179.9	-58.4	0	0	0	0	111.2	H168 P296 Q301 R302 I340	H168-T298 WeakPolarHBondContact O-CB 3.3Å; H168-T298 PolarHBondContact O-N 3.22Å; H168-T298 VanDerWaalsContact O-N 3.15Å; H168-T298 PolarHBondContact O-OG1 3.31Å; P296-T298 VanDerWaalsContact C-N 3.28Å; P296-T298 PolarHBondContact O-N 3.28Å; P296-T298 VanDerWaalsContact O-N 3.12Å; T298-Q301 PolarHBondContact O-N 3.18Å; T298-R302 VanDerWaalsContact O-CG 3.26Å; T298-R302 WeakPolarHBondContact O-CG 3.25Å; T298-R302 PolarHBondContact O-N 3.33Å; T298-I340 HydrophobicContact CG2-CD1 3.92Å; T298-I340 HydrophobicContact CG2-CG1 4.18Å
299	L	98	Very high	93.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-68.7	-45.1	176.7	179.5	54.3	0	0	0	111.8	W169 L295 P296 R297 Q301 R302 I303 V333 I337 I340	W169-L299 HydrophobicContact CE3-CB 4.3Å; W169-L299 HydrophobicContact CE3-CD2 3.92Å; W169-L299 HydrophobicContact CZ3-CD2 3.6Å; L295-L299 HydrophobicContact CB-CD2 4.33Å; L295-L299 HydrophobicContact CD1-CD2 3.82Å; L295-L299 HydrophobicContact CD1-CG 4.13Å; L295-L299 HydrophobicContact CD2-CD2 4.18Å; L295-L299 HydrophobicContact CG-CD2 4.34Å; P296-L299 WeakPolarHBondContact O-CA 3.39Å; P296-L299 WeakPolarHBondContact O-CB 3.48Å; P296-L299 PolarHBondContact O-N 3.11Å; R297-L299 VanDerWaalsContact C-N 3.28Å; R297-L299 PolarHBondContact O-N 3.02Å; L299-Q301 VanDerWaalsContact C-N 3.29Å; L299-Q301 PolarHBondContact O-N 2.65Å; L299-R302 PolarHBondContact O-N 3.33Å; L299-I303 HydrophobicContact CD1-CD1 4.01Å; L299-I303 HydrophobicContact CD1-CG1 4.09Å; L299-I303 HydrophobicContact CG-CD1 3.91Å; L299-I303 HydrophobicContact CG-CG1 4.47Å; L299-I303 WeakPolarHBondContact O-CG1 3.07Å; L299-I303 PolarHBondContact O-N 2.84Å; L299-V333 HydrophobicContact CD2-CG1 4.36Å; L299-I337 HydrophobicContact CD1-CG1 3.65Å; L299-I337 HydrophobicContact CD2-CD1 3.99Å; L299-I337 HydrophobicContact CD2-CG1 3.67Å; L299-I337 HydrophobicContact CG-CG1 4.34Å; L299-I340 HydrophobicContact CB-CD1 4.24Å; L299-I340 HydrophobicContact CD1-CD1 4.38Å
300	Q	97.4	Very high	91.6	Very high	31 Å²	31	56 Å²	56	15%	0.145	28%	0.283	C	S	.	.	H	α-helix	trans	-53.5	-48.5	173.9	-63.9	-177.8	5.6	0	0	111	L292 M293 L295 P296 R297 R302 I303 T304 V316 L320	L292-Q300 PolarHBondContact O-NE2 3.48Å; M293-Q300 PolarHBondContact O-NE2 2.99Å; L295-Q300 HydrophobicContact CB-CG 4.12Å; L295-Q300 PolarHBondContact O-NE2 3.26Å; P296-Q300 PolarHBondContact O-N 2.87Å; P296-Q300 VanDerWaalsContact O-N 3.13Å; R297-Q300 PolarHBondContact O-N 2.67Å; Q300-R302 VanDerWaalsContact C-N 3.31Å; Q300-R302 PolarHBondContact O-N 3.07Å; Q300-I303 PolarHBondContact O-N 3.35Å; Q300-T304 WeakPolarHBondContact O-CB 3.42Å; Q300-T304 PolarHBondContact O-N 2.86Å; Q300-T304 PolarHBondContact O-OG1 3.44Å; Q300-T304 VanDerWaalsContact O-OG1 3.11Å; Q300-V316 HydrophobicContact CB-CG1 4.25Å; Q300-L320 HydrophobicContact CB-CD1 4.28Å; Q300-L320 HydrophobicContact CG-CD1 4Å
301	Q	94.8	Very high	89.9	Confident	77 Å²	77	55 Å²	55	36%	0.36	30%	0.298	S	S	.	.	H	α-helix	trans	-61.6	-35	177.4	-71.2	172.7	-19.5	0	0	113.5	R297 T298 L299 K305	R297-Q301 HydrophobicContact CG-CG 4.45Å; R297-Q301 VanDerWaalsContact O-CG 3.27Å; R297-Q301 WeakPolarHBondContact O-CG 3.49Å; R297-Q301 PolarHBondContact O-N 3Å; T298-Q301 PolarHBondContact O-N 3.18Å; L299-Q301 VanDerWaalsContact C-N 3.29Å; L299-Q301 PolarHBondContact O-N 2.65Å; Q301-K305 VanDerWaalsContact O-CG 3.29Å; Q301-K305 WeakPolarHBondContact O-CG 3.4Å; Q301-K305 PolarHBondContact O-N 3.3Å; Q301-K305 VanDerWaalsContact O-N 3.11Å
302	R	95.3	Very high	88.3	Confident	92 Å²	92	60.7 Å²	60.7	35%	0.347	32%	0.323	S	S	.	.	H	α-helix	trans	-70.4	-42.7	176	-69.2	-63.2	-179.2	179.1	-0.7	111.2	T298 L299 Q300 K305 L306 S339 I340	T298-R302 VanDerWaalsContact O-CG 3.26Å; T298-R302 WeakPolarHBondContact O-CG 3.25Å; T298-R302 PolarHBondContact O-N 3.33Å; L299-R302 PolarHBondContact O-N 3.33Å; Q300-R302 VanDerWaalsContact C-N 3.31Å; Q300-R302 PolarHBondContact O-N 3.07Å; R302-K305 PolarHBondContact O-N 3Å; R302-L306 WeakPolarHBondContact O-CG 3.33Å; R302-L306 PolarHBondContact O-N 3.17Å; R302-S339 WeakPolarHBondContact CD-OG 3.3Å; R302-I340 HydrophobicContact CG-CD1 4.14Å; R302-I340 HydrophobicContact CG-CG1 3.81Å
303	I	95.2	Very high	86.8	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-60.4	-49.5	175.3	-67.1	166	0	0	0	109.6	L292 L295 L299 Q300 K305 L306 V307 L320 V323 V333	L292-I303 HydrophobicContact CD2-CD1 4.15Å; L295-I303 HydrophobicContact CD1-CD1 3.9Å; L299-I303 HydrophobicContact CD1-CD1 4.01Å; L299-I303 HydrophobicContact CD1-CG1 4.09Å; L299-I303 HydrophobicContact CG-CD1 3.91Å; L299-I303 HydrophobicContact CG-CG1 4.47Å; L299-I303 WeakPolarHBondContact O-CG1 3.07Å; L299-I303 PolarHBondContact O-N 2.84Å; Q300-I303 PolarHBondContact O-N 3.35Å; I303-K305 VanDerWaalsContact C-N 3.31Å; I303-K305 PolarHBondContact O-N 3.06Å; I303-L306 WeakPolarHBondContact O-CB 3.39Å; I303-L306 PolarHBondContact O-N 3.02Å; I303-V307 PolarHBondContact O-N 3.24Å; I303-L320 HydrophobicContact CG2-CD2 4.06Å; I303-V323 HydrophobicContact CG2-CG1 4.16Å; I303-V323 HydrophobicContact CG2-CG2 3.9Å; I303-V333 HydrophobicContact CD1-CB 4.47Å; I303-V333 HydrophobicContact CD1-CG2 3.9Å
304	T	92.6	Very high	85.7	Confident	17 Å²	17	67.7 Å²	67.7	10%	0.104	36%	0.358	C	S	.	.	H	α-helix	trans	-52.5	-47.2	175.7	-66.1	0	0	0	0	112.2	Q300 L306 V307 D308 I319	Q300-T304 WeakPolarHBondContact O-CB 3.42Å; Q300-T304 PolarHBondContact O-N 2.86Å; Q300-T304 PolarHBondContact O-OG1 3.44Å; Q300-T304 VanDerWaalsContact O-OG1 3.11Å; T304-L306 PolarHBondContact O-N 3.24Å; T304-V307 PolarHBondContact O-N 3.14Å; T304-V307 VanDerWaalsContact O-N 3.11Å; T304-D308 HydrophobicContact CG2-CB 4.44Å; T304-D308 VanDerWaalsContact O-CB 3.3Å; T304-D308 WeakPolarHBondContact O-CB 3.39Å; T304-D308 PolarHBondContact O-N 3.01Å; T304-I319 HydrophobicContact CG2-CD1 3.41Å; T304-I319 VanDerWaalsContact CG2-CD1 3.41Å; T304-I319 HydrophobicContact CG2-CG2 4.49Å
305	K	90.9	Very high	85.2	Confident	146 Å²	146	71.1 Å²	71.1	64%	0.635	37%	0.369	S	S	*	.	H	α-helix	trans	-65.1	-18.9	178.7	-75.4	177.1	-178.7	-174.6	0	114.8	Q301 R302 I303	Q301-K305 VanDerWaalsContact O-CG 3.29Å; Q301-K305 WeakPolarHBondContact O-CG 3.4Å; Q301-K305 PolarHBondContact O-N 3.3Å; Q301-K305 VanDerWaalsContact O-N 3.11Å; R302-K305 PolarHBondContact O-N 3Å; I303-K305 VanDerWaalsContact C-N 3.31Å; I303-K305 PolarHBondContact O-N 3.06Å
