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ATP synthase subunit beta

Catalytic subunit beta, of the mitochondrial membrane ATP synthase complex (F(1)F(0) ATP synthase or Complex V) that produces ATP from ADP in the presence of a proton gradient across the membrane which is generated by electron transport complexes of the respiratory chain. ATP synthase complex consist of a soluble F(1) head domain - the catalytic core - and a membrane F(1) domain - the membrane proton channel. These two domains are linked by a central stalk rotating inside the F(1) region and a stationary peripheral stalk. During catalysis, ATP synthesis in the catalytic domain of F(1) is coupled via a rotary mechanism of the central stalk subunits to proton translocation. In vivo, can only synthesize ATP although its ATP hydrolase activity can be activated artificially in vitro. With the subunit alpha (ATP5F1A), forms the catalytic core in the F(1) domain. Produces ATP from ADP in the presence of a proton gradient across the membrane.

AlphaFold DB , UniProt , Accession A0A060WPH4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110495788, Length 517 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	29.4	Very low	229 Å²	229	134.5 Å²	134.5	100%	1.128	85%	0.845	S	S	*	*				0	103.4	0	-74	-178.4	175.1	0	0	106.6
2	L	30.4	Very low	29.2	Very low	179 Å²	179	132.1 Å²	132.1	94%	0.937	85%	0.847	S	S	*	*				65.8	124.4	107.4	-75	151.9	0	0	0	111.4
3	G	28.2	Very low	29.3	Very low	71 Å²	71	135.2 Å²	135.2	73%	0.732	85%	0.851	S	S	*	*			cis	165.8	157.5	13.8	0	0	0	0	0	108
4	A	31.7	Very low	29.3	Very low	102 Å²	102	139.4 Å²	139.4	84%	0.843	86%	0.856	S	S	*	*			trans	-69.1	145.7	178.4	0	0	0	0	0	113.9
5	V	33.3	Very low	29.2	Very low	140 Å²	140	135.7 Å²	135.7	85%	0.848	85%	0.845	S	S	*	*			trans	-162.7	121.3	150.9	-178	0	0	0	0	105.7
6	G	27.7	Very low	29.1	Very low	60 Å²	60	137.8 Å²	137.8	62%	0.619	85%	0.847	S	S	*	*			cis	93.6	101.7	16	0	0	0	0	0	111.7
7	R	31.4	Very low	29.3	Very low	241 Å²	241	141.6 Å²	141.6	91%	0.909	85%	0.849	S	S	*	*			trans	142.5	141.7	159.2	-81.6	167.6	-167	-152.3	4.1	109.4
8	C	26.8	Very low	29.8	Very low	102 Å²	102	140.2 Å²	140.2	69%	0.689	84%	0.844	S	S	*	*			cis	-166.7	147.1	4.9	-117.9	0	0	0	0	106.5
9	C	26.6	Very low	29.7	Very low	135 Å²	135	137.2 Å²	137.2	91%	0.912	84%	0.844	S	S	*	*				177.8	87	128.4	-93.4	0	0	0	0	109.2
10	T	27.9	Very low	29.9	Very low	143 Å²	143	137 Å²	137	88%	0.877	84%	0.842	S	S	*	*			trans	-88.4	142.4	160.1	15.1	0	0	0	0	109.3
11	G	26.5	Very low	29.8	Very low	78 Å²	78	139.4 Å²	139.4	80%	0.804	84%	0.844	S	S	*	*			trans	128.5	89.5	143.3	0	0	0	0	0	116.6
12	A	27.5	Very low	29.8	Very low	105 Å²	105	134 Å²	134	87%	0.868	83%	0.826	S	S	*	*				-177.1	97.6	122.8	0	0	0	0	0	109.8
13	L	30	Very low	29.6	Very low	172 Å²	172	134 Å²	134	90%	0.901	83%	0.826	S	S	*	*			trans	-85.3	155.5	161.8	-104.4	153.9	0	0	0	108.8
14	Q	29.4	Very low	29.6	Very low	195 Å²	195	139.6 Å²	139.6	91%	0.911	83%	0.83	S	S	*	*			trans	103.4	126.5	174.2	-62.4	176.4	-7.5	0	0	112.9
15	A	28.6	Very low	29.7	Very low	84 Å²	84	139.3 Å²	139.3	69%	0.694	83%	0.828	S	S	*	*			cis	-158.5	149.2	11	0	0	0	0	0	107
16	L	27.6	Very low	29.4	Very low	169 Å²	169	140.7 Å²	140.7	89%	0.885	83%	0.83	S	S	*	*				176.9	133.4	86.3	-96.2	145	0	0	0	110.2
17	K	31.7	Very low	29.6	Very low	203 Å²	203	144.4 Å²	144.4	88%	0.883	84%	0.84	S	S	*	*			trans	-11.2	166.9	161.9	-85.4	-171.1	177.7	179.5	0	123.7
18	P	39	Very low	29.4	Very low	115 Å²	115	136.3 Å²	136.3	75%	0.747	83%	0.832	S	S	*	*			trans	-105.5	157.9	-142.5	40.6	-33.1	0	0	0	114.7
19	G	27.3	Very low	29.4	Very low	83 Å²	83	136.8 Å²	136.8	86%	0.856	84%	0.836	S	S	*	*			trans	-133.7	109.1	167.3	0	0	0	0	0	110.1
20	V	34	Very low	29.4	Very low	133 Å²	133	136.1 Å²	136.1	81%	0.806	83%	0.83	S	S	*	*			trans	-93.5	129.9	172.9	172.7	0	0	0	0	108.6
21	Q	28.6	Very low	29.6	Very low	189 Å²	189	134.5 Å²	134.5	88%	0.883	83%	0.825	S	S	*	*			trans	-138.7	141.5	143.4	-85.1	-168.4	-5.2	0	0	109.5
22	P	31.4	Very low	29.8	Very low	114 Å²	114	138 Å²	138	74%	0.74	83%	0.83	S	S	*	*			trans	-89	127.3	-164.7	34.2	-30.2	0	0	0	111.1	K24	P22-K24 PolarHBondContact O-N 3.42Å
23	L	27.6	Very low	30.1	Very low	180 Å²	180	141.4 Å²	141.4	94%	0.942	83%	0.833	S	S	*	*			trans	-73.2	111.8	161.7	-97.1	153.8	0	0	0	107.9	A25	L23-A25 PolarHBondContact O-N 2.95Å
24	K	27.4	Very low	30.4	Very low	189 Å²	189	136.7 Å²	136.7	82%	0.822	83%	0.826	S	S	*	*			trans	-46.3	130.7	173.9	-83.4	173.5	170.6	176.1	0	110.6	P22 L26	P22-K24 PolarHBondContact O-N 3.42Å; K24-L26 PolarHBondContact O-N 3.17Å; K24-L26 VanDerWaalsContact O-N 3.11Å
25	A	33.1	Very low	30.6	Very low	96 Å²	96	137.8 Å²	137.8	79%	0.793	82%	0.822	S	S	*	*			trans	-55.1	112	162.6	0	0	0	0	0	109.5	L23	L23-A25 PolarHBondContact O-N 2.95Å
26	L	26.5	Very low	30.9	Very low	169 Å²	169	141.9 Å²	141.9	89%	0.885	82%	0.819	S	S	*	*			trans	-90.4	104.1	156.5	-89.4	157.1	0	0	0	106	K24 G28	K24-L26 PolarHBondContact O-N 3.17Å; K24-L26 VanDerWaalsContact O-N 3.11Å; L26-G28 VanDerWaalsContact C-N 3.28Å; L26-G28 PolarHBondContact O-N 3.18Å
27	V	33.8	Very low	31.2	Very low	138 Å²	138	138.7 Å²	138.7	84%	0.836	80%	0.803	S	S	*	*			trans	-63.1	95.6	164	178.4	0	0	0	0	106.1
28	G	25.9	Very low	31.4	Very low	71 Å²	71	138 Å²	138	73%	0.732	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-88.3	120.7	173.4	0	0	0	0	0	109.8	L26	L26-G28 VanDerWaalsContact C-N 3.28Å; L26-G28 PolarHBondContact O-N 3.18Å
29	S	26.5	Very low	31.3	Very low	112 Å²	112	136.7 Å²	136.7	78%	0.783	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-49.2	151.8	175.4	-48.8	0	0	0	0	113.6
30	P	28.4	Very low	31.6	Very low	120 Å²	120	136.5 Å²	136.5	78%	0.779	78%	0.776	S	S	*	*	S	Bend	trans	-73.7	153.9	176.5	32.2	-31.9	0	0	0	111.4
31	S	32	Very low	31.5	Very low	110 Å²	110	136 Å²	136	77%	0.769	78%	0.776	S	S	*	*			trans	63.6	93	166.2	67.1	0	0	0	0	118.5
32	V	29.9	Very low	32	Very low	150 Å²	150	131.3 Å²	131.3	91%	0.909	77%	0.769	S	S	*	*			trans	-126.4	70.4	146.4	-173.7	0	0	0	0	107.3
33	L	34.6	Very low	32.1	Very low	178 Å²	178	129.8 Å²	129.8	93%	0.932	77%	0.766	S	S	*	*			trans	-137.3	95.7	166	-85.9	168.3	0	0	0	105.3
34	G	36.1	Very low	32.5	Very low	73 Å²	73	126.6 Å²	126.6	75%	0.753	77%	0.765	S	S	*	*			trans	158.6	74.8	-178	0	0	0	0	0	112.7
35	R	33.2	Very low	33.2	Very low	218 Å²	218	121.4 Å²	121.4	82%	0.823	76%	0.758	S	S	*	*			trans	-177.7	100.2	150	-104.1	174.9	-170.8	-176.8	0.8	107.2	D37	R35-D37 PolarHBondContact O-N 3.01Å
36	R	34.6	Very low	34.3	Very low	169 Å²	169	121.4 Å²	121.4	64%	0.638	76%	0.758	S	S	*	*			trans	-87.1	74.5	165.7	-72	-157.8	-176.3	140.4	20.3	107.7	E161	R36-E161 WeakPolarHBondContact CD-OE1 3.24Å; R36-E161 WeakPolarHBondContact CG-OE1 3.36Å; R36-E161 IonicContact CZ-OE1 2.71Å; R36-E161 IonicContact CZ-OE2 3.63Å; R36-E161 IonicContact NE-OE1 3.67Å; R36-E161 PolarHBondContact NE-OE1 3.16Å; R36-E161 VanDerWaalsContact NE-OE1 3.08Å; R36-E161 IonicContact NE-OE2 3.19Å; R36-E161 IonicContact NH1-OE1 2.8Å; R36-E161 PolarHBondContact NH1-OE1 3.22Å; R36-E161 IonicContact NH1-OE2 2.82Å; R36-E161 PolarHBondContact NH1-OE2 2.95Å; R36-E161 IonicContact NH2-OE1 3.65Å; R36-E161 PolarHBondContact NH2-OE1 2.88Å; R36-E161 IonicContact NH2-OE2 3.83Å; R36-E161 PolarHBondContact NH2-OE2 2.58Å
37	D	33.5	Very low	36.2	Very low	102 Å²	102	120 Å²	120	55%	0.545	74%	0.744	S	S	.	*			trans	-85.6	113.2	163.5	-62	-41.1	0	0	0	106.2	R35 V39	R35-D37 PolarHBondContact O-N 3.01Å; D37-V39 HydrophobicContact CB-CB 4.35Å; D37-V39 PolarHBondContact O-N 3.48Å
38	Y	35.4	Very low	38.4	Very low	190 Å²	190	114.1 Å²	114.1	75%	0.745	71%	0.711	S	S	*	*			trans	-73.5	4.1	164	-73.1	-77	0	0	0	112	A40 E158	Y38-A40 PolarHBondContact O-N 3.48Å; Y38-E158 HydrophobicContact CD2-CG 3.93Å; Y38-E158 HydrophobicContact CE2-CG 4.16Å
39	V	38.6	Very low	41.4	Very low	87 Å²	87	115 Å²	115	53%	0.527	70%	0.695	S	S	.	*	S	Bend	trans	-77.4	112.4	167.1	-175.4	0	0	0	0	107	D37	D37-V39 HydrophobicContact CB-CB 4.35Å; D37-V39 PolarHBondContact O-N 3.48Å
40	A	31.8	Very low	44.6	Very low	78 Å²	78	109.7 Å²	109.7	65%	0.645	66%	0.659	S	S	*	*			trans	-47.1	133	163.2	0	0	0	0	0	107.7	Y38 A42	Y38-A40 PolarHBondContact O-N 3.48Å; A40-A42 PolarHBondContact O-N 3.13Å
41	P	32.3	Very low	47.8	Very low	124 Å²	124	111 Å²	111	81%	0.805	65%	0.648	S	S	*	*			trans	-49	122	-176.6	19.6	-31.3	0	0	0	107.9	A43	P41-A43 VanDerWaalsContact C-N 3.3Å; P41-A43 PolarHBondContact O-N 3.33Å
42	A	40.3	Very low	50.8	Low	89 Å²	89	105.9 Å²	105.9	74%	0.736	61%	0.612	S	S	*	*			trans	-53.6	99.8	-178.2	0	0	0	0	0	107.8	A40 A44	A40-A42 PolarHBondContact O-N 3.13Å; A42-A44 PolarHBondContact O-N 3.38Å
43	A	33.9	Very low	54	Low	83 Å²	83	101.6 Å²	101.6	69%	0.686	59%	0.586	S	S	*	*			trans	-57.7	129.3	158.8	0	0	0	0	0	104.1	P41 A45	P41-A43 VanDerWaalsContact C-N 3.3Å; P41-A43 PolarHBondContact O-N 3.33Å; A43-A45 PolarHBondContact O-N 2.98Å
44	A	35.4	Very low	56.8	Low	112 Å²	112	94.1 Å²	94.1	93%	0.926	55%	0.55	S	S	*	.			trans	-62.9	75.1	169.9	0	0	0	0	0	108.4	A42	A42-A44 PolarHBondContact O-N 3.38Å
45	A	42.5	Very low	59.7	Low	80 Å²	80	92.9 Å²	92.9	66%	0.661	53%	0.528	S	S	*	.			trans	-84.9	131	171.4	0	0	0	0	0	106.1	A43 F47	A43-A45 PolarHBondContact O-N 2.98Å; A45-F47 PolarHBondContact O-N 2.75Å
46	A	55.5	Low	62.5	Low	96 Å²	96	87.2 Å²	87.2	79%	0.793	51%	0.513	S	S	*	.			trans	-50.7	136.5	170.5	0	0	0	0	0	109.2	A48	A46-A48 PolarHBondContact O-N 3.45Å
47	F	65.5	Low	65.2	Low	139 Å²	139	81.4 Å²	81.4	61%	0.61	51%	0.506	S	S	*	.			trans	-46.4	113.5	-179.2	-65.3	-70.7	0	0	0	110.5	A45 H49 V115 D116	A45-F47 PolarHBondContact O-N 2.75Å; F47-H49 PolarHBondContact O-N 3.11Å; F47-V115 HydrophobicContact CB-CG1 4.06Å; F47-D116 WeakPolarHBondContact CD1-O 3.47Å
48	A	80.4	Confident	68	Low	16 Å²	16	77.2 Å²	77.2	13%	0.132	49%	0.485	C	S	.	.			trans	-64.4	138	-178.5	0	0	0	0	0	108.9	A46 F64 G67 D116	A46-A48 PolarHBondContact O-N 3.45Å; A48-F64 HydrophobicContact CB-CD1 3.87Å; A48-F64 HydrophobicContact CB-CE1 3.99Å; A48-G67 WeakPolarHBondContact CB-O 3.22Å; A48-D116 HydrophobicContact CB-CB 4.09Å; A48-D116 WeakPolarHBondContact O-CB 3.32Å; A48-D116 PolarHBondContact O-N 3.25Å
49	H	89.4	Confident	70.9	Confident	88 Å²	88	68.3 Å²	68.3	41%	0.407	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.8	180	-68.3	-38.6	0	0	0	109.5	F47 K113 V114	F47-H49 PolarHBondContact O-N 3.11Å; H49-K113 PolarHBondContact CD2-NZ 2.99Å; H49-K113 PolarHBondContact CE1-NZ 3.46Å; H49-K113 VanDerWaalsContact CE1-NZ 3.34Å; H49-K113 VanDerWaalsContact ND1-CE 3.26Å; H49-K113 WeakPolarHBondContact ND1-CE 3.19Å; H49-K113 PolarHBondContact NE2-NZ 3.48Å; H49-V114 WeakPolarHBondContact CA-O 3.47Å
50	G	93.1	Very high	73.7	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.01	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	170.8	175.5	0	0	0	0	0	112	Q63 V114	G50-Q63 CarbonylContact C-O 3.43Å; G50-Q63 WeakPolarHBondContact CA-O 3.35Å; G50-V114 PolarHBondContact N-O 3.45Å; G50-V114 PolarHBondContact O-N 2.69Å
51	R	95.2	Very high	76.8	Confident	147 Å²	147	61.1 Å²	61.1	56%	0.555	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	140.5	172.2	-63.4	-179.3	-171.2	161.5	7.3	110.1	V53 V62 Q63 Q112	R51-V53 PolarHBondContact O-N 3.21Å; R51-V62 WeakPolarHBondContact O-CA 3.27Å; R51-Q63 PolarHBondContact N-O 3.08Å; R51-Q63 PolarHBondContact O-N 3.1Å; R51-Q112 WeakPolarHBondContact CA-O 3.46Å
52	I	96.4	Very high	79.8	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.015	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	125	176.4	-60.2	-177.2	0	0	0	109.7	V55 V60 V77 L108 R110 G111 Q112 V114	I52-V55 HydrophobicContact CG2-CG2 3.65Å; I52-V60 HydrophobicContact CD1-CG1 4.16Å; I52-V60 HydrophobicContact CG1-CG1 4.12Å; I52-V60 HydrophobicContact CG2-CG1 3.86Å; I52-V77 HydrophobicContact CD1-CG1 4.26Å; I52-L108 HydrophobicContact CD1-CB 4.42Å; I52-L108 HydrophobicContact CD1-CD1 4.21Å; I52-L108 HydrophobicContact CD1-CD2 3.85Å; I52-L108 HydrophobicContact CD1-CG 4.41Å; I52-R110 CarbonylContact O-C 3.54Å; I52-R110 WeakPolarHBondContact O-CA 3.49Å; I52-G111 PolarHBondContact O-N 3.4Å; I52-Q112 HydrophobicContact CD1-CB 4.04Å; I52-Q112 HydrophobicContact CG1-CB 4.38Å; I52-Q112 PolarHBondContact N-O 3.26Å; I52-V114 HydrophobicContact CD1-CG2 4.25Å; I52-V114 HydrophobicContact CG1-CG2 3.63Å
53	V	96	Very high	82.5	Confident	61 Å²	61	54.8 Å²	54.8	37%	0.37	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-41.4	176.9	-179.4	0	0	0	0	111.1	R51 D61 Q63 R110	R51-V53 PolarHBondContact O-N 3.21Å; V53-D61 PolarHBondContact N-O 3.16Å; V53-Q63 HydrophobicContact CG2-CB 3.39Å; V53-R110 VanDerWaalsContact O-CD 3.24Å; V53-R110 WeakPolarHBondContact O-CD 3.45Å; V53-R110 WeakPolarHBondContact O-CG 3.42Å; V53-R110 PolarHBondContact O-NE 2.91Å
54	A	94.8	Very high	85.4	Confident	20 Å²	20	50.9 Å²	50.9	17%	0.165	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	151.6	179.6	0	0	0	0	0	111.7	D61	A54-D61 HydrophobicContact CB-CB 4.19Å; A54-D61 PolarHBondContact N-O 3.19Å; A54-D61 PolarHBondContact O-N 3.34Å
55	V	95.3	Very high	87.8	Confident	48 Å²	48	50.7 Å²	50.7	29%	0.291	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	120.7	175.3	-177.7	0	0	0	0	106.8	I52 V60 L108	I52-V55 HydrophobicContact CG2-CG2 3.65Å; V55-V60 HydrophobicContact CG1-CG2 4.38Å; V55-V60 HydrophobicContact CG2-CG1 4.36Å; V55-L108 HydrophobicContact CG1-CD1 4.4Å; V55-L108 HydrophobicContact CG2-CB 3.96Å; V55-L108 HydrophobicContact CG2-CD1 4.24Å
56	I	92.8	Very high	89.6	Confident	98 Å²	98	54.9 Å²	54.9	50%	0.503	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	91.5	-178.1	-53.5	173.1	0	0	0	107.5	A58 V59	I56-A58 PolarHBondContact O-N 3.39Å; I56-V59 PolarHBondContact N-O 3.27Å; I56-V59 PolarHBondContact O-N 2.91Å
57	G	91.1	Very high	90.8	Very high	48 Å²	48	52.9 Å²	52.9	50%	0.495	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	-123.4	-173.4	0	0	0	0	0	111	V59 T105	G57-V59 VanDerWaalsContact C-N 3.31Å; G57-T105 WeakPolarHBondContact O-CG2 3.33Å; G57-T105 PolarHBondContact O-OG1 3.45Å
58	A	93	Very high	92	Very high	13 Å²	13	49.3 Å²	49.3	11%	0.107	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-1.4	177.2	0	0	0	0	0	114.2	I56 A101 P264 P265 L310	I56-A58 PolarHBondContact O-N 3.39Å; A58-A101 WeakPolarHBondContact O-CB 3.29Å; A58-A101 PolarHBondContact O-N 3.17Å; A58-P264 HydrophobicContact CB-CB 4.41Å; A58-P265 HydrophobicContact CB-CG 4.46Å; A58-L310 HydrophobicContact CB-CD1 4.08Å
59	V	95.9	Very high	92.6	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.018	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	128.6	177.9	175.1	0	0	0	0	110	I56 G57 R98 T99 L310 L311	I56-V59 PolarHBondContact N-O 3.27Å; I56-V59 PolarHBondContact O-N 2.91Å; G57-V59 VanDerWaalsContact C-N 3.31Å; V59-R98 HydrophobicContact CG1-CG 3.58Å; V59-T99 WeakPolarHBondContact CA-O 3.13Å; V59-L310 HydrophobicContact CG2-CB 3.62Å; V59-L311 HydrophobicContact CG2-CD2 4.34Å
60	V	96.6	Very high	92.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.4	179.9	-176.4	0	0	0	0	108.7	I52 V55 V62 L86 T99 T105 L108	I52-V60 HydrophobicContact CD1-CG1 4.16Å; I52-V60 HydrophobicContact CG1-CG1 4.12Å; I52-V60 HydrophobicContact CG2-CG1 3.86Å; V55-V60 HydrophobicContact CG1-CG2 4.38Å; V55-V60 HydrophobicContact CG2-CG1 4.36Å; V60-V62 HydrophobicContact CG1-CG2 4.08Å; V60-L86 HydrophobicContact CB-CD1 4.08Å; V60-L86 HydrophobicContact CB-CD2 4.38Å; V60-L86 HydrophobicContact CG1-CD1 3.95Å; V60-L86 HydrophobicContact CG2-CD2 4.1Å; V60-T99 PolarHBondContact N-O 2.93Å; V60-T99 WeakPolarHBondContact O-CA 3.48Å; V60-T99 WeakPolarHBondContact O-CB 3.19Å; V60-T99 PolarHBondContact O-N 3.16Å; V60-T99 PolarHBondContact O-OG1 3.27Å; V60-T105 HydrophobicContact CG2-CG2 3.94Å; V60-L108 HydrophobicContact CG2-CD1 3.84Å
61	D	96.8	Very high	92.8	Very high	15 Å²	15	52.3 Å²	52.3	8%	0.08	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124.6	175.2	-67.5	-20.5	0	0	0	108.6	V53 A54 T96 V97 R98	V53-D61 PolarHBondContact N-O 3.16Å; A54-D61 HydrophobicContact CB-CB 4.19Å; A54-D61 PolarHBondContact N-O 3.19Å; A54-D61 PolarHBondContact O-N 3.34Å; D61-T96 HydrophobicContact CB-CG2 4.11Å; D61-V97 WeakPolarHBondContact CA-O 3.32Å; D61-R98 WeakPolarHBondContact OD1-CA 3.42Å; D61-R98 WeakPolarHBondContact OD1-CB 3.47Å; D61-R98 WeakPolarHBondContact OD1-CG 3.4Å; D61-R98 IonicContact OD1-CZ 2.9Å; D61-R98 IonicContact OD1-NE 3.75Å; D61-R98 PolarHBondContact OD1-NE 3.43Å; D61-R98 IonicContact OD1-NH2 3.72Å; D61-R98 IonicContact OD2-CZ 3.84Å; D61-R98 IonicContact OD2-NE 2.67Å; D61-R98 IonicContact OD2-NH2 3.01Å; D61-R98 PolarHBondContact OD2-NH2 3.34Å
62	V	96.7	Very high	92.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.6	-176.4	-175.4	0	0	0	0	109	R51 V60 F64 L75 L86 T96 V97 T99 V114	R51-V62 WeakPolarHBondContact O-CA 3.27Å; V60-V62 HydrophobicContact CG1-CG2 4.08Å; V62-F64 HydrophobicContact CB-CE2 4.11Å; V62-F64 HydrophobicContact CG1-CD2 4.16Å; V62-F64 HydrophobicContact CG1-CE2 3.53Å; V62-F64 HydrophobicContact CG1-CZ 4Å; V62-L75 HydrophobicContact CB-CD1 4.47Å; V62-L75 HydrophobicContact CG2-CD1 4.4Å; V62-L86 HydrophobicContact CG2-CD1 4.09Å; V62-T96 WeakPolarHBondContact O-CA 3.28Å; V62-V97 HydrophobicContact CB-CG2 4.03Å; V62-V97 PolarHBondContact N-O 2.86Å; V62-V97 WeakPolarHBondContact O-CG2 3.49Å; V62-V97 PolarHBondContact O-N 3.15Å; V62-T99 HydrophobicContact CG2-CG2 4.37Å; V62-V114 HydrophobicContact CG1-CB 3.81Å; V62-V114 HydrophobicContact CG1-CG1 4.07Å; V62-V114 HydrophobicContact CG1-CG2 3.94Å; V62-V114 HydrophobicContact CG2-CG1 4.45Å; V62-V114 HydrophobicContact CG2-CG2 4.11Å
63	Q	95.8	Very high	92.8	Very high	79 Å²	79	48.3 Å²	48.3	37%	0.369	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.4	176.4	-178.9	173.2	48.5	0	0	110.5	G50 R51 V53 E94 N95	G50-Q63 CarbonylContact C-O 3.43Å; G50-Q63 WeakPolarHBondContact CA-O 3.35Å; R51-Q63 PolarHBondContact N-O 3.08Å; R51-Q63 PolarHBondContact O-N 3.1Å; V53-Q63 HydrophobicContact CG2-CB 3.39Å; Q63-E94 PolarHBondContact NE2-O 3.46Å; Q63-N95 WeakPolarHBondContact CA-O 3.39Å
64	F	94.5	Very high	92.8	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.009	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	141.6	176.5	-73.3	-96.8	0	0	0	109.9	A48 V62 L68 P69 L75 N95 V97 D116	A48-F64 HydrophobicContact CB-CD1 3.87Å; A48-F64 HydrophobicContact CB-CE1 3.99Å; V62-F64 HydrophobicContact CB-CE2 4.11Å; V62-F64 HydrophobicContact CG1-CD2 4.16Å; V62-F64 HydrophobicContact CG1-CE2 3.53Å; V62-F64 HydrophobicContact CG1-CZ 4Å; F64-L68 HydrophobicContact CB-CD1 4.4Å; F64-P69 HydrophobicContact CD1-CG 4.33Å; F64-P69 HydrophobicContact CD2-CG 4.29Å; F64-P69 HydrophobicContact CE1-CG 3.82Å; F64-P69 HydrophobicContact CE2-CG 3.78Å; F64-P69 HydrophobicContact CZ-CG 3.53Å; F64-L75 HydrophobicContact CE2-CD1 4.06Å; F64-L75 HydrophobicContact CZ-CD1 3.97Å; F64-L75 HydrophobicContact CZ-CD2 4.05Å; F64-N95 PolarHBondContact N-O 3.49Å; F64-N95 WeakPolarHBondContact O-CB 3.49Å; F64-V97 HydrophobicContact CD2-CG2 4.16Å; F64-V97 HydrophobicContact CE2-CG2 3.72Å; F64-D116 HydrophobicContact CE1-CB 4.22Å
65	D	85.7	Confident	92.8	Very high	108 Å²	108	44.7 Å²	44.7	58%	0.578	26%	0.26	S	S	*	.	S	Bend	trans	-73.5	-46.6	176.1	-66	-37	0	0	0	110	N95	D65-N95 PolarHBondContact O-ND2 3.48Å
66	E	82.1	Confident	92.8	Very high	168 Å²	168	45.5 Å²	45.5	79%	0.785	26%	0.261	S	S	*	.	S	Bend	trans	-144.9	156	174	-65.8	-175.1	172.6	0	0	110
67	G	80.5	Confident	92.9	Very high	53 Å²	53	41.3 Å²	41.3	55%	0.546	24%	0.24	S	C	.	.			trans	73.4	74	176.4	0	0	0	0	0	113.1	A48 P69	A48-G67 WeakPolarHBondContact CB-O 3.22Å; G67-P69 WeakPolarHBondContact O-CD 3.42Å
68	L	89.9	Confident	92.9	Very high	64 Å²	64	41 Å²	41	34%	0.335	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-69	121.2	179.1	-152.8	74.7	0	0	0	110.5	F64 H91 N95 V97	F64-L68 HydrophobicContact CB-CD1 4.4Å; L68-H91 HydrophobicContact CD2-CB 4.24Å; L68-N95 HydrophobicContact CD1-CB 4.06Å; L68-N95 VanDerWaalsContact CD1-O 3.3Å; L68-N95 WeakPolarHBondContact CD1-O 3.39Å; L68-V97 HydrophobicContact CD1-CG1 3.72Å; L68-V97 HydrophobicContact CD2-CG1 4.18Å; L68-V97 HydrophobicContact CG-CG1 3.69Å
69	P	92.8	Very high	92.4	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-65	145.6	-179.8	-22.6	34.3	0	0	0	111.8	F64 G67 N73 L75 V88 H91 D116	F64-P69 HydrophobicContact CD1-CG 4.33Å; F64-P69 HydrophobicContact CD2-CG 4.29Å; F64-P69 HydrophobicContact CE1-CG 3.82Å; F64-P69 HydrophobicContact CE2-CG 3.78Å; F64-P69 HydrophobicContact CZ-CG 3.53Å; G67-P69 WeakPolarHBondContact O-CD 3.42Å; P69-N73 HydrophobicContact CB-CB 4.17Å; P69-L75 HydrophobicContact CB-CD2 3.98Å; P69-L75 HydrophobicContact CG-CD2 3.79Å; P69-V88 HydrophobicContact CB-CG2 4.28Å; P69-H91 PolarHBondContact O-CE1 2.71Å; P69-H91 PolarHBondContact O-NE2 3.35Å; P69-D116 HydrophobicContact CG-CB 3.97Å
70	P	93.3	Very high	91.9	Very high	73 Å²	73	47.2 Å²	47.2	47%	0.474	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-63.7	164	177.6	27.3	-33.3	0	0	0	111.9	N73 V88	P70-N73 HydrophobicContact CG-CB 4.04Å; P70-N73 WeakPolarHBondContact O-CB 3.37Å; P70-N73 PolarHBondContact O-N 2.91Å; P70-V88 WeakPolarHBondContact O-CB 3.34Å
71	I	94.4	Very high	91.2	Very high	94 Å²	94	57.3 Å²	57.3	48%	0.482	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	144.9	171.7	-55.1	177	0	0	0	108.2	N73 A89	I71-N73 PolarHBondContact O-N 2.84Å; I71-A89 WeakPolarHBondContact CG2-O 3.38Å
72	L	94.9	Very high	90.7	Very high	62 Å²	62	59.4 Å²	59.4	33%	0.325	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	-0.5	-175.3	-46	179.7	0	0	0	115.5	E87 V88 P120 H156	L72-E87 WeakPolarHBondContact CD2-OE1 3.42Å; L72-V88 WeakPolarHBondContact CA-O 3.24Å; L72-V88 PolarHBondContact N-O 3.5Å; L72-P120 WeakPolarHBondContact O-CA 3.48Å; L72-P120 WeakPolarHBondContact O-CB 2.99Å; L72-H156 HydrophobicContact CD1-CB 4.23Å
73	N	95.1	Very high	90.5	Very high	5 Å²	5	64.4 Å²	64.4	3%	0.027	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	146.2	174.3	-126.2	36.1	0	0	0	111.7	P69 P70 I71 E87 V88 D116 G118 D119	P69-N73 HydrophobicContact CB-CB 4.17Å; P70-N73 HydrophobicContact CG-CB 4.04Å; P70-N73 WeakPolarHBondContact O-CB 3.37Å; P70-N73 PolarHBondContact O-N 2.91Å; I71-N73 PolarHBondContact O-N 2.84Å; N73-E87 WeakPolarHBondContact O-CA 3.38Å; N73-V88 HydrophobicContact CB-CG2 4.44Å; N73-V88 PolarHBondContact O-N 3.06Å; N73-D116 PolarHBondContact ND2-OD1 3.01Å; N73-G118 VanDerWaalsContact ND2-C 3.29Å; N73-G118 WeakPolarHBondContact ND2-CA 3.44Å; N73-G118 PolarHBondContact ND2-N 3.43Å; N73-G118 PolarHBondContact OD1-O 3.46Å; N73-D119 WeakPolarHBondContact OD1-CA 3.47Å; N73-D119 PolarHBondContact OD1-N 2.93Å; N73-D119 PolarHBondContact OD1-O 3.24Å; N73-D119 VanDerWaalsContact OD1-O 3.08Å
74	A	96.1	Very high	90.4	Very high	4 Å²	4	60.7 Å²	60.7	3%	0.033	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	136.7	172.2	0	0	0	0	0	110.9	V85 L86 T117 D119 I121	A74-V85 HydrophobicContact CB-CG1 3.92Å; A74-L86 CarbonylContact C-O 3.58Å; A74-L86 WeakPolarHBondContact CA-O 3.38Å; A74-T117 HydrophobicContact CB-CG2 4.36Å; A74-T117 WeakPolarHBondContact O-CB 3.37Å; A74-T117 WeakPolarHBondContact O-CG2 3.36Å; A74-T117 PolarHBondContact O-N 2.75Å; A74-T117 PolarHBondContact O-OG1 3.34Å; A74-D119 PolarHBondContact N-O 3.45Å; A74-I121 HydrophobicContact CB-CG1 3.8Å
75	L	95.9	Very high	90.5	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	142.9	173.1	-44	179.3	0	0	0	109.3	V62 F64 P69 V85 L86 V88 V97 T99 V114 V115 D116	V62-L75 HydrophobicContact CB-CD1 4.47Å; V62-L75 HydrophobicContact CG2-CD1 4.4Å; F64-L75 HydrophobicContact CE2-CD1 4.06Å; F64-L75 HydrophobicContact CZ-CD1 3.97Å; F64-L75 HydrophobicContact CZ-CD2 4.05Å; P69-L75 HydrophobicContact CB-CD2 3.98Å; P69-L75 HydrophobicContact CG-CD2 3.79Å; L75-V85 CarbonylContact O-C 3.59Å; L75-V85 WeakPolarHBondContact O-CA 3.24Å; L75-L86 HydrophobicContact CB-CB 4.3Å; L75-L86 PolarHBondContact N-O 2.92Å; L75-L86 PolarHBondContact O-N 3.12Å; L75-V88 HydrophobicContact CD1-CG2 3.86Å; L75-V88 HydrophobicContact CD2-CG2 4.1Å; L75-V88 HydrophobicContact CG-CG2 3.92Å; L75-V97 HydrophobicContact CD1-CG2 4.16Å; L75-T99 HydrophobicContact CD1-CG2 3.61Å; L75-V114 HydrophobicContact CB-CG1 3.54Å; L75-V114 HydrophobicContact CD1-CG1 4.04Å; L75-V114 HydrophobicContact CG-CG1 4.39Å; L75-V115 CarbonylContact C-O 3.54Å; L75-V115 WeakPolarHBondContact CA-O 3.5Å; L75-D116 HydrophobicContact CD2-CB 3.92Å; L75-D116 WeakPolarHBondContact CD2-OD1 3.29Å
76	E	95.6	Very high	91.1	Very high	65 Å²	65	55.7 Å²	55.7	30%	0.304	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	131.6	178.1	-69	-170	171.4	0	0	111.5	R83 V85 V114 V115 T117	E76-R83 IonicContact OE1-CZ 2.82Å; E76-R83 VanDerWaalsContact OE1-CZ 3.24Å; E76-R83 IonicContact OE1-NE 3.68Å; E76-R83 PolarHBondContact OE1-NE 3.31Å; E76-R83 IonicContact OE1-NH2 3.87Å; E76-R83 PolarHBondContact OE1-NH2 3.28Å; E76-V85 HydrophobicContact CG-CG2 4.44Å; E76-V114 CarbonylContact O-C 3.6Å; E76-V114 WeakPolarHBondContact O-CA 3.32Å; E76-V115 PolarHBondContact N-O 2.67Å; E76-V115 PolarHBondContact O-N 3.38Å; E76-T117 HydrophobicContact CG-CG2 3.77Å
77	V	94.8	Very high	91.8	Very high	11 Å²	11	47.7 Å²	47.7	7%	0.067	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	119.9	175.9	-174.2	0	0	0	0	109.7	I52 R80 L84 L86 L108 Q112 V114	I52-V77 HydrophobicContact CD1-CG1 4.26Å; V77-R80 HydrophobicContact CG1-CG 4.48Å; V77-L84 HydrophobicContact CB-CB 4.37Å; V77-L84 HydrophobicContact CB-CD2 4.34Å; V77-L84 HydrophobicContact CG2-CB 4.41Å; V77-L84 HydrophobicContact CG2-CD2 3.84Å; V77-L84 HydrophobicContact CG2-CG 4.11Å; V77-L84 PolarHBondContact N-O 2.93Å; V77-L84 VanDerWaalsContact N-O 3.12Å; V77-L86 HydrophobicContact CG2-CD1 3.66Å; V77-L86 HydrophobicContact CG2-CD2 4.42Å; V77-L86 HydrophobicContact CG2-CG 3.92Å; V77-L108 HydrophobicContact CG1-CD2 3.84Å; V77-L108 HydrophobicContact CG2-CD2 4.45Å; V77-Q112 VanDerWaalsContact CG1-CD 3.44Å; V77-Q112 HydrophobicContact CG1-CG 3.82Å; V77-V114 HydrophobicContact CG2-CG2 4.33Å
78	A	91	Very high	92.6	Very high	40 Å²	40	45.2 Å²	45.2	33%	0.331	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	149.1	-178.6	0	0	0	0	0	112.4	Q112 K113	A78-Q112 PolarHBondContact O-NE2 3.45Å; A78-K113 HydrophobicContact CB-CB 4.33Å; A78-K113 WeakPolarHBondContact CB-O 3.46Å; A78-K113 PolarHBondContact N-O 3.02Å
79	G	82.6	Confident	92.8	Very high	84 Å²	84	42.9 Å²	42.9	87%	0.866	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.4	25.4	170	0	0	0	0	0	115.2
80	R	85.8	Confident	92.9	Very high	64 Å²	64	45.3 Å²	45.3	24%	0.242	26%	0.255	C	S	.	.			trans	-105	152.1	169.4	-67.6	179.3	68.6	103	-6	110.4	V77 S82 G104 E106	V77-R80 HydrophobicContact CG1-CG 4.48Å; R80-S82 WeakPolarHBondContact CB-O 3.07Å; R80-G104 PolarHBondContact NH2-O 3.27Å; R80-E106 PolarHBondContact NH1-O 3.27Å; R80-E106 PolarHBondContact NH2-O 3.05Å; R80-E106 VanDerWaalsContact NH2-O 3.1Å
81	E	80.9	Confident	93	Very high	212 Å²	212	45.8 Å²	45.8	99%	0.991	25%	0.251	S	S	*	.	S	Bend	trans	-70.4	-45.9	172	-67.5	-175.3	169.5	0	0	111.1
82	S	86.3	Confident	92.9	Very high	58 Å²	58	45 Å²	45	41%	0.406	25%	0.247	S	C	.	.	S	Bend	trans	-88.4	139.1	170.2	64.9	0	0	0	0	111.1	R80 L84	R80-S82 WeakPolarHBondContact CB-O 3.07Å; S82-L84 PolarHBondContact O-N 3.11Å
83	R	92.4	Very high	92.6	Very high	106 Å²	106	44 Å²	44	40%	0.4	25%	0.252	S	S	.	.			trans	-70.5	119.1	177.7	-172	-168.8	-178.9	-161.4	-4.7	109.4	E76 V85 E139	E76-R83 IonicContact OE1-CZ 2.82Å; E76-R83 VanDerWaalsContact OE1-CZ 3.24Å; E76-R83 IonicContact OE1-NE 3.68Å; E76-R83 PolarHBondContact OE1-NE 3.31Å; E76-R83 IonicContact OE1-NH2 3.87Å; E76-R83 PolarHBondContact OE1-NH2 3.28Å; R83-V85 HydrophobicContact CG-CG2 4.39Å; R83-E139 WeakPolarHBondContact CD-OE1 3.2Å; R83-E139 IonicContact CZ-OE1 3.35Å; R83-E139 IonicContact NE-OE1 3.54Å; R83-E139 IonicContact NH1-OE1 3.59Å; R83-E139 PolarHBondContact NH1-OE1 3.06Å
84	L	94.8	Very high	92.3	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	29%	0.288	C	S	.	.			trans	-110.8	116.6	175.4	176.2	64.5	0	0	0	109.9	V77 S82 L86 A101 D103 L108	V77-L84 HydrophobicContact CB-CB 4.37Å; V77-L84 HydrophobicContact CB-CD2 4.34Å; V77-L84 HydrophobicContact CG2-CB 4.41Å; V77-L84 HydrophobicContact CG2-CD2 3.84Å; V77-L84 HydrophobicContact CG2-CG 4.11Å; V77-L84 PolarHBondContact N-O 2.93Å; V77-L84 VanDerWaalsContact N-O 3.12Å; S82-L84 PolarHBondContact O-N 3.11Å; L84-L86 HydrophobicContact CD1-CD2 4.31Å; L84-L86 HydrophobicContact CD2-CD2 4.21Å; L84-L86 HydrophobicContact CG-CD2 4.07Å; L84-A101 HydrophobicContact CD1-CB 4.26Å; L84-D103 HydrophobicContact CD1-CB 3.75Å; L84-L108 HydrophobicContact CD2-CD1 3.92Å; L84-L108 HydrophobicContact CD2-CD2 3.82Å; L84-L108 HydrophobicContact CD2-CG 4.17Å
85	V	96.6	Very high	92.1	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.024	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	134.1	175	-176.2	0	0	0	0	109.5	A74 L75 E76 R83 M102 I121 I137	A74-V85 HydrophobicContact CB-CG1 3.92Å; L75-V85 CarbonylContact O-C 3.59Å; L75-V85 WeakPolarHBondContact O-CA 3.24Å; E76-V85 HydrophobicContact CG-CG2 4.44Å; R83-V85 HydrophobicContact CG-CG2 4.39Å; V85-M102 HydrophobicContact CB-CB 4.49Å; V85-M102 HydrophobicContact CB-CG 4.42Å; V85-M102 WeakPolarHBondContact O-CB 3.48Å; V85-M102 PolarHBondContact O-N 3.48Å; V85-I121 HydrophobicContact CG1-CD1 4.28Å; V85-I121 HydrophobicContact CG1-CG1 4.06Å; V85-I137 HydrophobicContact CB-CG2 3.99Å; V85-I137 HydrophobicContact CG1-CG2 4.4Å; V85-I137 HydrophobicContact CG2-CD1 4.01Å; V85-I137 HydrophobicContact CG2-CG2 3.97Å
86	L	96.9	Very high	92	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.9	174.2	-50.1	177.4	0	0	0	108.5	V60 V62 A74 L75 V77 L84 T99 I100 A101	V60-L86 HydrophobicContact CB-CD1 4.08Å; V60-L86 HydrophobicContact CB-CD2 4.38Å; V60-L86 HydrophobicContact CG1-CD1 3.95Å; V60-L86 HydrophobicContact CG2-CD2 4.1Å; V62-L86 HydrophobicContact CG2-CD1 4.09Å; A74-L86 CarbonylContact C-O 3.58Å; A74-L86 WeakPolarHBondContact CA-O 3.38Å; L75-L86 HydrophobicContact CB-CB 4.3Å; L75-L86 PolarHBondContact N-O 2.92Å; L75-L86 PolarHBondContact O-N 3.12Å; V77-L86 HydrophobicContact CG2-CD1 3.66Å; V77-L86 HydrophobicContact CG2-CD2 4.42Å; V77-L86 HydrophobicContact CG2-CG 3.92Å; L84-L86 HydrophobicContact CD1-CD2 4.31Å; L84-L86 HydrophobicContact CD2-CD2 4.21Å; L84-L86 HydrophobicContact CG-CD2 4.07Å; L86-T99 HydrophobicContact CB-CG2 4.33Å; L86-I100 CarbonylContact C-O 3.45Å; L86-I100 WeakPolarHBondContact CA-O 3.32Å; L86-A101 HydrophobicContact CD2-CB 3.65Å
87	E	97.3	Very high	92.1	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.2	174.9	-176.1	-170.7	156.6	0	0	110.3	L72 N73 A89 T99 I100 M102 I121 H156 R270	L72-E87 WeakPolarHBondContact CD2-OE1 3.42Å; N73-E87 WeakPolarHBondContact O-CA 3.38Å; E87-A89 PolarHBondContact O-N 3.39Å; E87-T99 CarbonylContact O-C 3.56Å; E87-T99 WeakPolarHBondContact O-CA 3.42Å; E87-T99 VanDerWaalsContact O-CB 3.31Å; E87-T99 WeakPolarHBondContact O-CB 3.41Å; E87-I100 PolarHBondContact N-O 3.13Å; E87-I100 PolarHBondContact O-N 3.43Å; E87-M102 HydrophobicContact CB-CE 3.79Å; E87-I121 HydrophobicContact CB-CD1 4.47Å; E87-H156 IonicContact OE1-CD2 2.84Å; E87-H156 IonicContact OE1-CE1 2.76Å; E87-H156 PolarHBondContact OE1-CE1 3.14Å; E87-H156 IonicContact OE1-NE2 3.91Å; E87-H156 PolarHBondContact OE1-NE2 3.35Å; E87-H156 IonicContact OE2-NE2 2.97Å; E87-R270 VanDerWaalsContact CD-NE 3.27Å; E87-R270 IonicContact OE1-CZ 3.45Å; E87-R270 IonicContact OE1-NE 3.62Å; E87-R270 PolarHBondContact OE1-NE 3.12Å; E87-R270 IonicContact OE1-NH2 2.95Å; E87-R270 PolarHBondContact OE1-NH2 3.47Å; E87-R270 WeakPolarHBondContact OE2-CD 3.48Å; E87-R270 WeakPolarHBondContact OE2-CG 3.2Å; E87-R270 IonicContact OE2-CZ 3.67Å; E87-R270 IonicContact OE2-NE 2.78Å; E87-R270 PolarHBondContact OE2-NE 3.32Å; E87-R270 IonicContact OE2-NH2 3.99Å
88	V	96.8	Very high	92.2	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	118.5	177.3	-179.9	0	0	0	0	110.4	P69 P70 L72 N73 L75 V97 T99	P69-V88 HydrophobicContact CB-CG2 4.28Å; P70-V88 WeakPolarHBondContact O-CB 3.34Å; L72-V88 WeakPolarHBondContact CA-O 3.24Å; L72-V88 PolarHBondContact N-O 3.5Å; N73-V88 HydrophobicContact CB-CG2 4.44Å; N73-V88 PolarHBondContact O-N 3.06Å; L75-V88 HydrophobicContact CD1-CG2 3.86Å; L75-V88 HydrophobicContact CD2-CG2 4.1Å; L75-V88 HydrophobicContact CG-CG2 3.92Å; V88-V97 HydrophobicContact CG1-CB 3.98Å; V88-V97 HydrophobicContact CG1-CG1 4.25Å; V88-V97 HydrophobicContact CG2-CB 4.48Å; V88-V97 HydrophobicContact CG2-CG2 4.2Å; V88-T99 HydrophobicContact CB-CG2 4.48Å; V88-T99 HydrophobicContact CG2-CG2 3.96Å
89	A	94.7	Very high	92.4	Very high	15 Å²	15	53.1 Å²	53.1	12%	0.124	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-38.6	179.4	0	0	0	0	0	112.8	I71 E87 R98 I100 L311	I71-A89 WeakPolarHBondContact CG2-O 3.38Å; E87-A89 PolarHBondContact O-N 3.39Å; A89-R98 PolarHBondContact N-O 3.05Å; A89-I100 HydrophobicContact CB-CD1 3.7Å; A89-I100 HydrophobicContact CB-CG1 3.98Å; A89-L311 HydrophobicContact CB-CD1 4.19Å; A89-L311 HydrophobicContact CB-CD2 4.07Å
90	Q	94	Very high	93.1	Very high	53 Å²	53	49.3 Å²	49.3	25%	0.248	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	155.7	-174.9	-61.6	179.1	-28.1	0	0	111.4	V97 R98	Q90-V97 WeakPolarHBondContact O-CA 3.32Å; Q90-R98 HydrophobicContact CB-CB 4.29Å; Q90-R98 PolarHBondContact N-O 3.33Å; Q90-R98 PolarHBondContact O-N 3.09Å
91	H	95.5	Very high	93.6	Very high	83 Å²	83	46.3 Å²	46.3	38%	0.384	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.6	168.4	-62.7	173.1	0	0	0	109.1	L68 P69	L68-H91 HydrophobicContact CD2-CB 4.24Å; P69-H91 PolarHBondContact O-CE1 2.71Å; P69-H91 PolarHBondContact O-NE2 3.35Å
92	L	91.9	Very high	94.3	Very high	78 Å²	78	36.7 Å²	36.7	41%	0.408	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-17.3	-177	-61.4	-179.5	0	0	0	113.1	T96 R98	L92-T96 HydrophobicContact CD1-CG2 4.17Å; L92-T96 PolarHBondContact N-O 3.05Å; L92-R98 HydrophobicContact CD1-CB 4.09Å; L92-R98 HydrophobicContact CD2-CB 4.1Å; L92-R98 HydrophobicContact CG-CB 3.98Å
93	G	89.4	Confident	94.7	Very high	41 Å²	41	37.3 Å²	37.3	42%	0.423	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	100.2	176.2	-167.3	0	0	0	0	0	111.7	N95 T96	G93-N95 PolarHBondContact O-N 3.28Å; G93-N95 VanDerWaalsContact O-N 3.14Å; G93-T96 WeakPolarHBondContact O-CB 3.44Å; G93-T96 PolarHBondContact O-N 3.2Å
94	E	88.5	Confident	94.7	Very high	170 Å²	170	33.1 Å²	33.1	79%	0.794	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	39.5	-179.3	-58	-174.6	170.5	0	0	113.7	Q63 T96	Q63-E94 PolarHBondContact NE2-O 3.46Å; E94-T96 PolarHBondContact O-N 3.21Å; E94-T96 VanDerWaalsContact O-N 3.12Å; E94-T96 PolarHBondContact O-OG1 3Å
95	N	92	Very high	94.6	Very high	82 Å²	82	34.2 Å²	34.2	44%	0.439	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	29.8	-173.1	-59.5	-13.7	0	0	0	114.6	Q63 F64 D65 L68 G93	Q63-N95 WeakPolarHBondContact CA-O 3.39Å; F64-N95 PolarHBondContact N-O 3.49Å; F64-N95 WeakPolarHBondContact O-CB 3.49Å; D65-N95 PolarHBondContact O-ND2 3.48Å; L68-N95 HydrophobicContact CD1-CB 4.06Å; L68-N95 VanDerWaalsContact CD1-O 3.3Å; L68-N95 WeakPolarHBondContact CD1-O 3.39Å; G93-N95 PolarHBondContact O-N 3.28Å; G93-N95 VanDerWaalsContact O-N 3.14Å
96	T	94.8	Very high	94.3	Very high	17 Å²	17	41 Å²	41	10%	0.104	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.5	178.1	-55.4	0	0	0	0	110.6	D61 V62 L92 G93 E94	D61-T96 HydrophobicContact CB-CG2 4.11Å; V62-T96 WeakPolarHBondContact O-CA 3.28Å; L92-T96 HydrophobicContact CD1-CG2 4.17Å; L92-T96 PolarHBondContact N-O 3.05Å; G93-T96 WeakPolarHBondContact O-CB 3.44Å; G93-T96 PolarHBondContact O-N 3.2Å; E94-T96 PolarHBondContact O-N 3.21Å; E94-T96 VanDerWaalsContact O-N 3.12Å; E94-T96 PolarHBondContact O-OG1 3Å
97	V	96.4	Very high	93.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	140.7	172.5	-58.6	0	0	0	0	109.9	D61 V62 F64 L68 L75 V88 Q90 T99	D61-V97 WeakPolarHBondContact CA-O 3.32Å; V62-V97 HydrophobicContact CB-CG2 4.03Å; V62-V97 PolarHBondContact N-O 2.86Å; V62-V97 WeakPolarHBondContact O-CG2 3.49Å; V62-V97 PolarHBondContact O-N 3.15Å; F64-V97 HydrophobicContact CD2-CG2 4.16Å; F64-V97 HydrophobicContact CE2-CG2 3.72Å; L68-V97 HydrophobicContact CD1-CG1 3.72Å; L68-V97 HydrophobicContact CD2-CG1 4.18Å; L68-V97 HydrophobicContact CG-CG1 3.69Å; L75-V97 HydrophobicContact CD1-CG2 4.16Å; V88-V97 HydrophobicContact CG1-CB 3.98Å; V88-V97 HydrophobicContact CG1-CG1 4.25Å; V88-V97 HydrophobicContact CG2-CB 4.48Å; V88-V97 HydrophobicContact CG2-CG2 4.2Å; Q90-V97 WeakPolarHBondContact O-CA 3.32Å; V97-T99 HydrophobicContact CG2-CG2 3.91Å
98	R	96.8	Very high	93.7	Very high	47 Å²	47	45.4 Å²	45.4	18%	0.177	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.5	170.8	177.6	157.8	-71.4	171.9	1.2	108.9	V59 D61 A89 Q90 L92 L311	V59-R98 HydrophobicContact CG1-CG 3.58Å; D61-R98 WeakPolarHBondContact OD1-CA 3.42Å; D61-R98 WeakPolarHBondContact OD1-CB 3.47Å; D61-R98 WeakPolarHBondContact OD1-CG 3.4Å; D61-R98 IonicContact OD1-CZ 2.9Å; D61-R98 IonicContact OD1-NE 3.75Å; D61-R98 PolarHBondContact OD1-NE 3.43Å; D61-R98 IonicContact OD1-NH2 3.72Å; D61-R98 IonicContact OD2-CZ 3.84Å; D61-R98 IonicContact OD2-NE 2.67Å; D61-R98 IonicContact OD2-NH2 3.01Å; D61-R98 PolarHBondContact OD2-NH2 3.34Å; A89-R98 PolarHBondContact N-O 3.05Å; Q90-R98 HydrophobicContact CB-CB 4.29Å; Q90-R98 PolarHBondContact N-O 3.33Å; Q90-R98 PolarHBondContact O-N 3.09Å; L92-R98 HydrophobicContact CD1-CB 4.09Å; L92-R98 HydrophobicContact CD2-CB 4.1Å; L92-R98 HydrophobicContact CG-CB 3.98Å; R98-L311 HydrophobicContact CG-CD2 3.7Å