306	L	89.8	Confident	84.7	Confident	68 Å²	68	73.6 Å²	73.6	36%	0.356	39%	0.385	S	S	.	.	H	α-helix	trans	-81.3	-28.9	175.2	-65.5	170.8	0	0	0	111.9	R302 I303 T304 M332 Q335	R302-L306 WeakPolarHBondContact O-CG 3.33Å; R302-L306 PolarHBondContact O-N 3.17Å; I303-L306 WeakPolarHBondContact O-CB 3.39Å; I303-L306 PolarHBondContact O-N 3.02Å; T304-L306 PolarHBondContact O-N 3.24Å; L306-M332 HydrophobicContact CB-CE 3.66Å; L306-Q335 HydrophobicContact CD1-CB 3.78Å; L306-Q335 HydrophobicContact CD1-CG 3.7Å; L306-Q335 HydrophobicContact CD2-CG 4.04Å
307	V	85.4	Confident	84.4	Confident	28 Å²	28	78.8 Å²	78.8	17%	0.17	41%	0.408	C	S	.	.	H	α-helix	trans	-97.4	-34.2	-174.8	-177.1	0	0	0	0	111.7	I303 T304 L309 I319 V323 M332	I303-V307 PolarHBondContact O-N 3.24Å; T304-V307 PolarHBondContact O-N 3.14Å; T304-V307 VanDerWaalsContact O-N 3.11Å; V307-L309 PolarHBondContact O-N 3.34Å; V307-I319 HydrophobicContact CB-CG2 3.86Å; V307-I319 HydrophobicContact CG1-CG2 3.96Å; V307-I319 HydrophobicContact CG2-CG2 4.31Å; V307-V323 HydrophobicContact CG2-CG2 3.51Å; V307-M332 HydrophobicContact CG2-CE 3.32Å
308	D	80.1	Confident	84.1	Confident	42 Å²	42	76 Å²	76	23%	0.225	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-78.7	128.1	-170.1	-151.9	22	0	0	0	112.1	T304 R314 I319	T304-D308 HydrophobicContact CG2-CB 4.44Å; T304-D308 VanDerWaalsContact O-CB 3.3Å; T304-D308 WeakPolarHBondContact O-CB 3.39Å; T304-D308 PolarHBondContact O-N 3.01Å; D308-R314 IonicContact OD1-CZ 3.1Å; D308-R314 IonicContact OD1-NE 2.74Å; D308-R314 PolarHBondContact OD1-NE 3.26Å; D308-R314 VanDerWaalsContact OD1-NE 3.1Å; D308-R314 IonicContact OD1-NH2 2.84Å; D308-R314 PolarHBondContact OD1-NH2 3.26Å; D308-I319 HydrophobicContact CB-CD1 4.05Å
309	L	67.9	Low	83.9	Confident	118 Å²	118	74.9 Å²	74.9	62%	0.618	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-80	144.4	177.1	-69.3	166.4	0	0	0	109.2	V307 G311 K312	V307-L309 PolarHBondContact O-N 3.34Å; L309-G311 PolarHBondContact O-N 3.02Å; L309-K312 PolarHBondContact O-N 3.38Å
310	P	60.3	Low	83.8	Confident	133 Å²	133	74.9 Å²	74.9	86%	0.864	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	125.4	177.2	-21.4	30.5	0	0	0	111.4
311	G	60.8	Low	83.7	Confident	81 Å²	81	77 Å²	77	84%	0.835	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.9	-3.4	172.8	0	0	0	0	0	116.4	L309	L309-G311 PolarHBondContact O-N 3.02Å
312	K	62.9	Low	83.6	Confident	121 Å²	121	77.6 Å²	77.6	53%	0.526	41%	0.41	S	S	.	.			trans	-98.9	125	165.8	-73.3	-172.1	176.2	-175.6	0	108.8	L309 R314	L309-K312 PolarHBondContact O-N 3.38Å; K312-R314 VanDerWaalsContact C-N 3.34Å; K312-R314 HydrophobicContact CB-CG 4.27Å; K312-R314 PolarHBondContact O-N 2.93Å
313	N	66.1	Low	83.6	Confident	170 Å²	170	73.3 Å²	73.3	91%	0.909	39%	0.394	S	S	*	.			trans	-96.3	66.1	170.7	-72.7	-33.9	0	0	0	108.3
314	R	74.6	Confident	83.7	Confident	50 Å²	50	73.4 Å²	73.4	19%	0.189	40%	0.395	C	S	.	.			trans	-77.5	147.3	179.7	-78.9	-179	-65.6	166.8	4.4	110.8	D308 K312 I319	D308-R314 IonicContact OD1-CZ 3.1Å; D308-R314 IonicContact OD1-NE 2.74Å; D308-R314 PolarHBondContact OD1-NE 3.26Å; D308-R314 VanDerWaalsContact OD1-NE 3.1Å; D308-R314 IonicContact OD1-NH2 2.84Å; D308-R314 PolarHBondContact OD1-NH2 3.26Å; K312-R314 VanDerWaalsContact C-N 3.34Å; K312-R314 HydrophobicContact CB-CG 4.27Å; K312-R314 PolarHBondContact O-N 2.93Å; R314-I319 HydrophobicContact CB-CD1 3.79Å; R314-I319 HydrophobicContact CB-CG1 3.81Å
315	D	85.8	Confident	83.8	Confident	122 Å²	122	78.6 Å²	78.6	65%	0.652	42%	0.418	S	S	*	.			trans	-65.7	143.1	176.7	-74.2	-39.1	0	0	0	110.3	E317 E318 I319	D315-E317 PolarHBondContact O-N 3.25Å; D315-E318 PolarHBondContact O-N 3.4Å; D315-E318 VanDerWaalsContact O-N 3.14Å; D315-I319 PolarHBondContact O-N 3.05Å; D315-I319 VanDerWaalsContact O-N 3.16Å
316	V	88.6	Confident	84	Confident	57 Å²	57	74.4 Å²	74.4	35%	0.345	40%	0.403	S	S	.	.	H	α-helix	trans	-55.5	-39.6	-179.8	173.4	0	0	0	0	110.5	Q300 I319 L320	Q300-V316 HydrophobicContact CB-CG1 4.25Å; V316-I319 PolarHBondContact O-N 3.4Å; V316-L320 HydrophobicContact CG1-CD1 3.79Å; V316-L320 HydrophobicContact CG1-CG 4.1Å; V316-L320 WeakPolarHBondContact O-CB 3.43Å; V316-L320 VanDerWaalsContact O-CG 3.26Å; V316-L320 WeakPolarHBondContact O-CG 3.46Å; V316-L320 PolarHBondContact O-N 2.89Å
317	E	91.4	Very high	84.1	Confident	114 Å²	114	77.3 Å²	77.3	53%	0.533	43%	0.426	S	S	.	.	H	α-helix	trans	-60.9	-46.7	178.9	-167.7	174.3	174.2	0	0	112.4	F289 M293 D315 I319 L320 L321	F289-E317 HydrophobicContact CE2-CG 4.02Å; F289-E317 WeakPolarHBondContact CE2-O 3.48Å; F289-E317 HydrophobicContact CZ-CG 3.53Å; M293-E317 HydrophobicContact CE-CB 4.41Å; M293-E317 HydrophobicContact CE-CG 4.03Å; M293-E317 HydrophobicContact SD-CG 4.21Å; D315-E317 PolarHBondContact O-N 3.25Å; E317-I319 VanDerWaalsContact C-N 3.32Å; E317-I319 PolarHBondContact O-N 2.82Å; E317-L320 PolarHBondContact O-N 3.43Å; E317-L321 WeakPolarHBondContact O-CB 3.16Å; E317-L321 PolarHBondContact O-N 3.02Å
318	E	91.5	Very high	84.4	Confident	105 Å²	105	81.2 Å²	81.2	49%	0.491	45%	0.445	S	S	.	.	H	α-helix	trans	-60.6	-43	177.7	-171.5	-166.5	159	0	0	111.2	D315 L321 Q322	D315-E318 PolarHBondContact O-N 3.4Å; D315-E318 VanDerWaalsContact O-N 3.14Å; E318-L321 PolarHBondContact O-N 2.88Å; E318-Q322 PolarHBondContact O-N 3.39Å
319	I	92.7	Very high	85.2	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-68.6	-40.8	179.4	-61.4	172.5	0	0	0	110.8	T304 V307 D308 R314 D315 V316 E317 L321 Q322 V323	T304-I319 HydrophobicContact CG2-CD1 3.41Å; T304-I319 VanDerWaalsContact CG2-CD1 3.41Å; T304-I319 HydrophobicContact CG2-CG2 4.49Å; V307-I319 HydrophobicContact CB-CG2 3.86Å; V307-I319 HydrophobicContact CG1-CG2 3.96Å; V307-I319 HydrophobicContact CG2-CG2 4.31Å; D308-I319 HydrophobicContact CB-CD1 4.05Å; R314-I319 HydrophobicContact CB-CD1 3.79Å; R314-I319 HydrophobicContact CB-CG1 3.81Å; D315-I319 PolarHBondContact O-N 3.05Å; D315-I319 VanDerWaalsContact O-N 3.16Å; V316-I319 PolarHBondContact O-N 3.4Å; E317-I319 VanDerWaalsContact C-N 3.32Å; E317-I319 PolarHBondContact O-N 2.82Å; I319-L321 VanDerWaalsContact C-N 3.31Å; I319-L321 PolarHBondContact O-N 3.45Å; I319-Q322 WeakPolarHBondContact O-CB 3.43Å; I319-Q322 PolarHBondContact O-N 2.77Å; I319-V323 HydrophobicContact CG2-CG2 4.49Å; I319-V323 VanDerWaalsContact O-CG2 3.3Å; I319-V323 WeakPolarHBondContact O-CG2 3.47Å; I319-V323 PolarHBondContact O-N 2.97Å