99	T	96.8	Very high	93.5	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	158.3	-175.5	68.2	0	0	0	0	111.5	V59 V60 V62 L75 L86 E87 V88 V97	V59-T99 WeakPolarHBondContact CA-O 3.13Å; V60-T99 PolarHBondContact N-O 2.93Å; V60-T99 WeakPolarHBondContact O-CA 3.48Å; V60-T99 WeakPolarHBondContact O-CB 3.19Å; V60-T99 PolarHBondContact O-N 3.16Å; V60-T99 PolarHBondContact O-OG1 3.27Å; V62-T99 HydrophobicContact CG2-CG2 4.37Å; L75-T99 HydrophobicContact CD1-CG2 3.61Å; L86-T99 HydrophobicContact CB-CG2 4.33Å; E87-T99 CarbonylContact O-C 3.56Å; E87-T99 WeakPolarHBondContact O-CA 3.42Å; E87-T99 VanDerWaalsContact O-CB 3.31Å; E87-T99 WeakPolarHBondContact O-CB 3.41Å; V88-T99 HydrophobicContact CB-CG2 4.48Å; V88-T99 HydrophobicContact CG2-CG2 3.96Å; V97-T99 HydrophobicContact CG2-CG2 3.91Å
100	I	96.6	Very high	93.5	Very high	4 Å²	4	58.1 Å²	58.1	2%	0.021	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.6	174.3	-58.7	158.5	0	0	0	107.7	L86 E87 A89 M102 G266 V307 L311	L86-I100 CarbonylContact C-O 3.45Å; L86-I100 WeakPolarHBondContact CA-O 3.32Å; E87-I100 PolarHBondContact N-O 3.13Å; E87-I100 PolarHBondContact O-N 3.43Å; A89-I100 HydrophobicContact CB-CD1 3.7Å; A89-I100 HydrophobicContact CB-CG1 3.98Å; I100-M102 HydrophobicContact CB-CE 4.25Å; I100-M102 HydrophobicContact CG2-CE 4.06Å; I100-M102 WeakPolarHBondContact O-CE 3.2Å; I100-G266 VanDerWaalsContact CG2-CA 3.44Å; I100-V307 HydrophobicContact CD1-CG1 3.34Å; I100-V307 HydrophobicContact CG1-CG1 4.13Å; I100-V307 HydrophobicContact CG2-CG2 4.36Å; I100-L311 HydrophobicContact CD1-CD1 4.47Å; I100-L311 HydrophobicContact CG1-CD2 4.44Å
101	A	96.2	Very high	93.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	138.3	177.6	0	0	0	0	0	112.1	A58 L84 L86 D103 T105	A58-A101 WeakPolarHBondContact O-CB 3.29Å; A58-A101 PolarHBondContact O-N 3.17Å; L84-A101 HydrophobicContact CD1-CB 4.26Å; L86-A101 HydrophobicContact CD2-CB 3.65Å; A101-D103 WeakPolarHBondContact CB-O 3.47Å; A101-T105 HydrophobicContact CB-CG2 3.4Å; A101-T105 VanDerWaalsContact CB-CG2 3.4Å
102	M	95.4	Very high	93.4	Very high	10 Å²	10	55.7 Å²	55.7	5%	0.049	31%	0.314	C	S	.	.	S	Bend	trans	-90.4	-6.7	175	-60	-60.5	125.9	0	0	113.1	V85 E87 I100 I121 V136 I137 A267 R270	V85-M102 HydrophobicContact CB-CB 4.49Å; V85-M102 HydrophobicContact CB-CG 4.42Å; V85-M102 WeakPolarHBondContact O-CB 3.48Å; V85-M102 PolarHBondContact O-N 3.48Å; E87-M102 HydrophobicContact CB-CE 3.79Å; I100-M102 HydrophobicContact CB-CE 4.25Å; I100-M102 HydrophobicContact CG2-CE 4.06Å; I100-M102 WeakPolarHBondContact O-CE 3.2Å; M102-I121 HydrophobicContact CG-CD1 3.88Å; M102-I121 HydrophobicContact SD-CD1 4.08Å; M102-V136 HydrophobicContact CB-CG1 4.36Å; M102-V136 HydrophobicContact SD-CG2 4.4Å; M102-I137 HydrophobicContact CB-CG2 4.15Å; M102-I137 HydrophobicContact CG-CG2 4.28Å; M102-A267 WeakPolarHBondContact O-CB 3.38Å; M102-R270 HydrophobicContact CE-CG 4.31Å; M102-R270 HydrophobicContact SD-CB 4.44Å; M102-R270 HydrophobicContact SD-CG 4.21Å
103	D	94.4	Very high	93.5	Very high	72 Å²	72	56.7 Å²	56.7	39%	0.385	32%	0.315	S	S	.	.	S	Bend	trans	-145.7	175.6	176.6	-163.6	3.9	0	0	0	109.8	L84 A101 T105	L84-D103 HydrophobicContact CD1-CB 3.75Å; A101-D103 WeakPolarHBondContact CB-O 3.47Å; D103-T105 PolarHBondContact O-N 3.3Å
104	G	92.1	Very high	93.8	Very high	18 Å²	18	54.7 Å²	54.7	19%	0.186	30%	0.295	C	S	.	.			trans	-52	129.7	180	0	0	0	0	0	113.1	R80 E106	R80-G104 PolarHBondContact NH2-O 3.27Å; G104-E106 VanDerWaalsContact C-N 3.31Å; G104-E106 VanDerWaalsContact CA-OE2 3.27Å; G104-E106 WeakPolarHBondContact CA-OE2 3.25Å
105	T	93.3	Very high	94.1	Very high	23 Å²	23	48.5 Å²	48.5	14%	0.141	27%	0.268	C	S	.	.			trans	-89.7	5.4	179.8	55.5	0	0	0	0	112.7	G57 V60 A101 D103 G107 L108	G57-T105 WeakPolarHBondContact O-CG2 3.33Å; G57-T105 PolarHBondContact O-OG1 3.45Å; V60-T105 HydrophobicContact CG2-CG2 3.94Å; A101-T105 HydrophobicContact CB-CG2 3.4Å; A101-T105 VanDerWaalsContact CB-CG2 3.4Å; D103-T105 PolarHBondContact O-N 3.3Å; T105-G107 PolarHBondContact O-N 3.05Å; T105-L108 HydrophobicContact CG2-CD1 3.98Å; T105-L108 WeakPolarHBondContact O-CB 3.32Å; T105-L108 WeakPolarHBondContact O-CG 3.3Å; T105-L108 PolarHBondContact O-N 3.2Å
106	E	90.5	Very high	94.2	Very high	148 Å²	148	45.3 Å²	45.3	69%	0.692	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	140.6	175	-59.9	86.6	177.5	0	0	110.8	R80 G104 L108	R80-E106 PolarHBondContact NH1-O 3.27Å; R80-E106 PolarHBondContact NH2-O 3.05Å; R80-E106 VanDerWaalsContact NH2-O 3.1Å; G104-E106 VanDerWaalsContact C-N 3.31Å; G104-E106 VanDerWaalsContact CA-OE2 3.27Å; G104-E106 WeakPolarHBondContact CA-OE2 3.25Å; E106-L108 VanDerWaalsContact C-N 3.28Å; E106-L108 PolarHBondContact O-N 3.05Å
107	G	89.3	Confident	94	Very high	69 Å²	69	46.5 Å²	46.5	71%	0.711	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	2	-179.4	0	0	0	0	0	115.3	T105	T105-G107 PolarHBondContact O-N 3.05Å
108	L	92.6	Very high	93.7	Very high	24 Å²	24	48.5 Å²	48.5	13%	0.126	28%	0.279	C	S	.	.			trans	-69.4	136.1	171.3	-70.4	-176.8	0	0	0	112	I52 V55 V60 V77 L84 T105 E106	I52-L108 HydrophobicContact CD1-CB 4.42Å; I52-L108 HydrophobicContact CD1-CD1 4.21Å; I52-L108 HydrophobicContact CD1-CD2 3.85Å; I52-L108 HydrophobicContact CD1-CG 4.41Å; V55-L108 HydrophobicContact CG1-CD1 4.4Å; V55-L108 HydrophobicContact CG2-CB 3.96Å; V55-L108 HydrophobicContact CG2-CD1 4.24Å; V60-L108 HydrophobicContact CG2-CD1 3.84Å; V77-L108 HydrophobicContact CG1-CD2 3.84Å; V77-L108 HydrophobicContact CG2-CD2 4.45Å; L84-L108 HydrophobicContact CD2-CD1 3.92Å; L84-L108 HydrophobicContact CD2-CD2 3.82Å; L84-L108 HydrophobicContact CD2-CG 4.17Å; T105-L108 HydrophobicContact CG2-CD1 3.98Å; T105-L108 WeakPolarHBondContact O-CB 3.32Å; T105-L108 WeakPolarHBondContact O-CG 3.3Å; T105-L108 PolarHBondContact O-N 3.2Å; E106-L108 VanDerWaalsContact C-N 3.28Å; E106-L108 PolarHBondContact O-N 3.05Å
109	V	93.1	Very high	93.5	Very high	95 Å²	95	48.8 Å²	48.8	58%	0.576	28%	0.284	S	S	*	.			trans	-121.3	141.4	179.4	-173.2	0	0	0	0	110.1	Q112	V109-Q112 WeakPolarHBondContact O-CB 3.43Å; V109-Q112 PolarHBondContact O-N 2.94Å; V109-Q112 VanDerWaalsContact O-N 3.14Å
110	R	94.8	Very high	93.4	Very high	187 Å²	187	49.8 Å²	49.8	71%	0.706	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	138.3	173.9	-61.9	-178.7	-176	-177.6	-1.1	110.4	I52 V53 Q112	I52-R110 CarbonylContact O-C 3.54Å; I52-R110 WeakPolarHBondContact O-CA 3.49Å; V53-R110 VanDerWaalsContact O-CD 3.24Å; V53-R110 WeakPolarHBondContact O-CD 3.45Å; V53-R110 WeakPolarHBondContact O-CG 3.42Å; V53-R110 PolarHBondContact O-NE 2.91Å; R110-Q112 VanDerWaalsContact C-N 3.31Å
111	G	92.6	Very high	93.4	Very high	46 Å²	46	49.9 Å²	49.9	47%	0.474	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	-7	-174.2	0	0	0	0	0	114.3	I52 K113	I52-G111 PolarHBondContact O-N 3.4Å; G111-K113 PolarHBondContact O-N 2.7Å
112	Q	93.9	Very high	93.4	Very high	39 Å²	39	55.5 Å²	55.5	18%	0.182	31%	0.312	C	S	.	.			trans	-60	137.9	174.9	-173.5	168.3	12.4	0	0	110.4	R51 I52 V77 A78 V109 R110	R51-Q112 WeakPolarHBondContact CA-O 3.46Å; I52-Q112 HydrophobicContact CD1-CB 4.04Å; I52-Q112 HydrophobicContact CG1-CB 4.38Å; I52-Q112 PolarHBondContact N-O 3.26Å; V77-Q112 VanDerWaalsContact CG1-CD 3.44Å; V77-Q112 HydrophobicContact CG1-CG 3.82Å; A78-Q112 PolarHBondContact O-NE2 3.45Å; V109-Q112 WeakPolarHBondContact O-CB 3.43Å; V109-Q112 PolarHBondContact O-N 2.94Å; V109-Q112 VanDerWaalsContact O-N 3.14Å; R110-Q112 VanDerWaalsContact C-N 3.31Å
113	K	94.8	Very high	93.4	Very high	98 Å²	98	55 Å²	55	43%	0.426	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	133.6	-175.8	-172.7	178.1	-179.5	-176.1	0	110.3	H49 A78 G111	H49-K113 PolarHBondContact CD2-NZ 2.99Å; H49-K113 PolarHBondContact CE1-NZ 3.46Å; H49-K113 VanDerWaalsContact CE1-NZ 3.34Å; H49-K113 VanDerWaalsContact ND1-CE 3.26Å; H49-K113 WeakPolarHBondContact ND1-CE 3.19Å; H49-K113 PolarHBondContact NE2-NZ 3.48Å; A78-K113 HydrophobicContact CB-CB 4.33Å; A78-K113 WeakPolarHBondContact CB-O 3.46Å; A78-K113 PolarHBondContact N-O 3.02Å; G111-K113 PolarHBondContact O-N 2.7Å
114	V	95.4	Very high	93.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138.4	174.2	-179.4	0	0	0	0	108	H49 G50 I52 V62 L75 E76 V77	H49-V114 WeakPolarHBondContact CA-O 3.47Å; G50-V114 PolarHBondContact N-O 3.45Å; G50-V114 PolarHBondContact O-N 2.69Å; I52-V114 HydrophobicContact CD1-CG2 4.25Å; I52-V114 HydrophobicContact CG1-CG2 3.63Å; V62-V114 HydrophobicContact CG1-CB 3.81Å; V62-V114 HydrophobicContact CG1-CG1 4.07Å; V62-V114 HydrophobicContact CG1-CG2 3.94Å; V62-V114 HydrophobicContact CG2-CG1 4.45Å; V62-V114 HydrophobicContact CG2-CG2 4.11Å; L75-V114 HydrophobicContact CB-CG1 3.54Å; L75-V114 HydrophobicContact CD1-CG1 4.04Å; L75-V114 HydrophobicContact CG-CG1 4.39Å; E76-V114 CarbonylContact O-C 3.6Å; E76-V114 WeakPolarHBondContact O-CA 3.32Å; V77-V114 HydrophobicContact CG2-CG2 4.33Å
115	V	94.3	Very high	93.5	Very high	39 Å²	39	51.8 Å²	51.8	24%	0.236	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.6	-179.8	-175.7	0	0	0	0	108.1	F47 L75 E76	F47-V115 HydrophobicContact CB-CG1 4.06Å; L75-V115 CarbonylContact C-O 3.54Å; L75-V115 WeakPolarHBondContact CA-O 3.5Å; E76-V115 PolarHBondContact N-O 2.67Å; E76-V115 PolarHBondContact O-N 3.38Å
116	D	94.3	Very high	93.5	Very high	16 Å²	16	50.7 Å²	50.7	9%	0.086	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	131.5	169.4	-178.4	22	0	0	0	109.8	F47 A48 F64 P69 N73 L75 G118	F47-D116 WeakPolarHBondContact CD1-O 3.47Å; A48-D116 HydrophobicContact CB-CB 4.09Å; A48-D116 WeakPolarHBondContact O-CB 3.32Å; A48-D116 PolarHBondContact O-N 3.25Å; F64-D116 HydrophobicContact CE1-CB 4.22Å; P69-D116 HydrophobicContact CG-CB 3.97Å; N73-D116 PolarHBondContact ND2-OD1 3.01Å; L75-D116 HydrophobicContact CD2-CB 3.92Å; L75-D116 WeakPolarHBondContact CD2-OD1 3.29Å; D116-G118 VanDerWaalsContact C-N 3.35Å; D116-G118 PolarHBondContact OD1-N 3.49Å; D116-G118 VanDerWaalsContact OD1-N 3.08Å
117	T	91.3	Very high	93.5	Very high	42 Å²	42	46 Å²	46	26%	0.258	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-16.7	177.3	66.6	0	0	0	0	112.4	A74 E76 D119	A74-T117 HydrophobicContact CB-CG2 4.36Å; A74-T117 WeakPolarHBondContact O-CB 3.37Å; A74-T117 WeakPolarHBondContact O-CG2 3.36Å; A74-T117 PolarHBondContact O-N 2.75Å; A74-T117 PolarHBondContact O-OG1 3.34Å; E76-T117 HydrophobicContact CG-CG2 3.77Å; T117-D119 PolarHBondContact O-N 2.97Å; T117-D119 PolarHBondContact OG1-O 3Å
118	G	90.3	Very high	93.6	Very high	41 Å²	41	46.3 Å²	46.3	42%	0.423	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	83.7	-13.1	-179.6	0	0	0	0	0	114.8	N73 D116	N73-G118 VanDerWaalsContact ND2-C 3.29Å; N73-G118 WeakPolarHBondContact ND2-CA 3.44Å; N73-G118 PolarHBondContact ND2-N 3.43Å; N73-G118 PolarHBondContact OD1-O 3.46Å; D116-G118 VanDerWaalsContact C-N 3.35Å; D116-G118 PolarHBondContact OD1-N 3.49Å; D116-G118 VanDerWaalsContact OD1-N 3.08Å
119	D	92.1	Very high	93.7	Very high	53 Å²	53	45.2 Å²	45.2	28%	0.283	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	163.3	177.9	-74.8	-41.6	0	0	0	110.8	N73 A74 T117 R122	N73-D119 WeakPolarHBondContact OD1-CA 3.47Å; N73-D119 PolarHBondContact OD1-N 2.93Å; N73-D119 PolarHBondContact OD1-O 3.24Å; N73-D119 VanDerWaalsContact OD1-O 3.08Å; A74-D119 PolarHBondContact N-O 3.45Å; T117-D119 PolarHBondContact O-N 2.97Å; T117-D119 PolarHBondContact OG1-O 3Å; D119-R122 HydrophobicContact CB-CG 4.16Å; D119-R122 WeakPolarHBondContact OD2-CD 3.37Å; D119-R122 IonicContact OD2-CZ 2.69Å; D119-R122 IonicContact OD2-NH1 2.99Å; D119-R122 PolarHBondContact OD2-NH1 3.49Å
120	P	95.1	Very high	93.6	Very high	22 Å²	22	41.8 Å²	41.8	14%	0.143	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	173.6	163.9	-21.4	33.3	0	0	0	112	L72 R122 A154 H156	L72-P120 WeakPolarHBondContact O-CA 3.48Å; L72-P120 WeakPolarHBondContact O-CB 2.99Å; P120-R122 WeakPolarHBondContact O-CG 2.95Å; P120-R122 PolarHBondContact O-N 2.8Å; P120-A154 HydrophobicContact CB-CB 4.14Å; P120-A154 HydrophobicContact CG-CB 4.29Å; P120-H156 HydrophobicContact CB-CB 4.48Å
121	I	95.9	Very high	93.5	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.031	19%	0.187	C	C	.	.			trans	-55.5	118.6	174.4	-60.5	173.4	0	0	0	108.9	A74 V85 E87 M102 I123 I137 A154 I155	A74-I121 HydrophobicContact CB-CG1 3.8Å; V85-I121 HydrophobicContact CG1-CD1 4.28Å; V85-I121 HydrophobicContact CG1-CG1 4.06Å; E87-I121 HydrophobicContact CB-CD1 4.47Å; M102-I121 HydrophobicContact CG-CD1 3.88Å; M102-I121 HydrophobicContact SD-CD1 4.08Å; I121-I123 HydrophobicContact CG2-CG2 4.4Å; I121-I137 HydrophobicContact CD1-CG2 4.46Å; I121-I137 HydrophobicContact CG2-CB 4.31Å; I121-I137 HydrophobicContact CG2-CG2 4.14Å; I121-A154 WeakPolarHBondContact O-CA 3.34Å; I121-I155 HydrophobicContact CB-CD1 3.79Å; I121-I155 HydrophobicContact CB-CG1 4.02Å; I121-I155 HydrophobicContact CD1-CD1 4Å; I121-I155 HydrophobicContact CG1-CD1 4.35Å; I121-I155 HydrophobicContact CG2-CD1 4.24Å; I121-I155 HydrophobicContact CG2-CG2 4.38Å; I121-I155 PolarHBondContact O-N 3.38Å
122	R	95	Very high	93.6	Very high	118 Å²	118	32 Å²	32	45%	0.445	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.5	178.5	-62.6	-176.9	71	152.3	3.8	110.4	D119 P120 T152 A153	D119-R122 HydrophobicContact CB-CG 4.16Å; D119-R122 WeakPolarHBondContact OD2-CD 3.37Å; D119-R122 IonicContact OD2-CZ 2.69Å; D119-R122 IonicContact OD2-NH1 2.99Å; D119-R122 PolarHBondContact OD2-NH1 3.49Å; P120-R122 WeakPolarHBondContact O-CG 2.95Å; P120-R122 PolarHBondContact O-N 2.8Å; R122-T152 PolarHBondContact NE-OG1 3.23Å; R122-T152 PolarHBondContact NH2-O 3.06Å; R122-T152 VanDerWaalsContact NH2-O 3.08Å; R122-T152 PolarHBondContact NH2-OG1 2.8Å; R122-A153 CarbonylContact C-O 3.52Å; R122-A153 VanDerWaalsContact CA-O 3.27Å; R122-A153 WeakPolarHBondContact CA-O 3.34Å
123	I	95.7	Very high	93.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	154	-179.5	63.2	167	0	0	0	111.5	I121 V125 T152 A153 I155 T274 T277 V278	I121-I123 HydrophobicContact CG2-CG2 4.4Å; I123-V125 HydrophobicContact CD1-CG1 4.38Å; I123-V125 HydrophobicContact CG1-CG1 4.2Å; I123-T152 CarbonylContact O-C 3.59Å; I123-T152 WeakPolarHBondContact O-CA 3.12Å; I123-T152 WeakPolarHBondContact O-CB 3.42Å; I123-A153 PolarHBondContact N-O 2.85Å; I123-A153 PolarHBondContact O-N 2.84Å; I123-I155 HydrophobicContact CD1-CG2 4.26Å; I123-I155 HydrophobicContact CG1-CG2 4.24Å; I123-I155 HydrophobicContact CG2-CG2 3.8Å; I123-T274 HydrophobicContact CB-CG2 4.5Å; I123-T274 HydrophobicContact CD1-CG2 3.56Å; I123-T274 WeakPolarHBondContact CD1-O 3.39Å; I123-T274 HydrophobicContact CG2-CG2 3.88Å; I123-T277 HydrophobicContact CD1-CG2 3.97Å; I123-T277 HydrophobicContact CG1-CG2 4.17Å; I123-V278 HydrophobicContact CD1-CG2 3.82Å
124	P	95.6	Very high	93.7	Very high	19 Å²	19	26.2 Å²	26.2	12%	0.123	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	134.6	169.5	20.1	-20.3	0	0	0	110.5	M134 G138 I147 T149	P124-M134 HydrophobicContact CG-CE 3.69Å; P124-G138 VanDerWaalsContact CD-O 3.26Å; P124-G138 WeakPolarHBondContact CD-O 3.45Å; P124-G138 WeakPolarHBondContact CG-O 3.49Å; P124-I147 HydrophobicContact CB-CG2 4.37Å; P124-I147 HydrophobicContact CG-CB 4.43Å; P124-I147 HydrophobicContact CG-CD1 4.3Å; P124-T149 HydrophobicContact CB-CG2 3.33Å
125	V	94.6	Very high	93.7	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.012	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	156.9	173.9	-64.4	0	0	0	0	109.6	I123 T149 Q151 A153 T277 V278 Y281	I123-V125 HydrophobicContact CD1-CG1 4.38Å; I123-V125 HydrophobicContact CG1-CG1 4.2Å; V125-T149 WeakPolarHBondContact O-CB 3.45Å; V125-Q151 HydrophobicContact CG2-CB 4.05Å; V125-Q151 PolarHBondContact N-O 3.5Å; V125-Q151 VanDerWaalsContact N-O 3.15Å; V125-A153 HydrophobicContact CG1-CB 3.89Å; V125-A153 HydrophobicContact CG2-CB 4.03Å; V125-T277 HydrophobicContact CG1-CG2 4.37Å; V125-V278 HydrophobicContact CG1-CG2 4.49Å; V125-Y281 HydrophobicContact CB-CD2 3.9Å; V125-Y281 HydrophobicContact CB-CG 3.86Å; V125-Y281 HydrophobicContact CG2-CD2 3.51Å; V125-Y281 HydrophobicContact CG2-CE2 4.12Å; V125-Y281 HydrophobicContact CG2-CG 4.02Å
126	G	91.5	Very high	93.7	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.01	14%	0.14	C	C	.	.	S	Bend	trans	133.3	169.7	-177.2	0	0	0	0	0	112.8	E128 T129 Y281	G126-E128 WeakPolarHBondContact CA-OE2 3.23Å; G126-E128 PolarHBondContact O-N 2.93Å; G126-E128 VanDerWaalsContact O-N 3.12Å; G126-T129 PolarHBondContact O-N 3.39Å; G126-T129 VanDerWaalsContact O-N 3.11Å; G126-T129 PolarHBondContact O-OG1 2.92Å; G126-Y281 VanDerWaalsContact CA-CE1 3.48Å
127	P	91.6	Very high	93.8	Very high	50 Å²	50	25.5 Å²	25.5	33%	0.325	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-56.5	-23.2	171.6	-23.5	34.7	0	0	0	113.3	T129 L130	P127-T129 PolarHBondContact O-N 2.88Å; P127-L130 HydrophobicContact CB-CD1 4.26Å; P127-L130 VanDerWaalsContact O-CB 3.27Å; P127-L130 WeakPolarHBondContact O-CB 3.27Å; P127-L130 WeakPolarHBondContact O-CD1 3.09Å; P127-L130 VanDerWaalsContact O-CG 3.28Å; P127-L130 WeakPolarHBondContact O-CG 3.43Å; P127-L130 PolarHBondContact O-N 2.69Å; P127-L130 VanDerWaalsContact O-N 3.07Å
128	E	91.8	Very high	93.9	Very high	74 Å²	74	23.8 Å²	23.8	35%	0.346	13%	0.13	S	C	.	.	G	3₁₀ helix	trans	-67.9	-11.6	178.5	-55.1	90.4	162	0	0	113.6	G126 L130 I147 T149	G126-E128 WeakPolarHBondContact CA-OE2 3.23Å; G126-E128 PolarHBondContact O-N 2.93Å; G126-E128 VanDerWaalsContact O-N 3.12Å; E128-L130 VanDerWaalsContact C-N 3.35Å; E128-I147 HydrophobicContact CB-CG2 4.5Å; E128-T149 HydrophobicContact CB-CG2 4.26Å
129	T	93.4	Very high	94.1	Very high	2 Å²	2	25 Å²	25	1%	0.012	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-83.1	-12.2	172.6	68.8	0	0	0	0	112.9	G126 P127 R132 M134 I147 T149	G126-T129 PolarHBondContact O-N 3.39Å; G126-T129 VanDerWaalsContact O-N 3.11Å; G126-T129 PolarHBondContact O-OG1 2.92Å; P127-T129 PolarHBondContact O-N 2.88Å; T129-R132 WeakPolarHBondContact O-CB 3.26Å; T129-R132 PolarHBondContact O-N 3.05Å; T129-M134 HydrophobicContact CG2-CE 4.21Å; T129-I147 HydrophobicContact CG2-CG2 4.31Å; T129-T149 HydrophobicContact CG2-CG2 4.44Å
130	L	92.3	Very high	94.2	Very high	23 Å²	23	24.6 Å²	24.6	12%	0.12	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	134.3	-179.4	-63	168.3	0	0	0	110.9	P127 E128 R132 Y219 F282	P127-L130 HydrophobicContact CB-CD1 4.26Å; P127-L130 VanDerWaalsContact O-CB 3.27Å; P127-L130 WeakPolarHBondContact O-CB 3.27Å; P127-L130 WeakPolarHBondContact O-CD1 3.09Å; P127-L130 VanDerWaalsContact O-CG 3.28Å; P127-L130 WeakPolarHBondContact O-CG 3.43Å; P127-L130 PolarHBondContact O-N 2.69Å; P127-L130 VanDerWaalsContact O-N 3.07Å; E128-L130 VanDerWaalsContact C-N 3.35Å; L130-R132 PolarHBondContact O-N 3.33Å; L130-Y219 HydrophobicContact CD1-CD1 3.62Å; L130-Y219 HydrophobicContact CD1-CE1 3.28Å; L130-Y219 HydrophobicContact CD1-CE2 4.32Å; L130-Y219 HydrophobicContact CD1-CG 4.28Å; L130-Y219 HydrophobicContact CD2-CD1 3.72Å; L130-Y219 HydrophobicContact CD2-CE1 4.29Å; L130-Y219 HydrophobicContact CD2-CG 4.07Å; L130-Y219 HydrophobicContact CG-CD1 4.35Å; L130-Y219 HydrophobicContact CG-CE1 4.44Å; L130-F282 HydrophobicContact CD2-CE2 4.34Å; L130-F282 HydrophobicContact CD2-CZ 3.96Å; L130-F282 HydrophobicContact CG-CZ 4.13Å
131	G	91.3	Very high	94.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	72	7.8	-175.8	0	0	0	0	0	114.2	R144 V254	G131-R144 PolarHBondContact O-NH1 2.97Å; G131-V254 WeakPolarHBondContact CA-O 3.24Å; G131-V254 PolarHBondContact N-O 2.85Å
132	R	94.8	Very high	94	Very high	26 Å²	26	27.6 Å²	27.6	10%	0.098	14%	0.139	C	C	.	.			trans	-102.8	155.4	178	-52.5	-57.9	-57.1	-86.9	-4.7	110.9	T129 L130 D142 G145 P146 I147 L256	T129-R132 WeakPolarHBondContact O-CB 3.26Å; T129-R132 PolarHBondContact O-N 3.05Å; L130-R132 PolarHBondContact O-N 3.33Å; R132-D142 WeakPolarHBondContact CA-OD2 3.49Å; R132-D142 IonicContact CZ-OD1 2.72Å; R132-D142 IonicContact CZ-OD2 3.24Å; R132-D142 IonicContact NE-OD1 2.84Å; R132-D142 IonicContact NE-OD2 2.69Å; R132-D142 PolarHBondContact NE-OD2 2.91Å; R132-D142 IonicContact NH2-OD1 3.86Å; R132-D142 PolarHBondContact NH2-OD1 2.95Å; R132-D142 IonicContact NH2-OD2 3.82Å; R132-D142 PolarHBondContact NH2-OD2 3.27Å; R132-G145 PolarHBondContact NH2-O 3.4Å; R132-P146 PolarHBondContact NH1-O 2.91Å; R132-I147 HydrophobicContact CB-CD1 4.13Å; R132-I147 HydrophobicContact CG-CD1 4.49Å; R132-I147 HydrophobicContact CG-CG1 4.42Å; R132-L256 PolarHBondContact O-N 3.45Å
133	I	95.4	Very high	93.8	Very high	14 Å²	14	31.2 Å²	31.2	7%	0.072	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.6	170.2	-46.8	175.7	0	0	0	108.8	P140 I141 D142 Y236 L256 Y258	I133-P140 CarbonylContact O-C 3.57Å; I133-P140 VanDerWaalsContact O-CA 3.27Å; I133-P140 WeakPolarHBondContact O-CA 3.31Å; I133-I141 HydrophobicContact CB-CG1 3.93Å; I133-I141 HydrophobicContact CG2-CD1 3.67Å; I133-I141 HydrophobicContact CG2-CG1 3.44Å; I133-I141 VanDerWaalsContact CG2-CG1 3.44Å; I133-I141 PolarHBondContact O-N 3.35Å; I133-D142 HydrophobicContact CB-CB 4.02Å; I133-D142 HydrophobicContact CD1-CB 4.14Å; I133-D142 HydrophobicContact CG1-CB 4.01Å; I133-D142 PolarHBondContact N-OD2 2.87Å; I133-Y236 HydrophobicContact CD1-CD1 4Å; I133-Y236 HydrophobicContact CD1-CD2 3.77Å; I133-Y236 HydrophobicContact CD1-CE1 4.11Å; I133-Y236 HydrophobicContact CD1-CE2 3.88Å; I133-Y236 HydrophobicContact CD1-CG 3.82Å; I133-Y236 HydrophobicContact CG1-CD2 4.13Å; I133-Y236 HydrophobicContact CG1-CE2 4.02Å; I133-L256 CarbonylContact C-O 3.49Å; I133-L256 WeakPolarHBondContact CA-O 3.35Å; I133-L256 HydrophobicContact CB-CB 4.41Å; I133-L256 HydrophobicContact CD1-CD1 4.44Å; I133-L256 HydrophobicContact CG1-CB 4.15Å; I133-L256 HydrophobicContact CG1-CD1 3.92Å; I133-L256 HydrophobicContact CG2-CB 4.29Å; I133-Y258 HydrophobicContact CD1-CE2 4.28Å; I133-Y258 HydrophobicContact CG2-CD2 3.31Å; I133-Y258 HydrophobicContact CG2-CE2 3.75Å; I133-Y258 HydrophobicContact CG2-CG 4.14Å
134	M	95.6	Very high	93.5	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.015	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	150.8	175.8	51.1	167.2	39.8	0	0	112.7	P124 T129 E139 I147 L256 V257 Y258 T274 V278	P124-M134 HydrophobicContact CG-CE 3.69Å; T129-M134 HydrophobicContact CG2-CE 4.21Å; M134-E139 CarbonylContact C-O 3.57Å; M134-E139 VanDerWaalsContact CA-O 3.29Å; M134-E139 WeakPolarHBondContact CA-O 3.49Å; M134-I147 HydrophobicContact CB-CD1 4.42Å; M134-I147 HydrophobicContact CE-CD1 3.95Å; M134-L256 WeakPolarHBondContact CG-O 3.27Å; M134-L256 PolarHBondContact N-O 3.02Å; M134-V257 HydrophobicContact CG-CB 4.21Å; M134-V257 HydrophobicContact CG-CG1 4.15Å; M134-V257 HydrophobicContact CG-CG2 3.74Å; M134-V257 CarbonylContact O-C 3.57Å; M134-V257 WeakPolarHBondContact O-CA 3.5Å; M134-V257 HydrophobicContact SD-CG1 4.46Å; M134-V257 HydrophobicContact SD-CG2 3.79Å; M134-Y258 PolarHBondContact O-N 3.24Å; M134-T274 HydrophobicContact SD-CG2 4.24Å; M134-V278 HydrophobicContact SD-CG2 3.96Å
135	N	95.1	Very high	93.3	Very high	23 Å²	23	36.8 Å²	36.8	12%	0.123	19%	0.192	C	C	.	.			trans	-86.2	-178.9	170.3	70.3	11.4	0	0	0	111.8	I137 G138 E139 I141 Y258	N135-I137 VanDerWaalsContact C-N 3.25Å; N135-I137 PolarHBondContact O-N 3.4Å; N135-I137 WeakPolarHBondContact OD1-CG1 3.36Å; N135-I137 PolarHBondContact OD1-N 3.19Å; N135-I137 VanDerWaalsContact OD1-N 3.16Å; N135-G138 PolarHBondContact O-N 3.45Å; N135-G138 PolarHBondContact OD1-N 3.28Å; N135-G138 VanDerWaalsContact OD1-N 3.13Å; N135-E139 PolarHBondContact N-O 2.84Å; N135-E139 PolarHBondContact OD1-N 2.9Å; N135-E139 PolarHBondContact OD1-O 3.37Å; N135-I141 HydrophobicContact CB-CG2 3.97Å; N135-Y258 WeakPolarHBondContact CA-O 3.37Å
136	V	95.7	Very high	93.2	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.024	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-34.3	-179.1	58.8	0	0	0	0	114.3	M102 G138 A267 R270 V271 T274	M102-V136 HydrophobicContact CB-CG1 4.36Å; M102-V136 HydrophobicContact SD-CG2 4.4Å; V136-G138 VanDerWaalsContact C-N 3.33Å; V136-A267 HydrophobicContact CB-CB 4.34Å; V136-A267 HydrophobicContact CG1-CB 3.66Å; V136-R270 HydrophobicContact CG2-CB 3.58Å; V136-V271 HydrophobicContact CB-CB 4.39Å; V136-T274 PolarHBondContact O-OG1 3.46Å
137	I	95.2	Very high	93.2	Very high	13 Å²	13	42.4 Å²	42.4	7%	0.067	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	5.3	179.5	60.9	170.7	0	0	0	113.2	V85 M102 I121 N135 E139	V85-I137 HydrophobicContact CB-CG2 3.99Å; V85-I137 HydrophobicContact CG1-CG2 4.4Å; V85-I137 HydrophobicContact CG2-CD1 4.01Å; V85-I137 HydrophobicContact CG2-CG2 3.97Å; M102-I137 HydrophobicContact CB-CG2 4.15Å; M102-I137 HydrophobicContact CG-CG2 4.28Å; I121-I137 HydrophobicContact CD1-CG2 4.46Å; I121-I137 HydrophobicContact CG2-CB 4.31Å; I121-I137 HydrophobicContact CG2-CG2 4.14Å; N135-I137 VanDerWaalsContact C-N 3.25Å; N135-I137 PolarHBondContact O-N 3.4Å; N135-I137 WeakPolarHBondContact OD1-CG1 3.36Å; N135-I137 PolarHBondContact OD1-N 3.19Å; N135-I137 VanDerWaalsContact OD1-N 3.16Å; I137-E139 VanDerWaalsContact CD1-CD 3.49Å; I137-E139 HydrophobicContact CD1-CG 4.03Å; I137-E139 HydrophobicContact CG1-CB 4.48Å; I137-E139 HydrophobicContact CG1-CG 4.02Å
138	G	93.7	Very high	92.9	Very high	6 Å²	6	44.6 Å²	44.6	6%	0.062	24%	0.243	C	C	.	.	S	Bend	trans	84.9	11.1	175.3	0	0	0	0	0	115	P124 N135 V136	P124-G138 VanDerWaalsContact CD-O 3.26Å; P124-G138 WeakPolarHBondContact CD-O 3.45Å; P124-G138 WeakPolarHBondContact CG-O 3.49Å; N135-G138 PolarHBondContact O-N 3.45Å; N135-G138 PolarHBondContact OD1-N 3.28Å; N135-G138 VanDerWaalsContact OD1-N 3.13Å; V136-G138 VanDerWaalsContact C-N 3.33Å
139	E	94.8	Very high	92.6	Very high	66 Å²	66	42.7 Å²	42.7	31%	0.308	24%	0.237	S	C	.	.			trans	-82.4	139.2	176	-66.8	178	166.8	0	0	110.8	R83 M134 N135 I137	R83-E139 WeakPolarHBondContact CD-OE1 3.2Å; R83-E139 IonicContact CZ-OE1 3.35Å; R83-E139 IonicContact NE-OE1 3.54Å; R83-E139 IonicContact NH1-OE1 3.59Å; R83-E139 PolarHBondContact NH1-OE1 3.06Å; M134-E139 CarbonylContact C-O 3.57Å; M134-E139 VanDerWaalsContact CA-O 3.29Å; M134-E139 WeakPolarHBondContact CA-O 3.49Å; N135-E139 PolarHBondContact N-O 2.84Å; N135-E139 PolarHBondContact OD1-N 2.9Å; N135-E139 PolarHBondContact OD1-O 3.37Å; I137-E139 VanDerWaalsContact CD1-CD 3.49Å; I137-E139 HydrophobicContact CD1-CG 4.03Å; I137-E139 HydrophobicContact CG1-CB 4.48Å; I137-E139 HydrophobicContact CG1-CG 4.02Å
140	P	95.3	Very high	92.2	Very high	45 Å²	45	51.7 Å²	51.7	29%	0.292	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-70.7	132.8	177.7	26.7	-30.9	0	0	0	111.3	I133 G145 I147	I133-P140 CarbonylContact O-C 3.57Å; I133-P140 VanDerWaalsContact O-CA 3.27Å; I133-P140 WeakPolarHBondContact O-CA 3.31Å; P140-G145 WeakPolarHBondContact CG-O 3.38Å; P140-I147 HydrophobicContact CB-CD1 4.14Å; P140-I147 HydrophobicContact CB-CG1 3.88Å; P140-I147 HydrophobicContact CG-CG1 4.1Å
141	I	93.4	Very high	92.1	Very high	71 Å²	71	54.8 Å²	54.8	36%	0.364	29%	0.29	S	S	.	.			trans	-114.2	13.4	176.9	62.7	171.3	0	0	0	112.7	I133 N135 Y258	I133-I141 HydrophobicContact CB-CG1 3.93Å; I133-I141 HydrophobicContact CG2-CD1 3.67Å; I133-I141 HydrophobicContact CG2-CG1 3.44Å; I133-I141 VanDerWaalsContact CG2-CG1 3.44Å; I133-I141 PolarHBondContact O-N 3.35Å; N135-I141 HydrophobicContact CB-CG2 3.97Å; I141-Y258 HydrophobicContact CD1-CD2 4.49Å
142	D	92.1	Very high	92.2	Very high	20 Å²	20	58 Å²	58	11%	0.107	31%	0.31	C	S	.	.	S	Bend	trans	-96	5.4	-178	61.3	1.5	0	0	0	114.1	R132 I133 R144	R132-D142 WeakPolarHBondContact CA-OD2 3.49Å; R132-D142 IonicContact CZ-OD1 2.72Å; R132-D142 IonicContact CZ-OD2 3.24Å; R132-D142 IonicContact NE-OD1 2.84Å; R132-D142 IonicContact NE-OD2 2.69Å; R132-D142 PolarHBondContact NE-OD2 2.91Å; R132-D142 IonicContact NH2-OD1 3.86Å; R132-D142 PolarHBondContact NH2-OD1 2.95Å; R132-D142 IonicContact NH2-OD2 3.82Å; R132-D142 PolarHBondContact NH2-OD2 3.27Å; I133-D142 HydrophobicContact CB-CB 4.02Å; I133-D142 HydrophobicContact CD1-CB 4.14Å; I133-D142 HydrophobicContact CG1-CB 4.01Å; I133-D142 PolarHBondContact N-OD2 2.87Å; D142-R144 HydrophobicContact CB-CG 4.48Å; D142-R144 WeakPolarHBondContact O-CG 3.49Å; D142-R144 PolarHBondContact O-N 2.9Å; D142-R144 PolarHBondContact OD1-N 3.46Å
143	E	91.7	Very high	92.2	Very high	194 Å²	194	58.2 Å²	58.2	91%	0.907	32%	0.316	S	S	*	.	S	Bend	trans	57.1	15.9	-177.2	-57.4	-173.1	164.3	0	0	114.9	G145	E143-G145 VanDerWaalsContact C-N 3.3Å; E143-G145 PolarHBondContact O-N 3.19Å
144	R	89.8	Confident	92.3	Very high	97 Å²	97	59 Å²	59	37%	0.366	33%	0.325	S	S	.	.	S	Bend	trans	-93.8	23.8	-178.2	-67.9	169.3	69.7	-163	0.8	113.4	G131 D142 L247	G131-R144 PolarHBondContact O-NH1 2.97Å; D142-R144 HydrophobicContact CB-CG 4.48Å; D142-R144 WeakPolarHBondContact O-CG 3.49Å; D142-R144 PolarHBondContact O-N 2.9Å; D142-R144 PolarHBondContact OD1-N 3.46Å; R144-L247 VanDerWaalsContact NH1-CD2 3.32Å
145	G	91.6	Very high	92.3	Very high	38 Å²	38	58.9 Å²	58.9	39%	0.392	32%	0.324	S	S	.	.			trans	76.8	-174.3	-176.5	0	0	0	0	0	113.7	R132 P140 E143	R132-G145 PolarHBondContact NH2-O 3.4Å; P140-G145 WeakPolarHBondContact CG-O 3.38Å; E143-G145 VanDerWaalsContact C-N 3.3Å; E143-G145 PolarHBondContact O-N 3.19Å
146	P	91.7	Very high	92.3	Very high	102 Å²	102	59.8 Å²	59.8	66%	0.662	33%	0.328	S	S	*	.			trans	-68.6	150.3	-176.1	27.7	-34.2	0	0	0	112.6	R132 S148	R132-P146 PolarHBondContact NH1-O 2.91Å; P146-S148 PolarHBondContact O-N 3.15Å
147	I	91.3	Very high	92.1	Very high	20 Å²	20	61.4 Å²	61.4	10%	0.103	34%	0.342	C	S	.	.			trans	-81.3	107	169.1	-50.9	178.5	0	0	0	107.4	P124 E128 T129 R132 M134 P140 T149	P124-I147 HydrophobicContact CB-CG2 4.37Å; P124-I147 HydrophobicContact CG-CB 4.43Å; P124-I147 HydrophobicContact CG-CD1 4.3Å; E128-I147 HydrophobicContact CB-CG2 4.5Å; T129-I147 HydrophobicContact CG2-CG2 4.31Å; R132-I147 HydrophobicContact CB-CD1 4.13Å; R132-I147 HydrophobicContact CG-CD1 4.49Å; R132-I147 HydrophobicContact CG-CG1 4.42Å; M134-I147 HydrophobicContact CB-CD1 4.42Å; M134-I147 HydrophobicContact CE-CD1 3.95Å; P140-I147 HydrophobicContact CB-CD1 4.14Å; P140-I147 HydrophobicContact CB-CG1 3.88Å; P140-I147 HydrophobicContact CG-CG1 4.1Å; I147-T149 HydrophobicContact CB-CG2 4.42Å; I147-T149 HydrophobicContact CG2-CG2 3.48Å; I147-T149 VanDerWaalsContact CG2-CG2 3.48Å; I147-T149 PolarHBondContact O-N 3.36Å; I147-T149 VanDerWaalsContact O-N 3.14Å
148	S	85.5	Confident	91.9	Very high	96 Å²	96	67.2 Å²	67.2	67%	0.671	37%	0.369	S	S	*	.			trans	-85.7	81.9	-177.5	-62.9	0	0	0	0	110.5	P146	P146-S148 PolarHBondContact O-N 3.15Å
149	T	86.3	Confident	92	Very high	34 Å²	34	68.7 Å²	68.7	21%	0.209	38%	0.38	C	S	.	.			trans	-98.4	156.3	178	82.1	0	0	0	0	112.4	P124 V125 E128 T129 I147 Q151	P124-T149 HydrophobicContact CB-CG2 3.33Å; V125-T149 WeakPolarHBondContact O-CB 3.45Å; E128-T149 HydrophobicContact CB-CG2 4.26Å; T129-T149 HydrophobicContact CG2-CG2 4.44Å; I147-T149 HydrophobicContact CB-CG2 4.42Å; I147-T149 HydrophobicContact CG2-CG2 3.48Å; I147-T149 VanDerWaalsContact CG2-CG2 3.48Å; I147-T149 PolarHBondContact O-N 3.36Å; I147-T149 VanDerWaalsContact O-N 3.14Å; T149-Q151 PolarHBondContact OG1-O 3.04Å
150	K	83.7	Confident	91.9	Very high	190 Å²	190	66.5 Å²	66.5	83%	0.826	37%	0.372	S	S	*	.	S	Bend	trans	-88.2	-18	172.3	-64.2	173.6	-173.9	164.1	0	112.9
151	Q	91.2	Very high	91.8	Very high	89 Å²	89	67.1 Å²	67.1	42%	0.416	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.7	-172.3	-60.4	-169.6	33.2	0	0	111.2	V125 T149	V125-Q151 HydrophobicContact CG2-CB 4.05Å; V125-Q151 PolarHBondContact N-O 3.5Å; V125-Q151 VanDerWaalsContact N-O 3.15Å; T149-Q151 PolarHBondContact OG1-O 3.04Å
152	T	93.3	Very high	91.7	Very high	68 Å²	68	72.2 Å²	72.2	42%	0.417	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	141.3	171.2	62.6	0	0	0	0	109.9	R122 I123	R122-T152 PolarHBondContact NE-OG1 3.23Å; R122-T152 PolarHBondContact NH2-O 3.06Å; R122-T152 VanDerWaalsContact NH2-O 3.08Å; R122-T152 PolarHBondContact NH2-OG1 2.8Å; I123-T152 CarbonylContact O-C 3.59Å; I123-T152 WeakPolarHBondContact O-CA 3.12Å; I123-T152 WeakPolarHBondContact O-CB 3.42Å
153	A	95	Very high	91.7	Very high	29 Å²	29	75.4 Å²	75.4	24%	0.24	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147.5	-178.8	0	0	0	0	0	110.8	R122 I123 V125 T277	R122-A153 CarbonylContact C-O 3.52Å; R122-A153 VanDerWaalsContact CA-O 3.27Å; R122-A153 WeakPolarHBondContact CA-O 3.34Å; I123-A153 PolarHBondContact N-O 2.85Å; I123-A153 PolarHBondContact O-N 2.84Å; V125-A153 HydrophobicContact CG1-CB 3.89Å; V125-A153 HydrophobicContact CG2-CB 4.03Å; A153-T277 HydrophobicContact CB-CG2 3.63Å
154	A	96.4	Very high	91.6	Very high	31 Å²	31	69.6 Å²	69.6	26%	0.256	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	139.5	175.2	0	0	0	0	0	110.4	P120 I121 H156 T277	P120-A154 HydrophobicContact CB-CB 4.14Å; P120-A154 HydrophobicContact CG-CB 4.29Å; I121-A154 WeakPolarHBondContact O-CA 3.34Å; A154-H156 PolarHBondContact O-N 2.76Å; A154-T277 WeakPolarHBondContact O-CG2 3.29Å
155	I	95.9	Very high	91.5	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	38%	0.383	C	S	.	.	S	Bend	trans	-69.6	-23.2	179.9	65.7	173.5	0	0	0	113.5	I121 I123 R270 L273 T277 R334	I121-I155 HydrophobicContact CB-CD1 3.79Å; I121-I155 HydrophobicContact CB-CG1 4.02Å; I121-I155 HydrophobicContact CD1-CD1 4Å; I121-I155 HydrophobicContact CG1-CD1 4.35Å; I121-I155 HydrophobicContact CG2-CD1 4.24Å; I121-I155 HydrophobicContact CG2-CG2 4.38Å; I121-I155 PolarHBondContact O-N 3.38Å; I123-I155 HydrophobicContact CD1-CG2 4.26Å; I123-I155 HydrophobicContact CG1-CG2 4.24Å; I123-I155 HydrophobicContact CG2-CG2 3.8Å; I155-R270 HydrophobicContact CD1-CB 4.15Å; I155-R270 HydrophobicContact CD1-CG 4.46Å; I155-L273 HydrophobicContact CB-CB 4.28Å; I155-T277 VanDerWaalsContact CA-OG1 3.32Å; I155-T277 WeakPolarHBondContact CA-OG1 3.47Å; I155-T277 PolarHBondContact O-OG1 3.35Å; I155-R334 PolarHBondContact O-NH1 2.76Å; I155-R334 PolarHBondContact O-NH2 2.81Å
156	H	94.8	Very high	91.4	Very high	42 Å²	42	68 Å²	68	19%	0.194	38%	0.378	C	S	.	.			trans	-94	114.4	176.4	-69.5	-62.9	0	0	0	109	L72 E87 P120 A154	L72-H156 HydrophobicContact CD1-CB 4.23Å; E87-H156 IonicContact OE1-CD2 2.84Å; E87-H156 IonicContact OE1-CE1 2.76Å; E87-H156 PolarHBondContact OE1-CE1 3.14Å; E87-H156 IonicContact OE1-NE2 3.91Å; E87-H156 PolarHBondContact OE1-NE2 3.35Å; E87-H156 IonicContact OE2-NE2 2.97Å; P120-H156 HydrophobicContact CB-CB 4.48Å; A154-H156 PolarHBondContact O-N 2.76Å
157	A	91.5	Very high	91.1	Very high	39 Å²	39	69.8 Å²	69.8	32%	0.322	39%	0.387	S	S	.	.			trans	-137.8	151.5	176.8	0	0	0	0	0	109.2	R334	A157-R334 WeakPolarHBondContact O-CD 3.4Å
158	E	92.1	Very high	90.8	Very high	134 Å²	134	75.2 Å²	75.2	63%	0.626	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-73.5	153	171.5	-68.4	-64.4	147.1	0	0	110.5	Y38	Y38-E158 HydrophobicContact CD2-CG 3.93Å; Y38-E158 HydrophobicContact CE2-CG 4.16Å
159	A	94.1	Very high	90.8	Very high	37 Å²	37	76 Å²	76	31%	0.306	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-63	151.5	171.1	0	0	0	0	0	111	E333 R334	A159-E333 HydrophobicContact CB-CB 3.91Å; A159-R334 HydrophobicContact CB-CG 4.29Å
160	P	93.4	Very high	90.9	Very high	20 Å²	20	79 Å²	79	13%	0.13	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-52.2	143.3	174.4	-28.3	36.9	0	0	0	112.2	M165 T336 T338	P160-M165 WeakPolarHBondContact O-CE 3.46Å; P160-T336 HydrophobicContact CB-CG2 4.24Å; P160-T336 HydrophobicContact CG-CG2 3.73Å; P160-T338 HydrophobicContact CB-CG2 4.06Å; P160-T338 HydrophobicContact CG-CG2 3.98Å
161	E	93.1	Very high	91.3	Very high	58 Å²	58	71.9 Å²	71.9	27%	0.271	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-65.8	150.9	177	-65.4	-167.8	-160.9	0	0	111.2	R36 T163 D164 M165	R36-E161 WeakPolarHBondContact CD-OE1 3.24Å; R36-E161 WeakPolarHBondContact CG-OE1 3.36Å; R36-E161 IonicContact CZ-OE1 2.71Å; R36-E161 IonicContact CZ-OE2 3.63Å; R36-E161 IonicContact NE-OE1 3.67Å; R36-E161 PolarHBondContact NE-OE1 3.16Å; R36-E161 VanDerWaalsContact NE-OE1 3.08Å; R36-E161 IonicContact NE-OE2 3.19Å; R36-E161 IonicContact NH1-OE1 2.8Å; R36-E161 PolarHBondContact NH1-OE1 3.22Å; R36-E161 IonicContact NH1-OE2 2.82Å; R36-E161 PolarHBondContact NH1-OE2 2.95Å; R36-E161 IonicContact NH2-OE1 3.65Å; R36-E161 PolarHBondContact NH2-OE1 2.88Å; R36-E161 IonicContact NH2-OE2 3.83Å; R36-E161 PolarHBondContact NH2-OE2 2.58Å; E161-T163 PolarHBondContact O-N 2.89Å; E161-D164 PolarHBondContact O-N 2.62Å; E161-M165 PolarHBondContact O-N 3.28Å
162	F	91.6	Very high	91.3	Very high	179 Å²	179	68.3 Å²	68.3	79%	0.785	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-32.4	175.8	-177	-100.5	0	0	0	113.3	D164 M165	F162-D164 VanDerWaalsContact C-N 3.26Å; F162-D164 PolarHBondContact O-N 3.25Å; F162-M165 HydrophobicContact CD2-SD 4.49Å
163	T	92.5	Very high	91.2	Very high	86 Å²	86	67.4 Å²	67.4	53%	0.528	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-21.1	177.8	49.3	0	0	0	0	113.9	E161 K339	E161-T163 PolarHBondContact O-N 2.89Å; T163-K339 WeakPolarHBondContact O-CE 3.38Å; T163-K339 PolarHBondContact O-NZ 2.97Å
164	D	89.1	Confident	91.1	Very high	73 Å²	73	66.1 Å²	66.1	39%	0.39	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-11.6	-176	-66	-26.6	0	0	0	113	E161 F162 T338 K339	E161-D164 PolarHBondContact O-N 2.62Å; F162-D164 VanDerWaalsContact C-N 3.26Å; F162-D164 PolarHBondContact O-N 3.25Å; D164-T338 CarbonylContact O-C 3.59Å; D164-T338 VanDerWaalsContact O-CA 3.24Å; D164-T338 WeakPolarHBondContact O-CA 3.41Å; D164-K339 PolarHBondContact O-N 3.48Å
165	M	88.3	Confident	90.9	Very high	59 Å²	59	64.7 Å²	64.7	29%	0.291	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-69.1	139.1	174.4	-62.5	-178.6	-166.9	0	0	111	P160 E161 F162	P160-M165 WeakPolarHBondContact O-CE 3.46Å; E161-M165 PolarHBondContact O-N 3.28Å; F162-M165 HydrophobicContact CD2-SD 4.49Å
166	S	88.3	Confident	90.9	Very high	43 Å²	43	64.7 Å²	64.7	30%	0.301	34%	0.342	S	S	.	.			trans	-79.8	146.8	170.1	-171.3	0	0	0	0	110.8	E168 T337	S166-E168 PolarHBondContact OG-N 3.34Å; S166-T337 PolarHBondContact N-O 3.24Å
167	V	86.6	Confident	90.9	Very high	139 Å²	139	62.7 Å²	62.7	84%	0.842	33%	0.333	S	S	*	.			trans	-98.9	-7.5	173.8	-63.1	0	0	0	0	112.5
168	E	85.4	Confident	91.1	Very high	134 Å²	134	61 Å²	61	63%	0.626	32%	0.319	S	S	*	.			trans	-78.8	126.1	-177.3	-67.2	179	167	0	0	110.3	S166	S166-E168 PolarHBondContact OG-N 3.34Å
169	Q	85.1	Confident	91.3	Very high	113 Å²	113	54.6 Å²	54.6	53%	0.528	29%	0.289	S	S	.	.			trans	-102.9	101.9	175.8	-66.8	-175.7	-34.5	0	0	108.5	I401	Q169-I401 HydrophobicContact CB-CD1 4.48Å; Q169-I401 HydrophobicContact CB-CG2 4.37Å
170	E	88.1	Confident	91.3	Very high	97 Å²	97	52.9 Å²	52.9	45%	0.453	27%	0.274	S	S	.	.			trans	-110.4	149	178.7	-61.9	-173.6	155.5	0	0	110.9	A186 K187	E170-A186 WeakPolarHBondContact O-CA 3.39Å; E170-K187 HydrophobicContact CB-CB 4.26Å; E170-K187 PolarHBondContact O-N 3.34Å
171	I	91.6	Very high	91.4	Very high	40 Å²	40	51.9 Å²	51.9	21%	0.205	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	129.5	173.1	-52.1	177.1	0	0	0	109	V173 P184 Y185 I396 V402 L473	I171-V173 PolarHBondContact O-N 3.47Å; I171-P184 HydrophobicContact CG2-CB 4.02Å; I171-Y185 CarbonylContact C-O 3.43Å; I171-Y185 WeakPolarHBondContact CA-O 3.47Å; I171-I396 HydrophobicContact CG1-CD1 4.04Å; I171-V402 HydrophobicContact CD1-CB 4.02Å; I171-V402 HydrophobicContact CD1-CG1 3.65Å; I171-V402 HydrophobicContact CG1-CG1 4.26Å; I171-L473 HydrophobicContact CD1-CD2 4.42Å
172	L	91	Very high	91.6	Very high	14 Å²	14	49.2 Å²	49.2	7%	0.073	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	104.3	163	179.7	68	0	0	0	108.9	T174 Y185 L291 T344	L172-T174 PolarHBondContact O-N 3.14Å; L172-Y185 PolarHBondContact N-O 2.86Å; L172-L291 HydrophobicContact CD2-CD2 3.92Å; L172-T344 HydrophobicContact CD2-CG2 3.82Å
173	V	92.1	Very high	91.7	Very high	48 Å²	48	40.8 Å²	40.8	29%	0.291	22%	0.219	S	C	.	.			trans	-69.3	116.1	176.2	-177.7	0	0	0	0	109.3	I171 H216 L473	I171-V173 PolarHBondContact O-N 3.47Å; V173-H216 PolarHBondContact O-NE2 3.48Å; V173-L473 HydrophobicContact CG1-CB 4.33Å; V173-L473 HydrophobicContact CG2-CB 4.47Å; V173-L473 HydrophobicContact CG2-CD2 4.43Å
174	T	91.8	Very high	91.9	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.012	19%	0.194	C	C	.	.			trans	-90.8	-20.8	-177.3	67	0	0	0	0	113	L172 I176 V179 D180 Y185 L208 N211	L172-T174 PolarHBondContact O-N 3.14Å; T174-I176 PolarHBondContact O-N 3.25Å; T174-I176 PolarHBondContact OG1-N 3.15Å; T174-V179 HydrophobicContact CG2-CG1 3.97Å; T174-D180 WeakPolarHBondContact CB-OD1 3.41Å; T174-D180 PolarHBondContact N-OD1 2.78Å; T174-D180 PolarHBondContact N-OD2 2.88Å; T174-D180 VanDerWaalsContact OG1-CG 3.23Å; T174-D180 PolarHBondContact OG1-OD1 3.14Å; T174-D180 PolarHBondContact OG1-OD2 3.26Å; T174-Y185 HydrophobicContact CG2-CD2 3.61Å; T174-Y185 HydrophobicContact CG2-CE2 4.11Å; T174-Y185 HydrophobicContact CG2-CG 4.23Å; T174-L208 HydrophobicContact CG2-CD2 3.82Å; T174-N211 VanDerWaalsContact O-CB 3.28Å; T174-N211 WeakPolarHBondContact O-CB 3.38Å; T174-N211 PolarHBondContact O-ND2 3.21Å
175	G	92.4	Very high	92.1	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.01	18%	0.175	C	C	.	.	S	Bend	trans	77	9	-173.3	0	0	0	0	0	113.4	D180 Q455 V471	G175-D180 WeakPolarHBondContact CA-OD2 3.44Å; G175-D180 PolarHBondContact N-OD2 3.13Å; G175-Q455 PolarHBondContact O-NE2 2.77Å; G175-V471 WeakPolarHBondContact CA-O 3.49Å; G175-V471 PolarHBondContact O-N 2.95Å
176	I	95.2	Very high	92.3	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.166	C	C	.	.			trans	-107.5	113.8	179.1	-57.3	177.7	0	0	0	108.5	T174 V178 V179 D180 L204 E207 L208 P385 F457	T174-I176 PolarHBondContact O-N 3.25Å; T174-I176 PolarHBondContact OG1-N 3.15Å; I176-V178 HydrophobicContact CG2-CG1 4Å; I176-V178 PolarHBondContact O-N 3.04Å; I176-V179 HydrophobicContact CB-CB 4.23Å; I176-V179 HydrophobicContact CB-CG2 4.28Å; I176-V179 HydrophobicContact CG2-CB 4.32Å; I176-V179 HydrophobicContact CG2-CG2 3.97Å; I176-V179 PolarHBondContact O-N 3.02Å; I176-V179 VanDerWaalsContact O-N 3.14Å; I176-D180 WeakPolarHBondContact O-CB 3.49Å; I176-D180 PolarHBondContact O-N 3.04Å; I176-L204 HydrophobicContact CD1-CD1 3.51Å; I176-E207 HydrophobicContact CD1-CG 4.35Å; I176-L208 HydrophobicContact CD1-CD2 3.87Å; I176-L208 HydrophobicContact CD1-CG 4.19Å; I176-P385 HydrophobicContact CG2-CG 4.07Å; I176-F457 HydrophobicContact CD1-CE1 4.06Å; I176-F457 HydrophobicContact CD1-CZ 3.97Å; I176-F457 HydrophobicContact CG1-CE1 4.06Å; I176-F457 HydrophobicContact CG1-CZ 4.44Å; I176-F457 HydrophobicContact CG2-CE1 4.17Å; I176-F457 HydrophobicContact CG2-CZ 4.3Å
177	K	95.8	Very high	92.4	Very high	1 Å²	1	31.9 Å²	31.9	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-51.1	-50.8	-171.2	-73.8	-175.9	-71	-178.3	0	114	V179 L181 F452 S454 V471 T476 F480 V499 G500	K177-V179 PolarHBondContact O-N 3.05Å; K177-L181 WeakPolarHBondContact O-CB 3.5Å; K177-L181 PolarHBondContact O-N 2.98Å; K177-F452 HydrophobicContact CD-CE1 4.46Å; K177-F452 HydrophobicContact CD-CZ 4.3Å; K177-F452 VanDerWaalsContact CE-O 3.23Å; K177-F452 WeakPolarHBondContact CE-O 3.36Å; K177-F452 PolarHBondContact NZ-O 3.3Å; K177-S454 WeakPolarHBondContact CE-O 3.5Å; K177-S454 PolarHBondContact NZ-O 3.4Å; K177-S454 VanDerWaalsContact NZ-O 3.13Å; K177-V471 HydrophobicContact CD-CB 4.5Å; K177-V471 HydrophobicContact CD-CG1 4.28Å; K177-V471 HydrophobicContact CD-CG2 4.2Å; K177-V471 HydrophobicContact CG-CB 3.94Å; K177-V471 HydrophobicContact CG-CG1 3.97Å; K177-V471 HydrophobicContact CG-CG2 4.03Å; K177-T476 HydrophobicContact CB-CG2 4.06Å; K177-T476 HydrophobicContact CG-CG2 4.08Å; K177-F480 HydrophobicContact CB-CE2 4.36Å; K177-V499 PolarHBondContact NZ-O 2.86Å; K177-G500 WeakPolarHBondContact CE-O 3.42Å; K177-G500 PolarHBondContact NZ-O 2.98Å
178	V	95.7	Very high	92.5	Very high	3 Å²	3	25.6 Å²	25.6	2%	0.018	13%	0.128	C	C	.	.	H	α-helix	trans	-66.1	-37.4	-176.5	60.8	0	0	0	0	112.5	I176 L182 P385 V387 L453	I176-V178 HydrophobicContact CG2-CG1 4Å; I176-V178 PolarHBondContact O-N 3.04Å; V178-L182 HydrophobicContact CG2-CD1 4.28Å; V178-L182 WeakPolarHBondContact O-CB 3.45Å; V178-L182 PolarHBondContact O-N 3.48Å; V178-L182 VanDerWaalsContact O-N 3.14Å; V178-P385 HydrophobicContact CG1-CG 3.76Å; V178-V387 HydrophobicContact CG1-CB 3.88Å; V178-V387 HydrophobicContact CG1-CG1 4.38Å; V178-V387 HydrophobicContact CG1-CG2 3.89Å; V178-V387 HydrophobicContact CG2-CB 3.79Å; V178-V387 HydrophobicContact CG2-CG1 3.7Å; V178-L453 HydrophobicContact CB-CB 4.33Å; V178-L453 HydrophobicContact CB-CD2 3.83Å; V178-L453 HydrophobicContact CG2-CD2 3.93Å
179	V	95.4	Very high	92.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-72	-54.6	178.6	175.4	0	0	0	0	109.3	T174 I176 K177 L181 A183 P184 Y185	T174-V179 HydrophobicContact CG2-CG1 3.97Å; I176-V179 HydrophobicContact CB-CB 4.23Å; I176-V179 HydrophobicContact CB-CG2 4.28Å; I176-V179 HydrophobicContact CG2-CB 4.32Å; I176-V179 HydrophobicContact CG2-CG2 3.97Å; I176-V179 PolarHBondContact O-N 3.02Å; I176-V179 VanDerWaalsContact O-N 3.14Å; K177-V179 PolarHBondContact O-N 3.05Å; V179-L181 VanDerWaalsContact C-N 3.28Å; V179-L181 PolarHBondContact O-N 3.02Å; V179-A183 CarbonylContact O-C 3.57Å; V179-A183 WeakPolarHBondContact O-CA 3.23Å; V179-A183 PolarHBondContact O-N 2.86Å; V179-P184 WeakPolarHBondContact O-CA 3.41Å; V179-Y185 HydrophobicContact CG1-CD1 3.79Å; V179-Y185 HydrophobicContact CG1-CD2 4.07Å; V179-Y185 HydrophobicContact CG1-CE1 3.46Å; V179-Y185 VanDerWaalsContact CG1-CE1 3.46Å; V179-Y185 HydrophobicContact CG1-CE2 3.76Å; V179-Y185 HydrophobicContact CG1-CG 4.08Å; V179-Y185 VanDerWaalsContact CG1-CZ 3.44Å
180	D	95.3	Very high	93.3	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-62.1	-33.8	-176.3	-75.1	-11.1	0	0	0	112.6	T174 G175 I176 H406 L473	T174-D180 WeakPolarHBondContact CB-OD1 3.41Å; T174-D180 PolarHBondContact N-OD1 2.78Å; T174-D180 PolarHBondContact N-OD2 2.88Å; T174-D180 VanDerWaalsContact OG1-CG 3.23Å; T174-D180 PolarHBondContact OG1-OD1 3.14Å; T174-D180 PolarHBondContact OG1-OD2 3.26Å; G175-D180 WeakPolarHBondContact CA-OD2 3.44Å; G175-D180 PolarHBondContact N-OD2 3.13Å; I176-D180 WeakPolarHBondContact O-CB 3.49Å; I176-D180 PolarHBondContact O-N 3.04Å; D180-H406 PolarHBondContact O-CE1 3.47Å; D180-H406 PolarHBondContact O-NE2 3.13Å; D180-L473 HydrophobicContact CB-CD1 4.02Å
181	L	96	Very high	93.6	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-79.5	-52.7	178.2	-175.4	72.3	0	0	0	113.2	K177 V179 H406 V409 A410 V413 T476 F480	K177-L181 WeakPolarHBondContact O-CB 3.5Å; K177-L181 PolarHBondContact O-N 2.98Å; V179-L181 VanDerWaalsContact C-N 3.28Å; V179-L181 PolarHBondContact O-N 3.02Å; L181-H406 PolarHBondContact O-NE2 3.18Å; L181-V409 HydrophobicContact CD1-CG1 4.12Å; L181-A410 HydrophobicContact CD1-CB 4.35Å; L181-A410 HydrophobicContact CG-CB 4.33Å; L181-A410 WeakPolarHBondContact O-CB 3.29Å; L181-V413 HydrophobicContact CD2-CG1 4.49Å; L181-V413 HydrophobicContact CD2-CG2 4.17Å; L181-T476 HydrophobicContact CB-CG2 4.01Å; L181-F480 HydrophobicContact CD2-CB 4.14Å; L181-F480 HydrophobicContact CD2-CD1 3.97Å; L181-F480 HydrophobicContact CD2-CD2 3.47Å; L181-F480 VanDerWaalsContact CD2-CD2 3.47Å; L181-F480 HydrophobicContact CD2-CE1 4.24Å; L181-F480 HydrophobicContact CD2-CE2 3.79Å; L181-F480 HydrophobicContact CD2-CG 3.58Å; L181-F480 HydrophobicContact CD2-CZ 4.17Å; L181-F480 HydrophobicContact CG-CD2 4.49Å
182	L	95.7	Very high	93.7	Very high	2 Å²	2	8.3 Å²	8.3	1%	0.01	5%	0.047	C	C	.	.	H	α-helix	trans	-102.3	-32.6	-163.6	-61	179	0	0	0	113.9	V178 P389 A410 V413 Q414 L453	V178-L182 HydrophobicContact CG2-CD1 4.28Å; V178-L182 WeakPolarHBondContact O-CB 3.45Å; V178-L182 PolarHBondContact O-N 3.48Å; V178-L182 VanDerWaalsContact O-N 3.14Å; L182-P389 HydrophobicContact CD1-CB 3.24Å; L182-A410 HydrophobicContact CD2-CB 4.2Å; L182-V413 HydrophobicContact CD1-CG1 4.47Å; L182-V413 HydrophobicContact CD2-CB 4.38Å; L182-V413 HydrophobicContact CD2-CG1 4.02Å; L182-Q414 HydrophobicContact CD2-CG 4.02Å; L182-L453 HydrophobicContact CD1-CD1 4.46Å; L182-L453 HydrophobicContact CD1-CD2 4.16Å
183	A	95.4	Very high	93.7	Very high	1 Å²	1	7.6 Å²	7.6	1%	0.008	4%	0.043	C	C	.	.	S	Bend	trans	-136	60.1	-179.7	0	0	0	0	0	110.4	V179 Y185	V179-A183 CarbonylContact O-C 3.57Å; V179-A183 WeakPolarHBondContact O-CA 3.23Å; V179-A183 PolarHBondContact O-N 2.86Å; A183-Y185 VanDerWaalsContact O-CD1 3.24Å; A183-Y185 WeakPolarHBondContact O-CD1 3.47Å; A183-Y185 WeakPolarHBondContact O-CE1 3.41Å
184	P	95.5	Very high	93.5	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.032	C	C	.	.	P	Polyproline II helix	trans	-60.5	143.4	-175	23.9	-34.4	0	0	0	110.8	I171 V179 S394 I396 M397 V402	I171-P184 HydrophobicContact CG2-CB 4.02Å; V179-P184 WeakPolarHBondContact O-CA 3.41Å; P184-S394 WeakPolarHBondContact O-CB 3.43Å; P184-S394 PolarHBondContact O-OG 3.25Å; P184-I396 HydrophobicContact CB-CD1 3.89Å; P184-I396 HydrophobicContact CB-CG1 4.48Å; P184-I396 HydrophobicContact CG-CD1 4.01Å; P184-I396 HydrophobicContact CG-CG1 4.12Å; P184-I396 WeakPolarHBondContact O-CD1 3.16Å; P184-I396 WeakPolarHBondContact O-CG1 3.38Å; P184-M397 WeakPolarHBondContact CD-SD 3.5Å; P184-M397 HydrophobicContact CG-CG 3.84Å; P184-M397 HydrophobicContact CG-SD 3.34Å; P184-M397 WeakPolarHBondContact CG-SD 3.17Å; P184-V402 HydrophobicContact CG-CG1 4.33Å
185	Y	94.7	Very high	93	Very high	2 Å²	2	7 Å²	7	1%	0.008	4%	0.042	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	136.7	-178.8	-66.1	-8.9	0	0	0	110.6	I171 L172 T174 V179 A183 I191 L208 A370 T372	I171-Y185 CarbonylContact C-O 3.43Å; I171-Y185 WeakPolarHBondContact CA-O 3.47Å; L172-Y185 PolarHBondContact N-O 2.86Å; T174-Y185 HydrophobicContact CG2-CD2 3.61Å; T174-Y185 HydrophobicContact CG2-CE2 4.11Å; T174-Y185 HydrophobicContact CG2-CG 4.23Å; V179-Y185 HydrophobicContact CG1-CD1 3.79Å; V179-Y185 HydrophobicContact CG1-CD2 4.07Å; V179-Y185 HydrophobicContact CG1-CE1 3.46Å; V179-Y185 VanDerWaalsContact CG1-CE1 3.46Å; V179-Y185 HydrophobicContact CG1-CE2 3.76Å; V179-Y185 HydrophobicContact CG1-CG 4.08Å; V179-Y185 VanDerWaalsContact CG1-CZ 3.44Å; A183-Y185 VanDerWaalsContact O-CD1 3.24Å; A183-Y185 WeakPolarHBondContact O-CD1 3.47Å; A183-Y185 WeakPolarHBondContact O-CE1 3.41Å; Y185-I191 HydrophobicContact CD1-CG1 3.65Å; Y185-I191 HydrophobicContact CD1-CG2 4.1Å; Y185-I191 HydrophobicContact CD2-CD1 4.27Å; Y185-I191 HydrophobicContact CD2-CG1 3.96Å; Y185-I191 HydrophobicContact CE1-CB 4.39Å; Y185-I191 HydrophobicContact CE1-CG1 3.95Å; Y185-I191 HydrophobicContact CE1-CG2 3.49Å; Y185-I191 VanDerWaalsContact CE1-CG2 3.49Å; Y185-I191 HydrophobicContact CE2-CG1 4.24Å; Y185-I191 HydrophobicContact CE2-CG2 4.07Å; Y185-I191 HydrophobicContact CG-CD1 4.13Å; Y185-I191 HydrophobicContact CG-CG1 3.67Å; Y185-I191 VanDerWaalsContact CZ-CG2 3.48Å; Y185-L208 HydrophobicContact CE2-CD1 4.2Å; Y185-L208 HydrophobicContact CE2-CD2 4.24Å; Y185-A370 HydrophobicContact CD1-CB 4.05Å; Y185-A370 HydrophobicContact CE1-CB 4.34Å; Y185-T372 WeakPolarHBondContact CE1-OG1 3.31Å; Y185-T372 PolarHBondContact OH-OG1 2.87Å
186	A	92.2	Very high	92	Very high	11 Å²	11	8.6 Å²	8.6	9%	0.091	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	138	172.9	0	0	0	0	0	109.7	E170 G188 G189 I396	E170-A186 WeakPolarHBondContact O-CA 3.39Å; A186-G188 PolarHBondContact O-N 3.48Å; A186-G189 WeakPolarHBondContact O-CA 3.33Å; A186-G189 PolarHBondContact O-N 2.76Å; A186-I396 HydrophobicContact CB-CD1 4.24Å; A186-I396 HydrophobicContact CB-CG1 4.44Å; A186-I396 HydrophobicContact CB-CG2 3.77Å
187	K	89.9	Confident	91.1	Very high	61 Å²	61	12.8 Å²	12.8	27%	0.265	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	122.6	173	-173.4	179.2	-175.8	174.9	0	110.4	E170 G189 D289 T337 S342	E170-K187 HydrophobicContact CB-CB 4.26Å; E170-K187 PolarHBondContact O-N 3.34Å; K187-G189 PolarHBondContact O-N 3.18Å; K187-D289 WeakPolarHBondContact CE-OD1 3.28Å; K187-D289 WeakPolarHBondContact CE-OD2 3.33Å; K187-D289 VanDerWaalsContact NZ-CG 3.35Å; K187-D289 IonicContact NZ-OD1 3.35Å; K187-D289 PolarHBondContact NZ-OD1 3.43Å; K187-D289 IonicContact NZ-OD2 2.71Å; K187-D289 PolarHBondContact NZ-OD2 3.2Å; K187-T337 PolarHBondContact O-OG1 2.97Å; K187-S342 WeakPolarHBondContact CE-OG 3.46Å; K187-S342 WeakPolarHBondContact CG-OG 3.44Å
188	G	88.6	Confident	90.2	Very high	8 Å²	8	16.1 Å²	16.1	8%	0.082	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	15.1	-171.5	0	0	0	0	0	114.9	A186 T337 I343 T344	A186-G188 PolarHBondContact O-N 3.48Å; G188-T337 VanDerWaalsContact CA-OG1 3.26Å; G188-T337 WeakPolarHBondContact CA-OG1 3Å; G188-I343 CarbonylContact C-O 3.52Å; G188-I343 VanDerWaalsContact CA-O 3.29Å; G188-I343 WeakPolarHBondContact CA-O 3.32Å; G188-T344 PolarHBondContact N-OG1 3.41Å
189	G	91.8	Very high	89.8	Confident	3 Å²	3	16.1 Å²	16.1	3%	0.031	13%	0.129	C	C	.	.			trans	-80.9	172.2	173.5	0	0	0	0	0	112.8	A186 K187 S345 D369	A186-G189 WeakPolarHBondContact O-CA 3.33Å; A186-G189 PolarHBondContact O-N 2.76Å; K187-G189 PolarHBondContact O-N 3.18Å; G189-S345 PolarHBondContact O-N 2.84Å; G189-D369 WeakPolarHBondContact CA-OD2 3.45Å
190	K	94.8	Very high	89.3	Confident	16 Å²	16	17.3 Å²	17.3	7%	0.07	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.3	177.5	-62.9	150.9	-175.7	178.4	0	109.4	Q332 E333 I335 H367 L368 D369 A370	K190-Q332 WeakPolarHBondContact CE-O 3.39Å; K190-Q332 PolarHBondContact NZ-O 3.08Å; K190-E333 IonicContact NZ-OE1 3.88Å; K190-E333 PolarHBondContact NZ-OE1 2.86Å; K190-I335 WeakPolarHBondContact CE-O 3.48Å; K190-I335 HydrophobicContact CG-CB 4.44Å; K190-I335 HydrophobicContact CG-CG2 3.93Å; K190-H367 WeakPolarHBondContact CB-O 3.24Å; K190-H367 HydrophobicContact CD-CB 4.16Å; K190-H367 WeakPolarHBondContact CD-O 3.3Å; K190-L368 HydrophobicContact CB-CD2 4.17Å; K190-L368 CarbonylContact O-C 3.23Å; K190-D369 PolarHBondContact N-OD2 3.43Å; K190-D369 PolarHBondContact O-N 3.24Å; K190-A370 PolarHBondContact O-N 3.46Å
191	I	94.9	Very high	88.8	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.5	-175.8	-60.2	89	0	0	0	109.2	Y185 T344 S345 V346 Q347 A370	Y185-I191 HydrophobicContact CD1-CG1 3.65Å; Y185-I191 HydrophobicContact CD1-CG2 4.1Å; Y185-I191 HydrophobicContact CD2-CD1 4.27Å; Y185-I191 HydrophobicContact CD2-CG1 3.96Å; Y185-I191 HydrophobicContact CE1-CB 4.39Å; Y185-I191 HydrophobicContact CE1-CG1 3.95Å; Y185-I191 HydrophobicContact CE1-CG2 3.49Å; Y185-I191 VanDerWaalsContact CE1-CG2 3.49Å; Y185-I191 HydrophobicContact CE2-CG1 4.24Å; Y185-I191 HydrophobicContact CE2-CG2 4.07Å; Y185-I191 HydrophobicContact CG-CD1 4.13Å; Y185-I191 HydrophobicContact CG-CG1 3.67Å; Y185-I191 VanDerWaalsContact CZ-CG2 3.48Å; I191-T344 HydrophobicContact CD1-CG2 3.41Å; I191-T344 VanDerWaalsContact CD1-CG2 3.41Å; I191-S345 VanDerWaalsContact CD1-O 3.27Å; I191-S345 WeakPolarHBondContact CD1-O 3.34Å; I191-S345 PolarHBondContact N-O 3.26Å; I191-V346 HydrophobicContact CB-CG2 4.4Å; I191-V346 HydrophobicContact CD1-CG2 4.38Å; I191-Q347 PolarHBondContact O-N 3.39Å; I191-A370 CarbonylContact C-O 3.58Å; I191-A370 WeakPolarHBondContact CA-O 3.45Å; I191-A370 HydrophobicContact CG1-CB 4.26Å
192	G	93.9	Very high	88.1	Confident	0 Å²	0	22 Å²	22	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	119.2	170.7	0	0	0	0	0	112	F194 Q347 A370 T371 T372	G192-F194 WeakPolarHBondContact O-CD2 3.28Å; G192-Q347 CarbonylContact C-O 3.57Å; G192-Q347 WeakPolarHBondContact CA-O 3.43Å; G192-A370 PolarHBondContact N-O 3.05Å; G192-T371 WeakPolarHBondContact O-CA 3.36Å; G192-T372 PolarHBondContact O-N 2.71Å
193	L	91.8	Very high	87.7	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	110.7	167.8	-72.5	178.7	0	0	0	109.8	L204 I205 V346 Q347 A348 I349 T372	L193-L204 HydrophobicContact CD2-CD2 3.71Å; L193-I205 HydrophobicContact CD1-CD1 4.01Å; L193-I205 HydrophobicContact CD1-CG1 3.67Å; L193-V346 HydrophobicContact CD1-CG1 3.29Å; L193-V346 HydrophobicContact CD2-CG1 4.42Å; L193-V346 HydrophobicContact CG-CG1 3.58Å; L193-Q347 PolarHBondContact N-O 3.42Å; L193-A348 WeakPolarHBondContact O-CA 3.34Å; L193-I349 PolarHBondContact O-N 3.34Å; L193-T372 WeakPolarHBondContact CA-O 3.29Å; L193-T372 HydrophobicContact CD2-CG2 4.01Å
194	F	87.7	Confident	87.4	Confident	14 Å²	14	24 Å²	24	6%	0.061	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	141.6	175.1	-61.9	-92.5	0	0	0	109.5	G192 I349 V351 F365 L368 T371 T372 V373 L374	G192-F194 WeakPolarHBondContact O-CD2 3.28Å; F194-I349 HydrophobicContact CD1-CB 4.01Å; F194-I349 HydrophobicContact CD1-CG2 4.21Å; F194-I349 HydrophobicContact CE1-CB 3.57Å; F194-I349 HydrophobicContact CE1-CD1 4Å; F194-I349 HydrophobicContact CE1-CG1 4.31Å; F194-I349 HydrophobicContact CE1-CG2 3.5Å; F194-I349 VanDerWaalsContact CE1-CG2 3.5Å; F194-I349 HydrophobicContact CE2-CD1 3.99Å; F194-I349 HydrophobicContact CZ-CB 3.89Å; F194-I349 HydrophobicContact CZ-CD1 3.39Å; F194-I349 HydrophobicContact CZ-CG1 4.12Å; F194-I349 HydrophobicContact CZ-CG2 4.05Å; F194-V351 HydrophobicContact CD1-CG2 3.76Å; F194-V351 HydrophobicContact CE1-CG2 3.93Å; F194-F365 HydrophobicContact CD1-CZ 4.5Å; F194-F365 AromaticContact CE1-CE1 3.62Å; F194-F365 HydrophobicContact CE1-CE1 3.62Å; F194-F365 AromaticContact CE1-CZ 3.43Å; F194-F365 HydrophobicContact CE1-CZ 3.43Å; F194-F365 VanDerWaalsContact CE1-CZ 3.43Å; F194-F365 AromaticContact CE2-CE1 3.82Å; F194-F365 HydrophobicContact CE2-CE1 3.82Å; F194-F365 HydrophobicContact CE2-CZ 4.45Å; F194-F365 HydrophobicContact CZ-CD1 4.02Å; F194-F365 AromaticContact CZ-CE1 3.05Å; F194-F365 HydrophobicContact CZ-CE1 3.05Å; F194-F365 AromaticContact CZ-CZ 3.43Å; F194-F365 HydrophobicContact CZ-CZ 3.43Å; F194-F365 VanDerWaalsContact CZ-CZ 3.43Å; F194-L368 HydrophobicContact CE2-CD1 4.27Å; F194-L368 HydrophobicContact CZ-CD1 4.16Å; F194-T371 HydrophobicContact CE2-CG2 3.87Å; F194-T372 PolarHBondContact N-O 2.66Å; F194-V373 HydrophobicContact CB-CB 4.45Å; F194-V373 HydrophobicContact CB-CG1 4.35Å; F194-V373 HydrophobicContact CB-CG2 4.21Å; F194-V373 HydrophobicContact CD2-CG2 4.29Å; F194-V373 HydrophobicContact CG-CG2 4.48Å; F194-L374 WeakPolarHBondContact O-CA 3.42Å; F194-L374 VanDerWaalsContact O-CB 3.29Å; F194-L374 WeakPolarHBondContact O-CB 3.21Å; F194-L374 PolarHBondContact O-N 3.38Å
195	G	79.8	Confident	87	Confident	22 Å²	22	24.2 Å²	24.2	23%	0.227	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.8	145.9	174.7	0	0	0	0	0	113.6	K201	G195-K201 VanDerWaalsContact O-CE 3.29Å; G195-K201 WeakPolarHBondContact O-CE 3.4Å; G195-K201 PolarHBondContact O-NZ 2.95Å
196	G	72.4	Confident	86.5	Confident	36 Å²	36	24.4 Å²	24.4	37%	0.371	18%	0.181	S	C	.	.			trans	-70.2	-178.3	173.8	0	0	0	0	0	113.1	V199 K201	G196-V199 WeakPolarHBondContact O-CG2 3.22Å; G196-K201 WeakPolarHBondContact O-CE 3.24Å
197	A	75.7	Confident	86.4	Confident	87 Å²	87	24 Å²	24	72%	0.719	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	142.8	169.6	0	0	0	0	0	110.7
198	G	78	Confident	86.4	Confident	71 Å²	71	21.2 Å²	21.2	73%	0.732	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.9	0.3	172.7	0	0	0	0	0	116.6	G200	G198-G200 VanDerWaalsContact C-N 3.31Å; G198-G200 PolarHBondContact O-N 3.38Å
199	V	85.8	Confident	86.2	Confident	4 Å²	4	20.9 Å²	20.9	2%	0.024	16%	0.161	C	C	.	.	S	Bend	trans	-86.5	5.3	-179.9	-56.1	0	0	0	0	114.3	G196 K201 L374 R376	G196-V199 WeakPolarHBondContact O-CG2 3.22Å; V199-K201 HydrophobicContact CG2-CG 4.08Å; V199-L374 HydrophobicContact CB-CB 4.04Å; V199-L374 HydrophobicContact CG2-CB 3.46Å; V199-L374 VanDerWaalsContact CG2-CB 3.46Å; V199-L374 HydrophobicContact CG2-CD1 4.14Å; V199-L374 HydrophobicContact CG2-CG 4.38Å; V199-R376 HydrophobicContact CG1-CB 4.3Å
200	G	85.9	Confident	85.8	Confident	24 Å²	24	21.3 Å²	21.3	25%	0.247	16%	0.163	C	C	.	.	S	Bend	trans	87.7	21.9	177.1	0	0	0	0	0	116.4	G198 T202 V203 L204	G198-G200 VanDerWaalsContact C-N 3.31Å; G198-G200 PolarHBondContact O-N 3.38Å; G200-T202 PolarHBondContact O-N 3.36Å; G200-V203 PolarHBondContact O-N 3.37Å; G200-L204 PolarHBondContact O-N 3.34Å
201	K	85.2	Confident	85.4	Confident	39 Å²	39	20.7 Å²	20.7	17%	0.17	16%	0.16	C	C	.	.	H	α-helix	trans	-51.4	-52.9	177.5	-77.9	-173.2	-61.9	-177.7	0	113.5	G195 G196 V199 V203 L204 I205 L374	G195-K201 VanDerWaalsContact O-CE 3.29Å; G195-K201 WeakPolarHBondContact O-CE 3.4Å; G195-K201 PolarHBondContact O-NZ 2.95Å; G196-K201 WeakPolarHBondContact O-CE 3.24Å; V199-K201 HydrophobicContact CG2-CG 4.08Å; K201-V203 VanDerWaalsContact C-N 3.33Å; K201-V203 PolarHBondContact O-N 3.06Å; K201-L204 PolarHBondContact O-N 2.81Å; K201-I205 WeakPolarHBondContact O-CG1 3.4Å; K201-I205 PolarHBondContact O-N 3.41Å; K201-L374 HydrophobicContact CB-CD1 4.28Å; K201-L374 HydrophobicContact CD-CD1 4.47Å; K201-L374 HydrophobicContact CG-CD1 3.4Å
202	T	80.8	Confident	84.6	Confident	61 Å²	61	21 Å²	21	37%	0.374	16%	0.162	S	C	.	.	H	α-helix	trans	-61.4	-42.7	-178.6	-47.2	0	0	0	0	111.5	G200 L204 I205 M206 L235	G200-T202 PolarHBondContact O-N 3.36Å; T202-L204 PolarHBondContact O-N 3.46Å; T202-I205 PolarHBondContact O-N 3.33Å; T202-M206 HydrophobicContact CG2-CE 4.29Å; T202-M206 WeakPolarHBondContact O-CG 3.23Å; T202-M206 PolarHBondContact O-N 2.94Å; T202-L235 HydrophobicContact CG2-CD1 3.66Å
203	V	86.2	Confident	83.6	Confident	45 Å²	45	22 Å²	22	27%	0.273	17%	0.171	S	C	.	.	H	α-helix	trans	-64.1	-41.9	178.3	-172.1	0	0	0	0	110.9	G200 K201 M206 E207 F457 V459 A460	G200-V203 PolarHBondContact O-N 3.37Å; K201-V203 VanDerWaalsContact C-N 3.33Å; K201-V203 PolarHBondContact O-N 3.06Å; V203-M206 HydrophobicContact CG2-CE 4.4Å; V203-M206 PolarHBondContact O-N 3.44Å; V203-E207 WeakPolarHBondContact O-CB 3.42Å; V203-E207 PolarHBondContact O-N 2.93Å; V203-F457 HydrophobicContact CG1-CD2 3.89Å; V203-V459 HydrophobicContact CG1-CG2 3.94Å; V203-A460 HydrophobicContact CG1-CB 4.11Å
204	L	89.9	Confident	82.8	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-42.6	174.8	-179.4	63.6	0	0	0	112	I176 L193 G200 K201 T202 E207 L208 L374 P385 F457	I176-L204 HydrophobicContact CD1-CD1 3.51Å; L193-L204 HydrophobicContact CD2-CD2 3.71Å; G200-L204 PolarHBondContact O-N 3.34Å; K201-L204 PolarHBondContact O-N 2.81Å; T202-L204 PolarHBondContact O-N 3.46Å; L204-E207 PolarHBondContact O-N 3.47Å; L204-L208 HydrophobicContact CG-CD1 4.33Å; L204-L208 WeakPolarHBondContact O-CG 3.36Å; L204-L208 PolarHBondContact O-N 3.18Å; L204-L374 HydrophobicContact CD2-CD1 4.23Å; L204-L374 HydrophobicContact CD2-CD2 4.2Å; L204-P385 HydrophobicContact CD1-CB 4.35Å; L204-F457 HydrophobicContact CD1-CE2 4.08Å; L204-F457 HydrophobicContact CD1-CZ 3.79Å
205	I	87.4	Confident	82.1	Confident	4 Å²	4	30 Å²	30	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-48.1	176.4	-74.2	166	0	0	0	110.8	L193 K201 T202 E207 L208 I209 F222 F293	L193-I205 HydrophobicContact CD1-CD1 4.01Å; L193-I205 HydrophobicContact CD1-CG1 3.67Å; K201-I205 WeakPolarHBondContact O-CG1 3.4Å; K201-I205 PolarHBondContact O-N 3.41Å; T202-I205 PolarHBondContact O-N 3.33Å; I205-E207 VanDerWaalsContact C-N 3.32Å; I205-E207 PolarHBondContact O-N 2.88Å; I205-L208 PolarHBondContact O-N 3.14Å; I205-I209 HydrophobicContact CG2-CD1 3.97Å; I205-I209 WeakPolarHBondContact O-CG1 3.5Å; I205-I209 PolarHBondContact O-N 3.42Å; I205-F222 HydrophobicContact CG2-CD2 4.4Å; I205-F222 HydrophobicContact CG2-CE2 4.22Å; I205-F293 HydrophobicContact CB-CD1 4.19Å; I205-F293 HydrophobicContact CB-CE1 4.19Å; I205-F293 HydrophobicContact CG1-CD1 3.96Å; I205-F293 HydrophobicContact CG1-CE1 4.16Å; I205-F293 HydrophobicContact CG2-CD1 3.47Å; I205-F293 VanDerWaalsContact CG2-CD1 3.47Å; I205-F293 HydrophobicContact CG2-CE1 3.69Å; I205-F293 HydrophobicContact CG2-CG 3.98Å; I205-F293 HydrophobicContact CG2-CZ 4.38Å
206	M	84.8	Confident	81.7	Confident	6 Å²	6	33 Å²	33	3%	0.03	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-40.2	178.5	-71.1	-170.5	-66.7	0	0	112.2	T202 V203 I209 N210 L235 E238 V459	T202-M206 HydrophobicContact CG2-CE 4.29Å; T202-M206 WeakPolarHBondContact O-CG 3.23Å; T202-M206 PolarHBondContact O-N 2.94Å; V203-M206 HydrophobicContact CG2-CE 4.4Å; V203-M206 PolarHBondContact O-N 3.44Å; M206-I209 PolarHBondContact O-N 3.28Å; M206-N210 WeakPolarHBondContact O-CB 3.27Å; M206-N210 PolarHBondContact O-N 3.27Å; M206-L235 HydrophobicContact CG-CD1 3.77Å; M206-L235 HydrophobicContact SD-CD1 3.85Å; M206-E238 HydrophobicContact CE-CB 4.39Å; M206-E238 WeakPolarHBondContact CE-OE2 3.29Å; M206-E238 HydrophobicContact SD-CB 3.73Å; M206-V459 HydrophobicContact CB-CB 4.25Å; M206-V459 HydrophobicContact CB-CG1 4.09Å; M206-V459 HydrophobicContact CB-CG2 4.03Å
207	E	88.9	Confident	81.5	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-65.6	-40.6	176.4	-171.5	72.5	170.3	0	0	111.5	I176 V203 L204 I205 I209 N210 N211 F457 Q458 V459	I176-E207 HydrophobicContact CD1-CG 4.35Å; V203-E207 WeakPolarHBondContact O-CB 3.42Å; V203-E207 PolarHBondContact O-N 2.93Å; L204-E207 PolarHBondContact O-N 3.47Å; I205-E207 VanDerWaalsContact C-N 3.32Å; I205-E207 PolarHBondContact O-N 2.88Å; E207-I209 PolarHBondContact O-N 3.44Å; E207-N210 PolarHBondContact O-N 3.42Å; E207-N211 WeakPolarHBondContact O-CB 3.36Å; E207-N211 VanDerWaalsContact O-CG 3.26Å; E207-N211 PolarHBondContact O-N 3.43Å; E207-N211 PolarHBondContact OE1-OD1 3.06Å; E207-F457 HydrophobicContact CB-CB 4.39Å; E207-F457 HydrophobicContact CB-CD1 4.3Å; E207-F457 HydrophobicContact CB-CD2 3.97Å; E207-F457 HydrophobicContact CB-CE2 4.19Å; E207-F457 HydrophobicContact CB-CG 3.99Å; E207-F457 HydrophobicContact CB-CZ 4.44Å; E207-F457 HydrophobicContact CG-CB 4.05Å; E207-F457 HydrophobicContact CG-CD1 3.57Å; E207-F457 HydrophobicContact CG-CD2 4.15Å; E207-F457 HydrophobicContact CG-CE1 3.91Å; E207-F457 HydrophobicContact CG-CE2 4.44Å; E207-F457 HydrophobicContact CG-CG 3.68Å; E207-F457 HydrophobicContact CG-CZ 4.31Å; E207-F457 WeakPolarHBondContact OE1-CA 3.11Å; E207-Q458 PolarHBondContact OE1-N 3.39Å; E207-Q458 PolarHBondContact OE2-N 3.35Å; E207-V459 HydrophobicContact CB-CG2 4.03Å; E207-V459 WeakPolarHBondContact OE2-CG2 3.1Å; E207-V459 PolarHBondContact OE2-N 3.23Å; E207-V459 VanDerWaalsContact OE2-N 3.1Å
208	L	89.3	Confident	81.7	Confident	4 Å²	4	29.3 Å²	29.3	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-60.7	-43.5	174.7	-74.4	169.7	0	0	0	111.8	T174 I176 Y185 L204 I205 V212 F293 V346	T174-L208 HydrophobicContact CG2-CD2 3.82Å; I176-L208 HydrophobicContact CD1-CD2 3.87Å; I176-L208 HydrophobicContact CD1-CG 4.19Å; Y185-L208 HydrophobicContact CE2-CD1 4.2Å; Y185-L208 HydrophobicContact CE2-CD2 4.24Å; L204-L208 HydrophobicContact CG-CD1 4.33Å; L204-L208 WeakPolarHBondContact O-CG 3.36Å; L204-L208 PolarHBondContact O-N 3.18Å; I205-L208 PolarHBondContact O-N 3.14Å; L208-V212 WeakPolarHBondContact O-CB 3.43Å; L208-V212 WeakPolarHBondContact O-CG2 3.3Å; L208-V212 PolarHBondContact O-N 3.37Å; L208-F293 HydrophobicContact CB-CE1 4.24Å; L208-F293 HydrophobicContact CB-CZ 4Å; L208-F293 HydrophobicContact CD1-CE1 4.38Å; L208-V346 HydrophobicContact CD1-CG1 4.35Å; L208-V346 HydrophobicContact CD1-CG2 4.44Å
209	I	84.4	Confident	82.3	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.6	-50.1	174.5	-66.8	165.4	0	0	0	110.1	I205 M206 E207 A213 M239 V244 F293	I205-I209 HydrophobicContact CG2-CD1 3.97Å; I205-I209 WeakPolarHBondContact O-CG1 3.5Å; I205-I209 PolarHBondContact O-N 3.42Å; M206-I209 PolarHBondContact O-N 3.28Å; E207-I209 PolarHBondContact O-N 3.44Å; I209-A213 WeakPolarHBondContact O-CB 3.17Å; I209-A213 PolarHBondContact O-N 2.93Å; I209-M239 HydrophobicContact CD1-CE 3.57Å; I209-V244 HydrophobicContact CG2-CG1 3.64Å; I209-F293 HydrophobicContact CB-CE2 4.48Å; I209-F293 HydrophobicContact CD1-CD2 4.05Å; I209-F293 HydrophobicContact CD1-CE2 3.85Å; I209-F293 HydrophobicContact CD1-CZ 4.26Å; I209-F293 HydrophobicContact CG1-CD2 3.89Å; I209-F293 HydrophobicContact CG1-CE1 4.41Å; I209-F293 HydrophobicContact CG1-CE2 3.18Å; I209-F293 HydrophobicContact CG1-CZ 3.49Å; I209-F293 VanDerWaalsContact CG1-CZ 3.49Å
210	N	84.1	Confident	82.6	Confident	13 Å²	13	27.7 Å²	27.7	7%	0.07	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-46	-178.4	175.6	59.8	0	0	0	112.4	M206 E207 K214 Q458 V459	M206-N210 WeakPolarHBondContact O-CB 3.27Å; M206-N210 PolarHBondContact O-N 3.27Å; E207-N210 PolarHBondContact O-N 3.42Å; N210-K214 WeakPolarHBondContact O-CB 3.41Å; N210-K214 WeakPolarHBondContact O-CG 3.04Å; N210-K214 PolarHBondContact O-N 3.12Å; N210-K214 VanDerWaalsContact OD1-CE 3.29Å; N210-K214 WeakPolarHBondContact OD1-CE 3.48Å; N210-K214 PolarHBondContact OD1-NZ 3.2Å; N210-Q458 PolarHBondContact ND2-OE1 3.26Å; N210-Q458 VanDerWaalsContact ND2-OE1 3.07Å; N210-V459 HydrophobicContact CB-CG1 3.99Å
211	N	85.4	Confident	83	Confident	3 Å²	3	26.5 Å²	26.5	2%	0.016	16%	0.155	C	C	.	.	H	α-helix	trans	-68.5	-43.3	-176.8	-72.5	-3.2	0	0	0	111.7	T174 E207 K214 A215 L470	T174-N211 VanDerWaalsContact O-CB 3.28Å; T174-N211 WeakPolarHBondContact O-CB 3.38Å; T174-N211 PolarHBondContact O-ND2 3.21Å; E207-N211 WeakPolarHBondContact O-CB 3.36Å; E207-N211 VanDerWaalsContact O-CG 3.26Å; E207-N211 PolarHBondContact O-N 3.43Å; E207-N211 PolarHBondContact OE1-OD1 3.06Å; N211-K214 PolarHBondContact O-N 2.89Å; N211-A215 WeakPolarHBondContact O-CB 3.24Å; N211-A215 PolarHBondContact O-N 3.24Å; N211-L470 HydrophobicContact CB-CD1 4.07Å
212	V	78.6	Confident	83.4	Confident	6 Å²	6	25 Å²	25	4%	0.036	15%	0.148	C	C	.	.	H	α-helix	trans	-72	-37	179.2	174.6	0	0	0	0	111.7	L208 K214 H216 G217 L291	L208-V212 WeakPolarHBondContact O-CB 3.43Å; L208-V212 WeakPolarHBondContact O-CG2 3.3Å; L208-V212 PolarHBondContact O-N 3.37Å; V212-K214 VanDerWaalsContact C-N 3.28Å; V212-K214 PolarHBondContact O-N 3.38Å; V212-H216 HydrophobicContact CG1-CB 4.13Å; V212-H216 WeakPolarHBondContact O-CA 3.36Å; V212-H216 PolarHBondContact O-N 2.97Å; V212-G217 PolarHBondContact O-N 2.9Å; V212-L291 HydrophobicContact CB-CD1 3.59Å; V212-L291 HydrophobicContact CB-CG 4.25Å; V212-L291 HydrophobicContact CG1-CD1 3.84Å; V212-L291 HydrophobicContact CG1-CD2 4.49Å; V212-L291 HydrophobicContact CG1-CG 3.92Å; V212-L291 HydrophobicContact CG2-CD1 3.68Å; V212-L291 HydrophobicContact CG2-CG 4.43Å
213	A	73.7	Confident	84.2	Confident	23 Å²	23	22 Å²	22	19%	0.19	13%	0.13	C	C	.	.	H	α-helix	trans	-60.9	-37.6	173.2	0	0	0	0	0	112.3	I209 G217 K253	I209-A213 WeakPolarHBondContact O-CB 3.17Å; I209-A213 PolarHBondContact O-N 2.93Å; A213-G217 WeakPolarHBondContact O-CA 3.1Å; A213-G217 PolarHBondContact O-N 3.14Å; A213-K253 HydrophobicContact CB-CB 4.28Å; A213-K253 HydrophobicContact CB-CG 4.31Å
214	K	75.6	Confident	84.5	Confident	118 Å²	118	19.9 Å²	19.9	51%	0.513	12%	0.117	S	C	.	.	H	α-helix	trans	-78.7	-41.6	178.7	-78.1	172	171.2	154.6	0	113.8	N210 N211 V212	N210-K214 WeakPolarHBondContact O-CB 3.41Å; N210-K214 WeakPolarHBondContact O-CG 3.04Å; N210-K214 PolarHBondContact O-N 3.12Å; N210-K214 VanDerWaalsContact OD1-CE 3.29Å; N210-K214 WeakPolarHBondContact OD1-CE 3.48Å; N210-K214 PolarHBondContact OD1-NZ 3.2Å; N211-K214 PolarHBondContact O-N 2.89Å; V212-K214 VanDerWaalsContact C-N 3.28Å; V212-K214 PolarHBondContact O-N 3.38Å
215	A	72.9	Confident	84.8	Confident	63 Å²	63	19.9 Å²	19.9	52%	0.521	12%	0.117	S	C	.	.	H	α-helix	trans	-86.8	-38.9	-173	0	0	0	0	0	113.3	N211	N211-A215 WeakPolarHBondContact O-CB 3.24Å; N211-A215 PolarHBondContact O-N 3.24Å
216	H	69.6	Low	84.9	Confident	86 Å²	86	19.9 Å²	19.9	40%	0.398	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-9	-172	-59.5	-77.1	0	0	0	113.4	V173 V212 G218	V173-H216 PolarHBondContact O-NE2 3.48Å; V212-H216 HydrophobicContact CG1-CB 4.13Å; V212-H216 WeakPolarHBondContact O-CA 3.36Å; V212-H216 PolarHBondContact O-N 2.97Å; H216-G218 PolarHBondContact O-N 3.14Å
217	G	69.7	Low	85	Confident	42 Å²	42	20.5 Å²	20.5	43%	0.433	12%	0.121	S	C	.	.			trans	68.3	11.1	177.9	0	0	0	0	0	114.9	V212 A213	V212-G217 PolarHBondContact O-N 2.9Å; A213-G217 WeakPolarHBondContact O-CA 3.1Å; A213-G217 PolarHBondContact O-N 3.14Å
218	G	80.1	Confident	85.1	Confident	3 Å²	3	26.2 Å²	26.2	3%	0.031	14%	0.142	C	C	.	.			trans	-78.5	159.9	-178.1	0	0	0	0	0	113.9	H216 D289	H216-G218 PolarHBondContact O-N 3.14Å; G218-D289 WeakPolarHBondContact CA-O 3.37Å
219	Y	89.1	Confident	85.1	Confident	40 Å²	40	29.5 Å²	29.5	16%	0.157	16%	0.163	C	C	.	.			trans	-87.8	155.4	171.8	-65.2	-56	0	0	0	111.6	L130 K253 F282 V290 L291	L130-Y219 HydrophobicContact CD1-CD1 3.62Å; L130-Y219 HydrophobicContact CD1-CE1 3.28Å; L130-Y219 HydrophobicContact CD1-CE2 4.32Å; L130-Y219 HydrophobicContact CD1-CG 4.28Å; L130-Y219 HydrophobicContact CD2-CD1 3.72Å; L130-Y219 HydrophobicContact CD2-CE1 4.29Å; L130-Y219 HydrophobicContact CD2-CG 4.07Å; L130-Y219 HydrophobicContact CG-CD1 4.35Å; L130-Y219 HydrophobicContact CG-CE1 4.44Å; Y219-K253 HydrophobicContact CD1-CD 4.06Å; Y219-K253 HydrophobicContact CE1-CD 3.87Å; Y219-F282 AromaticContact CD2-CD1 3.56Å; Y219-F282 HydrophobicContact CD2-CD1 3.56Å; Y219-F282 AromaticContact CD2-CE1 3.76Å; Y219-F282 HydrophobicContact CD2-CE1 3.76Å; Y219-F282 HydrophobicContact CD2-CG 4.08Å; Y219-F282 HydrophobicContact CD2-CZ 4.4Å; Y219-F282 HydrophobicContact CE2-CD1 4.09Å; Y219-F282 HydrophobicContact CE2-CE1 4.08Å; Y219-F282 HydrophobicContact CG-CD1 4.43Å; Y219-F282 HydrophobicContact CG-CE1 4.43Å; Y219-V290 WeakPolarHBondContact O-CA 3.26Å; Y219-L291 PolarHBondContact O-N 2.82Å
220	S	92	Very high	85.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	148.3	173.5	-62.2	0	0	0	0	110.9	K253 V254 A255 L291	S220-K253 PolarHBondContact N-O 3.06Å; S220-V254 CarbonylContact O-C 3.31Å; S220-V254 WeakPolarHBondContact O-CA 3.33Å; S220-A255 PolarHBondContact O-N 3.49Å; S220-L291 CarbonylContact C-O 2.91Å; S220-L291 VanDerWaalsContact CA-O 3.29Å; S220-L291 WeakPolarHBondContact CA-O 3.39Å
221	V	94.9	Very high	85.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	127.8	170.9	-175.9	0	0	0	0	107.7	A255 V257 G275 V278 A279 F282 V290 L291 L292 F293	V221-A255 WeakPolarHBondContact CA-O 3.47Å; V221-V257 HydrophobicContact CG1-CG2 4.29Å; V221-G275 WeakPolarHBondContact CG1-O 3.3Å; V221-V278 HydrophobicContact CG1-CB 4.25Å; V221-V278 HydrophobicContact CG1-CG1 4.31Å; V221-V278 HydrophobicContact CG2-CB 4.34Å; V221-V278 HydrophobicContact CG2-CG1 3.83Å; V221-A279 HydrophobicContact CB-CB 4.45Å; V221-A279 HydrophobicContact CG2-CB 4.07Å; V221-F282 HydrophobicContact CG2-CD2 4.33Å; V221-F282 HydrophobicContact CG2-CE2 4.39Å; V221-V290 HydrophobicContact CG2-CG1 4.26Å; V221-L291 PolarHBondContact N-O 3.01Å; V221-L292 HydrophobicContact CB-CD1 4.02Å; V221-L292 HydrophobicContact CG1-CD1 4.13Å; V221-L292 WeakPolarHBondContact O-CA 3.05Å; V221-F293 PolarHBondContact O-N 3.26Å