320	L	95.6	Very high	86.5	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-67.3	-33.2	176.8	-68.7	-179.5	0	0	0	111.9	F289 L292 M293 Q300 I303 V316 E317 V323 A324	F289-L320 HydrophobicContact CD2-CB 4.31Å; F289-L320 HydrophobicContact CE2-CB 4.19Å; L292-L320 HydrophobicContact CB-CB 4.36Å; L292-L320 HydrophobicContact CB-CD1 4.44Å; L292-L320 HydrophobicContact CB-CD2 4.29Å; L292-L320 WeakPolarHBondContact CD1-O 3.35Å; L292-L320 HydrophobicContact CD2-CD2 4.33Å; M293-L320 HydrophobicContact SD-CB 4.49Å; M293-L320 HydrophobicContact SD-CD1 3.66Å; Q300-L320 HydrophobicContact CB-CD1 4.28Å; Q300-L320 HydrophobicContact CG-CD1 4Å; I303-L320 HydrophobicContact CG2-CD2 4.06Å; V316-L320 HydrophobicContact CG1-CD1 3.79Å; V316-L320 HydrophobicContact CG1-CG 4.1Å; V316-L320 WeakPolarHBondContact O-CB 3.43Å; V316-L320 VanDerWaalsContact O-CG 3.26Å; V316-L320 WeakPolarHBondContact O-CG 3.46Å; V316-L320 PolarHBondContact O-N 2.89Å; E317-L320 PolarHBondContact O-N 3.43Å; L320-V323 PolarHBondContact O-N 3.23Å; L320-A324 WeakPolarHBondContact O-CB 3.46Å; L320-A324 PolarHBondContact O-N 3.09Å
321	L	94.9	Very high	88.3	Confident	77 Å²	77	70.8 Å²	70.8	40%	0.403	40%	0.395	S	S	.	.	H	α-helix	trans	-64.1	-42.6	171.9	-176	64.1	0	0	0	111.2	F289 E317 E318 I319 A324 Q325	F289-L321 HydrophobicContact CB-CD1 4.4Å; F289-L321 HydrophobicContact CD1-CD1 4.36Å; F289-L321 HydrophobicContact CD2-CB 3.96Å; F289-L321 HydrophobicContact CD2-CD1 4.07Å; F289-L321 HydrophobicContact CE2-CB 3.84Å; F289-L321 HydrophobicContact CE2-CD1 4.42Å; F289-L321 HydrophobicContact CG-CD1 4.02Å; E317-L321 WeakPolarHBondContact O-CB 3.16Å; E317-L321 PolarHBondContact O-N 3.02Å; E318-L321 PolarHBondContact O-N 2.88Å; I319-L321 VanDerWaalsContact C-N 3.31Å; I319-L321 PolarHBondContact O-N 3.45Å; L321-A324 WeakPolarHBondContact O-CB 3.35Å; L321-A324 PolarHBondContact O-N 3.11Å; L321-Q325 PolarHBondContact O-N 3.21Å
322	Q	94.1	Very high	90	Very high	89 Å²	89	68.5 Å²	68.5	42%	0.416	36%	0.363	S	S	.	.	H	α-helix	trans	-60.6	-44.8	173.2	-174.2	-173.2	-14.9	0	0	111.3	E318 I319 A324 Q325 D326	E318-Q322 PolarHBondContact O-N 3.39Å; I319-Q322 WeakPolarHBondContact O-CB 3.43Å; I319-Q322 PolarHBondContact O-N 2.77Å; Q322-A324 VanDerWaalsContact C-N 3.3Å; Q322-A324 PolarHBondContact O-N 2.88Å; Q322-Q325 PolarHBondContact O-N 2.97Å; Q322-D326 PolarHBondContact O-N 3.17Å
323	V	95.4	Very high	91.6	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.012	34%	0.338	C	S	.	.	H	α-helix	trans	-63.8	-36.1	178	173.4	0	0	0	0	111.7	L292 I303 V307 I319 L320 Q325 D326 C329 M332	L292-V323 HydrophobicContact CD1-CB 4.2Å; L292-V323 HydrophobicContact CD1-CG1 3.95Å; L292-V323 HydrophobicContact CD2-CG1 4.31Å; I303-V323 HydrophobicContact CG2-CG1 4.16Å; I303-V323 HydrophobicContact CG2-CG2 3.9Å; V307-V323 HydrophobicContact CG2-CG2 3.51Å; I319-V323 HydrophobicContact CG2-CG2 4.49Å; I319-V323 VanDerWaalsContact O-CG2 3.3Å; I319-V323 WeakPolarHBondContact O-CG2 3.47Å; I319-V323 PolarHBondContact O-N 2.97Å; L320-V323 PolarHBondContact O-N 3.23Å; V323-Q325 PolarHBondContact O-N 3.24Å; V323-D326 VanDerWaalsContact O-CB 3.24Å; V323-D326 WeakPolarHBondContact O-CB 3.32Å; V323-D326 PolarHBondContact O-N 2.93Å; V323-C329 HydrophobicContact CG1-CB 4.35Å; V323-C329 WeakPolarHBondContact O-CB 3.18Å; V323-M332 HydrophobicContact CG1-CB 4.4Å
324	A	96.7	Very high	93.1	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.008	31%	0.314	C	S	.	.	H	α-helix	trans	-63.9	-26.3	178.8	0	0	0	0	0	113.3	P285 Q288 F289 L292 L320 L321 Q322	P285-A324 WeakPolarHBondContact O-CB 3.18Å; Q288-A324 HydrophobicContact CB-CB 4.05Å; F289-A324 HydrophobicContact CB-CB 3.72Å; L292-A324 HydrophobicContact CD1-CB 3.87Å; L320-A324 WeakPolarHBondContact O-CB 3.46Å; L320-A324 PolarHBondContact O-N 3.09Å; L321-A324 WeakPolarHBondContact O-CB 3.35Å; L321-A324 PolarHBondContact O-N 3.11Å; Q322-A324 VanDerWaalsContact C-N 3.3Å; Q322-A324 PolarHBondContact O-N 2.88Å
325	Q	95.3	Very high	94.2	Very high	127 Å²	127	61.2 Å²	61.2	59%	0.593	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-11.4	175.6	-63.7	173.2	6.6	0	0	112.7	P285 L321 Q322 V323	P285-Q325 HydrophobicContact CB-CG 4.02Å; P285-Q325 HydrophobicContact CG-CG 4.5Å; L321-Q325 PolarHBondContact O-N 3.21Å; Q322-Q325 PolarHBondContact O-N 2.97Å; V323-Q325 PolarHBondContact O-N 3.24Å
326	D	93.9	Very high	94.8	Very high	58 Å²	58	55.4 Å²	55.4	31%	0.31	30%	0.296	S	S	.	.			trans	-76.1	125.9	-178.4	-163.1	-48.5	0	0	0	110.3	Q322 V323 D328 C329	Q322-D326 PolarHBondContact O-N 3.17Å; V323-D326 VanDerWaalsContact O-CB 3.24Å; V323-D326 WeakPolarHBondContact O-CB 3.32Å; V323-D326 PolarHBondContact O-N 2.93Å; D326-D328 PolarHBondContact O-N 3.25Å; D326-D328 VanDerWaalsContact O-N 3.11Å; D326-D328 WeakPolarHBondContact OD1-CA 3.48Å; D326-D328 WeakPolarHBondContact OD1-CB 3.28Å; D326-D328 PolarHBondContact OD1-N 3.48Å; D326-C329 WeakPolarHBondContact O-CB 3.42Å; D326-C329 PolarHBondContact O-N 2.94Å
327	P	91.8	Very high	95.2	Very high	129 Å²	129	52.7 Å²	52.7	84%	0.838	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-28.8	173.8	-25.5	34.7	0	0	0	113.6
328	D	92.4	Very high	95.5	Very high	109 Å²	109	48.7 Å²	48.7	58%	0.583	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	19.1	-179.3	-69.9	-39	0	0	0	113.2	D326 G330 A331 M332	D326-D328 PolarHBondContact O-N 3.25Å; D326-D328 VanDerWaalsContact O-N 3.11Å; D326-D328 WeakPolarHBondContact OD1-CA 3.48Å; D326-D328 WeakPolarHBondContact OD1-CB 3.28Å; D326-D328 PolarHBondContact OD1-N 3.48Å; D328-G330 VanDerWaalsContact C-N 3.25Å; D328-G330 PolarHBondContact O-N 2.91Å; D328-G330 VanDerWaalsContact O-N 3.13Å; D328-A331 HydrophobicContact CB-CB 4.26Å; D328-A331 WeakPolarHBondContact O-CA 3.38Å; D328-A331 WeakPolarHBondContact O-CB 3.29Å; D328-A331 PolarHBondContact O-N 3.4Å; D328-M332 PolarHBondContact O-N 3.39Å
329	C	95.8	Very high	95.8	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-45.7	-47.1	177.4	174.6	0	0	0	0	113.2	Q288 V323 D326 A331 M332 V333	Q288-C329 PolarHBondContact OE1-SG 3.3Å; V323-C329 HydrophobicContact CG1-CB 4.35Å; V323-C329 WeakPolarHBondContact O-CB 3.18Å; D326-C329 WeakPolarHBondContact O-CB 3.42Å; D326-C329 PolarHBondContact O-N 2.94Å; C329-A331 VanDerWaalsContact C-N 3.29Å; C329-A331 PolarHBondContact O-N 2.9Å; C329-M332 WeakPolarHBondContact O-CB 3.34Å; C329-M332 PolarHBondContact O-N 3.23Å; C329-M332 VanDerWaalsContact O-N 3.16Å; C329-V333 WeakPolarHBondContact O-CG2 3.48Å; C329-V333 PolarHBondContact O-N 3.5Å