222	F	94.8	Very high	85.4	Confident	6 Å²	6	38.7 Å²	38.7	3%	0.026	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	118.2	175.6	-172.2	-83.7	0	0	0	109.6	I205 L235 V254 A255 L256 V257 Y258 F293 D295	I205-F222 HydrophobicContact CG2-CD2 4.4Å; I205-F222 HydrophobicContact CG2-CE2 4.22Å; F222-L235 HydrophobicContact CD1-CD2 4.16Å; F222-L235 HydrophobicContact CD2-CD2 4.05Å; F222-L235 HydrophobicContact CE1-CD2 3.79Å; F222-L235 HydrophobicContact CE2-CD2 3.66Å; F222-L235 HydrophobicContact CG-CD2 4.3Å; F222-L235 HydrophobicContact CZ-CD2 3.52Å; F222-V254 HydrophobicContact CB-CG2 4.41Å; F222-A255 PolarHBondContact N-O 2.82Å; F222-L256 HydrophobicContact CB-CD2 3.58Å; F222-L256 HydrophobicContact CD1-CD2 4.43Å; F222-L256 HydrophobicContact CG-CD2 4.22Å; F222-V257 PolarHBondContact O-N 3.08Å; F222-Y258 HydrophobicContact CD1-CD1 4.47Å; F222-Y258 AromaticContact CD1-CE1 3.72Å; F222-Y258 HydrophobicContact CD1-CE1 3.72Å; F222-Y258 HydrophobicContact CE1-CD1 4.5Å; F222-Y258 AromaticContact CE1-CE1 3.74Å; F222-Y258 HydrophobicContact CE1-CE1 3.74Å; F222-F293 HydrophobicContact CD2-CB 3.58Å; F222-F293 HydrophobicContact CD2-CG 4.32Å; F222-F293 HydrophobicContact CE2-CB 4.14Å; F222-F293 HydrophobicContact CG-CB 4.33Å; F222-D295 HydrophobicContact CE2-CB 4.42Å; F222-D295 HydrophobicContact CZ-CB 3.83Å
223	A	95.8	Very high	86	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	100.4	174.3	0	0	0	0	0	109.5	V225 V257 F293 D295	A223-V225 PolarHBondContact O-N 2.75Å; A223-V257 CarbonylContact C-O 3.47Å; A223-V257 WeakPolarHBondContact CA-O 3.45Å; A223-F293 PolarHBondContact N-O 2.82Å; A223-D295 PolarHBondContact O-N 2.65Å
224	G	94.4	Very high	86.6	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	91.8	173.3	0	0	0	0	0	111.1	E227 V257 G259 D295	G224-E227 VanDerWaalsContact CA-CG 3.44Å; G224-V257 PolarHBondContact N-O 2.96Å; G224-G259 PolarHBondContact O-N 2.82Å; G224-D295 CarbonylContact C-O 3.55Å; G224-D295 VanDerWaalsContact C-O 3.31Å; G224-D295 WeakPolarHBondContact CA-O 3.38Å
225	V	94.3	Very high	87.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	109	178.2	-170.2	0	0	0	0	110.8	A223 E227 R268 V271 A272 I294 D295 N296 R299 F300	A223-V225 PolarHBondContact O-N 2.75Å; V225-E227 PolarHBondContact O-N 3.34Å; V225-R268 WeakPolarHBondContact CG1-O 3.33Å; V225-V271 HydrophobicContact CB-CG1 3.99Å; V225-V271 HydrophobicContact CG1-CG1 3.85Å; V225-V271 HydrophobicContact CG2-CG1 3.81Å; V225-A272 HydrophobicContact CG2-CB 3.85Å; V225-I294 HydrophobicContact CG2-CG2 3.82Å; V225-D295 PolarHBondContact N-O 3.07Å; V225-N296 PolarHBondContact O-N 2.94Å; V225-N296 VanDerWaalsContact O-N 3.15Å; V225-R299 HydrophobicContact CG1-CB 4.1Å; V225-R299 WeakPolarHBondContact O-CB 3.29Å; V225-R299 WeakPolarHBondContact O-CG 3.32Å; V225-F300 HydrophobicContact CG1-CB 3.99Å
226	G	90.9	Very high	87.9	Confident	3 Å²	3	37.1 Å²	37.1	3%	0.031	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	61.2	35.7	-178.2	0	0	0	0	0	112.1	G259 M261	G226-G259 VanDerWaalsContact CA-O 3.26Å; G226-G259 WeakPolarHBondContact CA-O 3.17Å; G226-G259 PolarHBondContact N-O 3.28Å; G226-M261 WeakPolarHBondContact O-CG 3.35Å
227	E	87.3	Confident	88.8	Confident	19 Å²	19	37.2 Å²	37.2	9%	0.089	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	151	178.7	-80.5	-56.1	124.8	0	0	111.9	G224 V225 M261 D295	G224-E227 VanDerWaalsContact CA-CG 3.44Å; V225-E227 PolarHBondContact O-N 3.34Å; E227-M261 WeakPolarHBondContact O-CG 3.43Å; E227-M261 PolarHBondContact O-N 2.8Å; E227-D295 VanDerWaalsContact CG-O 3.24Å; E227-D295 WeakPolarHBondContact CG-O 3.08Å; E227-D295 VanDerWaalsContact OE1-O 3.04Å
228	R	90.4	Very high	89.4	Confident	122 Å²	122	37.9 Å²	37.9	46%	0.46	18%	0.176	S	C	.	.			trans	-72.3	132.5	172.4	-65.3	-176.2	-174	79.7	1.7	108.7	R230 E231 G232 M261	R228-R230 PolarHBondContact O-N 2.98Å; R228-R230 VanDerWaalsContact O-N 3.11Å; R228-E231 HydrophobicContact CB-CB 4.17Å; R228-E231 HydrophobicContact CB-CG 4.06Å; R228-E231 WeakPolarHBondContact CB-OE2 3.49Å; R228-E231 WeakPolarHBondContact CD-OE2 3.22Å; R228-E231 WeakPolarHBondContact CG-OE2 3.5Å; R228-E231 IonicContact CZ-OE2 3.44Å; R228-E231 IonicContact NH1-OE1 2.9Å; R228-E231 PolarHBondContact NH1-OE1 3.48Å; R228-E231 IonicContact NH1-OE2 2.97Å; R228-E231 PolarHBondContact NH1-OE2 3.06Å; R228-E231 PolarHBondContact O-N 2.82Å; R228-G232 PolarHBondContact O-N 2.99Å; R228-M261 HydrophobicContact CG-SD 3.55Å; R228-M261 VanDerWaalsContact CG-SD 3.55Å
229	T	88.5	Confident	89.7	Confident	72 Å²	72	37.8 Å²	37.8	44%	0.442	18%	0.175	S	C	.	.	H	α-helix	trans	-53.4	-37.2	177.6	-48.6	0	0	0	0	112.5	N233 Q260	T229-N233 VanDerWaalsContact O-CB 3.3Å; T229-N233 WeakPolarHBondContact O-CB 3.23Å; T229-N233 PolarHBondContact O-N 2.68Å; T229-Q260 PolarHBondContact OG1-OE1 2.77Å
230	R	89.8	Confident	89.6	Confident	145 Å²	145	38 Å²	38	55%	0.547	18%	0.178	S	C	.	.	H	α-helix	trans	-62.3	-47.5	174.1	-172.9	-167.4	60	72.6	1.9	112.1	R228 N233 D234	R228-R230 PolarHBondContact O-N 2.98Å; R228-R230 VanDerWaalsContact O-N 3.11Å; R230-N233 PolarHBondContact O-N 3.44Å; R230-D234 IonicContact CZ-OD2 2.74Å; R230-D234 IonicContact NH1-OD2 2.98Å; R230-D234 PolarHBondContact NH1-OD2 3.27Å; R230-D234 WeakPolarHBondContact O-CB 3.32Å; R230-D234 PolarHBondContact O-N 2.94Å
231	E	84.6	Confident	89.2	Confident	59 Å²	59	44.8 Å²	44.8	28%	0.276	21%	0.21	S	C	.	.	H	α-helix	trans	-67.9	-39.1	-177.1	-68.5	169.7	172.5	0	0	111	R228 D234 L235	R228-E231 HydrophobicContact CB-CB 4.17Å; R228-E231 HydrophobicContact CB-CG 4.06Å; R228-E231 WeakPolarHBondContact CB-OE2 3.49Å; R228-E231 WeakPolarHBondContact CD-OE2 3.22Å; R228-E231 WeakPolarHBondContact CG-OE2 3.5Å; R228-E231 IonicContact CZ-OE2 3.44Å; R228-E231 IonicContact NH1-OE1 2.9Å; R228-E231 PolarHBondContact NH1-OE1 3.48Å; R228-E231 IonicContact NH1-OE2 2.97Å; R228-E231 PolarHBondContact NH1-OE2 3.06Å; R228-E231 PolarHBondContact O-N 2.82Å; E231-D234 PolarHBondContact O-N 3.44Å; E231-L235 VanDerWaalsContact O-CB 3.29Å; E231-L235 WeakPolarHBondContact O-CB 3.49Å; E231-L235 PolarHBondContact O-N 2.97Å
232	G	87.3	Confident	88.3	Confident	6 Å²	6	46.8 Å²	46.8	6%	0.062	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-40.2	172.2	0	0	0	0	0	113.1	R228 Y236 Y258	R228-G232 PolarHBondContact O-N 2.99Å; G232-Y236 WeakPolarHBondContact O-CB 3.46Å; G232-Y236 PolarHBondContact O-N 3.45Å; G232-Y258 PolarHBondContact O-OH 3.43Å
233	N	90.4	Very high	87.5	Confident	80 Å²	80	49 Å²	49	43%	0.428	25%	0.248	S	C	.	.	H	α-helix	trans	-64.8	-47.6	175.5	-178.6	83.1	0	0	0	112	T229 R230 L235 Y236 H237	T229-N233 VanDerWaalsContact O-CB 3.3Å; T229-N233 WeakPolarHBondContact O-CB 3.23Å; T229-N233 PolarHBondContact O-N 2.68Å; R230-N233 PolarHBondContact O-N 3.44Å; N233-L235 VanDerWaalsContact C-N 3.34Å; N233-L235 PolarHBondContact O-N 3.46Å; N233-Y236 PolarHBondContact O-N 3.2Å; N233-H237 PolarHBondContact ND2-CD2 3.48Å; N233-H237 PolarHBondContact O-CD2 3.47Å; N233-H237 VanDerWaalsContact O-CD2 3.22Å; N233-H237 PolarHBondContact O-N 3.05Å
234	D	86.8	Confident	86.8	Confident	61 Å²	61	49.6 Å²	49.6	33%	0.326	25%	0.252	S	S	.	.	H	α-helix	trans	-59.9	-46.4	178.5	-64.2	-14.8	0	0	0	110	R230 E231 Y236 H237 E238	R230-D234 IonicContact CZ-OD2 2.74Å; R230-D234 IonicContact NH1-OD2 2.98Å; R230-D234 PolarHBondContact NH1-OD2 3.27Å; R230-D234 WeakPolarHBondContact O-CB 3.32Å; R230-D234 PolarHBondContact O-N 2.94Å; E231-D234 PolarHBondContact O-N 3.44Å; D234-Y236 PolarHBondContact O-N 3.45Å; D234-H237 PolarHBondContact O-N 2.84Å; D234-E238 WeakPolarHBondContact O-CB 3.27Å; D234-E238 WeakPolarHBondContact O-CG 3.28Å; D234-E238 PolarHBondContact O-N 3Å
235	L	85.9	Confident	86.5	Confident	8 Å²	8	49.6 Å²	49.6	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-59.2	-43	175.9	-177.4	64.2	0	0	0	112.5	T202 M206 F222 E231 N233 H237 E238 M239	T202-L235 HydrophobicContact CG2-CD1 3.66Å; M206-L235 HydrophobicContact CG-CD1 3.77Å; M206-L235 HydrophobicContact SD-CD1 3.85Å; F222-L235 HydrophobicContact CD1-CD2 4.16Å; F222-L235 HydrophobicContact CD2-CD2 4.05Å; F222-L235 HydrophobicContact CE1-CD2 3.79Å; F222-L235 HydrophobicContact CE2-CD2 3.66Å; F222-L235 HydrophobicContact CG-CD2 4.3Å; F222-L235 HydrophobicContact CZ-CD2 3.52Å; E231-L235 VanDerWaalsContact O-CB 3.29Å; E231-L235 WeakPolarHBondContact O-CB 3.49Å; E231-L235 PolarHBondContact O-N 2.97Å; N233-L235 VanDerWaalsContact C-N 3.34Å; N233-L235 PolarHBondContact O-N 3.46Å; L235-H237 PolarHBondContact O-N 3.04Å; L235-E238 PolarHBondContact O-N 2.74Å; L235-M239 HydrophobicContact CD1-CE 3.78Å; L235-M239 HydrophobicContact CD1-CG 4.4Å; L235-M239 HydrophobicContact CD2-CE 4.03Å; L235-M239 HydrophobicContact CG-CE 3.83Å; L235-M239 HydrophobicContact CG-SD 4.4Å; L235-M239 WeakPolarHBondContact O-CB 3.34Å; L235-M239 VanDerWaalsContact O-CG 3.26Å; L235-M239 WeakPolarHBondContact O-CG 3.5Å; L235-M239 PolarHBondContact O-N 2.93Å
236	Y	89.9	Confident	86.1	Confident	27 Å²	27	51.6 Å²	51.6	11%	0.106	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-43.9	178.4	178.2	-121.4	0	0	0	111.8	I133 G232 N233 D234 M239 I240 I245 L256	I133-Y236 HydrophobicContact CD1-CD1 4Å; I133-Y236 HydrophobicContact CD1-CD2 3.77Å; I133-Y236 HydrophobicContact CD1-CE1 4.11Å; I133-Y236 HydrophobicContact CD1-CE2 3.88Å; I133-Y236 HydrophobicContact CD1-CG 3.82Å; I133-Y236 HydrophobicContact CG1-CD2 4.13Å; I133-Y236 HydrophobicContact CG1-CE2 4.02Å; G232-Y236 WeakPolarHBondContact O-CB 3.46Å; G232-Y236 PolarHBondContact O-N 3.45Å; N233-Y236 PolarHBondContact O-N 3.2Å; D234-Y236 PolarHBondContact O-N 3.45Å; Y236-M239 PolarHBondContact O-N 2.87Å; Y236-I240 HydrophobicContact CD1-CD1 3.94Å; Y236-I240 HydrophobicContact CD2-CD1 4.32Å; Y236-I240 HydrophobicContact CE1-CD1 3.64Å; Y236-I240 HydrophobicContact CE2-CD1 4.05Å; Y236-I240 HydrophobicContact CE2-CG1 4.48Å; Y236-I240 HydrophobicContact CG-CD1 4.29Å; Y236-I240 WeakPolarHBondContact O-CG1 3.22Å; Y236-I240 PolarHBondContact O-N 3.07Å; Y236-I240 VanDerWaalsContact O-N 3.1Å; Y236-I245 HydrophobicContact CD2-CD1 3.7Å; Y236-I245 HydrophobicContact CE2-CD1 3.83Å; Y236-I245 HydrophobicContact CE2-CG2 4.33Å; Y236-L256 HydrophobicContact CD2-CD1 3.53Å; Y236-L256 HydrophobicContact CE2-CD1 4.25Å; Y236-L256 HydrophobicContact CG-CD1 4.39Å
237	H	88.9	Confident	85.9	Confident	89 Å²	89	55.3 Å²	55.3	41%	0.412	28%	0.281	S	S	.	.	H	α-helix	trans	-68.3	-41.9	176.8	-76.1	-67.3	0	0	0	112.6	N233 D234 L235 M239 I240 E241	N233-H237 PolarHBondContact ND2-CD2 3.48Å; N233-H237 PolarHBondContact O-CD2 3.47Å; N233-H237 VanDerWaalsContact O-CD2 3.22Å; N233-H237 PolarHBondContact O-N 3.05Å; D234-H237 PolarHBondContact O-N 2.84Å; L235-H237 PolarHBondContact O-N 3.04Å; H237-M239 VanDerWaalsContact C-N 3.28Å; H237-M239 PolarHBondContact O-N 3.34Å; H237-I240 WeakPolarHBondContact O-CB 3.36Å; H237-I240 PolarHBondContact O-N 2.8Å; H237-I240 VanDerWaalsContact O-N 3.08Å; H237-E241 WeakPolarHBondContact O-CG 3.4Å; H237-E241 PolarHBondContact O-N 2.86Å
238	E	82.3	Confident	85.7	Confident	55 Å²	55	63.4 Å²	63.4	26%	0.257	32%	0.316	S	S	.	.	H	α-helix	trans	-60.6	-38.2	174.5	-73.5	177.7	172.1	0	0	111.6	M206 D234 L235 I240 E241 S242	M206-E238 HydrophobicContact CE-CB 4.39Å; M206-E238 WeakPolarHBondContact CE-OE2 3.29Å; M206-E238 HydrophobicContact SD-CB 3.73Å; D234-E238 WeakPolarHBondContact O-CB 3.27Å; D234-E238 WeakPolarHBondContact O-CG 3.28Å; D234-E238 PolarHBondContact O-N 3Å; L235-E238 PolarHBondContact O-N 2.74Å; E238-I240 VanDerWaalsContact C-N 3.33Å; E238-I240 PolarHBondContact O-N 3.43Å; E238-E241 PolarHBondContact O-N 2.56Å; E238-S242 VanDerWaalsContact O-CB 3.28Å; E238-S242 WeakPolarHBondContact O-CB 3.43Å; E238-S242 PolarHBondContact O-N 2.94Å; E238-S242 PolarHBondContact O-OG 3.32Å
239	M	85.4	Confident	85.2	Confident	1 Å²	1	62 Å²	62	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-67.6	-31.2	174.6	-75.3	-173.2	179.5	0	0	113.2	I209 L235 Y236 H237 S242 G243 V244 I245 V254 L256	I209-M239 HydrophobicContact CD1-CE 3.57Å; L235-M239 HydrophobicContact CD1-CE 3.78Å; L235-M239 HydrophobicContact CD1-CG 4.4Å; L235-M239 HydrophobicContact CD2-CE 4.03Å; L235-M239 HydrophobicContact CG-CE 3.83Å; L235-M239 HydrophobicContact CG-SD 4.4Å; L235-M239 WeakPolarHBondContact O-CB 3.34Å; L235-M239 VanDerWaalsContact O-CG 3.26Å; L235-M239 WeakPolarHBondContact O-CG 3.5Å; L235-M239 PolarHBondContact O-N 2.93Å; Y236-M239 PolarHBondContact O-N 2.87Å; H237-M239 VanDerWaalsContact C-N 3.28Å; H237-M239 PolarHBondContact O-N 3.34Å; M239-S242 WeakPolarHBondContact CA-OG 3.17Å; M239-S242 PolarHBondContact O-OG 3.28Å; M239-G243 PolarHBondContact O-N 2.95Å; M239-V244 HydrophobicContact CB-CB 4.31Å; M239-V244 HydrophobicContact CG-CB 4.5Å; M239-V244 PolarHBondContact O-N 3.41Å; M239-I245 HydrophobicContact CB-CB 4.42Å; M239-I245 HydrophobicContact CB-CD1 3.74Å; M239-I245 HydrophobicContact CB-CG1 3.94Å; M239-I245 PolarHBondContact O-N 3.05Å; M239-I245 HydrophobicContact SD-CD1 3.98Å; M239-V254 HydrophobicContact CE-CG2 4.49Å; M239-V254 HydrophobicContact SD-CG1 3.8Å; M239-V254 HydrophobicContact SD-CG2 4.41Å; M239-L256 HydrophobicContact CE-CD2 4.28Å; M239-L256 HydrophobicContact SD-CD2 3.88Å
240	I	87.1	Confident	84.7	Confident	46 Å²	46	67 Å²	67	24%	0.236	34%	0.342	C	S	.	.	H	α-helix	trans	-71.1	-46.5	173.4	-68.2	160.8	0	0	0	110.3	Y236 H237 E238 G243 I245 L247	Y236-I240 HydrophobicContact CD1-CD1 3.94Å; Y236-I240 HydrophobicContact CD2-CD1 4.32Å; Y236-I240 HydrophobicContact CE1-CD1 3.64Å; Y236-I240 HydrophobicContact CE2-CD1 4.05Å; Y236-I240 HydrophobicContact CE2-CG1 4.48Å; Y236-I240 HydrophobicContact CG-CD1 4.29Å; Y236-I240 WeakPolarHBondContact O-CG1 3.22Å; Y236-I240 PolarHBondContact O-N 3.07Å; Y236-I240 VanDerWaalsContact O-N 3.1Å; H237-I240 WeakPolarHBondContact O-CB 3.36Å; H237-I240 PolarHBondContact O-N 2.8Å; H237-I240 VanDerWaalsContact O-N 3.08Å; E238-I240 VanDerWaalsContact C-N 3.33Å; E238-I240 PolarHBondContact O-N 3.43Å; I240-G243 PolarHBondContact O-N 2.87Å; I240-I245 WeakPolarHBondContact CA-O 3.29Å; I240-I245 HydrophobicContact CG1-CB 4.09Å; I240-I245 HydrophobicContact CG1-CG2 3.98Å; I240-L247 HydrophobicContact CD1-CD1 4.01Å; I240-L247 HydrophobicContact CD1-CD2 4.23Å; I240-L247 HydrophobicContact CD1-CG 4.32Å; I240-L247 HydrophobicContact CG1-CD1 4.44Å; I240-L247 HydrophobicContact CG1-CD2 4.35Å; I240-L247 HydrophobicContact CG1-CG 4.31Å; I240-L247 HydrophobicContact CG2-CD1 4.3Å; I240-L247 HydrophobicContact CG2-CG 4.44Å
241	E	83.4	Confident	84.4	Confident	141 Å²	141	63.7 Å²	63.7	66%	0.659	34%	0.338	S	S	*	.	H	α-helix	trans	-66.5	-39	-178.5	-71.2	179.4	-176.4	0	0	112.5	H237 E238 G243	H237-E241 WeakPolarHBondContact O-CG 3.4Å; H237-E241 PolarHBondContact O-N 2.86Å; E238-E241 PolarHBondContact O-N 2.56Å; E241-G243 PolarHBondContact O-N 3.39Å
242	S	75.4	Confident	84.6	Confident	43 Å²	43	61.2 Å²	61.2	30%	0.301	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-7.9	175.2	58.8	0	0	0	0	113.9	E238 M239 V244	E238-S242 VanDerWaalsContact O-CB 3.28Å; E238-S242 WeakPolarHBondContact O-CB 3.43Å; E238-S242 PolarHBondContact O-N 2.94Å; E238-S242 PolarHBondContact O-OG 3.32Å; M239-S242 WeakPolarHBondContact CA-OG 3.17Å; M239-S242 PolarHBondContact O-OG 3.28Å; S242-V244 VanDerWaalsContact C-N 3.32Å; S242-V244 PolarHBondContact O-N 2.79Å
243	G	78.2	Confident	84.4	Confident	52 Å²	52	64.2 Å²	64.2	54%	0.536	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	11.7	178.9	0	0	0	0	0	114.9	M239 I240 E241	M239-G243 PolarHBondContact O-N 2.95Å; I240-G243 PolarHBondContact O-N 2.87Å; E241-G243 PolarHBondContact O-N 3.39Å
244	V	82.3	Confident	84.4	Confident	12 Å²	12	60.4 Å²	60.4	7%	0.073	32%	0.318	C	S	.	.	S	Bend	trans	-68.9	-38.3	172.4	176.5	0	0	0	0	110.7	I209 M239 S242 K253 V254	I209-V244 HydrophobicContact CG2-CG1 3.64Å; M239-V244 HydrophobicContact CB-CB 4.31Å; M239-V244 HydrophobicContact CG-CB 4.5Å; M239-V244 PolarHBondContact O-N 3.41Å; S242-V244 VanDerWaalsContact C-N 3.32Å; S242-V244 PolarHBondContact O-N 2.79Å; V244-K253 PolarHBondContact O-N 3.32Å; V244-V254 HydrophobicContact CG1-CB 4.13Å; V244-V254 HydrophobicContact CG1-CG1 3.71Å
245	I	87.8	Confident	84.8	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	30%	0.303	C	S	.	.	S	Bend	trans	-108.2	120.7	170.5	-64.6	175.2	0	0	0	108.2	Y236 M239 I240 L247 V254 L256	Y236-I245 HydrophobicContact CD2-CD1 3.7Å; Y236-I245 HydrophobicContact CE2-CD1 3.83Å; Y236-I245 HydrophobicContact CE2-CG2 4.33Å; M239-I245 HydrophobicContact CB-CB 4.42Å; M239-I245 HydrophobicContact CB-CD1 3.74Å; M239-I245 HydrophobicContact CB-CG1 3.94Å; M239-I245 PolarHBondContact O-N 3.05Å; M239-I245 HydrophobicContact SD-CD1 3.98Å; I240-I245 WeakPolarHBondContact CA-O 3.29Å; I240-I245 HydrophobicContact CG1-CB 4.09Å; I240-I245 HydrophobicContact CG1-CG2 3.98Å; I245-L247 HydrophobicContact CG2-CD2 4.03Å; I245-V254 HydrophobicContact CD1-CG1 3.7Å; I245-V254 HydrophobicContact CG1-CG1 3.35Å; I245-L256 HydrophobicContact CD1-CD1 3.72Å; I245-L256 HydrophobicContact CD1-CG 4.3Å
246	N	86.6	Confident	85.2	Confident	41 Å²	41	57.1 Å²	57.1	22%	0.219	30%	0.301	C	S	.	.			trans	-105.6	123.5	171.4	-169.1	-10.9	0	0	0	109.1	K248 D249 T251 S252	N246-K248 PolarHBondContact OD1-N 3.29Å; N246-D249 PolarHBondContact ND2-OD2 2.94Å; N246-T251 VanDerWaalsContact CB-OG1 3.32Å; N246-T251 WeakPolarHBondContact CB-OG1 3.35Å; N246-T251 PolarHBondContact ND2-OG1 3.32Å; N246-T251 VanDerWaalsContact ND2-OG1 3.14Å; N246-S252 PolarHBondContact N-OG 3.26Å; N246-S252 PolarHBondContact O-OG 2.78Å; N246-S252 VanDerWaalsContact O-OG 3.04Å
247	L	86.4	Confident	85.5	Confident	81 Å²	81	55.9 Å²	55.9	42%	0.424	30%	0.296	S	S	.	.	S	Bend	trans	-82.9	-18.1	179.4	-59.2	-178.4	0	0	0	113	R144 I240 I245	R144-L247 VanDerWaalsContact NH1-CD2 3.32Å; I240-L247 HydrophobicContact CD1-CD1 4.01Å; I240-L247 HydrophobicContact CD1-CD2 4.23Å; I240-L247 HydrophobicContact CD1-CG 4.32Å; I240-L247 HydrophobicContact CG1-CD1 4.44Å; I240-L247 HydrophobicContact CG1-CD2 4.35Å; I240-L247 HydrophobicContact CG1-CG 4.31Å; I240-L247 HydrophobicContact CG2-CD1 4.3Å; I240-L247 HydrophobicContact CG2-CG 4.44Å; I245-L247 HydrophobicContact CG2-CD2 4.03Å
248	K	81.7	Confident	85.9	Confident	190 Å²	190	52 Å²	52	83%	0.826	28%	0.277	S	S	*	.	S	Bend	trans	-96.5	-31.7	-173.7	-63.7	179.1	-178	173.3	0	112.9	N246	N246-K248 PolarHBondContact OD1-N 3.29Å
249	D	79.8	Confident	86.4	Confident	93 Å²	93	49.3 Å²	49.3	50%	0.497	27%	0.265	S	S	.	.	S	Bend	trans	-129.2	159.6	-175.1	-46.5	-54.1	0	0	0	111.3	N246 T251	N246-D249 PolarHBondContact ND2-OD2 2.94Å; D249-T251 HydrophobicContact CB-CG2 4.06Å; D249-T251 PolarHBondContact O-N 2.93Å
250	D	78.6	Confident	86.7	Confident	175 Å²	175	51 Å²	51	94%	0.936	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	27	178.9	-60	-29.5	0	0	0	113.1	S252	D250-S252 VanDerWaalsContact C-N 3.33Å
251	T	83.3	Confident	86.9	Confident	77 Å²	77	52.7 Å²	52.7	47%	0.472	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-0.6	-177.2	62.9	0	0	0	0	113.5	N246 D249	N246-T251 VanDerWaalsContact CB-OG1 3.32Å; N246-T251 WeakPolarHBondContact CB-OG1 3.35Å; N246-T251 PolarHBondContact ND2-OG1 3.32Å; N246-T251 VanDerWaalsContact ND2-OG1 3.14Å; D249-T251 HydrophobicContact CB-CG2 4.06Å; D249-T251 PolarHBondContact O-N 2.93Å
252	S	88.3	Confident	87.2	Confident	6 Å²	6	51.7 Å²	51.7	4%	0.042	28%	0.28	C	S	.	.			trans	-56.7	138.5	179.1	-67.5	0	0	0	0	111.2	N246 D250	N246-S252 PolarHBondContact N-OG 3.26Å; N246-S252 PolarHBondContact O-OG 2.78Å; N246-S252 VanDerWaalsContact O-OG 3.04Å; D250-S252 VanDerWaalsContact C-N 3.33Å
253	K	84.2	Confident	88.1	Confident	69 Å²	69	51.4 Å²	51.4	30%	0.3	27%	0.274	S	S	.	.			trans	-113	-3.2	-175.3	-62.4	-59.1	-174	176.9	0	114.7	A213 Y219 S220 V244	A213-K253 HydrophobicContact CB-CB 4.28Å; A213-K253 HydrophobicContact CB-CG 4.31Å; Y219-K253 HydrophobicContact CD1-CD 4.06Å; Y219-K253 HydrophobicContact CE1-CD 3.87Å; S220-K253 PolarHBondContact N-O 3.06Å; V244-K253 PolarHBondContact O-N 3.32Å
254	V	90.8	Very high	88.8	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	136.1	-176.4	67.3	0	0	0	0	111.4	G131 S220 F222 M239 V244 I245 L256	G131-V254 WeakPolarHBondContact CA-O 3.24Å; G131-V254 PolarHBondContact N-O 2.85Å; S220-V254 CarbonylContact O-C 3.31Å; S220-V254 WeakPolarHBondContact O-CA 3.33Å; F222-V254 HydrophobicContact CB-CG2 4.41Å; M239-V254 HydrophobicContact CE-CG2 4.49Å; M239-V254 HydrophobicContact SD-CG1 3.8Å; M239-V254 HydrophobicContact SD-CG2 4.41Å; V244-V254 HydrophobicContact CG1-CB 4.13Å; V244-V254 HydrophobicContact CG1-CG1 3.71Å; I245-V254 HydrophobicContact CD1-CG1 3.7Å; I245-V254 HydrophobicContact CG1-CG1 3.35Å; V254-L256 HydrophobicContact CG1-CD2 4.48Å; V254-L256 HydrophobicContact CG2-CD2 3.94Å
255	A	94	Very high	89.4	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.008	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	134.2	165	0	0	0	0	0	109.6	S220 V221 F222 V278	S220-A255 PolarHBondContact O-N 3.49Å; V221-A255 WeakPolarHBondContact CA-O 3.47Å; F222-A255 PolarHBondContact N-O 2.82Å; A255-V278 HydrophobicContact CB-CG1 4.09Å
256	L	95.2	Very high	89.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	127.9	-178.5	-58.1	178.3	0	0	0	110.1	R132 I133 M134 F222 Y236 M239 I245 V254	R132-L256 PolarHBondContact O-N 3.45Å; I133-L256 CarbonylContact C-O 3.49Å; I133-L256 WeakPolarHBondContact CA-O 3.35Å; I133-L256 HydrophobicContact CB-CB 4.41Å; I133-L256 HydrophobicContact CD1-CD1 4.44Å; I133-L256 HydrophobicContact CG1-CB 4.15Å; I133-L256 HydrophobicContact CG1-CD1 3.92Å; I133-L256 HydrophobicContact CG2-CB 4.29Å; M134-L256 WeakPolarHBondContact CG-O 3.27Å; M134-L256 PolarHBondContact N-O 3.02Å; F222-L256 HydrophobicContact CB-CD2 3.58Å; F222-L256 HydrophobicContact CD1-CD2 4.43Å; F222-L256 HydrophobicContact CG-CD2 4.22Å; Y236-L256 HydrophobicContact CD2-CD1 3.53Å; Y236-L256 HydrophobicContact CE2-CD1 4.25Å; Y236-L256 HydrophobicContact CG-CD1 4.39Å; M239-L256 HydrophobicContact CE-CD2 4.28Å; M239-L256 HydrophobicContact SD-CD2 3.88Å; I245-L256 HydrophobicContact CD1-CD1 3.72Å; I245-L256 HydrophobicContact CD1-CG 4.3Å; V254-L256 HydrophobicContact CG1-CD2 4.48Å; V254-L256 HydrophobicContact CG2-CD2 3.94Å
257	V	96.7	Very high	90.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	116.8	174.5	-167.7	0	0	0	0	108.2	M134 V221 F222 A223 G224 V271 T274	M134-V257 HydrophobicContact CG-CB 4.21Å; M134-V257 HydrophobicContact CG-CG1 4.15Å; M134-V257 HydrophobicContact CG-CG2 3.74Å; M134-V257 CarbonylContact O-C 3.57Å; M134-V257 WeakPolarHBondContact O-CA 3.5Å; M134-V257 HydrophobicContact SD-CG1 4.46Å; M134-V257 HydrophobicContact SD-CG2 3.79Å; V221-V257 HydrophobicContact CG1-CG2 4.29Å; F222-V257 PolarHBondContact O-N 3.08Å; A223-V257 CarbonylContact C-O 3.47Å; A223-V257 WeakPolarHBondContact CA-O 3.45Å; G224-V257 PolarHBondContact N-O 2.96Å; V257-V271 HydrophobicContact CG1-CG2 3.68Å; V257-T274 HydrophobicContact CG1-CG2 3.53Å
258	Y	95.7	Very high	90.5	Very high	7 Å²	7	45.5 Å²	45.5	3%	0.027	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134.8	-178.7	-69	-35.5	0	0	0	111.8	I133 M134 N135 I141 F222 G232	I133-Y258 HydrophobicContact CD1-CE2 4.28Å; I133-Y258 HydrophobicContact CG2-CD2 3.31Å; I133-Y258 HydrophobicContact CG2-CE2 3.75Å; I133-Y258 HydrophobicContact CG2-CG 4.14Å; M134-Y258 PolarHBondContact O-N 3.24Å; N135-Y258 WeakPolarHBondContact CA-O 3.37Å; I141-Y258 HydrophobicContact CD1-CD2 4.49Å; F222-Y258 HydrophobicContact CD1-CD1 4.47Å; F222-Y258 AromaticContact CD1-CE1 3.72Å; F222-Y258 HydrophobicContact CD1-CE1 3.72Å; F222-Y258 HydrophobicContact CE1-CD1 4.5Å; F222-Y258 AromaticContact CE1-CE1 3.74Å; F222-Y258 HydrophobicContact CE1-CE1 3.74Å; G232-Y258 PolarHBondContact O-OH 3.43Å
259	G	93.7	Very high	91.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	96.5	165.8	0	0	0	0	0	107	G224 G226 E263 V271	G224-G259 PolarHBondContact O-N 2.82Å; G226-G259 VanDerWaalsContact CA-O 3.26Å; G226-G259 WeakPolarHBondContact CA-O 3.17Å; G226-G259 PolarHBondContact N-O 3.28Å; G259-E263 WeakPolarHBondContact CA-OE2 3.23Å; G259-V271 VanDerWaalsContact N-CG2 3.34Å
260	Q	92.3	Very high	91.9	Very high	37 Å²	37	34.1 Å²	34.1	17%	0.173	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	164.3	-164.8	-63.5	-176.9	-10.3	0	0	112.7	T229 N262 E263	T229-Q260 PolarHBondContact OG1-OE1 2.77Å; Q260-N262 WeakPolarHBondContact CB-OD1 3.49Å; Q260-N262 PolarHBondContact O-N 2.8Å; Q260-N262 PolarHBondContact OE1-OD1 2.99Å; Q260-E263 HydrophobicContact CB-CG 4.37Å; Q260-E263 PolarHBondContact N-OE2 3.39Å; Q260-E263 WeakPolarHBondContact O-CB 3.39Å; Q260-E263 PolarHBondContact O-N 3.44Å; Q260-E263 VanDerWaalsContact O-N 3.09Å
261	M	90.3	Very high	92.7	Very high	81 Å²	81	25.8 Å²	25.8	40%	0.399	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-27.2	177.9	-72.4	-170.9	79.2	0	0	114.6	G226 E227 R228 E263	G226-M261 WeakPolarHBondContact O-CG 3.35Å; E227-M261 WeakPolarHBondContact O-CG 3.43Å; E227-M261 PolarHBondContact O-N 2.8Å; R228-M261 HydrophobicContact CG-SD 3.55Å; R228-M261 VanDerWaalsContact CG-SD 3.55Å; M261-E263 VanDerWaalsContact C-N 3.3Å
262	N	90.6	Very high	93.4	Very high	120 Å²	120	22.1 Å²	22.1	64%	0.642	11%	0.109	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-11.2	177.7	60.9	-46.8	0	0	0	113.2	Q260	Q260-N262 WeakPolarHBondContact CB-OD1 3.49Å; Q260-N262 PolarHBondContact O-N 2.8Å; Q260-N262 PolarHBondContact OE1-OD1 2.99Å
263	E	93	Very high	93.8	Very high	37 Å²	37	22.5 Å²	22.5	17%	0.173	11%	0.111	C	C	.	.	S	Bend	trans	-78.5	152.1	177.7	-67.9	-179.1	-169.6	0	0	111.8	G259 Q260 M261 A267 R268	G259-E263 WeakPolarHBondContact CA-OE2 3.23Å; Q260-E263 HydrophobicContact CB-CG 4.37Å; Q260-E263 PolarHBondContact N-OE2 3.39Å; Q260-E263 WeakPolarHBondContact O-CB 3.39Å; Q260-E263 PolarHBondContact O-N 3.44Å; Q260-E263 VanDerWaalsContact O-N 3.09Å; M261-E263 VanDerWaalsContact C-N 3.3Å; E263-A267 HydrophobicContact CB-CB 4Å; E263-A267 WeakPolarHBondContact OE2-CB 3.34Å; E263-R268 PolarHBondContact O-NE 2.88Å
264	P	94.3	Very high	94.4	Very high	24 Å²	24	19.2 Å²	19.2	16%	0.156	10%	0.096	C	C	.	.			trans	-60.1	157.3	178.8	26.2	-35.6	0	0	0	111.7	A58 G266 A267 R268	A58-P264 HydrophobicContact CB-CB 4.41Å; P264-G266 PolarHBondContact O-N 3.45Å; P264-G266 VanDerWaalsContact O-N 3.08Å; P264-A267 HydrophobicContact CG-CB 4.37Å; P264-A267 PolarHBondContact O-N 3.23Å; P264-A267 VanDerWaalsContact O-N 3.09Å; P264-R268 PolarHBondContact O-N 3.5Å
265	P	94.7	Very high	94.7	Very high	16 Å²	16	19.2 Å²	19.2	10%	0.104	10%	0.096	C	C	.	.	H	α-helix	trans	-60.2	-23.9	-179.5	24.9	-34.6	0	0	0	113.3	A58 A269 E306 V307 L310	A58-P265 HydrophobicContact CB-CG 4.46Å; P265-A269 WeakPolarHBondContact O-CB 3.31Å; P265-A269 PolarHBondContact O-N 3.44Å; P265-E306 HydrophobicContact CB-CB 3.76Å; P265-E306 WeakPolarHBondContact CB-OE2 3.44Å; P265-E306 HydrophobicContact CG-CB 4.23Å; P265-V307 HydrophobicContact CB-CG2 4.08Å; P265-L310 HydrophobicContact CG-CD1 4.13Å
266	G	94.4	Very high	94.8	Very high	2 Å²	2	19.1 Å²	19.1	2%	0.021	10%	0.096	C	C	.	.	H	α-helix	trans	-58.5	-51	172.1	0	0	0	0	0	113.1	I100 P264 A269 R270	I100-G266 VanDerWaalsContact CG2-CA 3.44Å; P264-G266 PolarHBondContact O-N 3.45Å; P264-G266 VanDerWaalsContact O-N 3.08Å; G266-A269 PolarHBondContact O-N 2.92Å; G266-R270 WeakPolarHBondContact O-CG 2.9Å; G266-R270 PolarHBondContact O-N 3.46Å
267	A	94.9	Very high	94.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.8	-47.9	178.2	0	0	0	0	0	111.9	M102 V136 E263 P264 A269 R270 V271	M102-A267 WeakPolarHBondContact O-CB 3.38Å; V136-A267 HydrophobicContact CB-CB 4.34Å; V136-A267 HydrophobicContact CG1-CB 3.66Å; E263-A267 HydrophobicContact CB-CB 4Å; E263-A267 WeakPolarHBondContact OE2-CB 3.34Å; P264-A267 HydrophobicContact CG-CB 4.37Å; P264-A267 PolarHBondContact O-N 3.23Å; P264-A267 VanDerWaalsContact O-N 3.09Å; A267-A269 VanDerWaalsContact C-N 3.26Å; A267-A269 PolarHBondContact O-N 3.01Å; A267-R270 PolarHBondContact O-N 3.2Å; A267-V271 PolarHBondContact O-N 3.14Å
268	R	95	Very high	94.8	Very high	21 Å²	21	19.3 Å²	19.3	8%	0.079	10%	0.097	C	C	.	.	H	α-helix	trans	-61.2	-33.5	178.3	-64.9	-171.5	-72.1	135	1.1	112.6	V225 E263 P264 R270 A303 E306	V225-R268 WeakPolarHBondContact CG1-O 3.33Å; E263-R268 PolarHBondContact O-NE 2.88Å; P264-R268 PolarHBondContact O-N 3.5Å; R268-R270 VanDerWaalsContact C-N 3.25Å; R268-R270 PolarHBondContact O-N 3.39Å; R268-A303 HydrophobicContact CB-CB 3.6Å; R268-E306 IonicContact CZ-OE1 3.08Å; R268-E306 IonicContact CZ-OE2 2.9Å; R268-E306 IonicContact NH1-OE1 3.5Å; R268-E306 PolarHBondContact NH1-OE1 3.08Å; R268-E306 IonicContact NH2-OE1 3.43Å; R268-E306 PolarHBondContact NH2-OE1 2.98Å; R268-E306 IonicContact NH2-OE2 2.96Å; R268-E306 PolarHBondContact NH2-OE2 3.4Å
269	A	94.4	Very high	94.9	Very high	2 Å²	2	19 Å²	19	2%	0.017	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-4.2	177.1	0	0	0	0	0	114.1	P265 G266 A267 F300 A303 V307	P265-A269 WeakPolarHBondContact O-CB 3.31Å; P265-A269 PolarHBondContact O-N 3.44Å; G266-A269 PolarHBondContact O-N 2.92Å; A267-A269 VanDerWaalsContact C-N 3.26Å; A267-A269 PolarHBondContact O-N 3.01Å; A269-F300 VanDerWaalsContact O-CE2 3.3Å; A269-F300 WeakPolarHBondContact O-CE2 3.41Å; A269-A303 HydrophobicContact CB-CB 3.9Å; A269-V307 HydrophobicContact CB-CG2 4.32Å
270	R	95.9	Very high	94.9	Very high	41 Å²	41	19.7 Å²	19.7	16%	0.155	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-23.4	-177.4	-67.2	-61.2	-178	-90.6	-1	114.3	E87 M102 V136 I155 G266 A267 R268 A272 L273 T274	E87-R270 VanDerWaalsContact CD-NE 3.27Å; E87-R270 IonicContact OE1-CZ 3.45Å; E87-R270 IonicContact OE1-NE 3.62Å; E87-R270 PolarHBondContact OE1-NE 3.12Å; E87-R270 IonicContact OE1-NH2 2.95Å; E87-R270 PolarHBondContact OE1-NH2 3.47Å; E87-R270 WeakPolarHBondContact OE2-CD 3.48Å; E87-R270 WeakPolarHBondContact OE2-CG 3.2Å; E87-R270 IonicContact OE2-CZ 3.67Å; E87-R270 IonicContact OE2-NE 2.78Å; E87-R270 PolarHBondContact OE2-NE 3.32Å; E87-R270 IonicContact OE2-NH2 3.99Å; M102-R270 HydrophobicContact CE-CG 4.31Å; M102-R270 HydrophobicContact SD-CB 4.44Å; M102-R270 HydrophobicContact SD-CG 4.21Å; V136-R270 HydrophobicContact CG2-CB 3.58Å; I155-R270 HydrophobicContact CD1-CB 4.15Å; I155-R270 HydrophobicContact CD1-CG 4.46Å; G266-R270 WeakPolarHBondContact O-CG 2.9Å; G266-R270 PolarHBondContact O-N 3.46Å; A267-R270 PolarHBondContact O-N 3.2Å; R268-R270 VanDerWaalsContact C-N 3.25Å; R268-R270 PolarHBondContact O-N 3.39Å; R270-A272 PolarHBondContact O-N 3.41Å; R270-A272 VanDerWaalsContact O-N 3.16Å; R270-L273 WeakPolarHBondContact O-CA 3.4Å; R270-L273 VanDerWaalsContact O-CB 3.3Å; R270-L273 WeakPolarHBondContact O-CB 3.35Å; R270-L273 PolarHBondContact O-N 2.92Å; R270-T274 PolarHBondContact O-N 3.07Å; R270-T274 VanDerWaalsContact O-N 3.13Å; R270-T274 PolarHBondContact O-OG1 2.97Å
271	V	96.3	Very high	95.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-56.7	-34.1	-178.8	70.5	0	0	0	0	113.4	V136 V225 V257 G259 A267 L273 T274 G275	V136-V271 HydrophobicContact CB-CB 4.39Å; V225-V271 HydrophobicContact CB-CG1 3.99Å; V225-V271 HydrophobicContact CG1-CG1 3.85Å; V225-V271 HydrophobicContact CG2-CG1 3.81Å; V257-V271 HydrophobicContact CG1-CG2 3.68Å; G259-V271 VanDerWaalsContact N-CG2 3.34Å; A267-V271 PolarHBondContact O-N 3.14Å; V271-L273 VanDerWaalsContact C-N 3.29Å; V271-L273 PolarHBondContact O-N 2.94Å; V271-T274 WeakPolarHBondContact O-CB 3Å; V271-T274 PolarHBondContact O-N 3.18Å; V271-G275 PolarHBondContact O-N 3.49Å
272	A	96.2	Very high	95.3	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-60.3	-39.3	173.8	0	0	0	0	0	112.1	V225 R270 G275 L276 F300	V225-A272 HydrophobicContact CG2-CB 3.85Å; R270-A272 PolarHBondContact O-N 3.41Å; R270-A272 VanDerWaalsContact O-N 3.16Å; A272-G275 PolarHBondContact O-N 3.38Å; A272-L276 WeakPolarHBondContact O-CB 3.45Å; A272-L276 PolarHBondContact O-N 3.23Å; A272-F300 HydrophobicContact CB-CD2 3.93Å; A272-F300 HydrophobicContact CB-CE2 4.39Å
273	L	96.8	Very high	95.4	Very high	14 Å²	14	9.8 Å²	9.8	7%	0.073	5%	0.047	C	C	.	.	H	α-helix	trans	-70.2	-35.2	177	-53.1	-179.4	0	0	0	111.4	I155 R270 V271 L276 T277 M331	I155-L273 HydrophobicContact CB-CB 4.28Å; R270-L273 WeakPolarHBondContact O-CA 3.4Å; R270-L273 VanDerWaalsContact O-CB 3.3Å; R270-L273 WeakPolarHBondContact O-CB 3.35Å; R270-L273 PolarHBondContact O-N 2.92Å; V271-L273 VanDerWaalsContact C-N 3.29Å; V271-L273 PolarHBondContact O-N 2.94Å; L273-L276 PolarHBondContact O-N 3.12Å; L273-T277 WeakPolarHBondContact O-CB 3.49Å; L273-T277 PolarHBondContact O-N 3.23Å; L273-T277 PolarHBondContact O-OG1 3.2Å; L273-M331 HydrophobicContact CD2-CB 3.96Å; L273-M331 HydrophobicContact CD2-CG 3.75Å
274	T	97.1	Very high	95.4	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-60.5	-50.4	173.5	-55	0	0	0	0	110.6	I123 M134 V136 V257 R270 V271 L276 T277 V278	I123-T274 HydrophobicContact CB-CG2 4.5Å; I123-T274 HydrophobicContact CD1-CG2 3.56Å; I123-T274 WeakPolarHBondContact CD1-O 3.39Å; I123-T274 HydrophobicContact CG2-CG2 3.88Å; M134-T274 HydrophobicContact SD-CG2 4.24Å; V136-T274 PolarHBondContact O-OG1 3.46Å; V257-T274 HydrophobicContact CG1-CG2 3.53Å; R270-T274 PolarHBondContact O-N 3.07Å; R270-T274 VanDerWaalsContact O-N 3.13Å; R270-T274 PolarHBondContact O-OG1 2.97Å; V271-T274 WeakPolarHBondContact O-CB 3Å; V271-T274 PolarHBondContact O-N 3.18Å; T274-L276 VanDerWaalsContact C-N 3.34Å; T274-L276 PolarHBondContact O-N 3.18Å; T274-T277 PolarHBondContact O-N 3.33Å; T274-V278 PolarHBondContact O-N 2.88Å
275	G	96.5	Very high	95.3	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.8	-42	175	0	0	0	0	0	112.9	V221 V271 A272 T277 V278 A279	V221-G275 WeakPolarHBondContact CG1-O 3.3Å; V271-G275 PolarHBondContact O-N 3.49Å; A272-G275 PolarHBondContact O-N 3.38Å; G275-T277 VanDerWaalsContact C-N 3.33Å; G275-T277 PolarHBondContact O-N 2.87Å; G275-V278 PolarHBondContact O-N 2.88Å; G275-A279 PolarHBondContact O-N 3.25Å
276	L	96.5	Very high	95.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.8	-40.7	176.7	-176.2	54	0	0	0	112.3	A272 L273 T274 V278 A279 E280 L292 M331 R334 I335 I343	A272-L276 WeakPolarHBondContact O-CB 3.45Å; A272-L276 PolarHBondContact O-N 3.23Å; L273-L276 PolarHBondContact O-N 3.12Å; T274-L276 VanDerWaalsContact C-N 3.34Å; T274-L276 PolarHBondContact O-N 3.18Å; L276-V278 VanDerWaalsContact C-N 3.32Å; L276-V278 PolarHBondContact O-N 2.94Å; L276-A279 CarbonylContact O-C 3.6Å; L276-A279 WeakPolarHBondContact O-CB 3.49Å; L276-A279 PolarHBondContact O-N 3.35Å; L276-A279 VanDerWaalsContact O-N 3.1Å; L276-E280 HydrophobicContact CD1-CG 4.26Å; L276-E280 HydrophobicContact CG-CG 4.37Å; L276-E280 WeakPolarHBondContact O-CB 3.15Å; L276-E280 VanDerWaalsContact O-CG 3.27Å; L276-E280 WeakPolarHBondContact O-CG 3.27Å; L276-E280 PolarHBondContact O-N 3.2Å; L276-L292 HydrophobicContact CB-CD2 4.36Å; L276-L292 HydrophobicContact CD1-CD2 3.73Å; L276-M331 HydrophobicContact CD2-CG 4.09Å; L276-M331 HydrophobicContact CD2-SD 4.41Å; L276-R334 HydrophobicContact CD1-CB 4.46Å; L276-R334 HydrophobicContact CD2-CB 3.64Å; L276-R334 HydrophobicContact CD2-CG 4.4Å; L276-R334 HydrophobicContact CG-CB 4.31Å; L276-I335 HydrophobicContact CD1-CG1 3.65Å; L276-I335 HydrophobicContact CD2-CG1 4.4Å; L276-I343 HydrophobicContact CD1-CD1 4.27Å
277	T	97.1	Very high	94.9	Very high	4 Å²	4	20.1 Å²	20.1	3%	0.025	10%	0.103	C	C	.	.	H	α-helix	trans	-65.4	-36.2	179.4	-56.8	0	0	0	0	112.1	I123 V125 A153 A154 I155 L273 T274 G275 Y281 R334	I123-T277 HydrophobicContact CD1-CG2 3.97Å; I123-T277 HydrophobicContact CG1-CG2 4.17Å; V125-T277 HydrophobicContact CG1-CG2 4.37Å; A153-T277 HydrophobicContact CB-CG2 3.63Å; A154-T277 WeakPolarHBondContact O-CG2 3.29Å; I155-T277 VanDerWaalsContact CA-OG1 3.32Å; I155-T277 WeakPolarHBondContact CA-OG1 3.47Å; I155-T277 PolarHBondContact O-OG1 3.35Å; L273-T277 WeakPolarHBondContact O-CB 3.49Å; L273-T277 PolarHBondContact O-N 3.23Å; L273-T277 PolarHBondContact O-OG1 3.2Å; T274-T277 PolarHBondContact O-N 3.33Å; G275-T277 VanDerWaalsContact C-N 3.33Å; G275-T277 PolarHBondContact O-N 2.87Å; T277-Y281 PolarHBondContact O-N 3.37Å; T277-Y281 VanDerWaalsContact O-N 3.14Å; T277-R334 PolarHBondContact OG1-NH2 3.4Å; T277-R334 VanDerWaalsContact OG1-NH2 3.14Å
278	V	96.3	Very high	94.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.9	-42.9	171.5	177.6	0	0	0	0	110.5	I123 V125 M134 V221 A255 T274 G275 L276 Y281 F282	I123-V278 HydrophobicContact CD1-CG2 3.82Å; V125-V278 HydrophobicContact CG1-CG2 4.49Å; M134-V278 HydrophobicContact SD-CG2 3.96Å; V221-V278 HydrophobicContact CG1-CB 4.25Å; V221-V278 HydrophobicContact CG1-CG1 4.31Å; V221-V278 HydrophobicContact CG2-CB 4.34Å; V221-V278 HydrophobicContact CG2-CG1 3.83Å; A255-V278 HydrophobicContact CB-CG1 4.09Å; T274-V278 PolarHBondContact O-N 2.88Å; G275-V278 PolarHBondContact O-N 2.88Å; L276-V278 VanDerWaalsContact C-N 3.32Å; L276-V278 PolarHBondContact O-N 2.94Å; V278-Y281 PolarHBondContact O-N 2.82Å; V278-F282 HydrophobicContact CG1-CD2 4.24Å; V278-F282 HydrophobicContact CG1-CE2 3.68Å; V278-F282 WeakPolarHBondContact O-CD2 3.34Å; V278-F282 PolarHBondContact O-N 3.06Å
279	A	95.9	Very high	94.3	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.6	-39.7	177.5	0	0	0	0	0	112.7	V221 G275 L276 Y281 F282 R283 V290 L292 I343	V221-A279 HydrophobicContact CB-CB 4.45Å; V221-A279 HydrophobicContact CG2-CB 4.07Å; G275-A279 PolarHBondContact O-N 3.25Å; L276-A279 CarbonylContact O-C 3.6Å; L276-A279 WeakPolarHBondContact O-CB 3.49Å; L276-A279 PolarHBondContact O-N 3.35Å; L276-A279 VanDerWaalsContact O-N 3.1Å; A279-Y281 VanDerWaalsContact C-N 3.33Å; A279-Y281 PolarHBondContact O-N 3.4Å; A279-F282 PolarHBondContact O-N 3.1Å; A279-R283 PolarHBondContact O-N 2.99Å; A279-V290 HydrophobicContact CB-CG1 3.85Å; A279-L292 HydrophobicContact CB-CD1 4.42Å; A279-I343 HydrophobicContact CB-CD1 4.08Å; A279-I343 HydrophobicContact CB-CG1 4.33Å; A279-I343 HydrophobicContact CB-CG2 4.35Å
280	E	95.6	Very high	94.2	Very high	14 Å²	14	24 Å²	24	7%	0.065	12%	0.124	C	C	.	.	H	α-helix	trans	-63.8	-36.2	176.8	-72.6	175.4	151.1	0	0	112.3	L276 F282 R283 D284 R334 I343	L276-E280 HydrophobicContact CD1-CG 4.26Å; L276-E280 HydrophobicContact CG-CG 4.37Å; L276-E280 WeakPolarHBondContact O-CB 3.15Å; L276-E280 VanDerWaalsContact O-CG 3.27Å; L276-E280 WeakPolarHBondContact O-CG 3.27Å; L276-E280 PolarHBondContact O-N 3.2Å; E280-F282 VanDerWaalsContact C-N 3.34Å; E280-F282 PolarHBondContact O-N 2.8Å; E280-R283 PolarHBondContact O-N 3.24Å; E280-R283 IonicContact OE1-NH2 2.7Å; E280-D284 VanDerWaalsContact O-CB 3.29Å; E280-D284 WeakPolarHBondContact O-CB 3.08Å; E280-D284 PolarHBondContact O-N 3.38Å; E280-R334 WeakPolarHBondContact OE1-CB 3.25Å; E280-R334 IonicContact OE1-CZ 3.87Å; E280-R334 IonicContact OE1-NE 2.85Å; E280-R334 PolarHBondContact OE1-NE 3.1Å; E280-R334 IonicContact OE1-NH2 3.72Å; E280-R334 IonicContact OE2-CZ 3.94Å; E280-R334 IonicContact OE2-NE 3.49Å; E280-R334 IonicContact OE2-NH2 2.78Å; E280-R334 PolarHBondContact OE2-NH2 3.06Å; E280-I343 HydrophobicContact CG-CD1 3.82Å
281	Y	95.3	Very high	94.1	Very high	27 Å²	27	22.3 Å²	22.3	11%	0.106	12%	0.118	C	C	.	.	H	α-helix	trans	-56.9	-49.1	172.2	173.7	-86.4	0	0	0	111.2	V125 G126 T277 V278 A279 R283 D284 Q285 E286	V125-Y281 HydrophobicContact CB-CD2 3.9Å; V125-Y281 HydrophobicContact CB-CG 3.86Å; V125-Y281 HydrophobicContact CG2-CD2 3.51Å; V125-Y281 HydrophobicContact CG2-CE2 4.12Å; V125-Y281 HydrophobicContact CG2-CG 4.02Å; G126-Y281 VanDerWaalsContact CA-CE1 3.48Å; T277-Y281 PolarHBondContact O-N 3.37Å; T277-Y281 VanDerWaalsContact O-N 3.14Å; V278-Y281 PolarHBondContact O-N 2.82Å; A279-Y281 VanDerWaalsContact C-N 3.33Å; A279-Y281 PolarHBondContact O-N 3.4Å; Y281-R283 VanDerWaalsContact C-N 3.32Å; Y281-R283 PolarHBondContact O-N 2.96Å; Y281-D284 PolarHBondContact O-N 3.14Å; Y281-Q285 HydrophobicContact CD2-CB 4.15Å; Y281-Q285 HydrophobicContact CD2-CG 3.79Å; Y281-Q285 HydrophobicContact CE2-CB 3.92Å; Y281-Q285 HydrophobicContact CE2-CG 3.83Å; Y281-Q285 HydrophobicContact CG-CG 4.5Å; Y281-Q285 VanDerWaalsContact O-CB 3.31Å; Y281-Q285 WeakPolarHBondContact O-CB 3.25Å; Y281-Q285 PolarHBondContact O-N 3.07Å; Y281-E286 HydrophobicContact CD1-CG 4.37Å; Y281-E286 HydrophobicContact CE1-CG 3.69Å; Y281-E286 PolarHBondContact O-N 2.67Å; Y281-E286 PolarHBondContact OH-OE1 3.45Å
282	F	93.6	Very high	94	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-66.5	-34	179.5	-66.5	-58.8	0	0	0	112.4	L130 Y219 V221 V278 A279 E280 E286 G287 Q288 V290	L130-F282 HydrophobicContact CD2-CE2 4.34Å; L130-F282 HydrophobicContact CD2-CZ 3.96Å; L130-F282 HydrophobicContact CG-CZ 4.13Å; Y219-F282 AromaticContact CD2-CD1 3.56Å; Y219-F282 HydrophobicContact CD2-CD1 3.56Å; Y219-F282 AromaticContact CD2-CE1 3.76Å; Y219-F282 HydrophobicContact CD2-CE1 3.76Å; Y219-F282 HydrophobicContact CD2-CG 4.08Å; Y219-F282 HydrophobicContact CD2-CZ 4.4Å; Y219-F282 HydrophobicContact CE2-CD1 4.09Å; Y219-F282 HydrophobicContact CE2-CE1 4.08Å; Y219-F282 HydrophobicContact CG-CD1 4.43Å; Y219-F282 HydrophobicContact CG-CE1 4.43Å; V221-F282 HydrophobicContact CG2-CD2 4.33Å; V221-F282 HydrophobicContact CG2-CE2 4.39Å; V278-F282 HydrophobicContact CG1-CD2 4.24Å; V278-F282 HydrophobicContact CG1-CE2 3.68Å; V278-F282 WeakPolarHBondContact O-CD2 3.34Å; V278-F282 PolarHBondContact O-N 3.06Å; A279-F282 PolarHBondContact O-N 3.1Å; E280-F282 VanDerWaalsContact C-N 3.34Å; E280-F282 PolarHBondContact O-N 2.8Å; F282-E286 HydrophobicContact CD1-CG 4.07Å; F282-E286 CarbonylContact O-C 3.56Å; F282-E286 WeakPolarHBondContact O-CB 3.24Å; F282-G287 PolarHBondContact O-N 2.89Å; F282-G287 VanDerWaalsContact O-N 3.15Å; F282-Q288 PolarHBondContact O-N 2.84Å; F282-V290 HydrophobicContact CB-CG2 3.46Å; F282-V290 VanDerWaalsContact CB-CG2 3.46Å
283	R	93.9	Very high	93.9	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.015	12%	0.118	C	C	.	.	H	α-helix	trans	-67.6	-51.1	173.7	-175.4	-168	63.3	-154.1	-8	112.3	A279 E280 Y281 G287 R334 G341 I343	A279-R283 PolarHBondContact O-N 2.99Å; E280-R283 PolarHBondContact O-N 3.24Å; E280-R283 IonicContact OE1-NH2 2.7Å; Y281-R283 VanDerWaalsContact C-N 3.32Å; Y281-R283 PolarHBondContact O-N 2.96Å; R283-G287 VanDerWaalsContact O-CA 3.3Å; R283-G287 WeakPolarHBondContact O-CA 3.48Å; R283-G287 PolarHBondContact O-N 3.14Å; R283-R334 PolarHBondContact NH1-O 3.43Å; R283-G341 WeakPolarHBondContact CG-O 3.39Å; R283-I343 HydrophobicContact CB-CD1 4.12Å; R283-I343 HydrophobicContact CB-CG1 3.95Å; R283-I343 HydrophobicContact CG-CG1 4.25Å
284	D	92.9	Very high	93.8	Very high	49 Å²	49	21.8 Å²	21.8	26%	0.262	12%	0.115	S	C	.	.	H	α-helix	trans	-92.9	-30.9	-163.1	-65.7	-28	0	0	0	113.9	E280 Y281 K340	E280-D284 VanDerWaalsContact O-CB 3.29Å; E280-D284 WeakPolarHBondContact O-CB 3.08Å; E280-D284 PolarHBondContact O-N 3.38Å; Y281-D284 PolarHBondContact O-N 3.14Å; D284-K340 VanDerWaalsContact O-CD 3.25Å; D284-K340 WeakPolarHBondContact O-CD 3.44Å; D284-K340 PolarHBondContact O-NZ 2.95Å
285	Q	91.8	Very high	93.5	Very high	125 Å²	125	22.7 Å²	22.7	58%	0.584	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-45.8	-179.8	-57.7	-68.2	4.9	0	0	111.7	Y281	Y281-Q285 HydrophobicContact CD2-CB 4.15Å; Y281-Q285 HydrophobicContact CD2-CG 3.79Å; Y281-Q285 HydrophobicContact CE2-CB 3.92Å; Y281-Q285 HydrophobicContact CE2-CG 3.83Å; Y281-Q285 HydrophobicContact CG-CG 4.5Å; Y281-Q285 VanDerWaalsContact O-CB 3.31Å; Y281-Q285 WeakPolarHBondContact O-CB 3.25Å; Y281-Q285 PolarHBondContact O-N 3.07Å
286	E	90.3	Very high	93.1	Very high	83 Å²	83	23.2 Å²	23.2	39%	0.388	12%	0.123	S	C	.	.	S	Bend	trans	-88.4	-15.4	-179.2	-56.3	-70.8	166.4	0	0	112.7	Y281 F282 Q288	Y281-E286 HydrophobicContact CD1-CG 4.37Å; Y281-E286 HydrophobicContact CE1-CG 3.69Å; Y281-E286 PolarHBondContact O-N 2.67Å; Y281-E286 PolarHBondContact OH-OE1 3.45Å; F282-E286 HydrophobicContact CD1-CG 4.07Å; F282-E286 CarbonylContact O-C 3.56Å; F282-E286 WeakPolarHBondContact O-CB 3.24Å; E286-Q288 HydrophobicContact CB-CG 4.08Å; E286-Q288 PolarHBondContact O-N 2.8Å
287	G	89.8	Confident	92.8	Very high	39 Å²	39	23.2 Å²	23.2	40%	0.402	12%	0.123	S	C	.	.			trans	67.2	34.1	177.6	0	0	0	0	0	113.4	F282 R283 K340	F282-G287 PolarHBondContact O-N 2.89Å; F282-G287 VanDerWaalsContact O-N 3.15Å; R283-G287 VanDerWaalsContact O-CA 3.3Å; R283-G287 WeakPolarHBondContact O-CA 3.48Å; R283-G287 PolarHBondContact O-N 3.14Å; G287-K340 CarbonylContact C-O 3.54Å; G287-K340 WeakPolarHBondContact CA-O 3.47Å
288	Q	87.8	Confident	92.5	Very high	52 Å²	52	24 Å²	24	24%	0.243	13%	0.126	C	C	.	.			trans	-104.6	160.6	-175.9	-63.4	-161.8	-6.2	0	0	112.8	F282 E286	F282-Q288 PolarHBondContact O-N 2.84Å; E286-Q288 HydrophobicContact CB-CG 4.08Å; E286-Q288 PolarHBondContact O-N 2.8Å
289	D	89.5	Confident	92.4	Very high	51 Å²	51	26.5 Å²	26.5	27%	0.273	14%	0.135	S	C	.	.			trans	-85.6	120.8	167.4	-63.6	-42.8	0	0	0	109.2	K187 G218 S342	K187-D289 WeakPolarHBondContact CE-OD1 3.28Å; K187-D289 WeakPolarHBondContact CE-OD2 3.33Å; K187-D289 VanDerWaalsContact NZ-CG 3.35Å; K187-D289 IonicContact NZ-OD1 3.35Å; K187-D289 PolarHBondContact NZ-OD1 3.43Å; K187-D289 IonicContact NZ-OD2 2.71Å; K187-D289 PolarHBondContact NZ-OD2 3.2Å; G218-D289 WeakPolarHBondContact CA-O 3.37Å; D289-S342 WeakPolarHBondContact CA-O 3.48Å; D289-S342 VanDerWaalsContact CG-OG 3.31Å; D289-S342 WeakPolarHBondContact OD1-CB 3.43Å; D289-S342 PolarHBondContact OD1-N 2.98Å; D289-S342 PolarHBondContact OD1-OG 2.94Å
290	V	92.6	Very high	92.3	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.006	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	137.3	-170.9	-172.9	0	0	0	0	109.6	Y219 V221 A279 F282 S342 I343 T344	Y219-V290 WeakPolarHBondContact O-CA 3.26Å; V221-V290 HydrophobicContact CG2-CG1 4.26Å; A279-V290 HydrophobicContact CB-CG1 3.85Å; F282-V290 HydrophobicContact CB-CG2 3.46Å; F282-V290 VanDerWaalsContact CB-CG2 3.46Å; V290-S342 PolarHBondContact N-O 2.88Å; V290-I343 HydrophobicContact CB-CG1 4.34Å; V290-I343 CarbonylContact O-C 3.59Å; V290-I343 WeakPolarHBondContact O-CA 3.36Å; V290-T344 PolarHBondContact O-N 2.67Å
291	L	93.5	Very high	92.2	Very high	5 Å²	5	26.5 Å²	26.5	3%	0.026	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	122.6	166.1	-68.3	-171.5	0	0	0	110.8	L172 V212 Y219 S220 V221 F293 T344	L172-L291 HydrophobicContact CD2-CD2 3.92Å; V212-L291 HydrophobicContact CB-CD1 3.59Å; V212-L291 HydrophobicContact CB-CG 4.25Å; V212-L291 HydrophobicContact CG1-CD1 3.84Å; V212-L291 HydrophobicContact CG1-CD2 4.49Å; V212-L291 HydrophobicContact CG1-CG 3.92Å; V212-L291 HydrophobicContact CG2-CD1 3.68Å; V212-L291 HydrophobicContact CG2-CG 4.43Å; Y219-L291 PolarHBondContact O-N 2.82Å; S220-L291 CarbonylContact C-O 2.91Å; S220-L291 VanDerWaalsContact CA-O 3.29Å; S220-L291 WeakPolarHBondContact CA-O 3.39Å; V221-L291 PolarHBondContact N-O 3.01Å; L291-F293 HydrophobicContact CB-CD2 4.35Å; L291-F293 HydrophobicContact CB-CE2 3.6Å; L291-F293 HydrophobicContact CB-CZ 4.21Å; L291-F293 HydrophobicContact CD1-CE2 3.92Å; L291-F293 HydrophobicContact CD1-CZ 3.82Å; L291-F293 HydrophobicContact CG-CE2 4.44Å; L291-T344 WeakPolarHBondContact CA-O 3.17Å; L291-T344 HydrophobicContact CD2-CG2 4.25Å
292	L	95.4	Very high	92.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	113.1	173.6	176.9	64.9	0	0	0	110.4	V221 L276 A279 I294 I335 I343 T344 S345 V346	V221-L292 HydrophobicContact CB-CD1 4.02Å; V221-L292 HydrophobicContact CG1-CD1 4.13Å; V221-L292 WeakPolarHBondContact O-CA 3.05Å; L276-L292 HydrophobicContact CB-CD2 4.36Å; L276-L292 HydrophobicContact CD1-CD2 3.73Å; A279-L292 HydrophobicContact CB-CD1 4.42Å; L292-I294 HydrophobicContact CD2-CD1 4.09Å; L292-I294 HydrophobicContact CD2-CG1 4.26Å; L292-I294 HydrophobicContact CG-CD1 4.42Å; L292-I294 HydrophobicContact CG-CG1 4.05Å; L292-I335 HydrophobicContact CD2-CD1 4.03Å; L292-I335 HydrophobicContact CD2-CG1 4.15Å; L292-I343 HydrophobicContact CB-CG2 3.73Å; L292-I343 HydrophobicContact CD2-CG2 4.27Å; L292-T344 PolarHBondContact N-O 3.14Å; L292-S345 CarbonylContact O-C 3.58Å; L292-S345 WeakPolarHBondContact O-CA 3.37Å; L292-S345 PolarHBondContact O-OG 3.11Å; L292-V346 PolarHBondContact O-N 2.76Å
293	F	94.4	Very high	92.1	Very high	1 Å²	1	27.9 Å²	27.9	0%	0.004	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.3	173.7	-64.2	-88.4	0	0	0	110.1	I205 L208 I209 V221 F222 A223 L291 V346	I205-F293 HydrophobicContact CB-CD1 4.19Å; I205-F293 HydrophobicContact CB-CE1 4.19Å; I205-F293 HydrophobicContact CG1-CD1 3.96Å; I205-F293 HydrophobicContact CG1-CE1 4.16Å; I205-F293 HydrophobicContact CG2-CD1 3.47Å; I205-F293 VanDerWaalsContact CG2-CD1 3.47Å; I205-F293 HydrophobicContact CG2-CE1 3.69Å; I205-F293 HydrophobicContact CG2-CG 3.98Å; I205-F293 HydrophobicContact CG2-CZ 4.38Å; L208-F293 HydrophobicContact CB-CE1 4.24Å; L208-F293 HydrophobicContact CB-CZ 4Å; L208-F293 HydrophobicContact CD1-CE1 4.38Å; I209-F293 HydrophobicContact CB-CE2 4.48Å; I209-F293 HydrophobicContact CD1-CD2 4.05Å; I209-F293 HydrophobicContact CD1-CE2 3.85Å; I209-F293 HydrophobicContact CD1-CZ 4.26Å; I209-F293 HydrophobicContact CG1-CD2 3.89Å; I209-F293 HydrophobicContact CG1-CE1 4.41Å; I209-F293 HydrophobicContact CG1-CE2 3.18Å; I209-F293 HydrophobicContact CG1-CZ 3.49Å; I209-F293 VanDerWaalsContact CG1-CZ 3.49Å; V221-F293 PolarHBondContact O-N 3.26Å; F222-F293 HydrophobicContact CD2-CB 3.58Å; F222-F293 HydrophobicContact CD2-CG 4.32Å; F222-F293 HydrophobicContact CE2-CB 4.14Å; F222-F293 HydrophobicContact CG-CB 4.33Å; A223-F293 PolarHBondContact N-O 2.82Å; L291-F293 HydrophobicContact CB-CD2 4.35Å; L291-F293 HydrophobicContact CB-CE2 3.6Å; L291-F293 HydrophobicContact CB-CZ 4.21Å; L291-F293 HydrophobicContact CD1-CE2 3.92Å; L291-F293 HydrophobicContact CD1-CZ 3.82Å; L291-F293 HydrophobicContact CG-CE2 4.44Å; F293-V346 VanDerWaalsContact CA-O 3.29Å; F293-V346 WeakPolarHBondContact CA-O 3.37Å; F293-V346 HydrophobicContact CD1-CB 3.68Å; F293-V346 HydrophobicContact CD1-CG1 4.08Å; F293-V346 HydrophobicContact CD1-CG2 4.4Å; F293-V346 HydrophobicContact CE1-CB 3.69Å; F293-V346 HydrophobicContact CE1-CG1 4.02Å; F293-V346 HydrophobicContact CE1-CG2 3.95Å
294	I	93.8	Very high	92.1	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	105.4	175.4	-53.2	179.7	0	0	0	108.1	V225 L292 I297 M331 I335 V346 Q347 A348	V225-I294 HydrophobicContact CG2-CG2 3.82Å; L292-I294 HydrophobicContact CD2-CD1 4.09Å; L292-I294 HydrophobicContact CD2-CG1 4.26Å; L292-I294 HydrophobicContact CG-CD1 4.42Å; L292-I294 HydrophobicContact CG-CG1 4.05Å; I294-I297 HydrophobicContact CG2-CB 4.29Å; I294-I297 HydrophobicContact CG2-CD1 4.26Å; I294-M331 HydrophobicContact CD1-CE 4.34Å; I294-M331 HydrophobicContact CD1-SD 4.1Å; I294-I335 HydrophobicContact CD1-CD1 4.18Å; I294-V346 PolarHBondContact N-O 2.8Å; I294-Q347 HydrophobicContact CB-CB 4.44Å; I294-Q347 HydrophobicContact CB-CG 4.17Å; I294-Q347 HydrophobicContact CD1-CG 4.17Å; I294-Q347 HydrophobicContact CG1-CG 4.35Å; I294-Q347 CarbonylContact O-C 3.59Å; I294-Q347 WeakPolarHBondContact O-CA 3.29Å; I294-A348 PolarHBondContact O-N 3.45Å
295	D	90.2	Very high	92.2	Very high	20 Å²	20	27 Å²	27	11%	0.107	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	107.7	172.1	-158.6	-1.1	0	0	0	108.3	F222 A223 G224 V225 E227 A348	F222-D295 HydrophobicContact CE2-CB 4.42Å; F222-D295 HydrophobicContact CZ-CB 3.83Å; A223-D295 PolarHBondContact O-N 2.65Å; G224-D295 CarbonylContact C-O 3.55Å; G224-D295 VanDerWaalsContact C-O 3.31Å; G224-D295 WeakPolarHBondContact CA-O 3.38Å; V225-D295 PolarHBondContact N-O 3.07Å; E227-D295 VanDerWaalsContact CG-O 3.24Å; E227-D295 WeakPolarHBondContact CG-O 3.08Å; E227-D295 VanDerWaalsContact OE1-O 3.04Å; D295-A348 HydrophobicContact CB-CB 4.21Å; D295-A348 WeakPolarHBondContact OD1-CB 3.44Å
296	N	88.6	Confident	92.3	Very high	11 Å²	11	24 Å²	24	6%	0.059	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	cis	-122	136.3	1.9	-163.7	-69.9	0	0	0	111.3	V225 F298 R299 F300 A348 Y350	V225-N296 PolarHBondContact O-N 2.94Å; V225-N296 VanDerWaalsContact O-N 3.15Å; N296-F298 PolarHBondContact O-N 2.82Å; N296-F298 WeakPolarHBondContact OD1-CB 3.27Å; N296-F298 PolarHBondContact OD1-N 3.24Å; N296-R299 HydrophobicContact CB-CB 4.5Å; N296-R299 HydrophobicContact CB-CG 3.98Å; N296-R299 WeakPolarHBondContact O-CB 3.45Å; N296-R299 PolarHBondContact O-N 2.76Å; N296-F300 PolarHBondContact O-N 3.39Å; N296-A348 PolarHBondContact ND2-O 3.38Å; N296-A348 PolarHBondContact OD1-O 2.96Å; N296-Y350 PolarHBondContact OD1-N 3.46Å
297	I	91.3	Very high	92.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.3	-27.5	-179.8	-169.3	59.2	0	0	0	112.8	I294 R299 F300 T301 M328 M331 Q347 A348 I349 T364	I294-I297 HydrophobicContact CG2-CB 4.29Å; I294-I297 HydrophobicContact CG2-CD1 4.26Å; I297-R299 VanDerWaalsContact C-N 3.26Å; I297-R299 PolarHBondContact O-N 2.84Å; I297-F300 HydrophobicContact CD1-CB 4.11Å; I297-F300 HydrophobicContact CD1-CD1 4.14Å; I297-F300 HydrophobicContact CD1-CG 4.34Å; I297-F300 WeakPolarHBondContact O-CB 3.47Å; I297-F300 PolarHBondContact O-N 2.81Å; I297-T301 PolarHBondContact O-N 2.85Å; I297-M328 HydrophobicContact CD1-CE 4.13Å; I297-M328 HydrophobicContact CD1-SD 4.03Å; I297-M328 HydrophobicContact CG1-CE 3.9Å; I297-M328 HydrophobicContact CG1-SD 4.07Å; I297-M331 HydrophobicContact CD1-CE 3.2Å; I297-M331 HydrophobicContact CG1-CE 4.38Å; I297-Q347 HydrophobicContact CB-CB 4.49Å; I297-Q347 HydrophobicContact CG2-CB 4.45Å; I297-A348 PolarHBondContact N-O 3.48Å; I297-A348 VanDerWaalsContact N-O 3.14Å; I297-I349 HydrophobicContact CG2-CB 4.39Å; I297-I349 HydrophobicContact CG2-CD1 4.43Å; I297-I349 HydrophobicContact CG2-CG1 3.63Å; I297-T364 HydrophobicContact CG1-CG2 4.48Å; I297-T364 HydrophobicContact CG2-CG2 4.13Å
298	F	91	Very high	92.7	Very high	20 Å²	20	19 Å²	19	9%	0.088	10%	0.096	C	C	.	.	H	α-helix	trans	-62.4	-35.3	172.7	177.9	-98.3	0	0	0	111.9	N296 F300 T301 Q302 Y320 Y350 P352 A360	N296-F298 PolarHBondContact O-N 2.82Å; N296-F298 WeakPolarHBondContact OD1-CB 3.27Å; N296-F298 PolarHBondContact OD1-N 3.24Å; F298-F300 VanDerWaalsContact C-N 3.32Å; F298-F300 PolarHBondContact O-N 2.97Å; F298-T301 WeakPolarHBondContact O-CB 3.47Å; F298-T301 PolarHBondContact O-N 2.91Å; F298-Q302 HydrophobicContact CE1-CB 4.49Å; F298-Q302 PolarHBondContact O-N 3.12Å; F298-Y320 WeakPolarHBondContact CE2-OH 3.12Å; F298-Y350 AromaticContact CD1-CD1 3.65Å; F298-Y350 HydrophobicContact CD1-CD1 3.65Å; F298-Y350 HydrophobicContact CD1-CG 4.39Å; F298-Y350 AromaticContact CE1-CD1 3.78Å; F298-Y350 HydrophobicContact CE1-CD1 3.78Å; F298-Y350 HydrophobicContact CE1-CE1 4.24Å; F298-Y350 HydrophobicContact CG-CD1 4.06Å; F298-Y350 HydrophobicContact CZ-CD1 4.3Å; F298-P352 HydrophobicContact CE2-CB 4.34Å; F298-P352 HydrophobicContact CE2-CG 3.89Å; F298-P352 HydrophobicContact CZ-CB 4.26Å; F298-P352 HydrophobicContact CZ-CG 4.29Å; F298-A360 HydrophobicContact CD2-CB 4.06Å; F298-A360 HydrophobicContact CE2-CB 4.09Å
299	R	92.7	Very high	93	Very high	53 Å²	53	19.5 Å²	19.5	20%	0.2	11%	0.109	C	C	.	.	H	α-helix	trans	-70.1	-29.9	178.8	-65	-64.9	-173.5	-161.3	-4.6	112.3	V225 N296 I297 Q302 A303	V225-R299 HydrophobicContact CG1-CB 4.1Å; V225-R299 WeakPolarHBondContact O-CB 3.29Å; V225-R299 WeakPolarHBondContact O-CG 3.32Å; N296-R299 HydrophobicContact CB-CB 4.5Å; N296-R299 HydrophobicContact CB-CG 3.98Å; N296-R299 WeakPolarHBondContact O-CB 3.45Å; N296-R299 PolarHBondContact O-N 2.76Å; I297-R299 VanDerWaalsContact C-N 3.26Å; I297-R299 PolarHBondContact O-N 2.84Å; R299-Q302 VanDerWaalsContact CD-OE1 3.25Å; R299-Q302 PolarHBondContact O-N 3.35Å; R299-A303 VanDerWaalsContact O-CB 3.3Å; R299-A303 WeakPolarHBondContact O-CB 3.33Å; R299-A303 PolarHBondContact O-N 2.86Å
300	F	94.1	Very high	93.2	Very high	13 Å²	13	20.3 Å²	20.3	6%	0.057	11%	0.113	C	C	.	.	H	α-helix	trans	-59.7	-49.4	169	171	-100.8	0	0	0	110.5	V225 A269 A272 N296 I297 F298 Q302 A303 G304 M328 M331	V225-F300 HydrophobicContact CG1-CB 3.99Å; A269-F300 VanDerWaalsContact O-CE2 3.3Å; A269-F300 WeakPolarHBondContact O-CE2 3.41Å; A272-F300 HydrophobicContact CB-CD2 3.93Å; A272-F300 HydrophobicContact CB-CE2 4.39Å; N296-F300 PolarHBondContact O-N 3.39Å; I297-F300 HydrophobicContact CD1-CB 4.11Å; I297-F300 HydrophobicContact CD1-CD1 4.14Å; I297-F300 HydrophobicContact CD1-CG 4.34Å; I297-F300 WeakPolarHBondContact O-CB 3.47Å; I297-F300 PolarHBondContact O-N 2.81Å; F298-F300 VanDerWaalsContact C-N 3.32Å; F298-F300 PolarHBondContact O-N 2.97Å; F300-Q302 PolarHBondContact O-N 2.68Å; F300-A303 PolarHBondContact O-N 3.16Å; F300-G304 PolarHBondContact O-N 3.5Å; F300-M328 HydrophobicContact CD1-CE 4.2Å; F300-M331 HydrophobicContact CZ-CB 4.44Å
301	T	93.6	Very high	93.2	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-62	-44	176.8	-65.8	0	0	0	0	112.5	I297 F298 G304 S305 Y320 L324 M328 A360	I297-T301 PolarHBondContact O-N 2.85Å; F298-T301 WeakPolarHBondContact O-CB 3.47Å; F298-T301 PolarHBondContact O-N 2.91Å; T301-G304 WeakPolarHBondContact O-CA 3.32Å; T301-G304 PolarHBondContact O-N 3.19Å; T301-G304 VanDerWaalsContact O-N 3.17Å; T301-S305 PolarHBondContact O-N 3.33Å; T301-Y320 HydrophobicContact CG2-CD1 3.73Å; T301-Y320 HydrophobicContact CG2-CE1 3.76Å; T301-L324 HydrophobicContact CG2-CD1 3.32Å; T301-M328 VanDerWaalsContact OG1-CE 3.24Å; T301-M328 WeakPolarHBondContact OG1-CE 3.5Å; T301-A360 HydrophobicContact CG2-CB 3.63Å
302	Q	93.4	Very high	93	Very high	55 Å²	55	23.4 Å²	23.4	26%	0.257	14%	0.144	S	C	.	.	H	α-helix	trans	-61.7	-44.5	177.6	-172.6	-175.6	24.6	0	0	111.8	F298 R299 F300 G304 S305 E306	F298-Q302 HydrophobicContact CE1-CB 4.49Å; F298-Q302 PolarHBondContact O-N 3.12Å; R299-Q302 VanDerWaalsContact CD-OE1 3.25Å; R299-Q302 PolarHBondContact O-N 3.35Å; F300-Q302 PolarHBondContact O-N 2.68Å; Q302-G304 VanDerWaalsContact C-N 3.27Å; Q302-G304 PolarHBondContact O-N 2.99Å; Q302-S305 PolarHBondContact O-N 3.16Å; Q302-S305 PolarHBondContact O-OG 3.08Å; Q302-E306 WeakPolarHBondContact O-CG 3.47Å; Q302-E306 PolarHBondContact O-N 2.95Å
303	A	94.6	Very high	92.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-38.4	175.1	0	0	0	0	0	111.3	R268 A269 R299 F300 E306 V307	R268-A303 HydrophobicContact CB-CB 3.6Å; A269-A303 HydrophobicContact CB-CB 3.9Å; R299-A303 VanDerWaalsContact O-CB 3.3Å; R299-A303 WeakPolarHBondContact O-CB 3.33Å; R299-A303 PolarHBondContact O-N 2.86Å; F300-A303 PolarHBondContact O-N 3.16Å; A303-E306 PolarHBondContact O-N 3.36Å; A303-V307 WeakPolarHBondContact O-CB 3.41Å; A303-V307 WeakPolarHBondContact O-CG2 3.37Å; A303-V307 PolarHBondContact O-N 3.38Å
304	G	94	Very high	92.9	Very high	12 Å²	12	34 Å²	34	12%	0.124	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-40.7	173.3	0	0	0	0	0	113.7	F300 T301 Q302 V307 S308	F300-G304 PolarHBondContact O-N 3.5Å; T301-G304 WeakPolarHBondContact O-CA 3.32Å; T301-G304 PolarHBondContact O-N 3.19Å; T301-G304 VanDerWaalsContact O-N 3.17Å; Q302-G304 VanDerWaalsContact C-N 3.27Å; Q302-G304 PolarHBondContact O-N 2.99Å; G304-V307 PolarHBondContact O-N 3.33Å; G304-S308 VanDerWaalsContact O-CB 3.27Å; G304-S308 WeakPolarHBondContact O-CB 3.42Å; G304-S308 PolarHBondContact O-N 3.12Å
305	S	94.6	Very high	92.8	Very high	23 Å²	23	37.6 Å²	37.6	16%	0.161	22%	0.217	C	C	.	.	H	α-helix	trans	-68.7	-40.2	176.8	70.4	0	0	0	0	112.1	T301 Q302 S308 A309	T301-S305 PolarHBondContact O-N 3.33Å; Q302-S305 PolarHBondContact O-N 3.16Å; Q302-S305 PolarHBondContact O-OG 3.08Å; S305-S308 PolarHBondContact O-N 3.04Å; S305-A309 PolarHBondContact O-N 3.43Å
306	E	94.4	Very high	92.9	Very high	63 Å²	63	40 Å²	40	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-60.2	-48.7	172.7	-69.5	176.4	-134	0	0	111.6	P265 R268 Q302 A303 S308 A309 L310	P265-E306 HydrophobicContact CB-CB 3.76Å; P265-E306 WeakPolarHBondContact CB-OE2 3.44Å; P265-E306 HydrophobicContact CG-CB 4.23Å; R268-E306 IonicContact CZ-OE1 3.08Å; R268-E306 IonicContact CZ-OE2 2.9Å; R268-E306 IonicContact NH1-OE1 3.5Å; R268-E306 PolarHBondContact NH1-OE1 3.08Å; R268-E306 IonicContact NH2-OE1 3.43Å; R268-E306 PolarHBondContact NH2-OE1 2.98Å; R268-E306 IonicContact NH2-OE2 2.96Å; R268-E306 PolarHBondContact NH2-OE2 3.4Å; Q302-E306 WeakPolarHBondContact O-CG 3.47Å; Q302-E306 PolarHBondContact O-N 2.95Å; A303-E306 PolarHBondContact O-N 3.36Å; E306-S308 VanDerWaalsContact C-N 3.35Å; E306-S308 PolarHBondContact O-N 3.17Å; E306-A309 PolarHBondContact O-N 2.91Å; E306-L310 WeakPolarHBondContact O-CG 3.45Å; E306-L310 PolarHBondContact O-N 3.08Å
307	V	94	Very high	92.9	Very high	13 Å²	13	42.2 Å²	42.2	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-58.9	-46.2	175.5	166.4	0	0	0	0	111	I100 P265 A269 A303 G304 A309 L310 L311	I100-V307 HydrophobicContact CD1-CG1 3.34Å; I100-V307 HydrophobicContact CG1-CG1 4.13Å; I100-V307 HydrophobicContact CG2-CG2 4.36Å; P265-V307 HydrophobicContact CB-CG2 4.08Å; A269-V307 HydrophobicContact CB-CG2 4.32Å; A303-V307 WeakPolarHBondContact O-CB 3.41Å; A303-V307 WeakPolarHBondContact O-CG2 3.37Å; A303-V307 PolarHBondContact O-N 3.38Å; G304-V307 PolarHBondContact O-N 3.33Å; V307-A309 VanDerWaalsContact C-N 3.32Å; V307-A309 PolarHBondContact O-N 3.45Å; V307-L310 PolarHBondContact O-N 2.84Å; V307-L311 HydrophobicContact CG1-CD1 4.01Å; V307-L311 HydrophobicContact CG1-CG 4.34Å; V307-L311 WeakPolarHBondContact O-CG 3.5Å; V307-L311 PolarHBondContact O-N 2.98Å
308	S	94.4	Very high	92.8	Very high	4 Å²	4	47.7 Å²	47.7	3%	0.028	29%	0.289	C	S	.	.	H	α-helix	trans	-61	-40.9	-179.6	179.3	0	0	0	0	112.4	G304 S305 E306 L311 G312 R313 Q321	G304-S308 VanDerWaalsContact O-CB 3.27Å; G304-S308 WeakPolarHBondContact O-CB 3.42Å; G304-S308 PolarHBondContact O-N 3.12Å; S305-S308 PolarHBondContact O-N 3.04Å; E306-S308 VanDerWaalsContact C-N 3.35Å; E306-S308 PolarHBondContact O-N 3.17Å; S308-L311 PolarHBondContact O-N 2.93Å; S308-G312 PolarHBondContact O-N 3.35Å; S308-R313 WeakPolarHBondContact O-CB 3.34Å; S308-R313 PolarHBondContact O-N 3.17Å; S308-R313 VanDerWaalsContact O-N 3.12Å; S308-R313 WeakPolarHBondContact OG-CB 3.29Å; S308-R313 WeakPolarHBondContact OG-CD 3.47Å; S308-Q321 VanDerWaalsContact OG-CB 3.3Å; S308-Q321 WeakPolarHBondContact OG-CB 3.48Å
309	A	93.8	Very high	92.8	Very high	61 Å²	61	48.9 Å²	48.9	50%	0.504	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-43.1	175.7	0	0	0	0	0	111.5	S305 E306 V307 L311 G312	S305-A309 PolarHBondContact O-N 3.43Å; E306-A309 PolarHBondContact O-N 2.91Å; V307-A309 VanDerWaalsContact C-N 3.32Å; V307-A309 PolarHBondContact O-N 3.45Å; A309-L311 VanDerWaalsContact C-N 3.3Å; A309-L311 PolarHBondContact O-N 3.14Å; A309-G312 PolarHBondContact O-N 3.11Å
310	L	92.3	Very high	92.8	Very high	69 Å²	69	47.4 Å²	47.4	36%	0.361	30%	0.301	S	S	.	.	H	α-helix	trans	-65.4	-31.8	177.1	-68.5	172.9	0	0	0	113	A58 V59 P265 E306 V307 G312	A58-L310 HydrophobicContact CB-CD1 4.08Å; V59-L310 HydrophobicContact CG2-CB 3.62Å; P265-L310 HydrophobicContact CG-CD1 4.13Å; E306-L310 WeakPolarHBondContact O-CG 3.45Å; E306-L310 PolarHBondContact O-N 3.08Å; V307-L310 PolarHBondContact O-N 2.84Å; L310-G312 PolarHBondContact O-N 3.34Å
311	L	92.6	Very high	92.9	Very high	8 Å²	8	47 Å²	47	4%	0.042	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-6.5	173.2	-67.5	177.5	0	0	0	113.2	V59 A89 R98 I100 V307 S308 A309 R313	V59-L311 HydrophobicContact CG2-CD2 4.34Å; A89-L311 HydrophobicContact CB-CD1 4.19Å; A89-L311 HydrophobicContact CB-CD2 4.07Å; R98-L311 HydrophobicContact CG-CD2 3.7Å; I100-L311 HydrophobicContact CD1-CD1 4.47Å; I100-L311 HydrophobicContact CG1-CD2 4.44Å; V307-L311 HydrophobicContact CG1-CD1 4.01Å; V307-L311 HydrophobicContact CG1-CG 4.34Å; V307-L311 WeakPolarHBondContact O-CG 3.5Å; V307-L311 PolarHBondContact O-N 2.98Å; S308-L311 PolarHBondContact O-N 2.93Å; A309-L311 VanDerWaalsContact C-N 3.3Å; A309-L311 PolarHBondContact O-N 3.14Å; L311-R313 HydrophobicContact CB-CG 4.34Å
312	G	90.5	Very high	92.9	Very high	63 Å²	63	50.4 Å²	50.4	65%	0.649	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	20.7	-179.5	0	0	0	0	0	113.8	S308 A309 L310	S308-G312 PolarHBondContact O-N 3.35Å; A309-G312 PolarHBondContact O-N 3.11Å; L310-G312 PolarHBondContact O-N 3.34Å
313	R	92.3	Very high	92.9	Very high	77 Å²	77	49.6 Å²	49.6	29%	0.291	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-73.6	143.4	173.5	-61	178	-176.3	177.4	0.9	109.4	S308 L311 P315 P322 T323	S308-R313 WeakPolarHBondContact O-CB 3.34Å; S308-R313 PolarHBondContact O-N 3.17Å; S308-R313 VanDerWaalsContact O-N 3.12Å; S308-R313 WeakPolarHBondContact OG-CB 3.29Å; S308-R313 WeakPolarHBondContact OG-CD 3.47Å; L311-R313 HydrophobicContact CB-CG 4.34Å; R313-P315 WeakPolarHBondContact O-CD 3.43Å; R313-P322 HydrophobicContact CB-CG 4.39Å; R313-T323 PolarHBondContact NH1-OG1 2.89Å
314	I	94.1	Very high	92.9	Very high	146 Å²	146	50.2 Å²	50.2	75%	0.749	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-68.4	124.6	175.1	-59.9	175.2	0	0	0	108.4
315	P	92.4	Very high	92.9	Very high	77 Å²	77	52.6 Å²	52.6	50%	0.5	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-63.3	149.4	176.1	-21.3	32.9	0	0	0	112.4	R313	R313-P315 WeakPolarHBondContact O-CD 3.43Å
316	S	92.6	Very high	92.9	Very high	72 Å²	72	56 Å²	56	50%	0.503	36%	0.362	S	S	.	.			trans	-95.2	-157.6	174.3	-168.3	0	0	0	0	110.7	V318 G319 Y320	S316-V318 PolarHBondContact O-N 3.19Å; S316-G319 PolarHBondContact O-N 2.72Å; S316-G319 VanDerWaalsContact O-N 3.12Å; S316-Y320 PolarHBondContact N-O 3.08Å
317	A	87.8	Confident	92.8	Very high	57 Å²	57	55.7 Å²	55.7	47%	0.471	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-48.3	134.3	177.6	0	0	0	0	0	111.9	G319 Y320 P359	A317-G319 PolarHBondContact O-N 2.93Å; A317-Y320 WeakPolarHBondContact O-CD2 3.45Å; A317-Y320 PolarHBondContact O-N 3.1Å; A317-P359 HydrophobicContact CB-CG 4.11Å
318	V	88.9	Confident	92.7	Very high	115 Å²	115	55.1 Å²	55.1	70%	0.697	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	57.3	13.3	177.5	-157.9	0	0	0	0	113.9	S316 Y320 P359	S316-V318 PolarHBondContact O-N 3.19Å; V318-Y320 HydrophobicContact CB-CD2 4.1Å; V318-Y320 HydrophobicContact CB-CE2 4.03Å; V318-Y320 HydrophobicContact CG1-CE2 4.38Å; V318-P359 HydrophobicContact CG2-CG 4.08Å
319	G	90.9	Very high	92.7	Very high	45 Å²	45	55.6 Å²	55.6	46%	0.464	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	88.7	7.4	178.5	0	0	0	0	0	115.2	S316 A317	S316-G319 PolarHBondContact O-N 2.72Å; S316-G319 VanDerWaalsContact O-N 3.12Å; A317-G319 PolarHBondContact O-N 2.93Å
320	Y	94.5	Very high	92.7	Very high	21 Å²	21	56.3 Å²	56.3	8%	0.082	36%	0.363	C	S	.	.			trans	-72.4	163.3	174.1	-67.5	-73.4	0	0	0	112.7	F298 T301 S316 A317 V318 L324 D358 P359 A360	F298-Y320 WeakPolarHBondContact CE2-OH 3.12Å; T301-Y320 HydrophobicContact CG2-CD1 3.73Å; T301-Y320 HydrophobicContact CG2-CE1 3.76Å; S316-Y320 PolarHBondContact N-O 3.08Å; A317-Y320 WeakPolarHBondContact O-CD2 3.45Å; A317-Y320 PolarHBondContact O-N 3.1Å; V318-Y320 HydrophobicContact CB-CD2 4.1Å; V318-Y320 HydrophobicContact CB-CE2 4.03Å; V318-Y320 HydrophobicContact CG1-CE2 4.38Å; Y320-L324 HydrophobicContact CG-CD2 4.21Å; Y320-D358 VanDerWaalsContact CE2-OD1 3.23Å; Y320-D358 WeakPolarHBondContact CE2-OD1 3.34Å; Y320-D358 WeakPolarHBondContact CE2-OD2 3.45Å; Y320-D358 VanDerWaalsContact CZ-OD1 3.27Å; Y320-D358 VanDerWaalsContact OH-CG 3.28Å; Y320-D358 PolarHBondContact OH-OD1 2.89Å; Y320-D358 PolarHBondContact OH-OD2 3.48Å; Y320-D358 VanDerWaalsContact OH-OD2 3.04Å; Y320-P359 HydrophobicContact CD2-CB 3.9Å; Y320-P359 HydrophobicContact CD2-CG 3.97Å; Y320-P359 HydrophobicContact CE2-CB 4.22Å; Y320-P359 HydrophobicContact CE2-CG 4.21Å; Y320-A360 HydrophobicContact CD1-CB 4.48Å; Y320-A360 HydrophobicContact CE1-CB 3.77Å; Y320-A360 HydrophobicContact CE2-CB 4.37Å
321	Q	94.3	Very high	92.8	Very high	5 Å²	5	53.1 Å²	53.1	2%	0.023	35%	0.346	C	S	.	.			trans	-65.6	145.8	175.1	70.6	-81.1	27.7	0	0	111.9	S308 T323 L324	S308-Q321 VanDerWaalsContact OG-CB 3.3Å; S308-Q321 WeakPolarHBondContact OG-CB 3.48Å; Q321-T323 PolarHBondContact O-N 3.33Å; Q321-L324 HydrophobicContact CG-CB 4.18Å; Q321-L324 WeakPolarHBondContact O-CB 3.49Å; Q321-L324 PolarHBondContact O-N 3.41Å
322	P	94.4	Very high	92.9	Very high	73 Å²	73	52.7 Å²	52.7	47%	0.474	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-17.8	176.7	26	-34.1	0	0	0	113.5	R313	R313-P322 HydrophobicContact CB-CG 4.39Å
323	T	94.2	Very high	93.1	Very high	38 Å²	38	53.5 Å²	53.5	23%	0.233	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	9.2	178.6	52.5	0	0	0	0	113.3	R313 Q321 A325 T326 D327	R313-T323 PolarHBondContact NH1-OG1 2.89Å; Q321-T323 PolarHBondContact O-N 3.33Å; T323-A325 VanDerWaalsContact C-N 3.33Å; T323-A325 PolarHBondContact O-N 2.71Å; T323-T326 PolarHBondContact O-N 2.91Å; T323-D327 WeakPolarHBondContact CB-OD2 3.41Å; T323-D327 VanDerWaalsContact O-CG 3.31Å; T323-D327 PolarHBondContact O-N 3.41Å; T323-D327 PolarHBondContact OG1-OD2 3.08Å
324	L	93.9	Very high	93.2	Very high	12 Å²	12	49.9 Å²	49.9	6%	0.063	32%	0.317	C	S	.	.	H	α-helix	trans	-50.8	-49.9	-170.9	173.5	60.8	0	0	0	112.7	T301 Y320 Q321 T326 M328 P359	T301-L324 HydrophobicContact CG2-CD1 3.32Å; Y320-L324 HydrophobicContact CG-CD2 4.21Å; Q321-L324 HydrophobicContact CG-CB 4.18Å; Q321-L324 WeakPolarHBondContact O-CB 3.49Å; Q321-L324 PolarHBondContact O-N 3.41Å; L324-T326 PolarHBondContact O-N 3.38Å; L324-M328 VanDerWaalsContact O-CB 3.29Å; L324-M328 WeakPolarHBondContact O-CB 3.5Å; L324-M328 PolarHBondContact O-N 3.29Å; L324-P359 HydrophobicContact CD2-CB 3.94Å
325	A	94.1	Very high	93.3	Very high	63 Å²	63	43 Å²	43	52%	0.521	28%	0.281	S	S	.	.	H	α-helix	trans	-64.8	-38.2	-179.5	0	0	0	0	0	112.7	T323 G329 T363	T323-A325 VanDerWaalsContact C-N 3.33Å; T323-A325 PolarHBondContact O-N 2.71Å; A325-G329 PolarHBondContact O-N 3.15Å; A325-T363 HydrophobicContact CB-CG2 4.27Å
326	T	93.6	Very high	93.3	Very high	94 Å²	94	40.9 Å²	40.9	58%	0.577	27%	0.267	S	S	*	.	H	α-helix	trans	-72.8	-42.7	179.5	-51.4	0	0	0	0	111.6	T323 L324 G329 T330	T323-T326 PolarHBondContact O-N 2.91Å; L324-T326 PolarHBondContact O-N 3.38Å; T326-G329 PolarHBondContact O-N 2.9Å; T326-T330 WeakPolarHBondContact O-CB 3.44Å; T326-T330 PolarHBondContact O-N 3.01Å; T326-T330 PolarHBondContact O-OG1 2.96Å
327	D	92.4	Very high	93.3	Very high	57 Å²	57	38.5 Å²	38.5	31%	0.305	25%	0.25	S	C	.	.	H	α-helix	trans	-65.3	-42.7	179.3	-63	-26.1	0	0	0	110.5	T323	T323-D327 WeakPolarHBondContact CB-OD2 3.41Å; T323-D327 VanDerWaalsContact O-CG 3.31Å; T323-D327 PolarHBondContact O-N 3.41Å; T323-D327 PolarHBondContact OG1-OD2 3.08Å
328	M	93.6	Very high	93.5	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-49.7	173.6	-173.5	59.9	68.5	0	0	111	I297 F300 T301 L324 T330 M331 Q332 T363	I297-M328 HydrophobicContact CD1-CE 4.13Å; I297-M328 HydrophobicContact CD1-SD 4.03Å; I297-M328 HydrophobicContact CG1-CE 3.9Å; I297-M328 HydrophobicContact CG1-SD 4.07Å; F300-M328 HydrophobicContact CD1-CE 4.2Å; T301-M328 VanDerWaalsContact OG1-CE 3.24Å; T301-M328 WeakPolarHBondContact OG1-CE 3.5Å; L324-M328 VanDerWaalsContact O-CB 3.29Å; L324-M328 WeakPolarHBondContact O-CB 3.5Å; L324-M328 PolarHBondContact O-N 3.29Å; M328-T330 PolarHBondContact O-N 2.74Å; M328-M331 PolarHBondContact O-N 2.87Å; M328-M331 HydrophobicContact SD-CE 4.03Å; M328-Q332 HydrophobicContact CG-CG 3.92Å; M328-Q332 WeakPolarHBondContact O-CB 3.4Å; M328-Q332 VanDerWaalsContact O-CG 3.23Å; M328-Q332 WeakPolarHBondContact O-CG 3.29Å; M328-Q332 PolarHBondContact O-N 3.33Å; M328-Q332 HydrophobicContact SD-CG 3.73Å; M328-Q332 PolarHBondContact SD-NE2 2.88Å; M328-T363 HydrophobicContact CB-CG2 4.08Å; M328-T363 HydrophobicContact CG-CG2 4.17Å
329	G	94.4	Very high	93.6	Very high	13 Å²	13	38 Å²	38	13%	0.134	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-43.9	-178.5	0	0	0	0	0	112.9	A325 T326 M331 Q332 E333	A325-G329 PolarHBondContact O-N 3.15Å; T326-G329 PolarHBondContact O-N 2.9Å; G329-M331 PolarHBondContact O-N 2.82Å; G329-Q332 PolarHBondContact O-N 3.26Å; G329-E333 WeakPolarHBondContact O-CB 3.42Å; G329-E333 VanDerWaalsContact O-CG 3.25Å; G329-E333 WeakPolarHBondContact O-CG 3.22Å; G329-E333 PolarHBondContact O-N 2.99Å
330	T	92.7	Very high	93.5	Very high	77 Å²	77	42.1 Å²	42.1	47%	0.472	23%	0.233	S	C	.	.	H	α-helix	trans	-59.3	-37.2	179.8	-53.7	0	0	0	0	111.9	T326 M328 R334	T326-T330 WeakPolarHBondContact O-CB 3.44Å; T326-T330 PolarHBondContact O-N 3.01Å; T326-T330 PolarHBondContact O-OG1 2.96Å; M328-T330 PolarHBondContact O-N 2.74Å; T330-R334 WeakPolarHBondContact O-CD 3.5Å
331	M	94.3	Very high	93.4	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-77.1	-47.5	176	-174.8	-79.3	-67.9	0	0	111.6	L273 L276 I294 I297 F300 M328 G329 E333 R334 I335	L273-M331 HydrophobicContact CD2-CB 3.96Å; L273-M331 HydrophobicContact CD2-CG 3.75Å; L276-M331 HydrophobicContact CD2-CG 4.09Å; L276-M331 HydrophobicContact CD2-SD 4.41Å; I294-M331 HydrophobicContact CD1-CE 4.34Å; I294-M331 HydrophobicContact CD1-SD 4.1Å; I297-M331 HydrophobicContact CD1-CE 3.2Å; I297-M331 HydrophobicContact CG1-CE 4.38Å; F300-M331 HydrophobicContact CZ-CB 4.44Å; M328-M331 PolarHBondContact O-N 2.87Å; M328-M331 HydrophobicContact SD-CE 4.03Å; G329-M331 PolarHBondContact O-N 2.82Å; M331-E333 PolarHBondContact O-N 3.2Å; M331-R334 WeakPolarHBondContact O-CB 3.23Å; M331-R334 PolarHBondContact O-N 3.3Å; M331-I335 HydrophobicContact SD-CD1 3.69Å
332	Q	95.3	Very high	93.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66.1	-38.8	-176.1	-66.7	-70.9	-2.4	0	0	112.1	K190 M328 G329 R334 I335 H367	K190-Q332 WeakPolarHBondContact CE-O 3.39Å; K190-Q332 PolarHBondContact NZ-O 3.08Å; M328-Q332 HydrophobicContact CG-CG 3.92Å; M328-Q332 WeakPolarHBondContact O-CB 3.4Å; M328-Q332 VanDerWaalsContact O-CG 3.23Å; M328-Q332 WeakPolarHBondContact O-CG 3.29Å; M328-Q332 PolarHBondContact O-N 3.33Å; M328-Q332 HydrophobicContact SD-CG 3.73Å; M328-Q332 PolarHBondContact SD-NE2 2.88Å; G329-Q332 PolarHBondContact O-N 3.26Å; Q332-R334 PolarHBondContact O-N 2.88Å; Q332-I335 WeakPolarHBondContact O-CB 3.39Å; Q332-I335 PolarHBondContact O-N 2.91Å; Q332-H367 HydrophobicContact CB-CB 4.15Å; Q332-H367 HydrophobicContact CG-CB 4.11Å
333	E	94	Very high	93.3	Very high	79 Å²	79	37.7 Å²	37.7	37%	0.369	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-17.6	-176.9	-65.7	-50.1	117.7	0	0	113.7	A159 K190 G329 M331 I335 H367	A159-E333 HydrophobicContact CB-CB 3.91Å; K190-E333 IonicContact NZ-OE1 3.88Å; K190-E333 PolarHBondContact NZ-OE1 2.86Å; G329-E333 WeakPolarHBondContact O-CB 3.42Å; G329-E333 VanDerWaalsContact O-CG 3.25Å; G329-E333 WeakPolarHBondContact O-CG 3.22Å; G329-E333 PolarHBondContact O-N 2.99Å; M331-E333 PolarHBondContact O-N 3.2Å; E333-I335 VanDerWaalsContact C-N 3.32Å; E333-H367 IonicContact OE1-CE1 3.96Å; E333-H367 IonicContact OE1-ND1 3.77Å; E333-H367 PolarHBondContact OE1-ND1 3.42Å
334	R	95.3	Very high	93.3	Very high	2 Å²	2	36 Å²	36	1%	0.008	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-24.7	169.9	-77	168.6	68.5	178.4	1.6	112.8	I155 A157 A159 L276 T277 E280 R283 T330 M331 Q332 T336	I155-R334 PolarHBondContact O-NH1 2.76Å; I155-R334 PolarHBondContact O-NH2 2.81Å; A157-R334 WeakPolarHBondContact O-CD 3.4Å; A159-R334 HydrophobicContact CB-CG 4.29Å; L276-R334 HydrophobicContact CD1-CB 4.46Å; L276-R334 HydrophobicContact CD2-CB 3.64Å; L276-R334 HydrophobicContact CD2-CG 4.4Å; L276-R334 HydrophobicContact CG-CB 4.31Å; T277-R334 PolarHBondContact OG1-NH2 3.4Å; T277-R334 VanDerWaalsContact OG1-NH2 3.14Å; E280-R334 WeakPolarHBondContact OE1-CB 3.25Å; E280-R334 IonicContact OE1-CZ 3.87Å; E280-R334 IonicContact OE1-NE 2.85Å; E280-R334 PolarHBondContact OE1-NE 3.1Å; E280-R334 IonicContact OE1-NH2 3.72Å; E280-R334 IonicContact OE2-CZ 3.94Å; E280-R334 IonicContact OE2-NE 3.49Å; E280-R334 IonicContact OE2-NH2 2.78Å; E280-R334 PolarHBondContact OE2-NH2 3.06Å; R283-R334 PolarHBondContact NH1-O 3.43Å; T330-R334 WeakPolarHBondContact O-CD 3.5Å; M331-R334 WeakPolarHBondContact O-CB 3.23Å; M331-R334 PolarHBondContact O-N 3.3Å; Q332-R334 PolarHBondContact O-N 2.88Å; R334-T336 PolarHBondContact O-N 3.41Å