330	G	96.8	Very high	96	Very high	19 Å²	19	45.9 Å²	45.9	20%	0.196	26%	0.256	C	S	.	.	H	α-helix	trans	-61.1	-35.3	177.8	0	0	0	0	0	113.5	L210 D328 H334	L210-G330 VanDerWaalsContact O-CA 3.28Å; L210-G330 WeakPolarHBondContact O-CA 3.47Å; D328-G330 VanDerWaalsContact C-N 3.25Å; D328-G330 PolarHBondContact O-N 2.91Å; D328-G330 VanDerWaalsContact O-N 3.13Å; G330-H334 WeakPolarHBondContact O-CB 3.43Å; G330-H334 PolarHBondContact O-N 3.28Å
331	A	96.4	Very high	96.1	Very high	55 Å²	55	46 Å²	46	46%	0.455	26%	0.257	S	S	.	.	H	α-helix	trans	-70.1	-37.9	176.1	0	0	0	0	0	111.6	D328 C329 H334 Q335	D328-A331 HydrophobicContact CB-CB 4.26Å; D328-A331 WeakPolarHBondContact O-CA 3.38Å; D328-A331 WeakPolarHBondContact O-CB 3.29Å; D328-A331 PolarHBondContact O-N 3.4Å; C329-A331 VanDerWaalsContact C-N 3.29Å; C329-A331 PolarHBondContact O-N 2.9Å; A331-H334 WeakPolarHBondContact O-CB 3.14Å; A331-H334 PolarHBondContact O-N 2.99Å; A331-Q335 WeakPolarHBondContact O-CB 3.22Å; A331-Q335 PolarHBondContact O-N 2.96Å
332	M	96.3	Very high	96	Very high	32 Å²	32	48.1 Å²	48.1	16%	0.158	26%	0.263	C	S	.	.	H	α-helix	trans	-63.6	-43.3	175.3	-64	-61.7	-84.3	0	0	111.5	L306 V307 V323 D328 C329 Q335 G336	L306-M332 HydrophobicContact CB-CE 3.66Å; V307-M332 HydrophobicContact CG2-CE 3.32Å; V323-M332 HydrophobicContact CG1-CB 4.4Å; D328-M332 PolarHBondContact O-N 3.39Å; C329-M332 WeakPolarHBondContact O-CB 3.34Å; C329-M332 PolarHBondContact O-N 3.23Å; C329-M332 VanDerWaalsContact O-N 3.16Å; M332-Q335 PolarHBondContact O-N 3.28Å; M332-G336 PolarHBondContact O-N 2.86Å
333	V	97.9	Very high	96	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.8	-47.4	172.4	175.5	0	0	0	0	110.6	L210 M211 L292 L295 L299 I303 C329 Q335 G336 I337	L210-V333 HydrophobicContact CB-CG2 4.07Å; L210-V333 HydrophobicContact CD1-CG2 3.9Å; M211-V333 HydrophobicContact CG-CB 4.24Å; M211-V333 HydrophobicContact CG-CG1 3.96Å; M211-V333 HydrophobicContact SD-CG1 4.04Å; L292-V333 HydrophobicContact CD2-CG2 3.88Å; L295-V333 HydrophobicContact CD1-CG2 4.41Å; L299-V333 HydrophobicContact CD2-CG1 4.36Å; I303-V333 HydrophobicContact CD1-CB 4.47Å; I303-V333 HydrophobicContact CD1-CG2 3.9Å; C329-V333 WeakPolarHBondContact O-CG2 3.48Å; C329-V333 PolarHBondContact O-N 3.5Å; V333-Q335 PolarHBondContact O-N 3.02Å; V333-G336 PolarHBondContact O-N 3.17Å; V333-I337 HydrophobicContact CG1-CD1 4.01Å; V333-I337 WeakPolarHBondContact O-CG1 3.31Å; V333-I337 PolarHBondContact O-N 2.87Å
334	H	98	Very high	95.9	Very high	87 Å²	87	47 Å²	47	40%	0.403	27%	0.265	S	S	.	.	H	α-helix	trans	-58.6	-44.8	177.4	179.5	-98.1	0	0	0	112.6	M211 G330 A331 I337 S338	M211-H334 HydrophobicContact CE-CB 3.52Å; M211-H334 WeakPolarHBondContact CE-CD2 3.45Å; G330-H334 WeakPolarHBondContact O-CB 3.43Å; G330-H334 PolarHBondContact O-N 3.28Å; A331-H334 WeakPolarHBondContact O-CB 3.14Å; A331-H334 PolarHBondContact O-N 2.99Å; H334-I337 PolarHBondContact O-N 2.92Å; H334-S338 VanDerWaalsContact O-CB 3.23Å; H334-S338 WeakPolarHBondContact O-CB 3.3Å; H334-S338 PolarHBondContact O-N 3.34Å
335	Q	97.1	Very high	95.6	Very high	101 Å²	101	46.9 Å²	46.9	47%	0.472	26%	0.264	S	S	.	.	H	α-helix	trans	-65.9	-39.9	178.7	-172.2	173.7	-0.2	0	0	111.6	L306 A331 M332 V333 S338 S339	L306-Q335 HydrophobicContact CD1-CB 3.78Å; L306-Q335 HydrophobicContact CD1-CG 3.7Å; L306-Q335 HydrophobicContact CD2-CG 4.04Å; A331-Q335 WeakPolarHBondContact O-CB 3.22Å; A331-Q335 PolarHBondContact O-N 2.96Å; M332-Q335 PolarHBondContact O-N 3.28Å; V333-Q335 PolarHBondContact O-N 3.02Å; Q335-S338 PolarHBondContact O-N 2.8Å; Q335-S339 PolarHBondContact O-N 3.04Å
336	G	97.6	Very high	95.4	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-56.2	-52.4	172.4	0	0	0	0	0	112	M332 V333 S339 I340	M332-G336 PolarHBondContact O-N 2.86Å; V333-G336 PolarHBondContact O-N 3.17Å; G336-S339 PolarHBondContact O-N 3.12Å; G336-S339 PolarHBondContact O-OG 2.9Å; G336-I340 PolarHBondContact O-N 3.1Å
337	I	98.3	Very high	95.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.2	-46.9	177.8	-67	175.9	0	0	0	111.2	W169 L172 A207 M211 L228 A231 L299 V333 H334 S339 I340 V341	W169-I337 HydrophobicContact CZ3-CD1 4.28Å; W169-I337 HydrophobicContact CZ3-CG1 4.49Å; L172-I337 HydrophobicContact CD2-CG2 3.84Å; A207-I337 HydrophobicContact CB-CD1 4.07Å; M211-I337 HydrophobicContact SD-CD1 4.05Å; L228-I337 HydrophobicContact CB-CG2 4.48Å; L228-I337 HydrophobicContact CD2-CD1 3.84Å; A231-I337 HydrophobicContact CB-CG2 4.07Å; L299-I337 HydrophobicContact CD1-CG1 3.65Å; L299-I337 HydrophobicContact CD2-CD1 3.99Å; L299-I337 HydrophobicContact CD2-CG1 3.67Å; L299-I337 HydrophobicContact CG-CG1 4.34Å; V333-I337 HydrophobicContact CG1-CD1 4.01Å; V333-I337 WeakPolarHBondContact O-CG1 3.31Å; V333-I337 PolarHBondContact O-N 2.87Å; H334-I337 PolarHBondContact O-N 2.92Å; I337-S339 PolarHBondContact O-N 2.9Å; I337-I340 PolarHBondContact O-N 2.89Å; I337-I340 VanDerWaalsContact O-N 3.08Å; I337-V341 HydrophobicContact CG2-CG2 4.34Å; I337-V341 PolarHBondContact O-N 2.93Å
338	S	97.6	Very high	95.4	Very high	30 Å²	30	38 Å²	38	21%	0.21	22%	0.215	C	C	.	.	H	α-helix	trans	-56.5	-38.3	178.8	-178.3	0	0	0	0	111.9	G232 H334 Q335 K342	G232-S338 VanDerWaalsContact CA-OG 3.29Å; G232-S338 WeakPolarHBondContact CA-OG 3.33Å; G232-S338 PolarHBondContact N-OG 3.45Å; H334-S338 VanDerWaalsContact O-CB 3.23Å; H334-S338 WeakPolarHBondContact O-CB 3.3Å; H334-S338 PolarHBondContact O-N 3.34Å; Q335-S338 PolarHBondContact O-N 2.8Å; S338-K342 WeakPolarHBondContact O-CB 3.48Å; S338-K342 PolarHBondContact O-N 3.12Å
339	S	96.6	Very high	95.2	Very high	42 Å²	42	34 Å²	34	29%	0.294	20%	0.196	S	C	.	.	H	α-helix	trans	-65.4	-40	177.3	80.7	0	0	0	0	113.1	R302 Q335 G336 I337 S343	R302-S339 WeakPolarHBondContact CD-OG 3.3Å; Q335-S339 PolarHBondContact O-N 3.04Å; G336-S339 PolarHBondContact O-N 3.12Å; G336-S339 PolarHBondContact O-OG 2.9Å; I337-S339 PolarHBondContact O-N 2.9Å; S339-S343 PolarHBondContact O-N 3.43Å