335	I	94.9	Very high	93.4	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	20%	0.196	C	C	.	.	S	Bend	trans	-83.7	96.9	175.2	-58.6	167.7	0	0	0	107.9	K190 L276 L292 I294 M331 Q332 E333 I343 S345	K190-I335 WeakPolarHBondContact CE-O 3.48Å; K190-I335 HydrophobicContact CG-CB 4.44Å; K190-I335 HydrophobicContact CG-CG2 3.93Å; L276-I335 HydrophobicContact CD1-CG1 3.65Å; L276-I335 HydrophobicContact CD2-CG1 4.4Å; L292-I335 HydrophobicContact CD2-CD1 4.03Å; L292-I335 HydrophobicContact CD2-CG1 4.15Å; I294-I335 HydrophobicContact CD1-CD1 4.18Å; M331-I335 HydrophobicContact SD-CD1 3.69Å; Q332-I335 WeakPolarHBondContact O-CB 3.39Å; Q332-I335 PolarHBondContact O-N 2.91Å; E333-I335 VanDerWaalsContact C-N 3.32Å; I335-I343 HydrophobicContact CG2-CG2 4.11Å; I335-I343 WeakPolarHBondContact CG2-O 3.26Å; I335-S345 VanDerWaalsContact CG2-CB 3.48Å
336	T	93.1	Very high	93.4	Very high	32 Å²	32	32.7 Å²	32.7	20%	0.196	17%	0.172	C	C	.	.	S	Bend	trans	-160.4	168.2	-179.4	-170.8	0	0	0	0	111.5	P160 R334 I343	P160-T336 HydrophobicContact CB-CG2 4.24Å; P160-T336 HydrophobicContact CG-CG2 3.73Å; R334-T336 PolarHBondContact O-N 3.41Å; T336-I343 PolarHBondContact O-N 3.35Å
337	T	92.6	Very high	93.4	Very high	23 Å²	23	28.2 Å²	28.2	14%	0.141	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-83.8	126.7	169.9	-60.9	0	0	0	0	110.7	S166 K187 G188 S342	S166-T337 PolarHBondContact N-O 3.24Å; K187-T337 PolarHBondContact O-OG1 2.97Å; G188-T337 VanDerWaalsContact CA-OG1 3.26Å; G188-T337 WeakPolarHBondContact CA-OG1 3Å; T337-S342 WeakPolarHBondContact OG1-CB 3.47Å
338	T	92.8	Very high	93.2	Very high	11 Å²	11	25.5 Å²	25.5	7%	0.067	13%	0.131	C	C	.	.	B	Isolated β-bridge	trans	-106.3	173.6	170.9	68.4	0	0	0	0	110.2	P160 D164 K340 G341	P160-T338 HydrophobicContact CB-CG2 4.06Å; P160-T338 HydrophobicContact CG-CG2 3.98Å; D164-T338 CarbonylContact O-C 3.59Å; D164-T338 VanDerWaalsContact O-CA 3.24Å; D164-T338 WeakPolarHBondContact O-CA 3.41Å; T338-K340 PolarHBondContact O-N 3.25Å; T338-K340 VanDerWaalsContact O-N 3.16Å; T338-K340 PolarHBondContact OG1-N 3.28Å; T338-G341 PolarHBondContact N-O 2.72Å; T338-G341 PolarHBondContact OG1-N 3.44Å; T338-G341 PolarHBondContact OG1-O 3.28Å
339	K	89.5	Confident	92.9	Very high	151 Å²	151	25.8 Å²	25.8	66%	0.657	13%	0.132	S	C	*	.	S	Bend	trans	-60.7	-18.5	171.5	-66.1	174.4	-172.9	161.5	0	114.8	T163 D164	T163-K339 WeakPolarHBondContact O-CE 3.38Å; T163-K339 PolarHBondContact O-NZ 2.97Å; D164-K339 PolarHBondContact O-N 3.48Å
340	K	90.3	Very high	92.4	Very high	130 Å²	130	30.8 Å²	30.8	57%	0.565	15%	0.148	S	C	*	.	S	Bend	trans	-95.7	-34.2	-176	-66.7	-177.1	174.8	-178.7	0	113.1	D284 G287 T338	D284-K340 VanDerWaalsContact O-CD 3.25Å; D284-K340 WeakPolarHBondContact O-CD 3.44Å; D284-K340 PolarHBondContact O-NZ 2.95Å; G287-K340 CarbonylContact C-O 3.54Å; G287-K340 WeakPolarHBondContact CA-O 3.47Å; T338-K340 PolarHBondContact O-N 3.25Å; T338-K340 VanDerWaalsContact O-N 3.16Å; T338-K340 PolarHBondContact OG1-N 3.28Å
341	G	91	Very high	91.8	Very high	7 Å²	7	28 Å²	28	7%	0.072	13%	0.131	C	C	.	.			trans	-179.4	177.6	-174.4	0	0	0	0	0	110.7	R283 T338	R283-G341 WeakPolarHBondContact CG-O 3.39Å; T338-G341 PolarHBondContact N-O 2.72Å; T338-G341 PolarHBondContact OG1-N 3.44Å; T338-G341 PolarHBondContact OG1-O 3.28Å
342	S	92.7	Very high	91.1	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-124.8	149.8	-177.1	66.8	0	0	0	0	112.7	K187 D289 V290 T337	K187-S342 WeakPolarHBondContact CE-OG 3.46Å; K187-S342 WeakPolarHBondContact CG-OG 3.44Å; D289-S342 WeakPolarHBondContact CA-O 3.48Å; D289-S342 VanDerWaalsContact CG-OG 3.31Å; D289-S342 WeakPolarHBondContact OD1-CB 3.43Å; D289-S342 PolarHBondContact OD1-N 2.98Å; D289-S342 PolarHBondContact OD1-OG 2.94Å; V290-S342 PolarHBondContact N-O 2.88Å; T337-S342 WeakPolarHBondContact OG1-CB 3.47Å
343	I	95	Very high	90.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	105.9	165.3	-62.8	166.3	0	0	0	107.1	G188 L276 A279 E280 R283 V290 L292 I335 T336	G188-I343 CarbonylContact C-O 3.52Å; G188-I343 VanDerWaalsContact CA-O 3.29Å; G188-I343 WeakPolarHBondContact CA-O 3.32Å; L276-I343 HydrophobicContact CD1-CD1 4.27Å; A279-I343 HydrophobicContact CB-CD1 4.08Å; A279-I343 HydrophobicContact CB-CG1 4.33Å; A279-I343 HydrophobicContact CB-CG2 4.35Å; E280-I343 HydrophobicContact CG-CD1 3.82Å; R283-I343 HydrophobicContact CB-CD1 4.12Å; R283-I343 HydrophobicContact CB-CG1 3.95Å; R283-I343 HydrophobicContact CG-CG1 4.25Å; V290-I343 HydrophobicContact CB-CG1 4.34Å; V290-I343 CarbonylContact O-C 3.59Å; V290-I343 WeakPolarHBondContact O-CA 3.36Å; L292-I343 HydrophobicContact CB-CG2 3.73Å; L292-I343 HydrophobicContact CD2-CG2 4.27Å; I335-I343 HydrophobicContact CG2-CG2 4.11Å; I335-I343 WeakPolarHBondContact CG2-O 3.26Å; T336-I343 PolarHBondContact O-N 3.35Å
344	T	94.6	Very high	89.3	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.018	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.1	172.1	-50	0	0	0	0	108	L172 G188 I191 V290 L291 L292	L172-T344 HydrophobicContact CD2-CG2 3.82Å; G188-T344 PolarHBondContact N-OG1 3.41Å; I191-T344 HydrophobicContact CD1-CG2 3.41Å; I191-T344 VanDerWaalsContact CD1-CG2 3.41Å; V290-T344 PolarHBondContact O-N 2.67Å; L291-T344 WeakPolarHBondContact CA-O 3.17Å; L291-T344 HydrophobicContact CD2-CG2 4.25Å; L292-T344 PolarHBondContact N-O 3.14Å
345	S	95.2	Very high	88.5	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	130.7	-176.2	-175.2	0	0	0	0	112.2	G189 I191 L292 I335 Q347	G189-S345 PolarHBondContact O-N 2.84Å; I191-S345 VanDerWaalsContact CD1-O 3.27Å; I191-S345 WeakPolarHBondContact CD1-O 3.34Å; I191-S345 PolarHBondContact N-O 3.26Å; L292-S345 CarbonylContact O-C 3.58Å; L292-S345 WeakPolarHBondContact O-CA 3.37Å; L292-S345 PolarHBondContact O-OG 3.11Å; I335-S345 VanDerWaalsContact CG2-CB 3.48Å; S345-Q347 VanDerWaalsContact OG-CG 3.23Å; S345-Q347 WeakPolarHBondContact OG-CG 3.34Å; S345-Q347 PolarHBondContact OG-NE2 2.87Å; S345-Q347 VanDerWaalsContact OG-NE2 3.11Å
346	V	93.9	Very high	87.6	Confident	4 Å²	4	45 Å²	45	2%	0.024	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	111.9	173.3	-176.5	0	0	0	0	108.3	I191 L193 L208 L292 F293 I294	I191-V346 HydrophobicContact CB-CG2 4.4Å; I191-V346 HydrophobicContact CD1-CG2 4.38Å; L193-V346 HydrophobicContact CD1-CG1 3.29Å; L193-V346 HydrophobicContact CD2-CG1 4.42Å; L193-V346 HydrophobicContact CG-CG1 3.58Å; L208-V346 HydrophobicContact CD1-CG1 4.35Å; L208-V346 HydrophobicContact CD1-CG2 4.44Å; L292-V346 PolarHBondContact O-N 2.76Å; F293-V346 VanDerWaalsContact CA-O 3.29Å; F293-V346 WeakPolarHBondContact CA-O 3.37Å; F293-V346 HydrophobicContact CD1-CB 3.68Å; F293-V346 HydrophobicContact CD1-CG1 4.08Å; F293-V346 HydrophobicContact CD1-CG2 4.4Å; F293-V346 HydrophobicContact CE1-CB 3.69Å; F293-V346 HydrophobicContact CE1-CG1 4.02Å; F293-V346 HydrophobicContact CE1-CG2 3.95Å; I294-V346 PolarHBondContact N-O 2.8Å
347	Q	93.6	Very high	87.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	120.3	-167.8	-53	-179.5	13.8	0	0	109.2	I191 G192 L193 I294 I297 S345	I191-Q347 PolarHBondContact O-N 3.39Å; G192-Q347 CarbonylContact C-O 3.57Å; G192-Q347 WeakPolarHBondContact CA-O 3.43Å; L193-Q347 PolarHBondContact N-O 3.42Å; I294-Q347 HydrophobicContact CB-CB 4.44Å; I294-Q347 HydrophobicContact CB-CG 4.17Å; I294-Q347 HydrophobicContact CD1-CG 4.17Å; I294-Q347 HydrophobicContact CG1-CG 4.35Å; I294-Q347 CarbonylContact O-C 3.59Å; I294-Q347 WeakPolarHBondContact O-CA 3.29Å; I297-Q347 HydrophobicContact CB-CB 4.49Å; I297-Q347 HydrophobicContact CG2-CB 4.45Å; S345-Q347 VanDerWaalsContact OG-CG 3.23Å; S345-Q347 WeakPolarHBondContact OG-CG 3.34Å; S345-Q347 PolarHBondContact OG-NE2 2.87Å; S345-Q347 VanDerWaalsContact OG-NE2 3.11Å
348	A	89.3	Confident	87	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	129	170.6	0	0	0	0	0	109	L193 I294 D295 N296 I297	L193-A348 WeakPolarHBondContact O-CA 3.34Å; I294-A348 PolarHBondContact O-N 3.45Å; D295-A348 HydrophobicContact CB-CB 4.21Å; D295-A348 WeakPolarHBondContact OD1-CB 3.44Å; N296-A348 PolarHBondContact ND2-O 3.38Å; N296-A348 PolarHBondContact OD1-O 2.96Å; I297-A348 PolarHBondContact N-O 3.48Å; I297-A348 VanDerWaalsContact N-O 3.14Å
349	I	87.4	Confident	86.9	Confident	6 Å²	6	49.3 Å²	49.3	3%	0.031	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	116.7	-177.1	-55.4	178.7	0	0	0	108.8	L193 F194 I297 T364 L368	L193-I349 PolarHBondContact O-N 3.34Å; F194-I349 HydrophobicContact CD1-CB 4.01Å; F194-I349 HydrophobicContact CD1-CG2 4.21Å; F194-I349 HydrophobicContact CE1-CB 3.57Å; F194-I349 HydrophobicContact CE1-CD1 4Å; F194-I349 HydrophobicContact CE1-CG1 4.31Å; F194-I349 HydrophobicContact CE1-CG2 3.5Å; F194-I349 VanDerWaalsContact CE1-CG2 3.5Å; F194-I349 HydrophobicContact CE2-CD1 3.99Å; F194-I349 HydrophobicContact CZ-CB 3.89Å; F194-I349 HydrophobicContact CZ-CD1 3.39Å; F194-I349 HydrophobicContact CZ-CG1 4.12Å; F194-I349 HydrophobicContact CZ-CG2 4.05Å; I297-I349 HydrophobicContact CG2-CB 4.39Å; I297-I349 HydrophobicContact CG2-CD1 4.43Å; I297-I349 HydrophobicContact CG2-CG1 3.63Å; I349-T364 HydrophobicContact CD1-CG2 3.73Å; I349-T364 HydrophobicContact CG1-CG2 4.46Å; I349-L368 HydrophobicContact CD1-CD1 3.52Å; I349-L368 HydrophobicContact CD1-CD2 4.33Å; I349-L368 HydrophobicContact CD1-CG 4.47Å
350	Y	83.9	Confident	86.9	Confident	119 Å²	119	42.2 Å²	42.2	47%	0.467	23%	0.234	S	C	.	.			trans	-86.5	122.9	167.6	177.9	-100.9	0	0	0	109.6	N296 F298 P352	N296-Y350 PolarHBondContact OD1-N 3.46Å; F298-Y350 AromaticContact CD1-CD1 3.65Å; F298-Y350 HydrophobicContact CD1-CD1 3.65Å; F298-Y350 HydrophobicContact CD1-CG 4.39Å; F298-Y350 AromaticContact CE1-CD1 3.78Å; F298-Y350 HydrophobicContact CE1-CD1 3.78Å; F298-Y350 HydrophobicContact CE1-CE1 4.24Å; F298-Y350 HydrophobicContact CG-CD1 4.06Å; F298-Y350 HydrophobicContact CZ-CD1 4.3Å; Y350-P352 HydrophobicContact CE1-CB 4.14Å
351	V	79.8	Confident	86.7	Confident	18 Å²	18	36 Å²	36	11%	0.109	21%	0.207	C	C	.	.			trans	-94.7	111.9	174.2	-174.8	0	0	0	0	107.8	F194 A353 D354 D355 L356 P361	F194-V351 HydrophobicContact CD1-CG2 3.76Å; F194-V351 HydrophobicContact CE1-CG2 3.93Å; V351-A353 PolarHBondContact O-N 3.01Å; V351-D354 PolarHBondContact O-N 2.99Å; V351-D355 VanDerWaalsContact CG1-C 3.46Å; V351-D355 WeakPolarHBondContact CG1-O 3.47Å; V351-L356 HydrophobicContact CG1-CD2 3.95Å; V351-L356 HydrophobicContact CG2-CD2 3.9Å; V351-P361 HydrophobicContact CG1-CG 4.35Å
352	P	78.3	Confident	86.6	Confident	22 Å²	22	37.8 Å²	37.8	14%	0.143	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-65.5	129	-179.7	27.5	-32.9	0	0	0	110.2	F298 Y350 D354 D355 D358	F298-P352 HydrophobicContact CE2-CB 4.34Å; F298-P352 HydrophobicContact CE2-CG 3.89Å; F298-P352 HydrophobicContact CZ-CB 4.26Å; F298-P352 HydrophobicContact CZ-CG 4.29Å; Y350-P352 HydrophobicContact CE1-CB 4.14Å; P352-D354 PolarHBondContact O-N 3.43Å; P352-D355 PolarHBondContact O-N 3.3Å; P352-D358 HydrophobicContact CG-CB 3.88Å
353	A	79	Confident	86.5	Confident	94 Å²	94	39.3 Å²	39.3	78%	0.777	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	53.3	26.3	179.6	0	0	0	0	0	114.5	V351 D355	V351-A353 PolarHBondContact O-N 3.01Å; A353-D355 PolarHBondContact O-N 3.37Å; A353-D355 VanDerWaalsContact O-N 3.14Å
354	D	73.1	Confident	86.3	Confident	149 Å²	149	39.4 Å²	39.4	80%	0.797	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	55.7	23	-174.9	-56.4	-46.5	0	0	0	113.9	V351 P352	V351-D354 PolarHBondContact O-N 2.99Å; P352-D354 PolarHBondContact O-N 3.43Å
355	D	77.7	Confident	85.9	Confident	73 Å²	73	42.4 Å²	42.4	39%	0.39	24%	0.244	S	C	.	.			trans	-94.7	101.9	177.7	-173.8	3.5	0	0	0	111.9	V351 P352 A353 T357 D358	V351-D355 VanDerWaalsContact CG1-C 3.46Å; V351-D355 WeakPolarHBondContact CG1-O 3.47Å; P352-D355 PolarHBondContact O-N 3.3Å; A353-D355 PolarHBondContact O-N 3.37Å; A353-D355 VanDerWaalsContact O-N 3.14Å; D355-T357 VanDerWaalsContact CG-OG1 3.31Å; D355-T357 PolarHBondContact O-N 3.41Å; D355-T357 WeakPolarHBondContact OD1-CA 3.36Å; D355-T357 VanDerWaalsContact OD1-CB 3.32Å; D355-T357 WeakPolarHBondContact OD1-CB 3.41Å; D355-T357 PolarHBondContact OD1-N 3.26Å; D355-T357 PolarHBondContact OD1-OG1 2.93Å; D355-T357 PolarHBondContact OD2-OG1 3.37Å; D355-D358 WeakPolarHBondContact O-CB 3.29Å; D355-D358 PolarHBondContact O-N 3.32Å
356	L	76.9	Confident	85.7	Confident	101 Å²	101	46.5 Å²	46.5	53%	0.529	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-13.4	176.3	-62.1	175.3	0	0	0	113.5	V351 D358 F365	V351-L356 HydrophobicContact CG1-CD2 3.95Å; V351-L356 HydrophobicContact CG2-CD2 3.9Å; L356-D358 VanDerWaalsContact C-N 3.34Å; L356-F365 HydrophobicContact CB-CE2 4.42Å; L356-F365 HydrophobicContact CD2-CE2 3.85Å; L356-F365 HydrophobicContact CD2-CZ 3.68Å
357	T	85.1	Confident	85.7	Confident	114 Å²	114	48.2 Å²	48.2	70%	0.699	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-5.6	178.8	75.5	0	0	0	0	113.1	D355	D355-T357 VanDerWaalsContact CG-OG1 3.31Å; D355-T357 PolarHBondContact O-N 3.41Å; D355-T357 WeakPolarHBondContact OD1-CA 3.36Å; D355-T357 VanDerWaalsContact OD1-CB 3.32Å; D355-T357 WeakPolarHBondContact OD1-CB 3.41Å; D355-T357 PolarHBondContact OD1-N 3.26Å; D355-T357 PolarHBondContact OD1-OG1 2.93Å; D355-T357 PolarHBondContact OD2-OG1 3.37Å
358	D	88.6	Confident	85.7	Confident	14 Å²	14	49.4 Å²	49.4	8%	0.075	29%	0.291	C	S	.	.	S	Bend	trans	-56.9	136.7	171.5	-179.3	-74.3	0	0	0	110.2	Y320 P352 D355 L356 A360 P361 A362	Y320-D358 VanDerWaalsContact CE2-OD1 3.23Å; Y320-D358 WeakPolarHBondContact CE2-OD1 3.34Å; Y320-D358 WeakPolarHBondContact CE2-OD2 3.45Å; Y320-D358 VanDerWaalsContact CZ-OD1 3.27Å; Y320-D358 VanDerWaalsContact OH-CG 3.28Å; Y320-D358 PolarHBondContact OH-OD1 2.89Å; Y320-D358 PolarHBondContact OH-OD2 3.48Å; Y320-D358 VanDerWaalsContact OH-OD2 3.04Å; P352-D358 HydrophobicContact CG-CB 3.88Å; D355-D358 WeakPolarHBondContact O-CB 3.29Å; D355-D358 PolarHBondContact O-N 3.32Å; L356-D358 VanDerWaalsContact C-N 3.34Å; D358-A360 PolarHBondContact O-N 2.77Å; D358-A360 VanDerWaalsContact O-N 3.13Å; D358-A360 WeakPolarHBondContact OD1-CB 3.4Å; D358-A360 PolarHBondContact OD1-N 2.89Å; D358-P361 HydrophobicContact CB-CG 4.25Å; D358-P361 WeakPolarHBondContact O-CD 3.42Å; D358-P361 WeakPolarHBondContact OD1-CD 3.34Å; D358-A362 VanDerWaalsContact O-CB 3.23Å; D358-A362 WeakPolarHBondContact O-CB 3.37Å; D358-A362 PolarHBondContact O-N 2.75Å
359	P	89.9	Confident	85.8	Confident	30 Å²	30	51.3 Å²	51.3	20%	0.195	30%	0.301	C	S	.	.	H	α-helix	trans	-54.5	-31.9	-177.3	-28.7	34.4	0	0	0	115.2	A317 V318 Y320 L324 T363	A317-P359 HydrophobicContact CB-CG 4.11Å; V318-P359 HydrophobicContact CG2-CG 4.08Å; Y320-P359 HydrophobicContact CD2-CB 3.9Å; Y320-P359 HydrophobicContact CD2-CG 3.97Å; Y320-P359 HydrophobicContact CE2-CB 4.22Å; Y320-P359 HydrophobicContact CE2-CG 4.21Å; L324-P359 HydrophobicContact CD2-CB 3.94Å; P359-T363 VanDerWaalsContact O-CB 3.28Å; P359-T363 WeakPolarHBondContact O-CB 3.3Å; P359-T363 PolarHBondContact O-N 2.88Å; P359-T363 PolarHBondContact O-OG1 3.49Å
360	A	89.1	Confident	86.1	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-71.5	-54.6	-176.9	0	0	0	0	0	112.4	F298 T301 Y320 D358 T364	F298-A360 HydrophobicContact CD2-CB 4.06Å; F298-A360 HydrophobicContact CE2-CB 4.09Å; T301-A360 HydrophobicContact CG2-CB 3.63Å; Y320-A360 HydrophobicContact CD1-CB 4.48Å; Y320-A360 HydrophobicContact CE1-CB 3.77Å; Y320-A360 HydrophobicContact CE2-CB 4.37Å; D358-A360 PolarHBondContact O-N 2.77Å; D358-A360 VanDerWaalsContact O-N 3.13Å; D358-A360 WeakPolarHBondContact OD1-CB 3.4Å; D358-A360 PolarHBondContact OD1-N 2.89Å; A360-T364 PolarHBondContact O-N 3.22Å; A360-T364 VanDerWaalsContact O-N 3.13Å; A360-T364 PolarHBondContact O-OG1 3.12Å
361	P	87	Confident	86.5	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-57	-47	167.8	-24.5	32.4	0	0	0	112.7	V351 D358 T363 T364 F365	V351-P361 HydrophobicContact CG1-CG 4.35Å; D358-P361 HydrophobicContact CB-CG 4.25Å; D358-P361 WeakPolarHBondContact O-CD 3.42Å; D358-P361 WeakPolarHBondContact OD1-CD 3.34Å; P361-T363 VanDerWaalsContact C-N 3.32Å; P361-T363 PolarHBondContact O-N 2.92Å; P361-T364 CarbonylContact O-C 3.55Å; P361-T364 WeakPolarHBondContact O-CA 3.43Å; P361-T364 WeakPolarHBondContact O-CB 3.22Å; P361-T364 PolarHBondContact O-N 3.37Å; P361-F365 VanDerWaalsContact C-CD2 3.41Å; P361-F365 HydrophobicContact CB-CD2 4.16Å; P361-F365 HydrophobicContact CB-CE2 3.68Å; P361-F365 HydrophobicContact CB-CZ 4.49Å; P361-F365 WeakPolarHBondContact O-CD2 3.22Å; P361-F365 WeakPolarHBondContact O-CG 3.17Å; P361-F365 PolarHBondContact O-N 3.44Å
362	A	88.1	Confident	87.2	Confident	44 Å²	44	45.5 Å²	45.5	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-56.6	-43.1	-177.6	0	0	0	0	0	113	D358	D358-A362 VanDerWaalsContact O-CB 3.23Å; D358-A362 WeakPolarHBondContact O-CB 3.37Å; D358-A362 PolarHBondContact O-N 2.75Å
363	T	91.1	Very high	87.9	Confident	31 Å²	31	46.1 Å²	46.1	19%	0.19	28%	0.283	C	S	.	.	H	α-helix	trans	-68.6	-39.9	176.2	-54.9	0	0	0	0	111.2	A325 M328 P359 P361 A366 H367	A325-T363 HydrophobicContact CB-CG2 4.27Å; M328-T363 HydrophobicContact CB-CG2 4.08Å; M328-T363 HydrophobicContact CG-CG2 4.17Å; P359-T363 VanDerWaalsContact O-CB 3.28Å; P359-T363 WeakPolarHBondContact O-CB 3.3Å; P359-T363 PolarHBondContact O-N 2.88Å; P359-T363 PolarHBondContact O-OG1 3.49Å; P361-T363 VanDerWaalsContact C-N 3.32Å; P361-T363 PolarHBondContact O-N 2.92Å; T363-A366 PolarHBondContact O-N 2.84Å; T363-H367 PolarHBondContact O-CD2 3.24Å; T363-H367 VanDerWaalsContact O-CD2 3.27Å
364	T	90.1	Very high	88.4	Confident	2 Å²	2	42 Å²	42	1%	0.012	25%	0.247	C	C	.	.	H	α-helix	trans	-64.8	-42.4	178.8	-52.1	0	0	0	0	111	I297 I349 A360 P361 A366 H367 L368	I297-T364 HydrophobicContact CG1-CG2 4.48Å; I297-T364 HydrophobicContact CG2-CG2 4.13Å; I349-T364 HydrophobicContact CD1-CG2 3.73Å; I349-T364 HydrophobicContact CG1-CG2 4.46Å; A360-T364 PolarHBondContact O-N 3.22Å; A360-T364 VanDerWaalsContact O-N 3.13Å; A360-T364 PolarHBondContact O-OG1 3.12Å; P361-T364 CarbonylContact O-C 3.55Å; P361-T364 WeakPolarHBondContact O-CA 3.43Å; P361-T364 WeakPolarHBondContact O-CB 3.22Å; P361-T364 PolarHBondContact O-N 3.37Å; T364-A366 PolarHBondContact O-N 3.18Å; T364-H367 PolarHBondContact O-N 3.27Å; T364-L368 HydrophobicContact CG2-CD2 4.43Å
365	F	87.5	Confident	89.2	Confident	66 Å²	66	36.2 Å²	36.2	29%	0.289	22%	0.218	S	C	.	.	H	α-helix	trans	-56.1	-35.6	179.3	-77.5	-56.5	0	0	0	113.5	F194 L356 P361 H367 L368 T371	F194-F365 HydrophobicContact CD1-CZ 4.5Å; F194-F365 AromaticContact CE1-CE1 3.62Å; F194-F365 HydrophobicContact CE1-CE1 3.62Å; F194-F365 AromaticContact CE1-CZ 3.43Å; F194-F365 HydrophobicContact CE1-CZ 3.43Å; F194-F365 VanDerWaalsContact CE1-CZ 3.43Å; F194-F365 AromaticContact CE2-CE1 3.82Å; F194-F365 HydrophobicContact CE2-CE1 3.82Å; F194-F365 HydrophobicContact CE2-CZ 4.45Å; F194-F365 HydrophobicContact CZ-CD1 4.02Å; F194-F365 AromaticContact CZ-CE1 3.05Å; F194-F365 HydrophobicContact CZ-CE1 3.05Å; F194-F365 AromaticContact CZ-CZ 3.43Å; F194-F365 HydrophobicContact CZ-CZ 3.43Å; F194-F365 VanDerWaalsContact CZ-CZ 3.43Å; L356-F365 HydrophobicContact CB-CE2 4.42Å; L356-F365 HydrophobicContact CD2-CE2 3.85Å; L356-F365 HydrophobicContact CD2-CZ 3.68Å; P361-F365 VanDerWaalsContact C-CD2 3.41Å; P361-F365 HydrophobicContact CB-CD2 4.16Å; P361-F365 HydrophobicContact CB-CE2 3.68Å; P361-F365 HydrophobicContact CB-CZ 4.49Å; P361-F365 WeakPolarHBondContact O-CD2 3.22Å; P361-F365 WeakPolarHBondContact O-CG 3.17Å; P361-F365 PolarHBondContact O-N 3.44Å; F365-H367 PolarHBondContact O-N 3.43Å; F365-H367 VanDerWaalsContact O-N 3.12Å; F365-L368 HydrophobicContact CD1-CD1 3.9Å; F365-L368 HydrophobicContact CE1-CD1 4.38Å; F365-L368 PolarHBondContact O-N 2.86Å; F365-L368 VanDerWaalsContact O-N 3.16Å; F365-T371 HydrophobicContact CD1-CG2 4.43Å; F365-T371 HydrophobicContact CE1-CG2 4.35Å
366	A	91.2	Very high	89.7	Confident	87 Å²	87	39.9 Å²	39.9	72%	0.719	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.6	179	0	0	0	0	0	113.3	T363 T364	T363-A366 PolarHBondContact O-N 2.84Å; T364-A366 PolarHBondContact O-N 3.18Å
367	H	92.8	Very high	90.3	Very high	40 Å²	40	37.9 Å²	37.9	19%	0.185	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-9.1	178.9	-61.2	-79.2	0	0	0	113.7	K190 Q332 E333 T363 T364 F365	K190-H367 WeakPolarHBondContact CB-O 3.24Å; K190-H367 HydrophobicContact CD-CB 4.16Å; K190-H367 WeakPolarHBondContact CD-O 3.3Å; Q332-H367 HydrophobicContact CB-CB 4.15Å; Q332-H367 HydrophobicContact CG-CB 4.11Å; E333-H367 IonicContact OE1-CE1 3.96Å; E333-H367 IonicContact OE1-ND1 3.77Å; E333-H367 PolarHBondContact OE1-ND1 3.42Å; T363-H367 PolarHBondContact O-CD2 3.24Å; T363-H367 VanDerWaalsContact O-CD2 3.27Å; T364-H367 PolarHBondContact O-N 3.27Å; F365-H367 PolarHBondContact O-N 3.43Å; F365-H367 VanDerWaalsContact O-N 3.12Å
368	L	92.9	Very high	90.6	Very high	24 Å²	24	33.1 Å²	33.1	13%	0.126	20%	0.195	C	C	.	.			trans	-82.9	135.6	-175.3	-59.2	177.2	0	0	0	111.9	K190 F194 I349 T364 F365 T371	K190-L368 HydrophobicContact CB-CD2 4.17Å; K190-L368 CarbonylContact O-C 3.23Å; F194-L368 HydrophobicContact CE2-CD1 4.27Å; F194-L368 HydrophobicContact CZ-CD1 4.16Å; I349-L368 HydrophobicContact CD1-CD1 3.52Å; I349-L368 HydrophobicContact CD1-CD2 4.33Å; I349-L368 HydrophobicContact CD1-CG 4.47Å; T364-L368 HydrophobicContact CG2-CD2 4.43Å; F365-L368 HydrophobicContact CD1-CD1 3.9Å; F365-L368 HydrophobicContact CE1-CD1 4.38Å; F365-L368 PolarHBondContact O-N 2.86Å; F365-L368 VanDerWaalsContact O-N 3.16Å; L368-T371 HydrophobicContact CD1-CG2 4.01Å
369	D	92.6	Very high	90.7	Very high	41 Å²	41	33.1 Å²	33.1	22%	0.219	20%	0.197	C	C	.	.	S	Bend	trans	-88.4	-33.2	172	-63.5	-67.4	0	0	0	111.9	G189 K190 R395	G189-D369 WeakPolarHBondContact CA-OD2 3.45Å; K190-D369 PolarHBondContact N-OD2 3.43Å; K190-D369 PolarHBondContact O-N 3.24Å; D369-R395 VanDerWaalsContact O-CB 3.3Å; D369-R395 WeakPolarHBondContact O-CB 3.35Å; D369-R395 PolarHBondContact O-N 3.25Å
370	A	93.6	Very high	90.8	Very high	2 Å²	2	38.8 Å²	38.8	2%	0.017	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	147.5	176.4	0	0	0	0	0	111.4	Y185 K190 I191 G192 T393	Y185-A370 HydrophobicContact CD1-CB 4.05Å; Y185-A370 HydrophobicContact CE1-CB 4.34Å; K190-A370 PolarHBondContact O-N 3.46Å; I191-A370 CarbonylContact C-O 3.58Å; I191-A370 WeakPolarHBondContact CA-O 3.45Å; I191-A370 HydrophobicContact CG1-CB 4.26Å; G192-A370 PolarHBondContact N-O 3.05Å; A370-T393 CarbonylContact C-O 3.59Å; A370-T393 WeakPolarHBondContact CA-O 3.3Å
371	T	93.2	Very high	90.8	Very high	20 Å²	20	43.9 Å²	43.9	12%	0.123	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	127.9	172.7	62.3	0	0	0	0	109	G192 F194 F365 L368 S392 T393	G192-T371 WeakPolarHBondContact O-CA 3.36Å; F194-T371 HydrophobicContact CE2-CG2 3.87Å; F365-T371 HydrophobicContact CD1-CG2 4.43Å; F365-T371 HydrophobicContact CE1-CG2 4.35Å; L368-T371 HydrophobicContact CD1-CG2 4.01Å; T371-S392 CarbonylContact O-C 3.6Å; T371-S392 VanDerWaalsContact O-CA 3.27Å; T371-S392 WeakPolarHBondContact O-CA 3.44Å; T371-S392 WeakPolarHBondContact O-CB 3.27Å; T371-T393 PolarHBondContact N-O 3.49Å; T371-T393 PolarHBondContact O-N 2.8Å; T371-T393 WeakPolarHBondContact OG1-CG2 3.48Å; T371-T393 PolarHBondContact OG1-N 3.07Å
372	T	94	Very high	91	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	111.6	175.4	-60.2	0	0	0	0	107.4	Y185 G192 L193 F194 V387	Y185-T372 WeakPolarHBondContact CE1-OG1 3.31Å; Y185-T372 PolarHBondContact OH-OG1 2.87Å; G192-T372 PolarHBondContact O-N 2.71Å; L193-T372 WeakPolarHBondContact CA-O 3.29Å; L193-T372 HydrophobicContact CD2-CG2 4.01Å; F194-T372 PolarHBondContact N-O 2.66Å; T372-V387 HydrophobicContact CG2-CB 4.47Å; T372-V387 HydrophobicContact CG2-CG1 3.86Å; T372-V387 HydrophobicContact CG2-CG2 3.79Å
373	V	91.9	Very high	91.3	Very high	35 Å²	35	43.2 Å²	43.2	21%	0.212	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122.3	-176.9	-177.2	0	0	0	0	108.9	F194 V387 D388 D391 S392	F194-V373 HydrophobicContact CB-CB 4.45Å; F194-V373 HydrophobicContact CB-CG1 4.35Å; F194-V373 HydrophobicContact CB-CG2 4.21Å; F194-V373 HydrophobicContact CD2-CG2 4.29Å; F194-V373 HydrophobicContact CG-CG2 4.48Å; V373-V387 CarbonylContact O-C 3.57Å; V373-V387 WeakPolarHBondContact O-CA 3.34Å; V373-D388 HydrophobicContact CB-CB 4.43Å; V373-D388 PolarHBondContact O-N 3.43Å; V373-D391 HydrophobicContact CB-CB 4.22Å; V373-D391 HydrophobicContact CG1-CB 4.4Å; V373-D391 HydrophobicContact CG2-CB 4.18Å; V373-S392 PolarHBondContact N-OG 2.71Å
374	L	90.9	Very high	91.3	Very high	7 Å²	7	46.2 Å²	46.2	4%	0.037	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	115	175.3	-65	158.1	0	0	0	109.7	F194 V199 K201 L204 A386 V387	F194-L374 WeakPolarHBondContact O-CA 3.42Å; F194-L374 VanDerWaalsContact O-CB 3.29Å; F194-L374 WeakPolarHBondContact O-CB 3.21Å; F194-L374 PolarHBondContact O-N 3.38Å; V199-L374 HydrophobicContact CB-CB 4.04Å; V199-L374 HydrophobicContact CG2-CB 3.46Å; V199-L374 VanDerWaalsContact CG2-CB 3.46Å; V199-L374 HydrophobicContact CG2-CD1 4.14Å; V199-L374 HydrophobicContact CG2-CG 4.38Å; K201-L374 HydrophobicContact CB-CD1 4.28Å; K201-L374 HydrophobicContact CD-CD1 4.47Å; K201-L374 HydrophobicContact CG-CD1 3.4Å; L204-L374 HydrophobicContact CD2-CD1 4.23Å; L204-L374 HydrophobicContact CD2-CD2 4.2Å; L374-A386 CarbonylContact C-O 3.55Å; L374-A386 WeakPolarHBondContact CA-O 3.18Å; L374-A386 HydrophobicContact CD2-CB 4.39Å; L374-V387 HydrophobicContact CD2-CG2 3.73Å
375	S	88.3	Confident	91.6	Very high	27 Å²	27	46.6 Å²	46.6	19%	0.189	25%	0.253	C	S	.	.			trans	-99.2	134.3	-173.2	178.5	0	0	0	0	111.9	A377 I378 A379 A386	S375-A377 VanDerWaalsContact C-N 3.32Å; S375-A377 PolarHBondContact O-N 2.87Å; S375-A377 PolarHBondContact OG-N 3.02Å; S375-I378 PolarHBondContact O-N 3.27Å; S375-A379 PolarHBondContact O-N 3.13Å; S375-A386 PolarHBondContact N-O 3Å
376	R	88.9	Confident	91.9	Very high	151 Å²	151	43.4 Å²	43.4	57%	0.57	24%	0.239	S	C	*	.	H	α-helix	trans	-63.7	-38.9	173.8	-177.7	179.3	-67.6	154.7	1.6	111.7	V199 I378 A379 E380	V199-R376 HydrophobicContact CG1-CB 4.3Å; R376-I378 PolarHBondContact O-N 3.21Å; R376-A379 WeakPolarHBondContact O-CB 3.33Å; R376-A379 PolarHBondContact O-N 3.47Å; R376-A379 VanDerWaalsContact O-N 3.12Å; R376-E380 WeakPolarHBondContact CD-OE1 3.24Å; R376-E380 HydrophobicContact CG-CG 4.22Å; R376-E380 WeakPolarHBondContact CG-OE1 3.41Å; R376-E380 WeakPolarHBondContact O-CG 3.4Å; R376-E380 PolarHBondContact O-N 3.3Å
377	A	89.6	Confident	92	Very high	59 Å²	59	39.6 Å²	39.6	49%	0.488	21%	0.207	S	C	.	.	H	α-helix	trans	-60.5	-34.9	-179.5	0	0	0	0	0	111.8	S375 L381	S375-A377 VanDerWaalsContact C-N 3.32Å; S375-A377 PolarHBondContact O-N 2.87Å; S375-A377 PolarHBondContact OG-N 3.02Å; A377-L381 WeakPolarHBondContact O-CG 3.49Å; A377-L381 PolarHBondContact O-N 3.43Å
378	I	91.4	Very high	92.1	Very high	14 Å²	14	38.5 Å²	38.5	7%	0.072	20%	0.202	C	C	.	.	H	α-helix	trans	-73.5	-40.7	176.5	-62	179.6	0	0	0	110.9	S375 R376 E380 L381 I383 A386 V387 D388	S375-I378 PolarHBondContact O-N 3.27Å; R376-I378 PolarHBondContact O-N 3.21Å; I378-E380 VanDerWaalsContact C-N 3.32Å; I378-E380 PolarHBondContact O-N 2.82Å; I378-L381 WeakPolarHBondContact O-CB 3.29Å; I378-L381 PolarHBondContact O-N 3.29Å; I378-I383 HydrophobicContact CG2-CB 3.71Å; I378-I383 HydrophobicContact CG2-CG2 3.79Å; I378-I383 PolarHBondContact O-N 3.43Å; I378-A386 HydrophobicContact CB-CB 4.47Å; I378-A386 HydrophobicContact CG2-CB 4.35Å; I378-V387 VanDerWaalsContact CD1-O 3.31Å; I378-V387 WeakPolarHBondContact CD1-O 3.36Å; I378-D388 VanDerWaalsContact CD1-CA 3.46Å; I378-D388 HydrophobicContact CD1-CB 3.99Å
379	A	90.7	Very high	92.1	Very high	13 Å²	13	38 Å²	38	11%	0.107	20%	0.2	C	C	.	.	H	α-helix	trans	-62.2	-37.8	175.2	0	0	0	0	0	112.6	S375 R376 L381 G382 Y384 A386	S375-A379 PolarHBondContact O-N 3.13Å; R376-A379 WeakPolarHBondContact O-CB 3.33Å; R376-A379 PolarHBondContact O-N 3.47Å; R376-A379 VanDerWaalsContact O-N 3.12Å; A379-L381 PolarHBondContact O-N 2.92Å; A379-G382 WeakPolarHBondContact O-CA 3.37Å; A379-G382 PolarHBondContact O-N 3.39Å; A379-Y384 HydrophobicContact CB-CE1 4.27Å; A379-A386 HydrophobicContact CB-CB 3.82Å
380	E	91.3	Very high	92.2	Very high	149 Å²	149	38.1 Å²	38.1	70%	0.696	20%	0.201	S	C	*	.	H	α-helix	trans	-65.4	-26.4	176.4	-74.4	172.7	-174.7	0	0	112.9	R376 I378 G382	R376-E380 WeakPolarHBondContact CD-OE1 3.24Å; R376-E380 HydrophobicContact CG-CG 4.22Å; R376-E380 WeakPolarHBondContact CG-OE1 3.41Å; R376-E380 WeakPolarHBondContact O-CG 3.4Å; R376-E380 PolarHBondContact O-N 3.3Å; I378-E380 VanDerWaalsContact C-N 3.32Å; I378-E380 PolarHBondContact O-N 2.82Å; E380-G382 PolarHBondContact O-N 3.17Å
381	L	90.4	Very high	92.1	Very high	109 Å²	109	42.4 Å²	42.4	57%	0.571	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-2.2	170.7	-63.2	171.9	0	0	0	113	A377 I378 A379 I383 Q450	A377-L381 WeakPolarHBondContact O-CG 3.49Å; A377-L381 PolarHBondContact O-N 3.43Å; I378-L381 WeakPolarHBondContact O-CB 3.29Å; I378-L381 PolarHBondContact O-N 3.29Å; A379-L381 PolarHBondContact O-N 2.92Å; L381-I383 VanDerWaalsContact C-N 3.3Å; L381-I383 HydrophobicContact CB-CD1 4.17Å; L381-I383 HydrophobicContact CB-CG1 4.16Å; L381-I383 HydrophobicContact CD1-CD1 4.49Å; L381-Q450 VanDerWaalsContact CD1-NE2 3.29Å
382	G	91.2	Very high	92.1	Very high	20 Å²	20	41.5 Å²	41.5	21%	0.206	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	12.9	-176.8	0	0	0	0	0	114.1	A379 E380 Y384 Y497	A379-G382 WeakPolarHBondContact O-CA 3.37Å; A379-G382 PolarHBondContact O-N 3.39Å; E380-G382 PolarHBondContact O-N 3.17Å; G382-Y384 WeakPolarHBondContact O-CD2 3.28Å; G382-Y497 WeakPolarHBondContact O-CE2 3.44Å; G382-Y497 PolarHBondContact O-OH 2.9Å; G382-Y497 VanDerWaalsContact O-OH 3.07Å
383	I	92.9	Very high	92.1	Very high	11 Å²	11	45.6 Å²	45.6	6%	0.056	24%	0.243	C	C	.	.			trans	-87.7	115.4	-177.5	-61.4	177.1	0	0	0	108.9	I378 L381 A386 Q450	I378-I383 HydrophobicContact CG2-CB 3.71Å; I378-I383 HydrophobicContact CG2-CG2 3.79Å; I378-I383 PolarHBondContact O-N 3.43Å; L381-I383 VanDerWaalsContact C-N 3.3Å; L381-I383 HydrophobicContact CB-CD1 4.17Å; L381-I383 HydrophobicContact CB-CG1 4.16Å; L381-I383 HydrophobicContact CD1-CD1 4.49Å; I383-A386 WeakPolarHBondContact O-CA 3.29Å; I383-Q450 HydrophobicContact CD1-CB 4.5Å; I383-Q450 HydrophobicContact CD1-CG 3.68Å
384	Y	92.8	Very high	92.2	Very high	94 Å²	94	44.4 Å²	44.4	37%	0.369	24%	0.236	S	C	.	.	S	Bend	trans	-123.2	135.8	177.1	-68.8	-80	0	0	0	111	A379 G382 S454 Q455	A379-Y384 HydrophobicContact CB-CE1 4.27Å; G382-Y384 WeakPolarHBondContact O-CD2 3.28Å; Y384-S454 CarbonylContact O-C 3.47Å; Y384-S454 VanDerWaalsContact O-CA 3.24Å; Y384-S454 WeakPolarHBondContact O-CA 3.44Å; Y384-S454 WeakPolarHBondContact O-CB 3.46Å; Y384-Q455 PolarHBondContact O-N 2.92Å
385	P	94.6	Very high	92.2	Very high	9 Å²	9	52.9 Å²	52.9	6%	0.058	27%	0.268	C	S	.	.	S	Bend	cis	-67.7	147.3	-3	31.4	-37.2	0	0	0	112.5	I176 V178 L204 V387 F457	I176-P385 HydrophobicContact CG2-CG 4.07Å; V178-P385 HydrophobicContact CG1-CG 3.76Å; L204-P385 HydrophobicContact CD1-CB 4.35Å; P385-V387 HydrophobicContact CB-CG2 4.15Å; P385-V387 HydrophobicContact CG-CG2 4.3Å; P385-V387 PolarHBondContact O-N 3.37Å; P385-F457 HydrophobicContact CB-CE2 3.93Å; P385-F457 HydrophobicContact CB-CZ 3.63Å; P385-F457 HydrophobicContact CG-CE1 4.24Å; P385-F457 HydrophobicContact CG-CE2 4.38Å; P385-F457 HydrophobicContact CG-CZ 3.62Å
386	A	93.9	Very high	92.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.259	C	S	.	.			trans	-79.8	39.7	-172.2	0	0	0	0	0	113.5	L374 S375 I378 A379 I383	L374-A386 CarbonylContact C-O 3.55Å; L374-A386 WeakPolarHBondContact CA-O 3.18Å; L374-A386 HydrophobicContact CD2-CB 4.39Å; S375-A386 PolarHBondContact N-O 3Å; I378-A386 HydrophobicContact CB-CB 4.47Å; I378-A386 HydrophobicContact CG2-CB 4.35Å; A379-A386 HydrophobicContact CB-CB 3.82Å; I383-A386 WeakPolarHBondContact O-CA 3.29Å
387	V	94.9	Very high	92.7	Very high	7 Å²	7	45.4 Å²	45.4	4%	0.042	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-76.1	129.8	-175.9	178.4	0	0	0	0	110	V178 T372 V373 L374 I378 P385 P389 S392	V178-V387 HydrophobicContact CG1-CB 3.88Å; V178-V387 HydrophobicContact CG1-CG1 4.38Å; V178-V387 HydrophobicContact CG1-CG2 3.89Å; V178-V387 HydrophobicContact CG2-CB 3.79Å; V178-V387 HydrophobicContact CG2-CG1 3.7Å; T372-V387 HydrophobicContact CG2-CB 4.47Å; T372-V387 HydrophobicContact CG2-CG1 3.86Å; T372-V387 HydrophobicContact CG2-CG2 3.79Å; V373-V387 CarbonylContact O-C 3.57Å; V373-V387 WeakPolarHBondContact O-CA 3.34Å; L374-V387 HydrophobicContact CD2-CG2 3.73Å; I378-V387 VanDerWaalsContact CD1-O 3.31Å; I378-V387 WeakPolarHBondContact CD1-O 3.36Å; P385-V387 HydrophobicContact CB-CG2 4.15Å; P385-V387 HydrophobicContact CG-CG2 4.3Å; P385-V387 PolarHBondContact O-N 3.37Å; V387-P389 WeakPolarHBondContact O-CD 3.23Å; V387-S392 WeakPolarHBondContact CG1-OG 3.44Å
388	D	94.2	Very high	92.8	Very high	17 Å²	17	45.5 Å²	45.5	9%	0.091	23%	0.229	C	C	.	.			trans	-77.4	114	172.6	-163.4	-53.4	0	0	0	110.4	V373 I378 L390 D391 S392	V373-D388 HydrophobicContact CB-CB 4.43Å; V373-D388 PolarHBondContact O-N 3.43Å; I378-D388 VanDerWaalsContact CD1-CA 3.46Å; I378-D388 HydrophobicContact CD1-CB 3.99Å; D388-L390 PolarHBondContact O-N 2.74Å; D388-L390 PolarHBondContact OD1-N 2.78Å; D388-D391 HydrophobicContact CB-CB 4.14Å; D388-D391 PolarHBondContact OD1-N 3.36Å; D388-D391 VanDerWaalsContact OD1-N 3.12Å; D388-S392 WeakPolarHBondContact O-CB 2.93Å; D388-S392 PolarHBondContact O-N 3.41Å; D388-S392 VanDerWaalsContact O-N 3.16Å; D388-S392 PolarHBondContact O-OG 3.38Å
389	P	93.4	Very high	93	Very high	12 Å²	12	47.3 Å²	47.3	8%	0.078	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-14.3	-175.3	29.8	-35.3	0	0	0	114	L182 V387 L417 L453	L182-P389 HydrophobicContact CD1-CB 3.24Å; V387-P389 WeakPolarHBondContact O-CD 3.23Å; P389-L417 HydrophobicContact CB-CD1 3.73Å; P389-L417 HydrophobicContact CG-CD1 3.65Å; P389-L453 HydrophobicContact CB-CD1 4.02Å; P389-L453 HydrophobicContact CG-CD1 4.21Å
390	L	93.6	Very high	93.1	Very high	44 Å²	44	53.7 Å²	53.7	23%	0.23	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-36.2	-177.9	-62.5	176.7	0	0	0	112	D388 Q414 L417 Q418 K421	D388-L390 PolarHBondContact O-N 2.74Å; D388-L390 PolarHBondContact OD1-N 2.78Å; L390-Q414 HydrophobicContact CD2-CB 4.46Å; L390-L417 HydrophobicContact CD2-CB 4.12Å; L390-L417 HydrophobicContact CG-CB 4.5Å; L390-Q418 HydrophobicContact CD2-CB 4.35Å; L390-K421 HydrophobicContact CD1-CD 3.86Å
391	D	91.3	Very high	93.1	Very high	92 Å²	92	49 Å²	49	49%	0.492	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-17.6	-179.8	-66.7	-17	0	0	0	113	V373 D388	V373-D391 HydrophobicContact CB-CB 4.22Å; V373-D391 HydrophobicContact CG1-CB 4.4Å; V373-D391 HydrophobicContact CG2-CB 4.18Å; D388-D391 HydrophobicContact CB-CB 4.14Å; D388-D391 PolarHBondContact OD1-N 3.36Å; D388-D391 VanDerWaalsContact OD1-N 3.12Å
392	S	93.4	Very high	93.2	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.014	23%	0.232	C	C	.	.			trans	-79.8	134.8	173.2	-56.6	0	0	0	0	111.1	T371 V373 V387 D388	T371-S392 CarbonylContact O-C 3.6Å; T371-S392 VanDerWaalsContact O-CA 3.27Å; T371-S392 WeakPolarHBondContact O-CA 3.44Å; T371-S392 WeakPolarHBondContact O-CB 3.27Å; V373-S392 PolarHBondContact N-OG 2.71Å; V387-S392 WeakPolarHBondContact CG1-OG 3.44Å; D388-S392 WeakPolarHBondContact O-CB 2.93Å; D388-S392 PolarHBondContact O-N 3.41Å; D388-S392 VanDerWaalsContact O-N 3.16Å; D388-S392 PolarHBondContact O-OG 3.38Å
393	T	93.9	Very high	93.3	Very high	86 Å²	86	45.3 Å²	45.3	53%	0.528	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	158.3	-177.8	178.4	0	0	0	0	111.4	A370 T371	A370-T393 CarbonylContact C-O 3.59Å; A370-T393 WeakPolarHBondContact CA-O 3.3Å; T371-T393 PolarHBondContact N-O 3.49Å; T371-T393 PolarHBondContact O-N 2.8Å; T371-T393 WeakPolarHBondContact OG1-CG2 3.48Å; T371-T393 PolarHBondContact OG1-N 3.07Å
394	S	94.6	Very high	93.5	Very high	9 Å²	9	47.6 Å²	47.6	6%	0.063	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	138.4	174.5	175.5	0	0	0	0	110.2	P184 I396 M397	P184-S394 WeakPolarHBondContact O-CB 3.43Å; P184-S394 PolarHBondContact O-OG 3.25Å; S394-I396 PolarHBondContact O-N 2.88Å; S394-I396 WeakPolarHBondContact OG-CG1 3.39Å; S394-I396 PolarHBondContact OG-N 3.42Å; S394-M397 WeakPolarHBondContact O-CB 3.18Å; S394-M397 PolarHBondContact O-N 3.16Å
395	R	91.9	Very high	93.6	Very high	185 Å²	185	48.7 Å²	48.7	70%	0.698	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-29.2	177.5	-174.1	177.4	-178.8	178.9	1.6	112.1	D369 M397	D369-R395 VanDerWaalsContact O-CB 3.3Å; D369-R395 WeakPolarHBondContact O-CB 3.35Å; D369-R395 PolarHBondContact O-N 3.25Å; R395-M397 PolarHBondContact O-N 3.24Å
396	I	92.7	Very high	93.7	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.015	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-1.4	179.5	59	153.1	0	0	0	113	I171 P184 A186 S394 D398 I401 V402	I171-I396 HydrophobicContact CG1-CD1 4.04Å; P184-I396 HydrophobicContact CB-CD1 3.89Å; P184-I396 HydrophobicContact CB-CG1 4.48Å; P184-I396 HydrophobicContact CG-CD1 4.01Å; P184-I396 HydrophobicContact CG-CG1 4.12Å; P184-I396 WeakPolarHBondContact O-CD1 3.16Å; P184-I396 WeakPolarHBondContact O-CG1 3.38Å; A186-I396 HydrophobicContact CB-CD1 4.24Å; A186-I396 HydrophobicContact CB-CG1 4.44Å; A186-I396 HydrophobicContact CB-CG2 3.77Å; S394-I396 PolarHBondContact O-N 2.88Å; S394-I396 WeakPolarHBondContact OG-CG1 3.39Å; S394-I396 PolarHBondContact OG-N 3.42Å; I396-D398 PolarHBondContact O-N 2.88Å; I396-I401 HydrophobicContact CB-CD1 4.31Å; I396-I401 HydrophobicContact CB-CG2 4.21Å; I396-I401 HydrophobicContact CG2-CD1 4.27Å; I396-V402 WeakPolarHBondContact O-CG1 3.43Å
397	M	93.5	Very high	93.9	Very high	19 Å²	19	51.1 Å²	51.1	9%	0.094	27%	0.274	C	S	.	.			trans	-70.7	65	169.8	-75.7	-61.5	-67	0	0	111.7	P184 S394 R395 V402 Y407 A410	P184-M397 WeakPolarHBondContact CD-SD 3.5Å; P184-M397 HydrophobicContact CG-CG 3.84Å; P184-M397 HydrophobicContact CG-SD 3.34Å; P184-M397 WeakPolarHBondContact CG-SD 3.17Å; S394-M397 WeakPolarHBondContact O-CB 3.18Å; S394-M397 PolarHBondContact O-N 3.16Å; R395-M397 PolarHBondContact O-N 3.24Å; M397-V402 HydrophobicContact SD-CG1 4.49Å; M397-Y407 HydrophobicContact CE-CD2 4.49Å; M397-Y407 WeakPolarHBondContact O-CE2 3.43Å; M397-A410 HydrophobicContact CE-CB 3.35Å
398	D	93.1	Very high	94	Very high	61 Å²	61	55.7 Å²	55.7	33%	0.326	30%	0.299	S	S	.	.	S	Bend	trans	-127.7	132.1	177.7	-172.9	-54.7	0	0	0	108.2	I396 N400 I401 V402	I396-D398 PolarHBondContact O-N 2.88Å; D398-N400 PolarHBondContact O-N 3.4Å; D398-N400 VanDerWaalsContact OD1-CB 3.28Å; D398-N400 WeakPolarHBondContact OD1-CB 3.35Å; D398-N400 PolarHBondContact OD1-N 2.95Å; D398-N400 PolarHBondContact OD1-ND2 2.98Å; D398-I401 HydrophobicContact CB-CD1 4.12Å; D398-I401 HydrophobicContact CB-CG1 4.32Å; D398-I401 PolarHBondContact O-N 3.47Å; D398-V402 WeakPolarHBondContact O-CG2 3.47Å; D398-V402 PolarHBondContact O-N 3.02Å
399	P	94.3	Very high	94.1	Very high	52 Å²	52	55.2 Å²	55.2	34%	0.338	30%	0.296	S	S	.	.	H	α-helix	trans	-59	-21	-178.9	25.7	-36.4	0	0	0	113.9	I401 G403 Y407	P399-I401 VanDerWaalsContact C-N 3.32Å; P399-G403 CarbonylContact O-C 3.55Å; P399-G403 WeakPolarHBondContact O-CA 3.26Å; P399-G403 PolarHBondContact O-N 2.89Å; P399-Y407 HydrophobicContact CB-CD1 4.3Å; P399-Y407 HydrophobicContact CB-CG 4.1Å; P399-Y407 HydrophobicContact CG-CD1 4.49Å; P399-Y407 HydrophobicContact CG-CG 4.46Å
400	N	92.3	Very high	94.2	Very high	147 Å²	147	54.6 Å²	54.6	79%	0.786	29%	0.293	S	S	*	.	H	α-helix	trans	-75.7	-19.7	175.4	-59.1	-63.4	0	0	0	113.2	D398	D398-N400 PolarHBondContact O-N 3.4Å; D398-N400 VanDerWaalsContact OD1-CB 3.28Å; D398-N400 WeakPolarHBondContact OD1-CB 3.35Å; D398-N400 PolarHBondContact OD1-N 2.95Å; D398-N400 PolarHBondContact OD1-ND2 2.98Å
401	I	91.8	Very high	94.4	Very high	51 Å²	51	57.5 Å²	57.5	26%	0.262	30%	0.301	S	S	.	.	H	α-helix	trans	-103.7	-55.7	-178.4	-57	169.9	0	0	0	110	Q169 I396 D398 P399	Q169-I401 HydrophobicContact CB-CD1 4.48Å; Q169-I401 HydrophobicContact CB-CG2 4.37Å; I396-I401 HydrophobicContact CB-CD1 4.31Å; I396-I401 HydrophobicContact CB-CG2 4.21Å; I396-I401 HydrophobicContact CG2-CD1 4.27Å; D398-I401 HydrophobicContact CB-CD1 4.12Å; D398-I401 HydrophobicContact CB-CG1 4.32Å; D398-I401 PolarHBondContact O-N 3.47Å; P399-I401 VanDerWaalsContact C-N 3.32Å
402	V	92.7	Very high	94.6	Very high	19 Å²	19	54.2 Å²	54.2	12%	0.115	29%	0.288	C	S	.	.	H	α-helix	trans	-84.6	-13.9	-176.2	-54.8	0	0	0	0	113.6	I171 P184 I396 M397 D398 H406	I171-V402 HydrophobicContact CD1-CB 4.02Å; I171-V402 HydrophobicContact CD1-CG1 3.65Å; I171-V402 HydrophobicContact CG1-CG1 4.26Å; P184-V402 HydrophobicContact CG-CG1 4.33Å; I396-V402 WeakPolarHBondContact O-CG1 3.43Å; M397-V402 HydrophobicContact SD-CG1 4.49Å; D398-V402 WeakPolarHBondContact O-CG2 3.47Å; D398-V402 PolarHBondContact O-N 3.02Å; V402-H406 HydrophobicContact CB-CB 4.24Å; V402-H406 HydrophobicContact CG2-CB 4.13Å
403	G	94.5	Very high	94.8	Very high	31 Å²	31	54.1 Å²	54.1	32%	0.32	29%	0.287	S	S	.	.			trans	88.8	154.9	-172.6	0	0	0	0	0	113	P399 E405 Y407	P399-G403 CarbonylContact O-C 3.55Å; P399-G403 WeakPolarHBondContact O-CA 3.26Å; P399-G403 PolarHBondContact O-N 2.89Å; G403-E405 PolarHBondContact O-N 3.28Å; G403-Y407 WeakPolarHBondContact O-CB 3.18Å; G403-Y407 PolarHBondContact O-N 2.79Å; G403-Y407 VanDerWaalsContact O-N 3.15Å
404	A	95.5	Very high	94.9	Very high	59 Å²	59	51.4 Å²	51.4	49%	0.488	27%	0.269	S	S	.	.	H	α-helix	trans	-62.6	-41.2	-176.1	0	0	0	0	0	112.8	Y407 D408	A404-Y407 PolarHBondContact O-N 2.79Å; A404-D408 WeakPolarHBondContact O-CB 3.49Å; A404-D408 PolarHBondContact O-N 2.64Å
405	E	95.8	Very high	95	Very high	117 Å²	117	57.5 Å²	57.5	55%	0.547	29%	0.294	S	S	.	.	H	α-helix	trans	-61.7	-50.6	-177.9	-175.5	-179.8	-172	0	0	112.2	G403 Y407 D408 V409 I477	G403-E405 PolarHBondContact O-N 3.28Å; E405-Y407 PolarHBondContact O-N 3.46Å; E405-D408 PolarHBondContact O-N 2.97Å; E405-V409 VanDerWaalsContact O-CG2 3.27Å; E405-V409 WeakPolarHBondContact O-CG2 3.45Å; E405-V409 PolarHBondContact O-N 2.9Å; E405-V409 VanDerWaalsContact O-N 3.1Å; E405-I477 HydrophobicContact CG-CG2 4.04Å
406	H	96.6	Very high	95.2	Very high	3 Å²	3	49.9 Å²	49.9	1%	0.014	27%	0.267	C	S	.	.	H	α-helix	trans	-60.2	-47.7	176.6	-173.7	175.2	0	0	0	110.4	D180 L181 V402 D408 V409 A410 I477	D180-H406 PolarHBondContact O-CE1 3.47Å; D180-H406 PolarHBondContact O-NE2 3.13Å; L181-H406 PolarHBondContact O-NE2 3.18Å; V402-H406 HydrophobicContact CB-CB 4.24Å; V402-H406 HydrophobicContact CG2-CB 4.13Å; H406-D408 PolarHBondContact O-N 3.08Å; H406-V409 PolarHBondContact O-N 3.16Å; H406-A410 WeakPolarHBondContact O-CB 2.96Å; H406-A410 PolarHBondContact O-N 3.47Å; H406-I477 HydrophobicContact CB-CD1 3.72Å; H406-I477 HydrophobicContact CB-CG1 4.34Å
407	Y	96.9	Very high	95.3	Very high	57 Å²	57	50.1 Å²	50.1	22%	0.224	27%	0.268	C	S	.	.	H	α-helix	trans	-59.2	-48.5	-179.5	-176.3	-95.3	0	0	0	112.7	M397 P399 G403 A404 E405 V409 A410 R411	M397-Y407 HydrophobicContact CE-CD2 4.49Å; M397-Y407 WeakPolarHBondContact O-CE2 3.43Å; P399-Y407 HydrophobicContact CB-CD1 4.3Å; P399-Y407 HydrophobicContact CB-CG 4.1Å; P399-Y407 HydrophobicContact CG-CD1 4.49Å; P399-Y407 HydrophobicContact CG-CG 4.46Å; G403-Y407 WeakPolarHBondContact O-CB 3.18Å; G403-Y407 PolarHBondContact O-N 2.79Å; G403-Y407 VanDerWaalsContact O-N 3.15Å; A404-Y407 PolarHBondContact O-N 2.79Å; E405-Y407 PolarHBondContact O-N 3.46Å; Y407-V409 PolarHBondContact O-N 3.38Å; Y407-A410 PolarHBondContact O-N 2.78Å; Y407-R411 HydrophobicContact CD1-CG 4.1Å; Y407-R411 HydrophobicContact CE1-CG 3.69Å; Y407-R411 HydrophobicContact CE2-CG 4.21Å; Y407-R411 VanDerWaalsContact CZ-NE 3.33Å; Y407-R411 WeakPolarHBondContact O-CB 3.46Å; Y407-R411 WeakPolarHBondContact O-CG 3.46Å; Y407-R411 PolarHBondContact O-N 2.95Å; Y407-R411 PolarHBondContact OH-NE 3.14Å; Y407-R411 PolarHBondContact OH-NH2 2.94Å
408	D	97.1	Very high	95.5	Very high	103 Å²	103	53.3 Å²	53.3	55%	0.551	28%	0.283	S	S	*	.	H	α-helix	trans	-66	-40.2	-177.3	-70.7	-23.2	0	0	0	111.7	A404 E405 H406 R411 G412	A404-D408 WeakPolarHBondContact O-CB 3.49Å; A404-D408 PolarHBondContact O-N 2.64Å; E405-D408 PolarHBondContact O-N 2.97Å; H406-D408 PolarHBondContact O-N 3.08Å; D408-R411 PolarHBondContact O-N 3.21Å; D408-G412 PolarHBondContact O-N 2.88Å
409	V	97.1	Very high	95.6	Very high	7 Å²	7	53.2 Å²	53.2	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-64.3	-46.7	175.4	173.8	0	0	0	0	110.7	L181 E405 H406 Y407 R411 G412 V413 I477 F480 Q481 L484	L181-V409 HydrophobicContact CD1-CG1 4.12Å; E405-V409 VanDerWaalsContact O-CG2 3.27Å; E405-V409 WeakPolarHBondContact O-CG2 3.45Å; E405-V409 PolarHBondContact O-N 2.9Å; E405-V409 VanDerWaalsContact O-N 3.1Å; H406-V409 PolarHBondContact O-N 3.16Å; Y407-V409 PolarHBondContact O-N 3.38Å; V409-R411 PolarHBondContact O-N 3.28Å; V409-G412 PolarHBondContact O-N 2.66Å; V409-V413 WeakPolarHBondContact O-CG2 3.47Å; V409-V413 PolarHBondContact O-N 3.03Å; V409-I477 HydrophobicContact CG2-CG2 4.18Å; V409-F480 HydrophobicContact CG1-CB 3.71Å; V409-Q481 HydrophobicContact CG2-CB 3.87Å; V409-Q481 HydrophobicContact CG2-CG 4.06Å; V409-L484 HydrophobicContact CG1-CD1 4.08Å
410	A	96.6	Very high	95.6	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.8	-43	178.5	0	0	0	0	0	112.1	L181 L182 M397 H406 Y407 V413 Q414	L181-A410 HydrophobicContact CD1-CB 4.35Å; L181-A410 HydrophobicContact CG-CB 4.33Å; L181-A410 WeakPolarHBondContact O-CB 3.29Å; L182-A410 HydrophobicContact CD2-CB 4.2Å; M397-A410 HydrophobicContact CE-CB 3.35Å; H406-A410 WeakPolarHBondContact O-CB 2.96Å; H406-A410 PolarHBondContact O-N 3.47Å; Y407-A410 PolarHBondContact O-N 2.78Å; A410-V413 PolarHBondContact O-N 3.49Å; A410-Q414 WeakPolarHBondContact O-CG 3.41Å; A410-Q414 PolarHBondContact O-N 3.45Å
411	R	96.6	Very high	95.6	Very high	105 Å²	105	49.5 Å²	49.5	40%	0.396	25%	0.253	S	S	.	.	H	α-helix	trans	-65.8	-37.5	175.1	-68.7	-55.2	-174.3	-169.9	-0.1	112.5	Y407 D408 V409 Q414 K415	Y407-R411 HydrophobicContact CD1-CG 4.1Å; Y407-R411 HydrophobicContact CE1-CG 3.69Å; Y407-R411 HydrophobicContact CE2-CG 4.21Å; Y407-R411 VanDerWaalsContact CZ-NE 3.33Å; Y407-R411 WeakPolarHBondContact O-CB 3.46Å; Y407-R411 WeakPolarHBondContact O-CG 3.46Å; Y407-R411 PolarHBondContact O-N 2.95Å; Y407-R411 PolarHBondContact OH-NE 3.14Å; Y407-R411 PolarHBondContact OH-NH2 2.94Å; D408-R411 PolarHBondContact O-N 3.21Å; V409-R411 PolarHBondContact O-N 3.28Å; R411-Q414 PolarHBondContact O-N 2.9Å; R411-K415 WeakPolarHBondContact O-CB 3.44Å; R411-K415 PolarHBondContact O-N 3.33Å
412	G	96.7	Very high	95.7	Very high	22 Å²	22	50.5 Å²	50.5	23%	0.227	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-45.3	173.4	0	0	0	0	0	112.4	D408 V409 K415 I416	D408-G412 PolarHBondContact O-N 2.88Å; V409-G412 PolarHBondContact O-N 2.66Å; G412-K415 PolarHBondContact O-N 2.86Å; G412-I416 PolarHBondContact O-N 3.22Å; G412-I416 VanDerWaalsContact O-N 3.12Å
413	V	96.6	Very high	95.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-49	175.2	166.6	0	0	0	0	111.3	L181 L182 V409 A410 K415 I416 L417 I449 F480 L484	L181-V413 HydrophobicContact CD2-CG1 4.49Å; L181-V413 HydrophobicContact CD2-CG2 4.17Å; L182-V413 HydrophobicContact CD1-CG1 4.47Å; L182-V413 HydrophobicContact CD2-CB 4.38Å; L182-V413 HydrophobicContact CD2-CG1 4.02Å; V409-V413 WeakPolarHBondContact O-CG2 3.47Å; V409-V413 PolarHBondContact O-N 3.03Å; A410-V413 PolarHBondContact O-N 3.49Å; V413-K415 VanDerWaalsContact C-N 3.3Å; V413-K415 PolarHBondContact O-N 2.96Å; V413-I416 PolarHBondContact O-N 3.19Å; V413-L417 HydrophobicContact CG1-CD1 3.78Å; V413-L417 WeakPolarHBondContact O-CG 3.41Å; V413-L417 PolarHBondContact O-N 2.82Å; V413-I449 HydrophobicContact CG1-CG2 3.7Å; V413-F480 HydrophobicContact CG2-CB 4.14Å; V413-F480 HydrophobicContact CG2-CD1 3.75Å; V413-F480 HydrophobicContact CG2-CG 4.23Å; V413-L484 HydrophobicContact CG2-CD1 4.2Å; V413-L484 HydrophobicContact CG2-CD2 4.16Å; V413-L484 HydrophobicContact CG2-CG 4.31Å
414	Q	96.1	Very high	95.6	Very high	29 Å²	29	52.7 Å²	52.7	14%	0.136	27%	0.266	C	S	.	.	H	α-helix	trans	-59	-41.5	177.7	-75.1	178.7	-24.3	0	0	111.9	L182 L390 A410 R411 L417 Q418	L182-Q414 HydrophobicContact CD2-CG 4.02Å; L390-Q414 HydrophobicContact CD2-CB 4.46Å; A410-Q414 WeakPolarHBondContact O-CG 3.41Å; A410-Q414 PolarHBondContact O-N 3.45Å; R411-Q414 PolarHBondContact O-N 2.9Å; Q414-L417 PolarHBondContact O-N 3.38Å; Q414-Q418 VanDerWaalsContact O-CB 3.29Å; Q414-Q418 WeakPolarHBondContact O-CB 3.44Å; Q414-Q418 PolarHBondContact O-N 2.78Å
415	K	96.8	Very high	95.4	Very high	137 Å²	137	55.5 Å²	55.5	60%	0.596	27%	0.273	S	S	*	.	H	α-helix	trans	-61.1	-50.3	178.3	-175	179.9	177	-173.9	0	111.8	R411 G412 V413 L417 Q418 D419	R411-K415 WeakPolarHBondContact O-CB 3.44Å; R411-K415 PolarHBondContact O-N 3.33Å; G412-K415 PolarHBondContact O-N 2.86Å; V413-K415 VanDerWaalsContact C-N 3.3Å; V413-K415 PolarHBondContact O-N 2.96Å; K415-L417 VanDerWaalsContact C-N 3.3Å; K415-L417 PolarHBondContact O-N 2.99Å; K415-Q418 PolarHBondContact O-N 3.47Å; K415-D419 WeakPolarHBondContact O-CB 3.41Å; K415-D419 VanDerWaalsContact O-CG 3.24Å; K415-D419 PolarHBondContact O-N 2.98Å
416	I	96.3	Very high	95.2	Very high	25 Å²	25	53.4 Å²	53.4	13%	0.128	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-41.2	179	-69.7	-177.2	0	0	0	111.3	G412 V413 Y420 I442 A446 I449 L484	G412-I416 PolarHBondContact O-N 3.22Å; G412-I416 VanDerWaalsContact O-N 3.12Å; V413-I416 PolarHBondContact O-N 3.19Å; I416-Y420 VanDerWaalsContact O-CB 3.32Å; I416-Y420 WeakPolarHBondContact O-CB 3.3Å; I416-Y420 PolarHBondContact O-N 3.25Å; I416-I442 HydrophobicContact CG2-CG2 4.38Å; I416-A446 HydrophobicContact CG2-CB 3.73Å; I416-I449 HydrophobicContact CB-CD1 4.35Å; I416-I449 HydrophobicContact CD1-CD1 4.16Å; I416-I449 HydrophobicContact CG2-CD1 4.03Å; I416-L484 HydrophobicContact CD1-CD2 3.42Å; I416-L484 VanDerWaalsContact CD1-CD2 3.42Å; I416-L484 HydrophobicContact CG1-CD2 4.35Å
417	L	95.6	Very high	95	Very high	9 Å²	9	54.7 Å²	54.7	5%	0.047	27%	0.271	C	S	.	.	H	α-helix	trans	-67.7	-36.8	178.2	-69.9	170.5	0	0	0	112.3	P389 L390 V413 Q414 K415 K421 I449 Q450 L453	P389-L417 HydrophobicContact CB-CD1 3.73Å; P389-L417 HydrophobicContact CG-CD1 3.65Å; L390-L417 HydrophobicContact CD2-CB 4.12Å; L390-L417 HydrophobicContact CG-CB 4.5Å; V413-L417 HydrophobicContact CG1-CD1 3.78Å; V413-L417 WeakPolarHBondContact O-CG 3.41Å; V413-L417 PolarHBondContact O-N 2.82Å; Q414-L417 PolarHBondContact O-N 3.38Å; K415-L417 VanDerWaalsContact C-N 3.3Å; K415-L417 PolarHBondContact O-N 2.99Å; L417-K421 PolarHBondContact O-N 3.2Å; L417-I449 HydrophobicContact CD1-CG2 4.08Å; L417-I449 HydrophobicContact CD2-CG2 4.1Å; L417-I449 HydrophobicContact CG-CG2 4.15Å; L417-Q450 HydrophobicContact CD2-CB 4.41Å; L417-L453 HydrophobicContact CD1-CD1 4.27Å
418	Q	95.8	Very high	94.7	Very high	86 Å²	86	56 Å²	56	40%	0.402	29%	0.294	S	S	.	.	H	α-helix	trans	-67.1	-45.9	175.3	-176.6	59.7	52	0	0	111.6	L390 Q414 K415 Y420 K421 S422	L390-Q418 HydrophobicContact CD2-CB 4.35Å; Q414-Q418 VanDerWaalsContact O-CB 3.29Å; Q414-Q418 WeakPolarHBondContact O-CB 3.44Å; Q414-Q418 PolarHBondContact O-N 2.78Å; K415-Q418 PolarHBondContact O-N 3.47Å; Q418-Y420 VanDerWaalsContact C-N 3.3Å; Q418-Y420 PolarHBondContact O-N 2.86Å; Q418-K421 WeakPolarHBondContact O-CB 3.18Å; Q418-K421 PolarHBondContact O-N 2.98Å; Q418-S422 PolarHBondContact O-N 2.87Å; Q418-S422 VanDerWaalsContact O-N 3.08Å; Q418-S422 PolarHBondContact O-OG 3.13Å
419	D	95.3	Very high	94.5	Very high	59 Å²	59	57.9 Å²	57.9	32%	0.316	30%	0.302	S	S	.	.	H	α-helix	trans	-61.3	-42.5	176.5	-66.7	-21.4	0	0	0	110.1	K415 K421 S422 L423 I442	K415-D419 WeakPolarHBondContact O-CB 3.41Å; K415-D419 VanDerWaalsContact O-CG 3.24Å; K415-D419 PolarHBondContact O-N 2.98Å; D419-K421 PolarHBondContact O-N 2.69Å; D419-S422 PolarHBondContact O-N 2.97Å; D419-L423 WeakPolarHBondContact O-CG 3.35Å; D419-L423 PolarHBondContact O-N 3.29Å; D419-I442 HydrophobicContact CB-CG2 4.09Å
420	Y	95.2	Very high	94.3	Very high	26 Å²	26	62.8 Å²	62.8	10%	0.102	33%	0.328	C	S	.	.	H	α-helix	trans	-59.4	-44.6	173.6	173.2	-125.7	0	0	0	112.8	I416 Q418 S422 L423 Q424 V443 A446	I416-Y420 VanDerWaalsContact O-CB 3.32Å; I416-Y420 WeakPolarHBondContact O-CB 3.3Å; I416-Y420 PolarHBondContact O-N 3.25Å; Q418-Y420 VanDerWaalsContact C-N 3.3Å; Q418-Y420 PolarHBondContact O-N 2.86Å; Y420-S422 VanDerWaalsContact C-N 3.28Å; Y420-S422 PolarHBondContact O-N 3.38Å; Y420-L423 CarbonylContact O-C 3.55Å; Y420-L423 PolarHBondContact O-N 3.22Å; Y420-L423 VanDerWaalsContact O-N 3.08Å; Y420-Q424 HydrophobicContact CD2-CG 4.27Å; Y420-Q424 HydrophobicContact CE1-CG 4.23Å; Y420-Q424 HydrophobicContact CE2-CG 3.79Å; Y420-Q424 WeakPolarHBondContact O-CG 3.46Å; Y420-Q424 PolarHBondContact O-N 2.85Å; Y420-Q424 PolarHBondContact OH-NE2 2.88Å; Y420-Q424 VanDerWaalsContact OH-NE2 3.08Å; Y420-V443 HydrophobicContact CD2-CB 4.38Å; Y420-V443 HydrophobicContact CD2-CG1 4.2Å; Y420-V443 HydrophobicContact CD2-CG2 4.07Å; Y420-V443 HydrophobicContact CE2-CG1 3.96Å; Y420-V443 HydrophobicContact CE2-CG2 4.49Å; Y420-A446 HydrophobicContact CD1-CB 3.83Å; Y420-A446 HydrophobicContact CD2-CB 4.12Å; Y420-A446 HydrophobicContact CG-CB 3.5Å; Y420-A446 VanDerWaalsContact CG-CB 3.5Å
421	K	92.9	Very high	94.1	Very high	94 Å²	94	64.1 Å²	64.1	41%	0.409	34%	0.341	S	S	.	.	H	α-helix	trans	-59.9	-38.9	176.9	-168.9	171.8	-177.6	174.3	0	111.6	L390 L417 Q418 D419 Q424	L390-K421 HydrophobicContact CD1-CD 3.86Å; L417-K421 PolarHBondContact O-N 3.2Å; Q418-K421 WeakPolarHBondContact O-CB 3.18Å; Q418-K421 PolarHBondContact O-N 2.98Å; D419-K421 PolarHBondContact O-N 2.69Å; K421-Q424 PolarHBondContact O-N 3.04Å
422	S	92.7	Very high	93.8	Very high	72 Å²	72	62.4 Å²	62.4	50%	0.503	34%	0.339	S	S	.	.	H	α-helix	trans	-68.3	-32.7	174.2	-66.4	0	0	0	0	113.4	Q418 D419 Y420	Q418-S422 PolarHBondContact O-N 2.87Å; Q418-S422 VanDerWaalsContact O-N 3.08Å; Q418-S422 PolarHBondContact O-OG 3.13Å; D419-S422 PolarHBondContact O-N 2.97Å; Y420-S422 VanDerWaalsContact C-N 3.28Å; Y420-S422 PolarHBondContact O-N 3.38Å
423	L	94.5	Very high	93.5	Very high	18 Å²	18	68 Å²	68	9%	0.094	36%	0.364	C	S	.	.	H	α-helix	trans	-77.6	-22.6	176.6	-67.8	172.7	0	0	0	113.2	D419 Y420 D425 I426 I427 L435 D439 I442 V443	D419-L423 WeakPolarHBondContact O-CG 3.35Å; D419-L423 PolarHBondContact O-N 3.29Å; Y420-L423 CarbonylContact O-C 3.55Å; Y420-L423 PolarHBondContact O-N 3.22Å; Y420-L423 VanDerWaalsContact O-N 3.08Å; L423-D425 VanDerWaalsContact C-N 3.34Å; L423-D425 PolarHBondContact O-N 2.93Å; L423-I426 HydrophobicContact CD2-CD1 4.28Å; L423-I426 PolarHBondContact O-N 3.46Å; L423-I426 VanDerWaalsContact O-N 3.17Å; L423-I427 HydrophobicContact CB-CD1 4.33Å; L423-I427 VanDerWaalsContact O-CG1 3.25Å; L423-I427 WeakPolarHBondContact O-CG1 3.49Å; L423-I427 PolarHBondContact O-N 3.22Å; L423-L435 HydrophobicContact CD2-CD2 4.02Å; L423-D439 HydrophobicContact CD1-CB 3.98Å; L423-D439 HydrophobicContact CD2-CB 4.38Å; L423-I442 HydrophobicContact CD1-CG2 4.37Å; L423-V443 HydrophobicContact CB-CG2 4.38Å; L423-V443 HydrophobicContact CD1-CG2 3.88Å
424	Q	91.9	Very high	93.2	Very high	78 Å²	78	74.9 Å²	74.9	36%	0.364	40%	0.396	S	S	.	.	H	α-helix	trans	-57.8	-41.8	-178.9	-81.9	-178.9	-22.2	0	0	113.1	Y420 K421 I426 I427 A428	Y420-Q424 HydrophobicContact CD2-CG 4.27Å; Y420-Q424 HydrophobicContact CE1-CG 4.23Å; Y420-Q424 HydrophobicContact CE2-CG 3.79Å; Y420-Q424 WeakPolarHBondContact O-CG 3.46Å; Y420-Q424 PolarHBondContact O-N 2.85Å; Y420-Q424 PolarHBondContact OH-NE2 2.88Å; Y420-Q424 VanDerWaalsContact OH-NE2 3.08Å; K421-Q424 PolarHBondContact O-N 3.04Å; Q424-I426 VanDerWaalsContact C-N 3.32Å; Q424-I426 PolarHBondContact O-N 3.43Å; Q424-I427 PolarHBondContact O-N 3.28Å; Q424-A428 WeakPolarHBondContact O-CB 3.48Å; Q424-A428 PolarHBondContact O-N 2.94Å
425	D	90.4	Very high	93	Very high	119 Å²	119	74.1 Å²	74.1	64%	0.636	39%	0.392	S	S	*	.	H	α-helix	trans	-64.2	-39.6	178.2	-71.9	-18.6	0	0	0	111.6	L423 A428 I429	L423-D425 VanDerWaalsContact C-N 3.34Å; L423-D425 PolarHBondContact O-N 2.93Å; D425-A428 PolarHBondContact O-N 2.9Å; D425-I429 WeakPolarHBondContact O-CG1 3.48Å; D425-I429 PolarHBondContact O-N 3.38Å
426	I	91.1	Very high	92.9	Very high	73 Å²	73	70.2 Å²	70.2	37%	0.374	38%	0.383	S	S	.	.	H	α-helix	trans	-65.9	-46.5	176.7	-56.8	-179.7	0	0	0	109.9	L423 Q424 A428 I429 L430 L435	L423-I426 HydrophobicContact CD2-CD1 4.28Å; L423-I426 PolarHBondContact O-N 3.46Å; L423-I426 VanDerWaalsContact O-N 3.17Å; Q424-I426 VanDerWaalsContact C-N 3.32Å; Q424-I426 PolarHBondContact O-N 3.43Å; I426-A428 VanDerWaalsContact C-N 3.28Å; I426-A428 PolarHBondContact O-N 3.5Å; I426-I429 PolarHBondContact O-N 3.39Å; I426-I429 VanDerWaalsContact O-N 3.17Å; I426-L430 HydrophobicContact CG2-CD1 3.94Å; I426-L430 PolarHBondContact O-N 2.98Å; I426-L435 HydrophobicContact CG2-CD2 4.17Å
427	I	91.9	Very high	92.7	Very high	30 Å²	30	75.8 Å²	75.8	15%	0.154	41%	0.408	C	S	.	.	H	α-helix	trans	-59.8	-40.2	178	-67.7	163.6	0	0	0	111	L423 Q424 I429 G431 M432 L435 V443	L423-I427 HydrophobicContact CB-CD1 4.33Å; L423-I427 VanDerWaalsContact O-CG1 3.25Å; L423-I427 WeakPolarHBondContact O-CG1 3.49Å; L423-I427 PolarHBondContact O-N 3.22Å; Q424-I427 PolarHBondContact O-N 3.28Å; I427-I429 VanDerWaalsContact C-N 3.27Å; I427-I429 PolarHBondContact O-N 2.72Å; I427-G431 VanDerWaalsContact O-CA 3.24Å; I427-G431 WeakPolarHBondContact O-CA 3.42Å; I427-G431 PolarHBondContact O-N 2.69Å; I427-M432 HydrophobicContact CG1-CG 4.36Å; I427-M432 HydrophobicContact CG2-CG 3.75Å; I427-L435 HydrophobicContact CD1-CD1 3.91Å; I427-L435 HydrophobicContact CG1-CD1 3.67Å; I427-L435 HydrophobicContact CG1-CG 4.38Å; I427-V443 HydrophobicContact CD1-CG1 4.23Å; I427-V443 HydrophobicContact CD1-CG2 3.82Å
428	A	92.6	Very high	92.5	Very high	85 Å²	85	82.8 Å²	82.8	70%	0.702	44%	0.44	S	S	*	.	H	α-helix	trans	-66.1	-28.8	-180	0	0	0	0	0	113.1	Q424 D425 I426	Q424-A428 WeakPolarHBondContact O-CB 3.48Å; Q424-A428 PolarHBondContact O-N 2.94Å; D425-A428 PolarHBondContact O-N 2.9Å; I426-A428 VanDerWaalsContact C-N 3.28Å; I426-A428 PolarHBondContact O-N 3.5Å
429	I	92.8	Very high	92.4	Very high	141 Å²	141	81 Å²	81	72%	0.723	43%	0.434	S	S	*	.	H	α-helix	trans	-94.5	-50.1	-177.5	-63.2	168.9	0	0	0	111.9	D425 I426 I427	D425-I429 WeakPolarHBondContact O-CG1 3.48Å; D425-I429 PolarHBondContact O-N 3.38Å; I426-I429 PolarHBondContact O-N 3.39Å; I426-I429 VanDerWaalsContact O-N 3.17Å; I427-I429 VanDerWaalsContact C-N 3.27Å; I427-I429 PolarHBondContact O-N 2.72Å
430	L	92.1	Very high	92.3	Very high	111 Å²	111	80.7 Å²	80.7	58%	0.581	43%	0.43	S	S	*	.	H	α-helix	trans	-99.7	-19.9	-170.2	-62.3	179.7	0	0	0	113.1	I426 E434	I426-L430 HydrophobicContact CG2-CD1 3.94Å; I426-L430 PolarHBondContact O-N 2.98Å; L430-E434 HydrophobicContact CB-CB 4.08Å; L430-E434 HydrophobicContact CB-CG 4.1Å
431	G	91.4	Very high	92.2	Very high	27 Å²	27	83 Å²	83	28%	0.278	44%	0.443	S	S	.	.			trans	88.6	166.6	-172.4	0	0	0	0	0	113.2	I427 D433	I427-G431 VanDerWaalsContact O-CA 3.24Å; I427-G431 WeakPolarHBondContact O-CA 3.42Å; I427-G431 PolarHBondContact O-N 2.69Å; G431-D433 VanDerWaalsContact C-N 3.31Å; G431-D433 PolarHBondContact O-N 3.13Å
432	M	90.7	Very high	92.3	Very high	70 Å²	70	80.5 Å²	80.5	35%	0.345	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-70.9	-23.5	-178	-79.7	-171.7	55.8	0	0	114	I427 E434 L435 K440 V443 R447	I427-M432 HydrophobicContact CG1-CG 4.36Å; I427-M432 HydrophobicContact CG2-CG 3.75Å; M432-E434 VanDerWaalsContact C-N 3.28Å; M432-E434 PolarHBondContact O-N 2.98Å; M432-L435 WeakPolarHBondContact O-CB 3.39Å; M432-L435 PolarHBondContact O-N 3.16Å; M432-K440 VanDerWaalsContact O-CE 3.23Å; M432-K440 WeakPolarHBondContact O-CE 3.41Å; M432-V443 HydrophobicContact CE-CG1 4.37Å; M432-R447 PolarHBondContact SD-NH2 2.93Å
433	D	90.4	Very high	92.4	Very high	139 Å²	139	77.1 Å²	77.1	74%	0.743	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-71.4	-26	-173.5	-65.7	-40.9	0	0	0	112.9	G431 L435 K440	G431-D433 VanDerWaalsContact C-N 3.31Å; G431-D433 PolarHBondContact O-N 3.13Å; D433-L435 VanDerWaalsContact C-N 3.27Å; D433-L435 PolarHBondContact O-N 3.2Å; D433-K440 PolarHBondContact O-NZ 3.45Å
434	E	90.4	Very high	92.4	Very high	144 Å²	144	78.2 Å²	78.2	67%	0.673	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-79.6	-6.6	-179.4	-63.7	-61.5	144.6	0	0	113.5	L430 M432	L430-E434 HydrophobicContact CB-CB 4.08Å; L430-E434 HydrophobicContact CB-CG 4.1Å; M432-E434 VanDerWaalsContact C-N 3.28Å; M432-E434 PolarHBondContact O-N 2.98Å
435	L	92.4	Very high	92.5	Very high	13 Å²	13	76.7 Å²	76.7	7%	0.068	41%	0.41	C	S	.	.	S	Bend	trans	-75.8	150.5	175.5	-68	-177.9	0	0	0	111.5	L423 I426 I427 M432 D433 D439 K440 V443	L423-L435 HydrophobicContact CD2-CD2 4.02Å; I426-L435 HydrophobicContact CG2-CD2 4.17Å; I427-L435 HydrophobicContact CD1-CD1 3.91Å; I427-L435 HydrophobicContact CG1-CD1 3.67Å; I427-L435 HydrophobicContact CG1-CG 4.38Å; M432-L435 WeakPolarHBondContact O-CB 3.39Å; M432-L435 PolarHBondContact O-N 3.16Å; D433-L435 VanDerWaalsContact C-N 3.27Å; D433-L435 PolarHBondContact O-N 3.2Å; L435-D439 HydrophobicContact CB-CB 4.04Å; L435-D439 HydrophobicContact CD1-CB 4.43Å; L435-D439 HydrophobicContact CD2-CB 4.3Å; L435-K440 HydrophobicContact CB-CG 3.88Å; L435-K440 WeakPolarHBondContact O-CE 3.32Å; L435-V443 HydrophobicContact CD1-CG2 3.97Å
436	S	93.8	Very high	92.8	Very high	56 Å²	56	71 Å²	71	39%	0.392	38%	0.38	S	S	.	.			trans	-63.6	157.5	168.8	75.4	0	0	0	0	110.6	E438 D439 K440	S436-E438 PolarHBondContact O-N 2.85Å; S436-D439 WeakPolarHBondContact CB-OD2 3.45Å; S436-D439 PolarHBondContact O-N 2.98Å; S436-D439 VanDerWaalsContact O-N 3.14Å; S436-D439 WeakPolarHBondContact OG-CB 3.43Å; S436-D439 PolarHBondContact OG-N 3.11Å; S436-D439 VanDerWaalsContact OG-N 3.14Å; S436-D439 PolarHBondContact OG-OD2 2.91Å; S436-K440 WeakPolarHBondContact O-CG 3.3Å; S436-K440 PolarHBondContact O-N 2.97Å
437	E	92.8	Very high	92.9	Very high	141 Å²	141	70.9 Å²	70.9	66%	0.659	38%	0.375	S	S	*	.	H	α-helix	trans	-62.1	-29.8	177.9	-65.8	-58.7	125.9	0	0	112.3	K440 L441	E437-K440 IonicContact OE1-NZ 3.51Å; E437-K440 PolarHBondContact OE1-NZ 2.82Å; E437-L441 PolarHBondContact O-N 3.06Å; E437-L441 VanDerWaalsContact O-N 3.14Å
438	E	92.2	Very high	93.1	Very high	156 Å²	156	69.6 Å²	69.6	73%	0.729	37%	0.368	S	S	*	.	H	α-helix	trans	-67.2	-45.7	173.3	-65.2	-177.2	178.9	0	0	111.3	S436 K440 L441 I442	S436-E438 PolarHBondContact O-N 2.85Å; E438-K440 PolarHBondContact O-N 3.08Å; E438-L441 WeakPolarHBondContact O-CB 3.26Å; E438-L441 PolarHBondContact O-N 2.72Å; E438-I442 WeakPolarHBondContact O-CG1 3.2Å; E438-I442 PolarHBondContact O-N 2.92Å
439	D	94.1	Very high	93.2	Very high	49 Å²	49	65.6 Å²	65.6	26%	0.262	34%	0.335	S	S	.	.	H	α-helix	trans	-65.5	-38.7	177.6	-65.1	-40.5	0	0	0	111.7	L423 L435 S436 L441 I442 V443	L423-D439 HydrophobicContact CD1-CB 3.98Å; L423-D439 HydrophobicContact CD2-CB 4.38Å; L435-D439 HydrophobicContact CB-CB 4.04Å; L435-D439 HydrophobicContact CD1-CB 4.43Å; L435-D439 HydrophobicContact CD2-CB 4.3Å; S436-D439 WeakPolarHBondContact CB-OD2 3.45Å; S436-D439 PolarHBondContact O-N 2.98Å; S436-D439 VanDerWaalsContact O-N 3.14Å; S436-D439 WeakPolarHBondContact OG-CB 3.43Å; S436-D439 PolarHBondContact OG-N 3.11Å; S436-D439 VanDerWaalsContact OG-N 3.14Å; S436-D439 PolarHBondContact OG-OD2 2.91Å; D439-L441 VanDerWaalsContact C-N 3.26Å; D439-L441 PolarHBondContact O-N 2.67Å; D439-I442 PolarHBondContact O-N 3.29Å; D439-V443 VanDerWaalsContact O-CG2 3.23Å; D439-V443 WeakPolarHBondContact O-CG2 3.23Å; D439-V443 PolarHBondContact O-N 3.02Å
440	K	92.9	Very high	93.3	Very high	53 Å²	53	60.5 Å²	60.5	23%	0.23	31%	0.308	C	S	.	.	H	α-helix	trans	-59.5	-40	173.7	-72.6	176.3	-173	165	0	111.4	M432 D433 L435 S436 E437 E438 V443 S444	M432-K440 VanDerWaalsContact O-CE 3.23Å; M432-K440 WeakPolarHBondContact O-CE 3.41Å; D433-K440 PolarHBondContact O-NZ 3.45Å; L435-K440 HydrophobicContact CB-CG 3.88Å; L435-K440 WeakPolarHBondContact O-CE 3.32Å; S436-K440 WeakPolarHBondContact O-CG 3.3Å; S436-K440 PolarHBondContact O-N 2.97Å; E437-K440 IonicContact OE1-NZ 3.51Å; E437-K440 PolarHBondContact OE1-NZ 2.82Å; E438-K440 PolarHBondContact O-N 3.08Å; K440-V443 PolarHBondContact O-N 3.29Å; K440-S444 WeakPolarHBondContact O-CB 2.97Å; K440-S444 PolarHBondContact O-N 3.15Å
441	L	93.2	Very high	93.5	Very high	74 Å²	74	58.6 Å²	58.6	39%	0.387	29%	0.293	S	S	.	.	H	α-helix	trans	-68	-41.8	176.8	-174.8	154.2	0	0	0	111.5	E437 E438 D439 V443 S444 R445	E437-L441 PolarHBondContact O-N 3.06Å; E437-L441 VanDerWaalsContact O-N 3.14Å; E438-L441 WeakPolarHBondContact O-CB 3.26Å; E438-L441 PolarHBondContact O-N 2.72Å; D439-L441 VanDerWaalsContact C-N 3.26Å; D439-L441 PolarHBondContact O-N 2.67Å; L441-V443 PolarHBondContact O-N 2.73Å; L441-S444 PolarHBondContact O-N 3.4Å; L441-R445 HydrophobicContact CD2-CG 4.26Å; L441-R445 PolarHBondContact O-N 2.92Å
442	I	93.8	Very high	93.7	Very high	42 Å²	42	57.4 Å²	57.4	22%	0.215	28%	0.28	C	S	.	.	H	α-helix	trans	-57.7	-48.3	172.6	-68.1	170.4	0	0	0	110.5	I416 D419 L423 E438 D439 S444 R445 A446	I416-I442 HydrophobicContact CG2-CG2 4.38Å; D419-I442 HydrophobicContact CB-CG2 4.09Å; L423-I442 HydrophobicContact CD1-CG2 4.37Å; E438-I442 WeakPolarHBondContact O-CG1 3.2Å; E438-I442 PolarHBondContact O-N 2.92Å; D439-I442 PolarHBondContact O-N 3.29Å; I442-S444 VanDerWaalsContact C-N 3.35Å; I442-S444 PolarHBondContact O-N 2.84Å; I442-R445 PolarHBondContact O-N 3.39Å; I442-A446 VanDerWaalsContact O-CB 3.24Å; I442-A446 WeakPolarHBondContact O-CB 3.36Å; I442-A446 PolarHBondContact O-N 2.97Å
443	V	94.8	Very high	94	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-44.2	178.3	171.7	0	0	0	0	111.2	Y420 L423 I427 M432 L435 D439 K440 L441 A446 R447	Y420-V443 HydrophobicContact CD2-CB 4.38Å; Y420-V443 HydrophobicContact CD2-CG1 4.2Å; Y420-V443 HydrophobicContact CD2-CG2 4.07Å; Y420-V443 HydrophobicContact CE2-CG1 3.96Å; Y420-V443 HydrophobicContact CE2-CG2 4.49Å; L423-V443 HydrophobicContact CB-CG2 4.38Å; L423-V443 HydrophobicContact CD1-CG2 3.88Å; I427-V443 HydrophobicContact CD1-CG1 4.23Å; I427-V443 HydrophobicContact CD1-CG2 3.82Å; M432-V443 HydrophobicContact CE-CG1 4.37Å; L435-V443 HydrophobicContact CD1-CG2 3.97Å; D439-V443 VanDerWaalsContact O-CG2 3.23Å; D439-V443 WeakPolarHBondContact O-CG2 3.23Å; D439-V443 PolarHBondContact O-N 3.02Å; K440-V443 PolarHBondContact O-N 3.29Å; L441-V443 PolarHBondContact O-N 2.73Å; V443-A446 PolarHBondContact O-N 3.4Å; V443-R447 WeakPolarHBondContact O-CG 3.5Å; V443-R447 PolarHBondContact O-N 3.39Å
444	S	94.2	Very high	94.2	Very high	41 Å²	41	47.8 Å²	47.8	29%	0.287	23%	0.23	S	C	.	.	H	α-helix	trans	-61.4	-47.6	177.9	-174.1	0	0	0	0	111.8	K440 L441 I442 R447 K448	K440-S444 WeakPolarHBondContact O-CB 2.97Å; K440-S444 PolarHBondContact O-N 3.15Å; L441-S444 PolarHBondContact O-N 3.4Å; I442-S444 VanDerWaalsContact C-N 3.35Å; I442-S444 PolarHBondContact O-N 2.84Å; S444-R447 PolarHBondContact O-N 3.35Å; S444-K448 WeakPolarHBondContact O-CG 3.37Å; S444-K448 PolarHBondContact O-N 3.36Å
445	R	95.1	Very high	94.4	Very high	45 Å²	45	41 Å²	41	17%	0.17	20%	0.199	C	C	.	.	H	α-helix	trans	-65.3	-42.1	177.1	-71.9	-171.8	-176.5	168.7	7	111.9	L441 I442 R447 K448 I449 L484 G486 D489	L441-R445 HydrophobicContact CD2-CG 4.26Å; L441-R445 PolarHBondContact O-N 2.92Å; I442-R445 PolarHBondContact O-N 3.39Å; R445-R447 PolarHBondContact O-N 2.74Å; R445-K448 WeakPolarHBondContact O-CB 3.49Å; R445-K448 PolarHBondContact O-N 2.98Å; R445-I449 WeakPolarHBondContact O-CB 3.4Å; R445-I449 VanDerWaalsContact O-CG1 3.31Å; R445-I449 WeakPolarHBondContact O-CG1 3.39Å; R445-I449 PolarHBondContact O-N 3.49Å; R445-L484 PolarHBondContact NH1-O 3.42Å; R445-G486 VanDerWaalsContact NH2-CA 3.27Å; R445-D489 WeakPolarHBondContact CG-OD1 3.49Å; R445-D489 IonicContact CZ-OD1 3.52Å; R445-D489 IonicContact CZ-OD2 3.53Å; R445-D489 VanDerWaalsContact CZ-OD2 3.28Å; R445-D489 IonicContact NE-OD1 3.35Å; R445-D489 PolarHBondContact NE-OD1 2.94Å; R445-D489 IonicContact NE-OD2 3.59Å; R445-D489 PolarHBondContact NE-OD2 2.82Å; R445-D489 IonicContact NH2-OD1 2.82Å; R445-D489 IonicContact NH2-OD2 3.83Å; R445-D489 PolarHBondContact NH2-OD2 2.83Å
446	A	95.4	Very high	94.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-44.6	178.4	0	0	0	0	0	112	I416 Y420 I442 V443 K448 I449 Q450	I416-A446 HydrophobicContact CG2-CB 3.73Å; Y420-A446 HydrophobicContact CD1-CB 3.83Å; Y420-A446 HydrophobicContact CD2-CB 4.12Å; Y420-A446 HydrophobicContact CG-CB 3.5Å; Y420-A446 VanDerWaalsContact CG-CB 3.5Å; I442-A446 VanDerWaalsContact O-CB 3.24Å; I442-A446 WeakPolarHBondContact O-CB 3.36Å; I442-A446 PolarHBondContact O-N 2.97Å; V443-A446 PolarHBondContact O-N 3.4Å; A446-K448 VanDerWaalsContact C-N 3.34Å; A446-K448 PolarHBondContact O-N 3.33Å; A446-I449 PolarHBondContact O-N 3.26Å; A446-Q450 VanDerWaalsContact O-CB 3.3Å; A446-Q450 WeakPolarHBondContact O-CB 3.46Å; A446-Q450 PolarHBondContact O-N 3.46Å
447	R	94.4	Very high	94.4	Very high	70 Å²	70	38.5 Å²	38.5	26%	0.264	18%	0.18	S	C	.	.	H	α-helix	trans	-62.4	-39.5	175.8	-73.6	-179.4	177	-179.4	3.3	112.7	M432 V443 S444 R445 R451 E493	M432-R447 PolarHBondContact SD-NH2 2.93Å; V443-R447 WeakPolarHBondContact O-CG 3.5Å; V443-R447 PolarHBondContact O-N 3.39Å; S444-R447 PolarHBondContact O-N 3.35Å; R445-R447 PolarHBondContact O-N 2.74Å; R447-R451 WeakPolarHBondContact O-CG 3.48Å; R447-R451 PolarHBondContact O-N 2.8Å; R447-E493 HydrophobicContact CB-CG 4.36Å; R447-E493 WeakPolarHBondContact CD-OE1 3.38Å; R447-E493 IonicContact NH1-OE1 3.41Å
448	K	95.5	Very high	94.2	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.017	17%	0.166	C	C	.	.	H	α-helix	trans	-65	-47.2	175.2	-69.2	172.4	-176.8	-177.7	0	111.6	S444 R445 A446 Q450 R451 F452 Y488 D489 L491 E493 F496	S444-K448 WeakPolarHBondContact O-CG 3.37Å; S444-K448 PolarHBondContact O-N 3.36Å; R445-K448 WeakPolarHBondContact O-CB 3.49Å; R445-K448 PolarHBondContact O-N 2.98Å; A446-K448 VanDerWaalsContact C-N 3.34Å; A446-K448 PolarHBondContact O-N 3.33Å; K448-Q450 PolarHBondContact O-N 3.37Å; K448-R451 PolarHBondContact O-N 3.43Å; K448-F452 VanDerWaalsContact O-CB 3.27Å; K448-F452 WeakPolarHBondContact O-CB 3.49Å; K448-F452 PolarHBondContact O-N 2.79Å; K448-Y488 PolarHBondContact NZ-O 3.12Å; K448-Y488 VanDerWaalsContact NZ-O 3.13Å; K448-D489 VanDerWaalsContact NZ-CA 3.28Å; K448-D489 PolarHBondContact NZ-O 3.36Å; K448-L491 WeakPolarHBondContact CE-O 3.03Å; K448-L491 PolarHBondContact NZ-O 2.81Å; K448-E493 HydrophobicContact CG-CG 4.15Å; K448-F496 HydrophobicContact CB-CD1 4.47Å; K448-F496 HydrophobicContact CB-CD2 4.01Å; K448-F496 HydrophobicContact CB-CE2 4.09Å; K448-F496 HydrophobicContact CB-CG 4.2Å; K448-F496 HydrophobicContact CB-CZ 4.34Å; K448-F496 HydrophobicContact CD-CD2 4.3Å; K448-F496 HydrophobicContact CD-CE2 3.71Å; K448-F496 HydrophobicContact CD-CZ 4.09Å; K448-F496 HydrophobicContact CG-CD2 3.84Å; K448-F496 HydrophobicContact CG-CE2 3.78Å; K448-F496 HydrophobicContact CG-CZ 4.39Å
449	I	96	Very high	93.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-57.9	-49.2	175.3	-71.3	171.4	0	0	0	110.1	V413 I416 L417 R445 A446 R451 F452 L453 F480 I483 L484	V413-I449 HydrophobicContact CG1-CG2 3.7Å; I416-I449 HydrophobicContact CB-CD1 4.35Å; I416-I449 HydrophobicContact CD1-CD1 4.16Å; I416-I449 HydrophobicContact CG2-CD1 4.03Å; L417-I449 HydrophobicContact CD1-CG2 4.08Å; L417-I449 HydrophobicContact CD2-CG2 4.1Å; L417-I449 HydrophobicContact CG-CG2 4.15Å; R445-I449 WeakPolarHBondContact O-CB 3.4Å; R445-I449 VanDerWaalsContact O-CG1 3.31Å; R445-I449 WeakPolarHBondContact O-CG1 3.39Å; R445-I449 PolarHBondContact O-N 3.49Å; A446-I449 PolarHBondContact O-N 3.26Å; I449-R451 VanDerWaalsContact C-N 3.29Å; I449-R451 PolarHBondContact O-N 2.9Å; I449-F452 PolarHBondContact O-N 2.95Å; I449-L453 HydrophobicContact CG2-CD1 4.46Å; I449-L453 WeakPolarHBondContact O-CG 3.33Å; I449-L453 PolarHBondContact O-N 3.42Å; I449-F480 HydrophobicContact CG2-CD1 4.44Å; I449-F480 HydrophobicContact CG2-CE1 4.06Å; I449-I483 HydrophobicContact CD1-CG2 4.19Å; I449-I483 HydrophobicContact CG1-CG2 3.61Å; I449-L484 HydrophobicContact CD1-CD2 4.12Å
450	Q	94.6	Very high	93.4	Very high	35 Å²	35	26.8 Å²	26.8	16%	0.164	13%	0.127	C	C	.	.	H	α-helix	trans	-58.2	-42.2	-179.2	-161.3	-169.2	0.5	0	0	111.6	L381 I383 L417 A446 K448	L381-Q450 VanDerWaalsContact CD1-NE2 3.29Å; I383-Q450 HydrophobicContact CD1-CB 4.5Å; I383-Q450 HydrophobicContact CD1-CG 3.68Å; L417-Q450 HydrophobicContact CD2-CB 4.41Å; A446-Q450 VanDerWaalsContact O-CB 3.3Å; A446-Q450 WeakPolarHBondContact O-CB 3.46Å; A446-Q450 PolarHBondContact O-N 3.46Å; K448-Q450 PolarHBondContact O-N 3.37Å
451	R	95.1	Very high	93	Very high	71 Å²	71	28.2 Å²	28.2	27%	0.268	13%	0.134	S	C	.	.	H	α-helix	trans	-71	-38.1	173.9	-70.7	175.9	-178.7	-103.3	9.1	112.2	R447 K448 I449 L453 S454 E493 F496	R447-R451 WeakPolarHBondContact O-CG 3.48Å; R447-R451 PolarHBondContact O-N 2.8Å; K448-R451 PolarHBondContact O-N 3.43Å; I449-R451 VanDerWaalsContact C-N 3.29Å; I449-R451 PolarHBondContact O-N 2.9Å; R451-L453 PolarHBondContact O-N 3.17Å; R451-S454 WeakPolarHBondContact O-CB 3.31Å; R451-S454 PolarHBondContact O-N 3.37Å; R451-S454 PolarHBondContact O-OG 2.87Å; R451-E493 VanDerWaalsContact CD-O 3.23Å; R451-E493 WeakPolarHBondContact CD-O 3.46Å; R451-E493 IonicContact NE-OE2 3.02Å; R451-F496 CarbonylContact C-O 3.4Å; R451-F496 VanDerWaalsContact C-O 3.23Å; R451-F496 HydrophobicContact CB-CB 4.07Å