340	I	97.4	Very high	94.8	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-65.5	-53.7	178.8	-61.7	171	0	0	0	109.3	W169 L172 T298 L299 R302 G336 I337 K342 S343 S344	W169-I340 WeakPolarHBondContact O-CG2 3.49Å; L172-I340 HydrophobicContact CB-CG2 3.82Å; T298-I340 HydrophobicContact CG2-CD1 3.92Å; T298-I340 HydrophobicContact CG2-CG1 4.18Å; L299-I340 HydrophobicContact CB-CD1 4.24Å; L299-I340 HydrophobicContact CD1-CD1 4.38Å; R302-I340 HydrophobicContact CG-CD1 4.14Å; R302-I340 HydrophobicContact CG-CG1 3.81Å; G336-I340 PolarHBondContact O-N 3.1Å; I337-I340 PolarHBondContact O-N 2.89Å; I337-I340 VanDerWaalsContact O-N 3.08Å; I340-K342 PolarHBondContact O-N 3.39Å; I340-S343 PolarHBondContact O-N 3.43Å; I340-S344 PolarHBondContact O-N 3.25Å; I340-S344 PolarHBondContact O-OG 2.99Å
341	V	97.1	Very high	94.5	Very high	4 Å²	4	39 Å²	39	2%	0.024	22%	0.216	C	C	.	.	H	α-helix	trans	-68.1	-36.4	-175.8	172	0	0	0	0	111.8	L172 A231 D233 I337 S343 S344 S345	L172-V341 HydrophobicContact CB-CG2 4.18Å; L172-V341 HydrophobicContact CD2-CG2 3.81Å; L172-V341 HydrophobicContact CG-CG2 4.11Å; A231-V341 WeakPolarHBondContact O-CB 3.39Å; A231-V341 WeakPolarHBondContact O-CG1 3.45Å; D233-V341 HydrophobicContact CB-CG1 4.01Å; I337-V341 HydrophobicContact CG2-CG2 4.34Å; I337-V341 PolarHBondContact O-N 2.93Å; V341-S343 VanDerWaalsContact C-N 3.33Å; V341-S343 PolarHBondContact O-N 3.08Å; V341-S344 PolarHBondContact O-N 3.4Å; V341-S344 PolarHBondContact O-OG 3.28Å; V341-S345 WeakPolarHBondContact O-CB 3Å; V341-S345 PolarHBondContact O-N 3.43Å
342	K	94.6	Very high	93.9	Very high	120 Å²	120	37.5 Å²	37.5	52%	0.522	21%	0.206	S	C	.	.	H	α-helix	trans	-58.9	-47.1	173.8	-178.3	-179.8	178.5	-174.5	0	110.9	G232 S338 I340 I346	G232-K342 WeakPolarHBondContact O-CA 3.48Å; G232-K342 WeakPolarHBondContact O-CB 3.33Å; S338-K342 WeakPolarHBondContact O-CB 3.48Å; S338-K342 PolarHBondContact O-N 3.12Å; I340-K342 PolarHBondContact O-N 3.39Å; K342-I346 HydrophobicContact CG-CD1 3.87Å; K342-I346 WeakPolarHBondContact O-CD1 3.29Å; K342-I346 VanDerWaalsContact O-CG1 3.27Å; K342-I346 WeakPolarHBondContact O-CG1 3.42Å; K342-I346 PolarHBondContact O-N 3.19Å
343	S	93.2	Very high	93.3	Very high	62 Å²	62	40.6 Å²	40.6	43%	0.434	22%	0.223	S	C	.	.	H	α-helix	trans	-61.7	-50.3	179	-176	0	0	0	0	111.5	S339 I340 V341 T347	S339-S343 PolarHBondContact O-N 3.43Å; I340-S343 PolarHBondContact O-N 3.43Å; V341-S343 VanDerWaalsContact C-N 3.33Å; V341-S343 PolarHBondContact O-N 3.08Å; S343-T347 WeakPolarHBondContact O-CB 3.42Å; S343-T347 WeakPolarHBondContact O-CG2 3.39Å; S343-T347 PolarHBondContact O-N 3.43Å; S343-T347 VanDerWaalsContact O-N 3.14Å; S343-T347 PolarHBondContact O-OG1 3.47Å
344	S	92.8	Very high	92.5	Very high	5 Å²	5	44.1 Å²	44.1	4%	0.035	25%	0.252	C	S	.	.	H	α-helix	trans	-69.3	-38.6	-177.7	67.2	0	0	0	0	112.8	T171 I340 V341 T347 Q348	T171-S344 WeakPolarHBondContact O-CB 3.46Å; T171-S344 PolarHBondContact O-OG 2.83Å; I340-S344 PolarHBondContact O-N 3.25Å; I340-S344 PolarHBondContact O-OG 2.99Å; V341-S344 PolarHBondContact O-N 3.4Å; V341-S344 PolarHBondContact O-OG 3.28Å; S344-T347 PolarHBondContact O-OG1 2.8Å; S344-Q348 WeakPolarHBondContact O-CB 3.23Å; S344-Q348 PolarHBondContact O-N 3.29Å
345	S	91.9	Very high	91.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-46.6	178.4	-177.6	0	0	0	0	112	D233 F234 R235 V341 S349	D233-S345 WeakPolarHBondContact OD1-CB 3.35Å; D233-S345 PolarHBondContact OD1-OG 3.13Å; F234-S345 WeakPolarHBondContact CD1-OG 3.44Å; F234-S345 WeakPolarHBondContact CE1-OG 3.22Å; R235-S345 PolarHBondContact NE-OG 2.85Å; V341-S345 WeakPolarHBondContact O-CB 3Å; V341-S345 PolarHBondContact O-N 3.43Å; S345-S349 VanDerWaalsContact O-CB 3.24Å; S345-S349 WeakPolarHBondContact O-CB 3.47Å; S345-S349 PolarHBondContact O-N 3.11Å; S345-S349 PolarHBondContact O-OG 3.03Å
346	I	90.3	Very high	90.7	Very high	65 Å²	65	36.4 Å²	36.4	33%	0.333	22%	0.219	S	C	.	.	H	α-helix	trans	-63.7	-55.7	179.9	-68.5	169.8	0	0	0	110.1	F234 K342 Q348 S349 I350	F234-I346 HydrophobicContact CD1-CG1 3.74Å; F234-I346 HydrophobicContact CE1-CG1 4.19Å; F234-I346 HydrophobicContact CG-CG1 4.42Å; K342-I346 HydrophobicContact CG-CD1 3.87Å; K342-I346 WeakPolarHBondContact O-CD1 3.29Å; K342-I346 VanDerWaalsContact O-CG1 3.27Å; K342-I346 WeakPolarHBondContact O-CG1 3.42Å; K342-I346 PolarHBondContact O-N 3.19Å; I346-Q348 VanDerWaalsContact C-N 3.34Å; I346-Q348 PolarHBondContact O-N 3.05Å; I346-S349 PolarHBondContact O-N 2.97Å; I346-S349 VanDerWaalsContact O-N 3.14Å; I346-I350 HydrophobicContact CG2-CD1 3.78Å; I346-I350 WeakPolarHBondContact O-CG1 3.48Å; I346-I350 PolarHBondContact O-N 3.27Å
347	T	92.9	Very high	89.1	Confident	56 Å²	56	37.7 Å²	37.7	34%	0.344	23%	0.232	S	C	.	.	H	α-helix	trans	-62.5	-40.3	-175.6	53.7	0	0	0	0	111.9	S343 S344 K351	S343-T347 WeakPolarHBondContact O-CB 3.42Å; S343-T347 WeakPolarHBondContact O-CG2 3.39Å; S343-T347 PolarHBondContact O-N 3.43Å; S343-T347 VanDerWaalsContact O-N 3.14Å; S343-T347 PolarHBondContact O-OG1 3.47Å; S344-T347 PolarHBondContact O-OG1 2.8Å; T347-K351 WeakPolarHBondContact O-CB 3.22Å; T347-K351 PolarHBondContact O-N 3.05Å
348	Q	93.1	Very high	87.2	Confident	6 Å²	6	45 Å²	45	3%	0.028	27%	0.271	C	S	.	.	H	α-helix	trans	-70.3	-32.8	176.7	-171.4	62.9	18.7	0	0	112.6	A137 V139 Y173 S344 I346 G352	A137-Q348 HydrophobicContact CB-CB 4.36Å; A137-Q348 HydrophobicContact CB-CG 4.26Å; V139-Q348 PolarHBondContact O-NE2 3.25Å; Y173-Q348 HydrophobicContact CD2-CB 4.38Å; Y173-Q348 HydrophobicContact CD2-CG 4.4Å; Y173-Q348 HydrophobicContact CE1-CG 4.1Å; Y173-Q348 HydrophobicContact CE2-CB 3.88Å; Y173-Q348 HydrophobicContact CE2-CG 3.7Å; Y173-Q348 WeakPolarHBondContact OH-CG 3.48Å; S344-Q348 WeakPolarHBondContact O-CB 3.23Å; S344-Q348 PolarHBondContact O-N 3.29Å; I346-Q348 VanDerWaalsContact C-N 3.34Å; I346-Q348 PolarHBondContact O-N 3.05Å; Q348-G352 PolarHBondContact O-N 3Å
349	S	87.2	Confident	85.4	Confident	26 Å²	26	54.2 Å²	54.2	18%	0.182	30%	0.301	C	S	.	.	H	α-helix	trans	-69.5	-43.2	175.8	-62.2	0	0	0	0	111.4	F234 S345 I346 K351 G352 I353	F234-S349 WeakPolarHBondContact CE1-OG 3.47Å; F234-S349 WeakPolarHBondContact CZ-OG 3.1Å; S345-S349 VanDerWaalsContact O-CB 3.24Å; S345-S349 WeakPolarHBondContact O-CB 3.47Å; S345-S349 PolarHBondContact O-N 3.11Å; S345-S349 PolarHBondContact O-OG 3.03Å; I346-S349 PolarHBondContact O-N 2.97Å; I346-S349 VanDerWaalsContact O-N 3.14Å; S349-K351 VanDerWaalsContact C-N 3.34Å; S349-K351 PolarHBondContact O-N 3.44Å; S349-G352 PolarHBondContact O-N 2.88Å; S349-I353 WeakPolarHBondContact O-CG1 3.5Å; S349-I353 PolarHBondContact O-N 2.82Å
350	I	87.6	Confident	84	Confident	109 Å²	109	54.7 Å²	54.7	56%	0.559	30%	0.298	S	S	*	.	H	α-helix	trans	-58.5	-48.4	172.8	-66.9	167.8	0	0	0	109.9	I346 G352 I353 A354	I346-I350 HydrophobicContact CG2-CD1 3.78Å; I346-I350 WeakPolarHBondContact O-CG1 3.48Å; I346-I350 PolarHBondContact O-N 3.27Å; I350-G352 VanDerWaalsContact C-N 3.33Å; I350-G352 PolarHBondContact O-N 2.54Å; I350-I353 PolarHBondContact O-N 3.5Å; I350-A354 PolarHBondContact O-N 3.37Å; I350-A354 VanDerWaalsContact O-N 3.08Å
351	K	90.4	Very high	82.4	Confident	14 Å²	14	55.5 Å²	55.5	6%	0.061	30%	0.303	C	S	.	.	H	α-helix	trans	-57.4	-46.5	176.3	-172.1	169.7	78.6	175.8	0	111.5	I131 Q132 Y135 V139 T347 S349 I353 A354 T355	I131-K351 HydrophobicContact CG2-CD 4.2Å; I131-K351 HydrophobicContact CG2-CG 4.47Å; I131-K351 PolarHBondContact O-NZ 2.94Å; Q132-K351 PolarHBondContact O-NZ 3.45Å; Q132-K351 VanDerWaalsContact O-NZ 3.12Å; Y135-K351 PolarHBondContact O-NZ 2.92Å; V139-K351 WeakPolarHBondContact O-CE 3.3Å; V139-K351 PolarHBondContact O-NZ 2.94Å; T347-K351 WeakPolarHBondContact O-CB 3.22Å; T347-K351 PolarHBondContact O-N 3.05Å; S349-K351 VanDerWaalsContact C-N 3.34Å; S349-K351 PolarHBondContact O-N 3.44Å; K351-I353 VanDerWaalsContact C-N 3.31Å; K351-I353 PolarHBondContact O-N 3.14Å; K351-A354 PolarHBondContact O-N 3.47Å; K351-T355 HydrophobicContact CG-CG2 3.96Å; K351-T355 WeakPolarHBondContact O-CG2 3.21Å; K351-T355 PolarHBondContact O-N 2.84Å; K351-T355 PolarHBondContact O-OG1 2.83Å; K351-T355 VanDerWaalsContact O-OG1 3.07Å
352	G	85.1	Confident	80.7	Confident	25 Å²	25	60 Å²	60	26%	0.258	33%	0.331	S	S	.	.	H	α-helix	trans	-59.7	-38.4	179.2	0	0	0	0	0	113.5	Q348 S349 I350 A356	Q348-G352 PolarHBondContact O-N 3Å; S349-G352 PolarHBondContact O-N 2.88Å; I350-G352 VanDerWaalsContact C-N 3.33Å; I350-G352 PolarHBondContact O-N 2.54Å; G352-A356 WeakPolarHBondContact O-CB 3.44Å; G352-A356 PolarHBondContact O-N 3.34Å
353	I	83	Confident	79.4	Confident	97 Å²	97	56.2 Å²	56.2	50%	0.497	32%	0.319	S	S	.	.	H	α-helix	trans	-64	-47.9	175.1	-67.4	166.7	0	0	0	110.4	S349 I350 K351 T361	S349-I353 WeakPolarHBondContact O-CG1 3.5Å; S349-I353 PolarHBondContact O-N 2.82Å; I350-I353 PolarHBondContact O-N 3.5Å; K351-I353 VanDerWaalsContact C-N 3.31Å; K351-I353 PolarHBondContact O-N 3.14Å; I353-T361 HydrophobicContact CB-CG2 4.22Å; I353-T361 HydrophobicContact CG1-CG2 3.75Å; I353-T361 HydrophobicContact CG2-CG2 4.1Å; I353-T361 PolarHBondContact O-OG1 3.06Å
354	A	81.4	Confident	78.2	Confident	74 Å²	74	56.2 Å²	56.2	61%	0.612	31%	0.31	S	S	*	.	H	α-helix	trans	-65.3	-38.3	-179.1	0	0	0	0	0	112.4	I350 K351	I350-A354 PolarHBondContact O-N 3.37Å; I350-A354 VanDerWaalsContact O-N 3.08Å; K351-A354 PolarHBondContact O-N 3.47Å
355	T	81.8	Confident	77	Confident	8 Å²	8	58.6 Å²	58.6	5%	0.049	33%	0.326	C	S	.	.	H	α-helix	trans	-89	-30.3	-174.1	63.3	0	0	0	0	114.2	S118 L120 I131 Y140 K351 G357	S118-T355 WeakPolarHBondContact CB-O 3.4Å; S118-T355 PolarHBondContact OG-O 2.81Å; L120-T355 HydrophobicContact CD1-CG2 3.67Å; I131-T355 HydrophobicContact CG2-CG2 3.94Å; Y140-T355 HydrophobicContact CD2-CG2 4.34Å; Y140-T355 HydrophobicContact CE2-CG2 3.79Å; K351-T355 HydrophobicContact CG-CG2 3.96Å; K351-T355 WeakPolarHBondContact O-CG2 3.21Å; K351-T355 PolarHBondContact O-N 2.84Å; K351-T355 PolarHBondContact O-OG1 2.83Å; K351-T355 VanDerWaalsContact O-OG1 3.07Å; T355-G357 VanDerWaalsContact C-N 3.33Å
356	A	75.1	Confident	75.8	Confident	17 Å²	17	61.6 Å²	61.6	14%	0.14	35%	0.348	C	S	.	.	H	α-helix	trans	-75.7	-22	-178.7	0	0	0	0	0	113.4	T143 G352 K360	T143-A356 HydrophobicContact CG2-CB 4.15Å; G352-A356 WeakPolarHBondContact O-CB 3.44Å; G352-A356 PolarHBondContact O-N 3.34Å; A356-K360 HydrophobicContact CB-CB 4.22Å
357	G	64.1	Low	75	Confident	27 Å²	27	63.8 Å²	63.8	28%	0.278	36%	0.355	S	S	.	.			trans	82.4	152	-172.6	0	0	0	0	0	112.8	T355 W359 K360 T361	T355-G357 VanDerWaalsContact C-N 3.33Å; G357-W359 PolarHBondContact O-N 2.91Å; G357-K360 PolarHBondContact O-N 3.05Å; G357-T361 PolarHBondContact O-N 3.25Å; G357-T361 VanDerWaalsContact O-N 3.11Å; G357-T361 PolarHBondContact O-OG1 3.3Å; G357-T361 VanDerWaalsContact O-OG1 3.11Å
358	L	59.2	Low	74.3	Confident	153 Å²	153	62.9 Å²	62.9	80%	0.801	35%	0.346	S	S	*	.	H	α-helix	trans	-50.9	-47.6	-170.1	-70.3	166.9	0	0	0	113.4	T361 V362	L358-T361 PolarHBondContact O-N 3.34Å; L358-V362 WeakPolarHBondContact O-CG2 3.47Å; L358-V362 PolarHBondContact O-N 2.89Å; L358-V362 VanDerWaalsContact O-N 3.1Å
359	W	58.8	Low	73.2	Confident	224 Å²	224	66.9 Å²	66.9	85%	0.848	37%	0.367	S	S	*	.	H	α-helix	trans	-65.4	-45.7	-176.4	-171.9	-106.4	0	0	0	113.8	G357 T361 V362 S363	G357-W359 PolarHBondContact O-N 2.91Å; W359-T361 VanDerWaalsContact C-N 3.32Å; W359-T361 PolarHBondContact O-N 3.24Å; W359-V362 PolarHBondContact O-N 3.24Å; W359-S363 PolarHBondContact O-N 3.48Å; W359-S363 VanDerWaalsContact O-N 3.17Å
360	K	67.9	Low	72.5	Confident	52 Å²	52	70.5 Å²	70.5	23%	0.226	38%	0.382	C	S	.	.	H	α-helix	trans	-67.7	-36.5	179.7	-68.8	-169.1	176.3	-172.9	0	111.2	T143 L144 A356 G357 Y364	T143-K360 HydrophobicContact CG2-CB 4.41Å; T143-K360 HydrophobicContact CG2-CD 4.28Å; T143-K360 PolarHBondContact O-NZ 3.35Å; L144-K360 HydrophobicContact CB-CD 4.48Å; L144-K360 HydrophobicContact CD1-CB 4.03Å; L144-K360 HydrophobicContact CD1-CG 4.1Å; A356-K360 HydrophobicContact CB-CB 4.22Å; G357-K360 PolarHBondContact O-N 3.05Å; K360-Y364 VanDerWaalsContact O-CB 3.26Å; K360-Y364 WeakPolarHBondContact O-CB 3.4Å; K360-Y364 PolarHBondContact O-N 3.46Å
361	T	63.3	Low	71.9	Confident	22 Å²	22	69.3 Å²	69.3	14%	0.135	37%	0.373	C	S	.	.	H	α-helix	trans	-61.4	-48.6	175.8	-63.5	0	0	0	0	111.4	I353 G357 L358 W359 S363 Y364 S365	I353-T361 HydrophobicContact CB-CG2 4.22Å; I353-T361 HydrophobicContact CG1-CG2 3.75Å; I353-T361 HydrophobicContact CG2-CG2 4.1Å; I353-T361 PolarHBondContact O-OG1 3.06Å; G357-T361 PolarHBondContact O-N 3.25Å; G357-T361 VanDerWaalsContact O-N 3.11Å; G357-T361 PolarHBondContact O-OG1 3.3Å; G357-T361 VanDerWaalsContact O-OG1 3.11Å; L358-T361 PolarHBondContact O-N 3.34Å; W359-T361 VanDerWaalsContact C-N 3.32Å; W359-T361 PolarHBondContact O-N 3.24Å; T361-S363 PolarHBondContact O-N 2.86Å; T361-Y364 PolarHBondContact O-N 2.89Å; T361-S365 WeakPolarHBondContact O-CB 3.27Å; T361-S365 PolarHBondContact O-N 3.28Å; T361-S365 PolarHBondContact O-OG 3.2Å; T361-S365 VanDerWaalsContact O-OG 3.06Å
362	V	61.2	Low	71.2	Confident	99 Å²	99	71.4 Å²	71.4	60%	0.6	38%	0.384	S	S	*	.	H	α-helix	trans	-61	-46.8	179	173.1	0	0	0	0	111.3	L358 W359 Y364 S366	L358-V362 WeakPolarHBondContact O-CG2 3.47Å; L358-V362 PolarHBondContact O-N 2.89Å; L358-V362 VanDerWaalsContact O-N 3.1Å; W359-V362 PolarHBondContact O-N 3.24Å; V362-Y364 PolarHBondContact O-N 3Å; V362-S366 WeakPolarHBondContact O-CB 3.4Å; V362-S366 PolarHBondContact O-N 3.37Å; V362-S366 VanDerWaalsContact O-N 3.07Å; V362-S366 PolarHBondContact O-OG 2.9Å
363	S	68.1	Low	70.5	Confident	40 Å²	40	76.3 Å²	76.3	28%	0.28	40%	0.395	S	S	.	.	H	α-helix	trans	-64.4	-37.5	178.5	-173.4	0	0	0	0	113.2	W359 T361 S366 K367	W359-S363 PolarHBondContact O-N 3.48Å; W359-S363 VanDerWaalsContact O-N 3.17Å; T361-S363 PolarHBondContact O-N 2.86Å; S363-S366 PolarHBondContact O-OG 2.71Å; S363-K367 WeakPolarHBondContact O-CG 3.49Å; S363-K367 PolarHBondContact O-N 3.28Å
364	Y	67.6	Low	70.2	Confident	61 Å²	61	76.4 Å²	76.4	24%	0.239	39%	0.391	C	S	.	.	H	α-helix	trans	-72.2	-45.5	179.2	-176.1	-101.8	0	0	0	112	M92 K360 T361 V362 S366 K367 K368	M92-Y364 HydrophobicContact CE-CD2 4.45Å; M92-Y364 HydrophobicContact CE-CE2 3.81Å; K360-Y364 VanDerWaalsContact O-CB 3.26Å; K360-Y364 WeakPolarHBondContact O-CB 3.4Å; K360-Y364 PolarHBondContact O-N 3.46Å; T361-Y364 PolarHBondContact O-N 2.89Å; V362-Y364 PolarHBondContact O-N 3Å; Y364-S366 VanDerWaalsContact C-N 3.33Å; Y364-S366 PolarHBondContact O-N 3.31Å; Y364-K367 PolarHBondContact O-N 3.18Å; Y364-K368 HydrophobicContact CE1-CG 4.15Å; Y364-K368 PolarHBondContact O-N 3.49Å; Y364-K368 VanDerWaalsContact OH-CE 3.28Å; Y364-K368 WeakPolarHBondContact OH-CE 3.46Å
365	S	67.8	Low	69.8	Low	55 Å²	55	73.3 Å²	73.3	39%	0.385	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-37.4	179.1	-64.7	0	0	0	0	112	T361 K368 L369	T361-S365 WeakPolarHBondContact O-CB 3.27Å; T361-S365 PolarHBondContact O-N 3.28Å; T361-S365 PolarHBondContact O-OG 3.2Å; T361-S365 VanDerWaalsContact O-OG 3.06Å; S365-K368 WeakPolarHBondContact O-CB 3.35Å; S365-K368 PolarHBondContact O-N 3.43Å; S365-L369 WeakPolarHBondContact O-CG 3.31Å; S365-L369 PolarHBondContact O-N 3.17Å
366	S	67.1	Low	69.3	Low	64 Å²	64	80.7 Å²	80.7	45%	0.448	39%	0.394	S	S	.	.	H	α-helix	trans	-64.9	-41.6	177	67.4	0	0	0	0	112.9	V362 S363 Y364 K368 L369 M370	V362-S366 WeakPolarHBondContact O-CB 3.4Å; V362-S366 PolarHBondContact O-N 3.37Å; V362-S366 VanDerWaalsContact O-N 3.07Å; V362-S366 PolarHBondContact O-OG 2.9Å; S363-S366 PolarHBondContact O-OG 2.71Å; Y364-S366 VanDerWaalsContact C-N 3.33Å; Y364-S366 PolarHBondContact O-N 3.31Å; S366-K368 VanDerWaalsContact C-N 3.26Å; S366-K368 PolarHBondContact O-N 3Å; S366-L369 PolarHBondContact O-N 3.4Å; S366-M370 WeakPolarHBondContact O-CB 3.37Å; S366-M370 PolarHBondContact O-N 3.35Å
367	K	73.5	Confident	69	Low	111 Å²	111	85 Å²	85	48%	0.483	41%	0.409	S	S	.	.	H	α-helix	trans	-60.5	-36	174.4	-72.4	178.3	-177.9	178.9	0	112.3	S363 Y364 K371	S363-K367 WeakPolarHBondContact O-CG 3.49Å; S363-K367 PolarHBondContact O-N 3.28Å; Y364-K367 PolarHBondContact O-N 3.18Å; K367-K371 WeakPolarHBondContact O-CG 3.48Å; K367-K371 PolarHBondContact O-N 3.18Å; K367-K371 VanDerWaalsContact O-N 3.14Å
368	K	77.8	Confident	69.4	Low	37 Å²	37	90 Å²	90	16%	0.161	42%	0.42	C	S	.	.	H	α-helix	trans	-68.9	-47.5	178	-78.7	-72.9	-179.6	174	0	111.7	G239 E240 Y364 S365 S366 M370 K371 M372	G239-K368 CarbonylContact O-C 3.5Å; G239-K368 VanDerWaalsContact O-CB 3.27Å; G239-K368 WeakPolarHBondContact O-CB 3.46Å; E240-K368 IonicContact OE1-NZ 3.27Å; E240-K368 PolarHBondContact OE1-NZ 3.25Å; E240-K368 IonicContact OE2-NZ 3.42Å; E240-K368 PolarHBondContact OE2-NZ 3.38Å; Y364-K368 HydrophobicContact CE1-CG 4.15Å; Y364-K368 PolarHBondContact O-N 3.49Å; Y364-K368 VanDerWaalsContact OH-CE 3.28Å; Y364-K368 WeakPolarHBondContact OH-CE 3.46Å; S365-K368 WeakPolarHBondContact O-CB 3.35Å; S365-K368 PolarHBondContact O-N 3.43Å; S366-K368 VanDerWaalsContact C-N 3.26Å; S366-K368 PolarHBondContact O-N 3Å; K368-M370 VanDerWaalsContact C-N 3.31Å; K368-M370 PolarHBondContact O-N 3.2Å; K368-K371 WeakPolarHBondContact O-CB 3.44Å; K368-K371 PolarHBondContact O-N 3.17Å; K368-K371 VanDerWaalsContact O-N 3.14Å; K368-M372 PolarHBondContact O-N 3.08Å
369	L	70.1	Confident	69.6	Low	89 Å²	89	89.5 Å²	89.5	47%	0.466	41%	0.411	S	S	.	.	H	α-helix	trans	-59.5	-40.1	173.1	-68	170.9	0	0	0	112.5	S365 S366 K371 M372 W373	S365-L369 WeakPolarHBondContact O-CG 3.31Å; S365-L369 PolarHBondContact O-N 3.17Å; S366-L369 PolarHBondContact O-N 3.4Å; L369-K371 VanDerWaalsContact C-N 3.34Å; L369-K371 PolarHBondContact O-N 3.49Å; L369-M372 HydrophobicContact CD2-CE 3.73Å; L369-M372 WeakPolarHBondContact O-CB 3.48Å; L369-M372 PolarHBondContact O-N 3.15Å; L369-W373 PolarHBondContact O-N 3.1Å
370	M	72.1	Confident	69.4	Low	102 Å²	102	83 Å²	83	50%	0.502	39%	0.39	S	S	.	.	H	α-helix	trans	-63.1	-39	175.9	-169.4	-172.9	-166.8	0	0	112.3	S366 K368 W373 K374	S366-M370 WeakPolarHBondContact O-CB 3.37Å; S366-M370 PolarHBondContact O-N 3.35Å; K368-M370 VanDerWaalsContact C-N 3.31Å; K368-M370 PolarHBondContact O-N 3.2Å; M370-W373 PolarHBondContact O-N 3.07Å; M370-K374 WeakPolarHBondContact O-CB 3.32Å; M370-K374 WeakPolarHBondContact O-CG 3.06Å; M370-K374 PolarHBondContact O-N 3.04Å
371	K	73.9	Confident	68.8	Low	84 Å²	84	83.6 Å²	83.6	37%	0.365	40%	0.401	S	S	.	.	H	α-helix	trans	-63.1	-45	174.2	-75.5	-174.7	178.8	-165.9	0	111.2	K367 K368 L369 W373 K374 G375	K367-K371 WeakPolarHBondContact O-CG 3.48Å; K367-K371 PolarHBondContact O-N 3.18Å; K367-K371 VanDerWaalsContact O-N 3.14Å; K368-K371 WeakPolarHBondContact O-CB 3.44Å; K368-K371 PolarHBondContact O-N 3.17Å; K368-K371 VanDerWaalsContact O-N 3.14Å; L369-K371 VanDerWaalsContact C-N 3.34Å; L369-K371 PolarHBondContact O-N 3.49Å; K371-W373 PolarHBondContact O-N 3.07Å; K371-K374 PolarHBondContact O-N 2.68Å; K371-G375 PolarHBondContact O-N 2.76Å
372	M	77	Confident	68.5	Low	58 Å²	58	86.8 Å²	86.8	29%	0.286	42%	0.42	S	S	.	.	H	α-helix	trans	-57.8	-47.9	175.7	-179	-179.3	73	0	0	111.7	G239 E240 K368 L369 K374 G375 W376	G239-M372 PolarHBondContact N-SD 3.02Å; E240-M372 WeakPolarHBondContact O-CG 3.09Å; K368-M372 PolarHBondContact O-N 3.08Å; L369-M372 HydrophobicContact CD2-CE 3.73Å; L369-M372 WeakPolarHBondContact O-CB 3.48Å; L369-M372 PolarHBondContact O-N 3.15Å; M372-K374 PolarHBondContact O-N 3.44Å; M372-G375 PolarHBondContact O-N 2.86Å; M372-W376 PolarHBondContact O-N 3.27Å
373	W	70.1	Confident	68.1	Low	129 Å²	129	85.8 Å²	85.8	49%	0.489	42%	0.418	S	S	.	.	H	α-helix	trans	-63.1	-42.5	178.5	-177.8	73.1	0	0	0	113.1	L369 M370 K371 G375 W376 K377	L369-W373 PolarHBondContact O-N 3.1Å; M370-W373 PolarHBondContact O-N 3.07Å; K371-W373 PolarHBondContact O-N 3.07Å; W373-G375 VanDerWaalsContact C-N 3.28Å; W373-G375 PolarHBondContact O-N 3.27Å; W373-W376 PolarHBondContact O-N 2.73Å; W373-K377 HydrophobicContact CD2-CD 4.44Å; W373-K377 HydrophobicContact CE3-CD 4.5Å; W373-K377 HydrophobicContact CH2-CD 4.05Å; W373-K377 HydrophobicContact CZ2-CD 3.92Å; W373-K377 HydrophobicContact CZ3-CD 4.31Å; W373-K377 PolarHBondContact O-N 3.05Å
374	K	77.4	Confident	67	Low	98 Å²	98	92 Å²	92	43%	0.426	44%	0.442	S	S	.	.	H	α-helix	trans	-62.7	-33.9	174	-75.7	-178.2	177.7	-176	0	112.7	M370 K371 M372 R378	M370-K374 WeakPolarHBondContact O-CB 3.32Å; M370-K374 WeakPolarHBondContact O-CG 3.06Å; M370-K374 PolarHBondContact O-N 3.04Å; K371-K374 PolarHBondContact O-N 2.68Å; M372-K374 PolarHBondContact O-N 3.44Å; K374-R378 PolarHBondContact O-N 3.45Å; K374-R378 PolarHBondContact O-NE 2.91Å
375	G	71.8	Confident	66	Low	9 Å²	9	94.9 Å²	94.9	9%	0.093	47%	0.466	C	S	.	.	H	α-helix	trans	-64.5	-44	172.7	0	0	0	0	0	111.5	K371 M372 W373 R378 K379	K371-G375 PolarHBondContact O-N 2.76Å; M372-G375 PolarHBondContact O-N 2.86Å; W373-G375 VanDerWaalsContact C-N 3.28Å; W373-G375 PolarHBondContact O-N 3.27Å; G375-R378 PolarHBondContact O-N 2.96Å; G375-K379 PolarHBondContact O-N 2.74Å
376	W	72.3	Confident	64.5	Low	163 Å²	163	99.4 Å²	99.4	62%	0.617	50%	0.498	S	S	*	.	H	α-helix	trans	-64	-44.8	179.8	-168.4	26.6	0	0	0	113.2	M372 W373 R378 K379 Q380	M372-W376 PolarHBondContact O-N 3.27Å; W373-W376 PolarHBondContact O-N 2.73Å; W376-R378 PolarHBondContact O-N 3.4Å; W376-K379 PolarHBondContact O-N 3.42Å; W376-K379 VanDerWaalsContact O-N 3.15Å; W376-Q380 PolarHBondContact O-N 3.12Å; W376-Q380 VanDerWaalsContact O-N 3.15Å
377	K	68.1	Low	64.4	Low	107 Å²	107	101.2 Å²	101.2	47%	0.465	50%	0.5	S	S	.	.	H	α-helix	trans	-58.7	-43	175.7	-81.9	-169.3	163.6	-174.8	0	113.2	W373 K379 Q380 S381	W373-K377 HydrophobicContact CD2-CD 4.44Å; W373-K377 HydrophobicContact CE3-CD 4.5Å; W373-K377 HydrophobicContact CH2-CD 4.05Å; W373-K377 HydrophobicContact CZ2-CD 3.92Å; W373-K377 HydrophobicContact CZ3-CD 4.31Å; W373-K377 PolarHBondContact O-N 3.05Å; K377-K379 VanDerWaalsContact C-N 3.28Å; K377-K379 PolarHBondContact O-N 3.25Å; K377-Q380 PolarHBondContact O-N 3.16Å; K377-S381 PolarHBondContact O-N 2.84Å; K377-S381 VanDerWaalsContact O-N 3.12Å
378	R	71.7	Confident	63.9	Low	134 Å²	134	100.6 Å²	100.6	51%	0.506	50%	0.501	S	S	.	.	H	α-helix	trans	-61.8	-36	176.5	-88.1	-176.8	-88	-177.2	-6.5	112.5	K374 G375 W376 S381 V382	K374-R378 PolarHBondContact O-N 3.45Å; K374-R378 PolarHBondContact O-NE 2.91Å; G375-R378 PolarHBondContact O-N 2.96Å; W376-R378 PolarHBondContact O-N 3.4Å; R378-S381 PolarHBondContact O-OG 3.15Å; R378-V382 WeakPolarHBondContact O-CG2 3.35Å; R378-V382 PolarHBondContact O-N 3.32Å
379	K	63.1	Low	63.1	Low	141 Å²	141	104.2 Å²	104.2	61%	0.613	52%	0.52	S	S	*	.	H	α-helix	trans	-67.9	-39.9	176.9	-162.2	175.2	-178.3	179.6	0	111.8	G375 W376 K377 V382 S383	G375-K379 PolarHBondContact O-N 2.74Å; W376-K379 PolarHBondContact O-N 3.42Å; W376-K379 VanDerWaalsContact O-N 3.15Å; K377-K379 VanDerWaalsContact C-N 3.28Å; K377-K379 PolarHBondContact O-N 3.25Å; K379-V382 PolarHBondContact O-N 3.41Å; K379-S383 PolarHBondContact O-N 2.84Å; K379-S383 VanDerWaalsContact O-N 3.16Å; K379-S383 PolarHBondContact O-OG 3.15Å
380	Q	55	Low	62.7	Low	89 Å²	89	105.1 Å²	105.1	42%	0.416	52%	0.523	S	S	.	.	H	α-helix	trans	-64.6	-39.8	176.8	-76.3	-179.2	-19.3	0	0	113	W376 K377 S383 Q384	W376-Q380 PolarHBondContact O-N 3.12Å; W376-Q380 VanDerWaalsContact O-N 3.15Å; K377-Q380 PolarHBondContact O-N 3.16Å; Q380-S383 WeakPolarHBondContact CA-OG 3.47Å; Q380-S383 PolarHBondContact O-N 3.19Å; Q380-S383 PolarHBondContact O-OG 2.95Å; Q380-Q384 WeakPolarHBondContact O-CG 3.37Å; Q380-Q384 PolarHBondContact O-N 3.38Å
381	S	55.4	Low	62.1	Low	63 Å²	63	105.3 Å²	105.3	44%	0.441	53%	0.525	S	S	.	.	H	α-helix	trans	-67.1	-36.4	178.5	58.1	0	0	0	0	112.7	K377 R378 Q384 T385	K377-S381 PolarHBondContact O-N 2.84Å; K377-S381 VanDerWaalsContact O-N 3.12Å; R378-S381 PolarHBondContact O-OG 3.15Å; S381-Q384 PolarHBondContact O-N 3.45Å; S381-T385 PolarHBondContact O-N 2.77Å; S381-T385 PolarHBondContact O-OG1 3.46Å
382	V	58.1	Low	61.4	Low	90 Å²	90	106.7 Å²	106.7	55%	0.545	54%	0.535	S	S	.	.	H	α-helix	trans	-68.8	-37.9	176.2	175.3	0	0	0	0	111.1	R378 K379 Q384 T385 S386	R378-V382 WeakPolarHBondContact O-CG2 3.35Å; R378-V382 PolarHBondContact O-N 3.32Å; K379-V382 PolarHBondContact O-N 3.41Å; V382-Q384 VanDerWaalsContact C-N 3.29Å; V382-Q384 PolarHBondContact O-N 3.21Å; V382-T385 PolarHBondContact O-N 3.33Å; V382-T385 PolarHBondContact O-OG1 3.28Å; V382-S386 PolarHBondContact O-N 3.36Å; V382-S386 PolarHBondContact O-OG 3.39Å
383	S	51.9	Low	60.2	Low	78 Å²	78	110.1 Å²	110.1	55%	0.545	55%	0.553	S	S	.	*	H	α-helix	trans	-73.8	-13.2	176.5	56.1	0	0	0	0	115	K379 Q380	K379-S383 PolarHBondContact O-N 2.84Å; K379-S383 VanDerWaalsContact O-N 3.16Å; K379-S383 PolarHBondContact O-OG 3.15Å; Q380-S383 WeakPolarHBondContact CA-OG 3.47Å; Q380-S383 PolarHBondContact O-N 3.19Å; Q380-S383 PolarHBondContact O-OG 2.95Å
384	Q	46.2	Very low	59.5	Low	169 Å²	169	108.7 Å²	108.7	79%	0.79	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-8.2	175	-75.9	-179.5	-18.9	0	0	112.9	Q380 S381 V382	Q380-Q384 WeakPolarHBondContact O-CG 3.37Å; Q380-Q384 PolarHBondContact O-N 3.38Å; S381-Q384 PolarHBondContact O-N 3.45Å; V382-Q384 VanDerWaalsContact C-N 3.29Å; V382-Q384 PolarHBondContact O-N 3.21Å
385	T	44.9	Very low	58	Low	122 Å²	122	109.6 Å²	109.6	75%	0.748	57%	0.569	S	S	*	*			trans	-114.8	2.4	-179.4	41.2	0	0	0	0	113	S381 V382	S381-T385 PolarHBondContact O-N 2.77Å; S381-T385 PolarHBondContact O-OG1 3.46Å; V382-T385 PolarHBondContact O-N 3.33Å; V382-T385 PolarHBondContact O-OG1 3.28Å
386	S	37.3	Very low	56.7	Low	150 Å²	150	118.7 Å²	118.7	100%	1.049	61%	0.612	S	S	*	*			trans	-112	0	170.8	-45.7	0	0	0	0	108.2	V382	V382-S386 PolarHBondContact O-N 3.36Å; V382-S386 PolarHBondContact O-OG 3.39Å

Retrieved 386 of 386 residues in 729.5 ms (Link to these results)

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