452	F	96.6	Very high	92.2	Very high	1 Å²	1	30.2 Å²	30.2	0%	0.004	15%	0.149	C	C	.	.	H	α-helix	trans	-68.4	-22.1	-179.9	-167.5	-124.7	0	0	0	113.4	K177 K448 I449 S454 F480 I483 F496 V499 I502 V505	K177-F452 HydrophobicContact CD-CE1 4.46Å; K177-F452 HydrophobicContact CD-CZ 4.3Å; K177-F452 VanDerWaalsContact CE-O 3.23Å; K177-F452 WeakPolarHBondContact CE-O 3.36Å; K177-F452 PolarHBondContact NZ-O 3.3Å; K448-F452 VanDerWaalsContact O-CB 3.27Å; K448-F452 WeakPolarHBondContact O-CB 3.49Å; K448-F452 PolarHBondContact O-N 2.79Å; I449-F452 PolarHBondContact O-N 2.95Å; F452-S454 PolarHBondContact O-N 3.49Å; F452-F480 HydrophobicContact CB-CE1 4.45Å; F452-F480 HydrophobicContact CD1-CD1 4.05Å; F452-F480 HydrophobicContact CD1-CD2 4.16Å; F452-F480 AromaticContact CD1-CE1 3.61Å; F452-F480 HydrophobicContact CD1-CE1 3.61Å; F452-F480 AromaticContact CD1-CE2 3.74Å; F452-F480 HydrophobicContact CD1-CE2 3.74Å; F452-F480 HydrophobicContact CD1-CG 4.31Å; F452-F480 AromaticContact CD1-CZ 3.43Å; F452-F480 HydrophobicContact CD1-CZ 3.43Å; F452-F480 VanDerWaalsContact CD1-CZ 3.43Å; F452-F480 HydrophobicContact CE1-CD2 4.01Å; F452-F480 HydrophobicContact CE1-CE1 4.41Å; F452-F480 AromaticContact CE1-CE2 3.82Å; F452-F480 HydrophobicContact CE1-CE2 3.82Å; F452-F480 HydrophobicContact CE1-CG 4.39Å; F452-F480 HydrophobicContact CE1-CZ 4.01Å; F452-F480 HydrophobicContact CG-CE1 4.5Å; F452-F480 HydrophobicContact CG-CZ 4.31Å; F452-I483 HydrophobicContact CB-CD1 4.21Å; F452-I483 HydrophobicContact CD1-CD1 3.43Å; F452-I483 VanDerWaalsContact CD1-CD1 3.43Å; F452-I483 HydrophobicContact CE1-CD1 3.93Å; F452-I483 HydrophobicContact CG-CD1 3.86Å; F452-F496 WeakPolarHBondContact CA-O 3.4Å; F452-F496 HydrophobicContact CB-CB 4.12Å; F452-F496 HydrophobicContact CB-CD1 3.92Å; F452-F496 HydrophobicContact CB-CG 4.48Å; F452-F496 AromaticContact CD2-CD1 3.93Å; F452-F496 HydrophobicContact CD2-CD1 3.93Å; F452-F496 HydrophobicContact CG-CD1 4.04Å; F452-F496 PolarHBondContact N-O 2.63Å; F452-V499 HydrophobicContact CD2-CG2 4Å; F452-V499 HydrophobicContact CE2-CG2 4.11Å; F452-I502 HydrophobicContact CE1-CD1 4.35Å; F452-I502 HydrophobicContact CE2-CD1 4.16Å; F452-I502 HydrophobicContact CZ-CB 4.25Å; F452-I502 HydrophobicContact CZ-CD1 3.94Å; F452-V505 HydrophobicContact CD2-CG2 3.95Å; F452-V505 HydrophobicContact CE2-CG2 3.72Å
453	L	95.6	Very high	91.3	Very high	8 Å²	8	34.7 Å²	34.7	4%	0.042	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.8	168.7	-68.8	168.2	0	0	0	112.6	V178 L182 P389 L417 I449 R451 F480	V178-L453 HydrophobicContact CB-CB 4.33Å; V178-L453 HydrophobicContact CB-CD2 3.83Å; V178-L453 HydrophobicContact CG2-CD2 3.93Å; L182-L453 HydrophobicContact CD1-CD1 4.46Å; L182-L453 HydrophobicContact CD1-CD2 4.16Å; P389-L453 HydrophobicContact CB-CD1 4.02Å; P389-L453 HydrophobicContact CG-CD1 4.21Å; L417-L453 HydrophobicContact CD1-CD1 4.27Å; I449-L453 HydrophobicContact CG2-CD1 4.46Å; I449-L453 WeakPolarHBondContact O-CG 3.33Å; I449-L453 PolarHBondContact O-N 3.42Å; R451-L453 PolarHBondContact O-N 3.17Å; L453-F480 HydrophobicContact CD2-CE1 3.88Å; L453-F480 HydrophobicContact CD2-CE2 4.35Å; L453-F480 HydrophobicContact CD2-CZ 3.44Å; L453-F480 VanDerWaalsContact CD2-CZ 3.44Å; L453-F480 HydrophobicContact CG-CE1 4.16Å; L453-F480 HydrophobicContact CG-CZ 3.99Å
454	S	95.1	Very high	90.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.184	C	C	.	.			trans	-68.8	148.7	171	72.6	0	0	0	0	111.6	K177 Y384 R451 F452 M498	K177-S454 WeakPolarHBondContact CE-O 3.5Å; K177-S454 PolarHBondContact NZ-O 3.4Å; K177-S454 VanDerWaalsContact NZ-O 3.13Å; Y384-S454 CarbonylContact O-C 3.47Å; Y384-S454 VanDerWaalsContact O-CA 3.24Å; Y384-S454 WeakPolarHBondContact O-CA 3.44Å; Y384-S454 WeakPolarHBondContact O-CB 3.46Å; R451-S454 WeakPolarHBondContact O-CB 3.31Å; R451-S454 PolarHBondContact O-N 3.37Å; R451-S454 PolarHBondContact O-OG 2.87Å; F452-S454 PolarHBondContact O-N 3.49Å; S454-M498 PolarHBondContact OG-N 2.84Å
455	Q	94.9	Very high	90.1	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.009	21%	0.205	C	C	.	.			trans	-150.1	131.9	-177.8	-178.6	175	-32.2	0	0	110.2	G175 Y384 F457 K469	G175-Q455 PolarHBondContact O-NE2 2.77Å; Y384-Q455 PolarHBondContact O-N 2.92Å; Q455-F457 HydrophobicContact CB-CE1 4.5Å; Q455-F457 HydrophobicContact CG-CD1 4.47Å; Q455-F457 PolarHBondContact O-N 3.22Å; Q455-K469 PolarHBondContact NE2-O 3.49Å
456	P	93.6	Very high	89.6	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.019	22%	0.216	C	C	.	.			trans	-71.5	122	171.9	29.6	-32.4	0	0	0	109.9	H466 G468 K469 M498	P456-H466 HydrophobicContact CB-CB 4.01Å; P456-G468 WeakPolarHBondContact O-CA 3.34Å; P456-K469 HydrophobicContact CG-CB 4.2Å; P456-K469 HydrophobicContact CG-CG 3.84Å; P456-K469 PolarHBondContact O-N 3.12Å; P456-M498 HydrophobicContact CB-CE 3.92Å
457	F	92.6	Very high	89.3	Confident	12 Å²	12	43.4 Å²	43.4	5%	0.053	24%	0.237	C	C	.	.			trans	-86.6	144.4	176.7	-71.6	-17.2	0	0	0	111.9	I176 V203 L204 E207 P385 Q455 V459 A460 E461	I176-F457 HydrophobicContact CD1-CE1 4.06Å; I176-F457 HydrophobicContact CD1-CZ 3.97Å; I176-F457 HydrophobicContact CG1-CE1 4.06Å; I176-F457 HydrophobicContact CG1-CZ 4.44Å; I176-F457 HydrophobicContact CG2-CE1 4.17Å; I176-F457 HydrophobicContact CG2-CZ 4.3Å; V203-F457 HydrophobicContact CG1-CD2 3.89Å; L204-F457 HydrophobicContact CD1-CE2 4.08Å; L204-F457 HydrophobicContact CD1-CZ 3.79Å; E207-F457 HydrophobicContact CB-CB 4.39Å; E207-F457 HydrophobicContact CB-CD1 4.3Å; E207-F457 HydrophobicContact CB-CD2 3.97Å; E207-F457 HydrophobicContact CB-CE2 4.19Å; E207-F457 HydrophobicContact CB-CG 3.99Å; E207-F457 HydrophobicContact CB-CZ 4.44Å; E207-F457 HydrophobicContact CG-CB 4.05Å; E207-F457 HydrophobicContact CG-CD1 3.57Å; E207-F457 HydrophobicContact CG-CD2 4.15Å; E207-F457 HydrophobicContact CG-CE1 3.91Å; E207-F457 HydrophobicContact CG-CE2 4.44Å; E207-F457 HydrophobicContact CG-CG 3.68Å; E207-F457 HydrophobicContact CG-CZ 4.31Å; E207-F457 WeakPolarHBondContact OE1-CA 3.11Å; P385-F457 HydrophobicContact CB-CE2 3.93Å; P385-F457 HydrophobicContact CB-CZ 3.63Å; P385-F457 HydrophobicContact CG-CE1 4.24Å; P385-F457 HydrophobicContact CG-CE2 4.38Å; P385-F457 HydrophobicContact CG-CZ 3.62Å; Q455-F457 HydrophobicContact CB-CE1 4.5Å; Q455-F457 HydrophobicContact CG-CD1 4.47Å; Q455-F457 PolarHBondContact O-N 3.22Å; F457-V459 HydrophobicContact CB-CG2 4.3Å; F457-A460 HydrophobicContact CB-CB 3.96Å; F457-A460 PolarHBondContact O-N 2.79Å; F457-E461 PolarHBondContact O-N 3.02Å
458	Q	88	Confident	89.1	Confident	76 Å²	76	41 Å²	41	36%	0.355	23%	0.234	S	C	.	.	S	Bend	trans	-69.7	-39	179.9	-170.8	167.3	23.1	0	0	111.9	E207 N210 A460 E461	E207-Q458 PolarHBondContact OE1-N 3.39Å; E207-Q458 PolarHBondContact OE2-N 3.35Å; N210-Q458 PolarHBondContact ND2-OE1 3.26Å; N210-Q458 VanDerWaalsContact ND2-OE1 3.07Å; Q458-A460 PolarHBondContact O-N 3.42Å; Q458-E461 WeakPolarHBondContact O-CB 3.39Å; Q458-E461 PolarHBondContact O-N 2.73Å
459	V	83.9	Confident	88.9	Confident	13 Å²	13	44.2 Å²	44.2	8%	0.079	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-21.1	174.9	-59.3	0	0	0	0	112.5	V203 M206 E207 N210 F457	V203-V459 HydrophobicContact CG1-CG2 3.94Å; M206-V459 HydrophobicContact CB-CB 4.25Å; M206-V459 HydrophobicContact CB-CG1 4.09Å; M206-V459 HydrophobicContact CB-CG2 4.03Å; E207-V459 HydrophobicContact CB-CG2 4.03Å; E207-V459 WeakPolarHBondContact OE2-CG2 3.1Å; E207-V459 PolarHBondContact OE2-N 3.23Å; E207-V459 VanDerWaalsContact OE2-N 3.1Å; N210-V459 HydrophobicContact CB-CG1 3.99Å; F457-V459 HydrophobicContact CB-CG2 4.3Å
460	A	85.3	Confident	88.7	Confident	11 Å²	11	48.1 Å²	48.1	9%	0.091	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	1.8	-180	0	0	0	0	0	113.8	V203 F457 Q458 V462 F463 T464	V203-A460 HydrophobicContact CG1-CB 4.11Å; F457-A460 HydrophobicContact CB-CB 3.96Å; F457-A460 PolarHBondContact O-N 2.79Å; Q458-A460 PolarHBondContact O-N 3.42Å; A460-V462 VanDerWaalsContact C-N 3.25Å; A460-V462 PolarHBondContact O-N 3.22Å; A460-F463 PolarHBondContact O-N 3.28Å; A460-F463 VanDerWaalsContact O-N 3.08Å; A460-T464 HydrophobicContact CB-CG2 4.15Å; A460-T464 WeakPolarHBondContact O-CB 3.49Å; A460-T464 WeakPolarHBondContact O-CG2 3.46Å; A460-T464 PolarHBondContact O-N 3.04Å; A460-T464 PolarHBondContact O-OG1 2.62Å
461	E	85.1	Confident	88.7	Confident	84 Å²	84	46.5 Å²	46.5	39%	0.393	26%	0.261	S	S	.	.	H	α-helix	trans	-59.5	-37.1	-177.7	-178.2	167.6	-178.1	0	0	111.8	F457 Q458 F463 G465 H466	F457-E461 PolarHBondContact O-N 3.02Å; Q458-E461 WeakPolarHBondContact O-CB 3.39Å; Q458-E461 PolarHBondContact O-N 2.73Å; E461-F463 VanDerWaalsContact C-N 3.27Å; E461-F463 PolarHBondContact O-N 3.05Å; E461-G465 WeakPolarHBondContact O-CA 3.3Å; E461-G465 PolarHBondContact O-N 3.14Å; E461-H466 WeakPolarHBondContact CG-O 3.49Å
462	V	76.1	Confident	88.6	Confident	115 Å²	115	45.7 Å²	45.7	70%	0.697	27%	0.265	S	S	*	.	H	α-helix	trans	-62.6	-33.6	177.7	-175	0	0	0	0	112.1	A460	A460-V462 VanDerWaalsContact C-N 3.25Å; A460-V462 PolarHBondContact O-N 3.22Å
463	F	76.3	Confident	88.5	Confident	137 Å²	137	47.3 Å²	47.3	60%	0.601	27%	0.274	S	S	*	.	H	α-helix	trans	-93	-34.2	-177.4	-53.7	-67.9	0	0	0	113	A460 E461	A460-F463 PolarHBondContact O-N 3.28Å; A460-F463 VanDerWaalsContact O-N 3.08Å; E461-F463 VanDerWaalsContact C-N 3.27Å; E461-F463 PolarHBondContact O-N 3.05Å
464	T	80.8	Confident	88.4	Confident	59 Å²	59	55.4 Å²	55.4	36%	0.362	31%	0.308	S	S	.	.	H	α-helix	trans	-97	-22.4	-173	62.1	0	0	0	0	113.4	A460 H466 M498	A460-T464 HydrophobicContact CB-CG2 4.15Å; A460-T464 WeakPolarHBondContact O-CB 3.49Å; A460-T464 WeakPolarHBondContact O-CG2 3.46Å; A460-T464 PolarHBondContact O-N 3.04Å; A460-T464 PolarHBondContact O-OG1 2.62Å; T464-H466 PolarHBondContact O-N 2.9Å; T464-H466 PolarHBondContact OG1-N 3.05Å; T464-M498 HydrophobicContact CG2-CE 4.48Å
465	G	82.3	Confident	88.4	Confident	69 Å²	69	59 Å²	59	71%	0.711	33%	0.325	S	S	*	.			trans	68.6	3.2	-172.7	0	0	0	0	0	114.3	E461	E461-G465 WeakPolarHBondContact O-CA 3.3Å; E461-G465 PolarHBondContact O-N 3.14Å
466	H	85.1	Confident	88.4	Confident	87 Å²	87	58.9 Å²	58.9	40%	0.403	33%	0.325	S	S	.	.	S	Bend	trans	-96.3	131.3	175.4	-68.2	-59.9	0	0	0	110.1	P456 E461 T464 G468	P456-H466 HydrophobicContact CB-CB 4.01Å; E461-H466 WeakPolarHBondContact CG-O 3.49Å; T464-H466 PolarHBondContact O-N 2.9Å; T464-H466 PolarHBondContact OG1-N 3.05Å; H466-G468 PolarHBondContact O-N 3.34Å
467	A	89.4	Confident	88.5	Confident	54 Å²	54	59.5 Å²	59.5	45%	0.446	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-62.2	127.9	175.8	0	0	0	0	0	110.5
468	G	90.3	Very high	88.7	Confident	20 Å²	20	61.1 Å²	61.1	21%	0.206	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-62	144.2	178.5	0	0	0	0	0	112.9	P456 H466	P456-G468 WeakPolarHBondContact O-CA 3.34Å; H466-G468 PolarHBondContact O-N 3.34Å
469	K	91.2	Very high	89	Confident	72 Å²	72	57.5 Å²	57.5	31%	0.313	32%	0.323	S	S	.	.			trans	-126.1	125.8	-179.1	-61.2	-67.2	178.4	156	0	110.5	Q455 P456 E504	Q455-K469 PolarHBondContact NE2-O 3.49Å; P456-K469 HydrophobicContact CG-CB 4.2Å; P456-K469 HydrophobicContact CG-CG 3.84Å; P456-K469 PolarHBondContact O-N 3.12Å; K469-E504 WeakPolarHBondContact CD-OE1 3.34Å; K469-E504 WeakPolarHBondContact CE-OE1 3.38Å; K469-E504 IonicContact NZ-OE1 3.28Å; K469-E504 PolarHBondContact NZ-OE1 3.24Å
470	L	91.2	Very high	89.6	Confident	82 Å²	82	56.9 Å²	56.9	43%	0.429	32%	0.32	S	S	.	.			trans	-97.2	115.6	169.7	-173.9	147.9	0	0	0	107.8	N211	N211-L470 HydrophobicContact CB-CD1 4.07Å
471	V	93.8	Very high	90.1	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.33	C	S	.	.			trans	-102.9	119.8	-173.3	-173	0	0	0	0	110	G175 K177 E475 T476 P501	G175-V471 WeakPolarHBondContact CA-O 3.49Å; G175-V471 PolarHBondContact O-N 2.95Å; K177-V471 HydrophobicContact CD-CB 4.5Å; K177-V471 HydrophobicContact CD-CG1 4.28Å; K177-V471 HydrophobicContact CD-CG2 4.2Å; K177-V471 HydrophobicContact CG-CB 3.94Å; K177-V471 HydrophobicContact CG-CG1 3.97Å; K177-V471 HydrophobicContact CG-CG2 4.03Å; V471-E475 HydrophobicContact CG1-CB 4.26Å; V471-T476 WeakPolarHBondContact CG1-OG1 3.27Å; V471-P501 HydrophobicContact CG1-CB 4.45Å
472	P	94.1	Very high	90.6	Very high	55 Å²	55	56.5 Å²	56.5	36%	0.357	32%	0.318	S	S	.	.			trans	-61.9	147.1	174.8	-22.7	33.9	0	0	0	112.8	K474 E475 T476	P472-K474 VanDerWaalsContact C-N 3.28Å; P472-K474 PolarHBondContact O-N 2.79Å; P472-E475 HydrophobicContact CB-CG 4.41Å; P472-E475 WeakPolarHBondContact CD-OE2 3.41Å; P472-E475 HydrophobicContact CG-CG 4.43Å; P472-E475 PolarHBondContact O-N 3.09Å; P472-E475 VanDerWaalsContact O-N 3.13Å; P472-T476 PolarHBondContact O-N 3.48Å; P472-T476 PolarHBondContact O-OG1 2.96Å
473	L	93.5	Very high	91.4	Very high	34 Å²	34	51.1 Å²	51.1	18%	0.178	29%	0.286	C	S	.	.	H	α-helix	trans	-53.8	-41.9	179.8	177.7	62.9	0	0	0	113.2	I171 V173 D180 E475 T476 I477	I171-L473 HydrophobicContact CD1-CD2 4.42Å; V173-L473 HydrophobicContact CG1-CB 4.33Å; V173-L473 HydrophobicContact CG2-CB 4.47Å; V173-L473 HydrophobicContact CG2-CD2 4.43Å; D180-L473 HydrophobicContact CB-CD1 4.02Å; L473-E475 PolarHBondContact O-N 3.08Å; L473-T476 WeakPolarHBondContact O-CB 3.41Å; L473-T476 PolarHBondContact O-N 2.82Å; L473-I477 HydrophobicContact CD1-CD1 4.02Å; L473-I477 HydrophobicContact CD1-CG1 4.28Å; L473-I477 HydrophobicContact CG-CD1 3.94Å; L473-I477 WeakPolarHBondContact O-CG1 3.41Å; L473-I477 PolarHBondContact O-N 2.74Å
474	K	94.8	Very high	92.3	Very high	178 Å²	178	46.1 Å²	46.1	77%	0.774	27%	0.265	S	S	*	.	H	α-helix	trans	-63.1	-42.2	-179.6	-68.3	-175.5	179	-179.1	0	112.5	P472 T476 I477 S478	P472-K474 VanDerWaalsContact C-N 3.28Å; P472-K474 PolarHBondContact O-N 2.79Å; K474-T476 VanDerWaalsContact C-N 3.33Å; K474-I477 PolarHBondContact O-N 2.96Å; K474-S478 PolarHBondContact O-N 2.84Å; K474-S478 PolarHBondContact O-OG 3.18Å
475	E	94.7	Very high	92.9	Very high	75 Å²	75	48.1 Å²	48.1	35%	0.35	27%	0.273	S	S	.	.	H	α-helix	trans	-68.7	-35	178.2	-67.4	177.2	-161.4	0	0	111.3	V471 P472 L473 S478 G479 P501	V471-E475 HydrophobicContact CG1-CB 4.26Å; P472-E475 HydrophobicContact CB-CG 4.41Å; P472-E475 WeakPolarHBondContact CD-OE2 3.41Å; P472-E475 HydrophobicContact CG-CG 4.43Å; P472-E475 PolarHBondContact O-N 3.09Å; P472-E475 VanDerWaalsContact O-N 3.13Å; L473-E475 PolarHBondContact O-N 3.08Å; E475-S478 WeakPolarHBondContact CA-OG 3.5Å; E475-S478 PolarHBondContact O-OG 2.83Å; E475-G479 PolarHBondContact O-N 3.31Å; E475-P501 HydrophobicContact CB-CB 4.35Å; E475-P501 WeakPolarHBondContact OE2-CB 3.45Å
476	T	95.2	Very high	93.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.3	-54	171.3	-57.4	0	0	0	0	110.4	K177 L181 V471 P472 L473 K474 S478 G479 F480	K177-T476 HydrophobicContact CB-CG2 4.06Å; K177-T476 HydrophobicContact CG-CG2 4.08Å; L181-T476 HydrophobicContact CB-CG2 4.01Å; V471-T476 WeakPolarHBondContact CG1-OG1 3.27Å; P472-T476 PolarHBondContact O-N 3.48Å; P472-T476 PolarHBondContact O-OG1 2.96Å; L473-T476 WeakPolarHBondContact O-CB 3.41Å; L473-T476 PolarHBondContact O-N 2.82Å; K474-T476 VanDerWaalsContact C-N 3.33Å; T476-S478 PolarHBondContact O-N 3.27Å; T476-G479 PolarHBondContact O-N 3.09Å; T476-F480 HydrophobicContact CG2-CD2 3.88Å; T476-F480 HydrophobicContact CG2-CE2 3.88Å; T476-F480 VanDerWaalsContact O-CD2 3.24Å; T476-F480 WeakPolarHBondContact O-CD2 3.17Å; T476-F480 PolarHBondContact O-N 2.99Å
477	I	95.8	Very high	93.8	Very high	17 Å²	17	47 Å²	47	9%	0.087	25%	0.254	C	S	.	.	H	α-helix	trans	-60.6	-49.5	-177.7	-64.7	164.1	0	0	0	111	E405 H406 V409 L473 K474 G479 F480 Q481	E405-I477 HydrophobicContact CG-CG2 4.04Å; H406-I477 HydrophobicContact CB-CD1 3.72Å; H406-I477 HydrophobicContact CB-CG1 4.34Å; V409-I477 HydrophobicContact CG2-CG2 4.18Å; L473-I477 HydrophobicContact CD1-CD1 4.02Å; L473-I477 HydrophobicContact CD1-CG1 4.28Å; L473-I477 HydrophobicContact CG-CD1 3.94Å; L473-I477 WeakPolarHBondContact O-CG1 3.41Å; L473-I477 PolarHBondContact O-N 2.74Å; K474-I477 PolarHBondContact O-N 2.96Å; I477-G479 VanDerWaalsContact C-N 3.34Å; I477-G479 PolarHBondContact O-N 2.81Å; I477-F480 PolarHBondContact O-N 3.23Å; I477-Q481 VanDerWaalsContact O-CB 3.32Å; I477-Q481 WeakPolarHBondContact O-CB 3.45Å; I477-Q481 PolarHBondContact O-N 2.86Å
478	S	95.5	Very high	93.9	Very high	45 Å²	45	46.9 Å²	46.9	32%	0.315	24%	0.242	S	C	.	.	H	α-helix	trans	-63.1	-40.4	-180	61.1	0	0	0	0	112.1	K474 E475 T476 Q481 S482	K474-S478 PolarHBondContact O-N 2.84Å; K474-S478 PolarHBondContact O-OG 3.18Å; E475-S478 WeakPolarHBondContact CA-OG 3.5Å; E475-S478 PolarHBondContact O-OG 2.83Å; T476-S478 PolarHBondContact O-N 3.27Å; S478-Q481 PolarHBondContact O-N 2.78Å; S478-S482 PolarHBondContact O-N 2.95Å; S478-S482 PolarHBondContact O-OG 3.45Å
479	G	94.8	Very high	94	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-47.4	178.1	0	0	0	0	0	112.6	E475 T476 I477 I483	E475-G479 PolarHBondContact O-N 3.31Å; T476-G479 PolarHBondContact O-N 3.09Å; I477-G479 VanDerWaalsContact C-N 3.34Å; I477-G479 PolarHBondContact O-N 2.81Å; G479-I483 WeakPolarHBondContact O-CG1 3.39Å; G479-I483 PolarHBondContact O-N 2.95Å
480	F	96.2	Very high	94	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.8	-36.6	176.3	-79	-79.2	0	0	0	112.3	K177 L181 V409 V413 I449 F452 L453 T476 I477 I483 L484	K177-F480 HydrophobicContact CB-CE2 4.36Å; L181-F480 HydrophobicContact CD2-CB 4.14Å; L181-F480 HydrophobicContact CD2-CD1 3.97Å; L181-F480 HydrophobicContact CD2-CD2 3.47Å; L181-F480 VanDerWaalsContact CD2-CD2 3.47Å; L181-F480 HydrophobicContact CD2-CE1 4.24Å; L181-F480 HydrophobicContact CD2-CE2 3.79Å; L181-F480 HydrophobicContact CD2-CG 3.58Å; L181-F480 HydrophobicContact CD2-CZ 4.17Å; L181-F480 HydrophobicContact CG-CD2 4.49Å; V409-F480 HydrophobicContact CG1-CB 3.71Å; V413-F480 HydrophobicContact CG2-CB 4.14Å; V413-F480 HydrophobicContact CG2-CD1 3.75Å; V413-F480 HydrophobicContact CG2-CG 4.23Å; I449-F480 HydrophobicContact CG2-CD1 4.44Å; I449-F480 HydrophobicContact CG2-CE1 4.06Å; F452-F480 HydrophobicContact CB-CE1 4.45Å; F452-F480 HydrophobicContact CD1-CD1 4.05Å; F452-F480 HydrophobicContact CD1-CD2 4.16Å; F452-F480 AromaticContact CD1-CE1 3.61Å; F452-F480 HydrophobicContact CD1-CE1 3.61Å; F452-F480 AromaticContact CD1-CE2 3.74Å; F452-F480 HydrophobicContact CD1-CE2 3.74Å; F452-F480 HydrophobicContact CD1-CG 4.31Å; F452-F480 AromaticContact CD1-CZ 3.43Å; F452-F480 HydrophobicContact CD1-CZ 3.43Å; F452-F480 VanDerWaalsContact CD1-CZ 3.43Å; F452-F480 HydrophobicContact CE1-CD2 4.01Å; F452-F480 HydrophobicContact CE1-CE1 4.41Å; F452-F480 AromaticContact CE1-CE2 3.82Å; F452-F480 HydrophobicContact CE1-CE2 3.82Å; F452-F480 HydrophobicContact CE1-CG 4.39Å; F452-F480 HydrophobicContact CE1-CZ 4.01Å; F452-F480 HydrophobicContact CG-CE1 4.5Å; F452-F480 HydrophobicContact CG-CZ 4.31Å; L453-F480 HydrophobicContact CD2-CE1 3.88Å; L453-F480 HydrophobicContact CD2-CE2 4.35Å; L453-F480 HydrophobicContact CD2-CZ 3.44Å; L453-F480 VanDerWaalsContact CD2-CZ 3.44Å; L453-F480 HydrophobicContact CG-CE1 4.16Å; L453-F480 HydrophobicContact CG-CZ 3.99Å; T476-F480 HydrophobicContact CG2-CD2 3.88Å; T476-F480 HydrophobicContact CG2-CE2 3.88Å; T476-F480 VanDerWaalsContact O-CD2 3.24Å; T476-F480 WeakPolarHBondContact O-CD2 3.17Å; T476-F480 PolarHBondContact O-N 2.99Å; I477-F480 PolarHBondContact O-N 3.23Å; F480-I483 PolarHBondContact O-N 3.2Å; F480-L484 WeakPolarHBondContact O-CG 3.13Å; F480-L484 PolarHBondContact O-N 3.4Å
481	Q	96.3	Very high	94.1	Very high	67 Å²	67	47.8 Å²	47.8	31%	0.313	26%	0.261	S	S	.	.	H	α-helix	trans	-60.8	-46.1	176.3	-170.1	179.7	25.6	0	0	112.2	V409 I477 S478 I483 L484 N485	V409-Q481 HydrophobicContact CG2-CB 3.87Å; V409-Q481 HydrophobicContact CG2-CG 4.06Å; I477-Q481 VanDerWaalsContact O-CB 3.32Å; I477-Q481 WeakPolarHBondContact O-CB 3.45Å; I477-Q481 PolarHBondContact O-N 2.86Å; S478-Q481 PolarHBondContact O-N 2.78Å; Q481-I483 VanDerWaalsContact C-N 3.3Å; Q481-I483 PolarHBondContact O-N 3.5Å; Q481-L484 WeakPolarHBondContact O-CB 3.46Å; Q481-L484 PolarHBondContact O-N 2.92Å; Q481-L484 VanDerWaalsContact O-N 3.16Å; Q481-N485 VanDerWaalsContact O-CG 3.25Å; Q481-N485 PolarHBondContact O-N 3.41Å; Q481-N485 PolarHBondContact O-ND2 3.38Å
482	S	94.9	Very high	94.1	Very high	20 Å²	20	50.7 Å²	50.7	14%	0.14	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-34.6	176.8	-73.4	0	0	0	0	112.9	S478 N485 G486 E487	S478-S482 PolarHBondContact O-N 2.95Å; S478-S482 PolarHBondContact O-OG 3.45Å; S482-N485 PolarHBondContact O-N 3.04Å; S482-G486 PolarHBondContact O-N 3.24Å; S482-E487 VanDerWaalsContact CB-OE2 3.22Å; S482-E487 WeakPolarHBondContact CB-OE2 3.47Å; S482-E487 PolarHBondContact O-N 2.9Å; S482-E487 VanDerWaalsContact O-N 3.08Å; S482-E487 PolarHBondContact OG-OE2 3.18Å
483	I	93.9	Very high	94	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-66.4	-42.7	173.2	-63.7	166.4	0	0	0	110.6	I449 F452 G479 F480 Q481 N485 G486 Y488 F496 I502	I449-I483 HydrophobicContact CD1-CG2 4.19Å; I449-I483 HydrophobicContact CG1-CG2 3.61Å; F452-I483 HydrophobicContact CB-CD1 4.21Å; F452-I483 HydrophobicContact CD1-CD1 3.43Å; F452-I483 VanDerWaalsContact CD1-CD1 3.43Å; F452-I483 HydrophobicContact CE1-CD1 3.93Å; F452-I483 HydrophobicContact CG-CD1 3.86Å; G479-I483 WeakPolarHBondContact O-CG1 3.39Å; G479-I483 PolarHBondContact O-N 2.95Å; F480-I483 PolarHBondContact O-N 3.2Å; Q481-I483 VanDerWaalsContact C-N 3.3Å; Q481-I483 PolarHBondContact O-N 3.5Å; I483-N485 VanDerWaalsContact C-N 3.32Å; I483-N485 PolarHBondContact O-N 2.88Å; I483-G486 PolarHBondContact O-N 3.12Å; I483-G486 VanDerWaalsContact O-N 3.16Å; I483-Y488 HydrophobicContact CG1-CD2 4.31Å; I483-F496 HydrophobicContact CD1-CD1 4.04Å; I483-F496 HydrophobicContact CD1-CE1 3.66Å; I483-F496 HydrophobicContact CG1-CE1 3.89Å; I483-I502 HydrophobicContact CD1-CD1 4Å; I483-I502 HydrophobicContact CG1-CD1 4.09Å
484	L	94.2	Very high	94	Very high	32 Å²	32	52.9 Å²	52.9	17%	0.168	28%	0.284	C	S	.	.	H	α-helix	trans	-62.4	-38.9	176	-68.8	178.1	0	0	0	112.1	V409 V413 I416 R445 I449 F480 Q481 G486	V409-L484 HydrophobicContact CG1-CD1 4.08Å; V413-L484 HydrophobicContact CG2-CD1 4.2Å; V413-L484 HydrophobicContact CG2-CD2 4.16Å; V413-L484 HydrophobicContact CG2-CG 4.31Å; I416-L484 HydrophobicContact CD1-CD2 3.42Å; I416-L484 VanDerWaalsContact CD1-CD2 3.42Å; I416-L484 HydrophobicContact CG1-CD2 4.35Å; R445-L484 PolarHBondContact NH1-O 3.42Å; I449-L484 HydrophobicContact CD1-CD2 4.12Å; F480-L484 WeakPolarHBondContact O-CG 3.13Å; F480-L484 PolarHBondContact O-N 3.4Å; Q481-L484 WeakPolarHBondContact O-CB 3.46Å; Q481-L484 PolarHBondContact O-N 2.92Å; Q481-L484 VanDerWaalsContact O-N 3.16Å; L484-G486 PolarHBondContact O-N 3.34Å
485	N	93.9	Very high	93.9	Very high	101 Å²	101	44.4 Å²	44.4	54%	0.54	25%	0.247	S	C	.	.	H	α-helix	trans	-71.2	-13.7	177.2	-68.2	-16.5	0	0	0	113.5	Q481 S482 I483 E487	Q481-N485 VanDerWaalsContact O-CG 3.25Å; Q481-N485 PolarHBondContact O-N 3.41Å; Q481-N485 PolarHBondContact O-ND2 3.38Å; S482-N485 PolarHBondContact O-N 3.04Å; I483-N485 VanDerWaalsContact C-N 3.32Å; I483-N485 PolarHBondContact O-N 2.88Å; N485-E487 HydrophobicContact CB-CG 4.24Å; N485-E487 PolarHBondContact ND2-OE1 2.8Å
486	G	92.3	Very high	94	Very high	16 Å²	16	40.9 Å²	40.9	17%	0.165	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	13.3	179.7	0	0	0	0	0	115.2	R445 S482 I483 L484 Y488 D489	R445-G486 VanDerWaalsContact NH2-CA 3.27Å; S482-G486 PolarHBondContact O-N 3.24Å; I483-G486 PolarHBondContact O-N 3.12Å; I483-G486 VanDerWaalsContact O-N 3.16Å; L484-G486 PolarHBondContact O-N 3.34Å; G486-Y488 PolarHBondContact O-N 2.94Å; G486-D489 PolarHBondContact O-N 2.98Å
487	E	92.8	Very high	93.9	Very high	116 Å²	116	43.7 Å²	43.7	54%	0.542	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.8	-178.2	-67.3	168.6	-155.6	0	0	112.2	S482 N485	S482-E487 VanDerWaalsContact CB-OE2 3.22Å; S482-E487 WeakPolarHBondContact CB-OE2 3.47Å; S482-E487 PolarHBondContact O-N 2.9Å; S482-E487 VanDerWaalsContact O-N 3.08Å; S482-E487 PolarHBondContact OG-OE2 3.18Å; N485-E487 HydrophobicContact CB-CG 4.24Å; N485-E487 PolarHBondContact ND2-OE1 2.8Å
488	Y	93.1	Very high	93.7	Very high	52 Å²	52	43.8 Å²	43.8	20%	0.204	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	23.2	-178.1	-57.8	-68.1	0	0	0	113.8	K448 I483 G486 A490 L491 I502 V506	K448-Y488 PolarHBondContact NZ-O 3.12Å; K448-Y488 VanDerWaalsContact NZ-O 3.13Å; I483-Y488 HydrophobicContact CG1-CD2 4.31Å; G486-Y488 PolarHBondContact O-N 2.94Å; Y488-A490 PolarHBondContact O-N 3.43Å; Y488-L491 HydrophobicContact CD1-CD1 3.61Å; Y488-L491 HydrophobicContact CD1-CG 4.31Å; Y488-L491 HydrophobicContact CE1-CD1 4.47Å; Y488-L491 HydrophobicContact CG-CD1 4.21Å; Y488-L491 PolarHBondContact O-N 3.31Å; Y488-I502 HydrophobicContact CD2-CD1 3.94Å; Y488-I502 HydrophobicContact CD2-CG1 3.95Å; Y488-I502 HydrophobicContact CE2-CD1 3.88Å; Y488-I502 HydrophobicContact CE2-CG1 3.35Å; Y488-V506 HydrophobicContact CD1-CG2 4.29Å; Y488-V506 HydrophobicContact CE1-CG2 3.64Å
489	D	91.6	Very high	93.6	Very high	53 Å²	53	41.9 Å²	41.9	28%	0.283	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-27.6	179.5	-80.5	-5.7	0	0	0	113.1	R445 K448 G486 L491	R445-D489 WeakPolarHBondContact CG-OD1 3.49Å; R445-D489 IonicContact CZ-OD1 3.52Å; R445-D489 IonicContact CZ-OD2 3.53Å; R445-D489 VanDerWaalsContact CZ-OD2 3.28Å; R445-D489 IonicContact NE-OD1 3.35Å; R445-D489 PolarHBondContact NE-OD1 2.94Å; R445-D489 IonicContact NE-OD2 3.59Å; R445-D489 PolarHBondContact NE-OD2 2.82Å; R445-D489 IonicContact NH2-OD1 2.82Å; R445-D489 IonicContact NH2-OD2 3.83Å; R445-D489 PolarHBondContact NH2-OD2 2.83Å; K448-D489 VanDerWaalsContact NZ-CA 3.28Å; K448-D489 PolarHBondContact NZ-O 3.36Å; G486-D489 PolarHBondContact O-N 2.98Å; D489-L491 VanDerWaalsContact C-N 3.32Å; D489-L491 PolarHBondContact O-N 2.85Å
490	A	91.6	Very high	93.4	Very high	103 Å²	103	41.9 Å²	41.9	85%	0.851	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-18.1	177	0	0	0	0	0	114.1	Y488	Y488-A490 PolarHBondContact O-N 3.43Å
491	L	93.3	Very high	93.3	Very high	37 Å²	37	42.8 Å²	42.8	19%	0.194	23%	0.234	C	C	.	.	S	Bend	trans	-78.8	145	-176	-59.6	-170.7	0	0	0	111.9	K448 Y488 D489 F496 V505 V506 A509	K448-L491 WeakPolarHBondContact CE-O 3.03Å; K448-L491 PolarHBondContact NZ-O 2.81Å; Y488-L491 HydrophobicContact CD1-CD1 3.61Å; Y488-L491 HydrophobicContact CD1-CG 4.31Å; Y488-L491 HydrophobicContact CE1-CD1 4.47Å; Y488-L491 HydrophobicContact CG-CD1 4.21Å; Y488-L491 PolarHBondContact O-N 3.31Å; D489-L491 VanDerWaalsContact C-N 3.32Å; D489-L491 PolarHBondContact O-N 2.85Å; L491-F496 HydrophobicContact CB-CE2 3.95Å; L491-F496 HydrophobicContact CB-CZ 4.34Å; L491-V505 HydrophobicContact CD1-CG1 3.89Å; L491-V506 HydrophobicContact CD1-CG2 4.32Å; L491-A509 HydrophobicContact CD1-CB 4.39Å; L491-A509 HydrophobicContact CD2-CB 3.86Å
492	P	93.4	Very high	93.1	Very high	61 Å²	61	39.8 Å²	39.8	40%	0.396	22%	0.221	S	C	.	.			trans	-70.3	147	178.4	29.2	-34.4	0	0	0	111.8	Q494 A495	P492-Q494 PolarHBondContact O-N 3.41Å; P492-Q494 VanDerWaalsContact O-N 3.15Å; P492-A495 HydrophobicContact CG-CB 4.17Å; P492-A495 WeakPolarHBondContact O-CB 3.43Å; P492-A495 PolarHBondContact O-N 3.24Å
493	E	92.4	Very high	93	Very high	51 Å²	51	43.5 Å²	43.5	24%	0.238	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-54.9	-36.2	-179.3	-63.4	179.8	-168.2	0	0	113.3	R447 K448 R451 A495 F496	R447-E493 HydrophobicContact CB-CG 4.36Å; R447-E493 WeakPolarHBondContact CD-OE1 3.38Å; R447-E493 IonicContact NH1-OE1 3.41Å; K448-E493 HydrophobicContact CG-CG 4.15Å; R451-E493 VanDerWaalsContact CD-O 3.23Å; R451-E493 WeakPolarHBondContact CD-O 3.46Å; R451-E493 IonicContact NE-OE2 3.02Å; E493-A495 PolarHBondContact O-N 2.86Å; E493-F496 PolarHBondContact O-N 2.87Å; E493-F496 VanDerWaalsContact O-N 3.14Å
494	Q	92.6	Very high	93	Very high	85 Å²	85	45.4 Å²	45.4	40%	0.397	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-67.6	-21.7	-177.4	-164.3	66.8	11	0	0	113.1	P492 F496 Y497 M512	P492-Q494 PolarHBondContact O-N 3.41Å; P492-Q494 VanDerWaalsContact O-N 3.15Å; Q494-F496 PolarHBondContact O-N 2.84Å; Q494-Y497 PolarHBondContact O-N 2.88Å; Q494-M512 HydrophobicContact CB-CE 3.95Å; Q494-M512 HydrophobicContact CB-SD 4.29Å; Q494-M512 HydrophobicContact CG-CE 4.15Å; Q494-M512 HydrophobicContact CG-SD 4.45Å
495	A	94.3	Very high	92.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-67.5	-24.7	175.1	0	0	0	0	0	112.3	P492 E493 Y497 V499 V505 A509	P492-A495 HydrophobicContact CG-CB 4.17Å; P492-A495 WeakPolarHBondContact O-CB 3.43Å; P492-A495 PolarHBondContact O-N 3.24Å; E493-A495 PolarHBondContact O-N 2.86Å; A495-Y497 VanDerWaalsContact C-N 3.35Å; A495-V499 WeakPolarHBondContact O-CG1 3.37Å; A495-V505 HydrophobicContact CB-CG1 3.89Å; A495-A509 HydrophobicContact CB-CB 3.85Å
496	F	95.1	Very high	92.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-85.2	-6	179.5	-65.6	-93.3	0	0	0	113.6	K448 R451 F452 I483 L491 E493 Q494 V499 I502 V505	K448-F496 HydrophobicContact CB-CD1 4.47Å; K448-F496 HydrophobicContact CB-CD2 4.01Å; K448-F496 HydrophobicContact CB-CE2 4.09Å; K448-F496 HydrophobicContact CB-CG 4.2Å; K448-F496 HydrophobicContact CB-CZ 4.34Å; K448-F496 HydrophobicContact CD-CD2 4.3Å; K448-F496 HydrophobicContact CD-CE2 3.71Å; K448-F496 HydrophobicContact CD-CZ 4.09Å; K448-F496 HydrophobicContact CG-CD2 3.84Å; K448-F496 HydrophobicContact CG-CE2 3.78Å; K448-F496 HydrophobicContact CG-CZ 4.39Å; R451-F496 CarbonylContact C-O 3.4Å; R451-F496 VanDerWaalsContact C-O 3.23Å; R451-F496 HydrophobicContact CB-CB 4.07Å; F452-F496 WeakPolarHBondContact CA-O 3.4Å; F452-F496 HydrophobicContact CB-CB 4.12Å; F452-F496 HydrophobicContact CB-CD1 3.92Å; F452-F496 HydrophobicContact CB-CG 4.48Å; F452-F496 AromaticContact CD2-CD1 3.93Å; F452-F496 HydrophobicContact CD2-CD1 3.93Å; F452-F496 HydrophobicContact CG-CD1 4.04Å; F452-F496 PolarHBondContact N-O 2.63Å; I483-F496 HydrophobicContact CD1-CD1 4.04Å; I483-F496 HydrophobicContact CD1-CE1 3.66Å; I483-F496 HydrophobicContact CG1-CE1 3.89Å; L491-F496 HydrophobicContact CB-CE2 3.95Å; L491-F496 HydrophobicContact CB-CZ 4.34Å; E493-F496 PolarHBondContact O-N 2.87Å; E493-F496 VanDerWaalsContact O-N 3.14Å; Q494-F496 PolarHBondContact O-N 2.84Å; F496-V499 WeakPolarHBondContact O-CG2 3.35Å; F496-I502 HydrophobicContact CE1-CD1 4.11Å; F496-V505 HydrophobicContact CD1-CG1 3.78Å; F496-V505 HydrophobicContact CD1-CG2 3.94Å; F496-V505 HydrophobicContact CD2-CG1 4Å; F496-V505 HydrophobicContact CE1-CG1 3.71Å; F496-V505 HydrophobicContact CE1-CG2 4.32Å; F496-V505 HydrophobicContact CE2-CG1 3.93Å; F496-V505 HydrophobicContact CG-CG1 3.94Å; F496-V505 HydrophobicContact CG-CG2 4.49Å; F496-V505 HydrophobicContact CZ-CG1 3.8Å
497	Y	94.3	Very high	92.9	Very high	59 Å²	59	48 Å²	48	23%	0.231	25%	0.252	C	S	.	.	S	Bend	trans	-86.4	131.7	-176.7	177.4	-106.6	0	0	0	112	G382 Q494 A495 K508	G382-Y497 WeakPolarHBondContact O-CE2 3.44Å; G382-Y497 PolarHBondContact O-OH 2.9Å; G382-Y497 VanDerWaalsContact O-OH 3.07Å; Q494-Y497 PolarHBondContact O-N 2.88Å; A495-Y497 VanDerWaalsContact C-N 3.35Å; Y497-K508 PolarHBondContact O-NZ 3.49Å
498	M	90.8	Very high	92.9	Very high	19 Å²	19	45.4 Å²	45.4	9%	0.094	24%	0.239	C	C	.	.	S	Bend	trans	50.3	59.6	176.6	-68.8	-70.2	-79.4	0	0	112.9	S454 P456 T464	S454-M498 PolarHBondContact OG-N 2.84Å; P456-M498 HydrophobicContact CB-CE 3.92Å; T464-M498 HydrophobicContact CG2-CE 4.48Å
499	V	93	Very high	92.8	Very high	5 Å²	5	43.4 Å²	43.4	3%	0.03	23%	0.234	C	C	.	.			trans	-135.1	155.3	179.1	-67.9	0	0	0	0	109.9	K177 F452 A495 F496 E504 V505 K508	K177-V499 PolarHBondContact NZ-O 2.86Å; F452-V499 HydrophobicContact CD2-CG2 4Å; F452-V499 HydrophobicContact CE2-CG2 4.11Å; A495-V499 WeakPolarHBondContact O-CG1 3.37Å; F496-V499 WeakPolarHBondContact O-CG2 3.35Å; V499-E504 HydrophobicContact CB-CB 4.32Å; V499-V505 HydrophobicContact CG2-CG2 3.75Å; V499-K508 HydrophobicContact CG1-CD 3.63Å
500	G	92	Very high	92.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.239	C	C	.	.	S	Bend	trans	-81.1	-110.2	175	0	0	0	0	0	111.9	K177 E504	K177-G500 WeakPolarHBondContact CE-O 3.42Å; K177-G500 PolarHBondContact NZ-O 2.98Å; G500-E504 PolarHBondContact N-OE2 2.84Å
501	P	94	Very high	92.7	Very high	19 Å²	19	42.7 Å²	42.7	12%	0.123	22%	0.219	C	C	.	.	S	Bend	trans	-76.3	173	-179.4	36.6	-39	0	0	0	112.4	V471 E475 E503 E504	V471-P501 HydrophobicContact CG1-CB 4.45Å; E475-P501 HydrophobicContact CB-CB 4.35Å; E475-P501 WeakPolarHBondContact OE2-CB 3.45Å; P501-E503 VanDerWaalsContact C-N 3.27Å; P501-E503 WeakPolarHBondContact CB-OE2 3.38Å; P501-E503 PolarHBondContact O-N 2.97Å; P501-E504 HydrophobicContact CG-CG 4.21Å; P501-E504 PolarHBondContact O-N 3.27Å
502	I	92.3	Very high	92.6	Very high	5 Å²	5	43.5 Å²	43.5	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-67.5	-27.2	-170.7	-164.9	63.2	0	0	0	112.8	F452 I483 Y488 F496 E504 V505 V506	F452-I502 HydrophobicContact CE1-CD1 4.35Å; F452-I502 HydrophobicContact CE2-CD1 4.16Å; F452-I502 HydrophobicContact CZ-CB 4.25Å; F452-I502 HydrophobicContact CZ-CD1 3.94Å; I483-I502 HydrophobicContact CD1-CD1 4Å; I483-I502 HydrophobicContact CG1-CD1 4.09Å; Y488-I502 HydrophobicContact CD2-CD1 3.94Å; Y488-I502 HydrophobicContact CD2-CG1 3.95Å; Y488-I502 HydrophobicContact CE2-CD1 3.88Å; Y488-I502 HydrophobicContact CE2-CG1 3.35Å; F496-I502 HydrophobicContact CE1-CD1 4.11Å; I502-E504 VanDerWaalsContact C-N 3.28Å; I502-E504 PolarHBondContact O-N 3.12Å; I502-V505 HydrophobicContact CD1-CB 4.38Å; I502-V505 HydrophobicContact CD1-CG2 4.05Å; I502-V505 VanDerWaalsContact O-CB 3.24Å; I502-V505 WeakPolarHBondContact O-CB 3.45Å; I502-V505 PolarHBondContact O-N 2.9Å; I502-V505 VanDerWaalsContact O-N 3.09Å; I502-V506 PolarHBondContact O-N 3.33Å
503	E	92.8	Very high	92.4	Very high	98 Å²	98	43.5 Å²	43.5	46%	0.458	23%	0.228	S	C	.	.	H	α-helix	trans	-61.3	-38.9	177.6	-63.9	73.8	-162.9	0	0	111.1	P501 V505 V506 E507	P501-E503 VanDerWaalsContact C-N 3.27Å; P501-E503 WeakPolarHBondContact CB-OE2 3.38Å; P501-E503 PolarHBondContact O-N 2.97Å; E503-V505 PolarHBondContact O-N 3.14Å; E503-V506 WeakPolarHBondContact O-CB 3.4Å; E503-V506 PolarHBondContact O-N 3.19Å; E503-V506 VanDerWaalsContact O-N 3.11Å; E503-E507 PolarHBondContact O-N 3.45Å; E503-E507 VanDerWaalsContact O-N 3.12Å
504	E	92.8	Very high	92.2	Very high	42 Å²	42	47.7 Å²	47.7	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-65.7	-27.2	177.2	-66.8	-172.2	-179.2	0	0	112.2	K469 V499 G500 P501 I502 V506 K508	K469-E504 WeakPolarHBondContact CD-OE1 3.34Å; K469-E504 WeakPolarHBondContact CE-OE1 3.38Å; K469-E504 IonicContact NZ-OE1 3.28Å; K469-E504 PolarHBondContact NZ-OE1 3.24Å; V499-E504 HydrophobicContact CB-CB 4.32Å; G500-E504 PolarHBondContact N-OE2 2.84Å; P501-E504 HydrophobicContact CG-CG 4.21Å; P501-E504 PolarHBondContact O-N 3.27Å; I502-E504 VanDerWaalsContact C-N 3.28Å; I502-E504 PolarHBondContact O-N 3.12Å; E504-V506 VanDerWaalsContact C-N 3.34Å; E504-K508 WeakPolarHBondContact O-CB 3.35Å; E504-K508 PolarHBondContact O-N 2.91Å
505	V	93	Very high	91.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-43.3	173.8	-179.2	0	0	0	0	110	F452 L491 A495 F496 V499 I502 E503 K508 A509	F452-V505 HydrophobicContact CD2-CG2 3.95Å; F452-V505 HydrophobicContact CE2-CG2 3.72Å; L491-V505 HydrophobicContact CD1-CG1 3.89Å; A495-V505 HydrophobicContact CB-CG1 3.89Å; F496-V505 HydrophobicContact CD1-CG1 3.78Å; F496-V505 HydrophobicContact CD1-CG2 3.94Å; F496-V505 HydrophobicContact CD2-CG1 4Å; F496-V505 HydrophobicContact CE1-CG1 3.71Å; F496-V505 HydrophobicContact CE1-CG2 4.32Å; F496-V505 HydrophobicContact CE2-CG1 3.93Å; F496-V505 HydrophobicContact CG-CG1 3.94Å; F496-V505 HydrophobicContact CG-CG2 4.49Å; F496-V505 HydrophobicContact CZ-CG1 3.8Å; V499-V505 HydrophobicContact CG2-CG2 3.75Å; I502-V505 HydrophobicContact CD1-CB 4.38Å; I502-V505 HydrophobicContact CD1-CG2 4.05Å; I502-V505 VanDerWaalsContact O-CB 3.24Å; I502-V505 WeakPolarHBondContact O-CB 3.45Å; I502-V505 PolarHBondContact O-N 2.9Å; I502-V505 VanDerWaalsContact O-N 3.09Å; E503-V505 PolarHBondContact O-N 3.14Å; V505-K508 PolarHBondContact O-N 3.01Å; V505-A509 VanDerWaalsContact O-CB 3.29Å; V505-A509 WeakPolarHBondContact O-CB 3.35Å; V505-A509 PolarHBondContact O-N 2.94Å
506	V	92.7	Very high	91.2	Very high	64 Å²	64	56.4 Å²	56.4	39%	0.388	29%	0.294	S	S	.	.	H	α-helix	trans	-66.9	-44	-179.9	-177.8	0	0	0	0	110.4	Y488 L491 I502 E503 E504 A509 A510	Y488-V506 HydrophobicContact CD1-CG2 4.29Å; Y488-V506 HydrophobicContact CE1-CG2 3.64Å; L491-V506 HydrophobicContact CD1-CG2 4.32Å; I502-V506 PolarHBondContact O-N 3.33Å; E503-V506 WeakPolarHBondContact O-CB 3.4Å; E503-V506 PolarHBondContact O-N 3.19Å; E503-V506 VanDerWaalsContact O-N 3.11Å; E504-V506 VanDerWaalsContact C-N 3.34Å; V506-A509 PolarHBondContact O-N 3.06Å; V506-A510 WeakPolarHBondContact O-CB 3.14Å; V506-A510 PolarHBondContact O-N 3.1Å
507	E	92.4	Very high	89.8	Confident	139 Å²	139	62.9 Å²	62.9	65%	0.65	35%	0.348	S	S	*	.	H	α-helix	trans	-60.9	-46.1	176.2	-68.4	-177.4	175.6	0	0	111.7	E503 A510 Q511	E503-E507 PolarHBondContact O-N 3.45Å; E503-E507 VanDerWaalsContact O-N 3.12Å; E507-A510 PolarHBondContact O-N 2.84Å; E507-Q511 PolarHBondContact O-N 3.31Å
508	K	92.5	Very high	89.5	Confident	61 Å²	61	63.1 Å²	63.1	27%	0.265	35%	0.353	S	S	.	.	H	α-helix	trans	-64.8	-41.9	178.3	-170.3	169.7	-176.7	170.2	0	111.7	Y497 V499 E504 V505 A510 Q511 M512	Y497-K508 PolarHBondContact O-NZ 3.49Å; V499-K508 HydrophobicContact CG1-CD 3.63Å; E504-K508 WeakPolarHBondContact O-CB 3.35Å; E504-K508 PolarHBondContact O-N 2.91Å; V505-K508 PolarHBondContact O-N 3.01Å; K508-A510 VanDerWaalsContact C-N 3.34Å; K508-A510 PolarHBondContact O-N 3.37Å; K508-Q511 PolarHBondContact O-N 3.14Å; K508-M512 VanDerWaalsContact O-CG 3.29Å; K508-M512 WeakPolarHBondContact O-CG 3.27Å; K508-M512 PolarHBondContact O-N 3.41Å
509	A	91.8	Very high	89.5	Confident	10 Å²	10	65.4 Å²	65.4	8%	0.083	37%	0.367	C	S	.	.	H	α-helix	trans	-62.3	-41.1	175	0	0	0	0	0	112	L491 A495 V505 V506 Q511 M512 A513	L491-A509 HydrophobicContact CD1-CB 4.39Å; L491-A509 HydrophobicContact CD2-CB 3.86Å; A495-A509 HydrophobicContact CB-CB 3.85Å; V505-A509 VanDerWaalsContact O-CB 3.29Å; V505-A509 WeakPolarHBondContact O-CB 3.35Å; V505-A509 PolarHBondContact O-N 2.94Å; V506-A509 PolarHBondContact O-N 3.06Å; A509-Q511 VanDerWaalsContact C-N 3.35Å; A509-M512 PolarHBondContact O-N 2.84Å; A509-A513 WeakPolarHBondContact O-CB 3.38Å; A509-A513 PolarHBondContact O-N 2.82Å
510	A	91.6	Very high	89.3	Confident	47 Å²	47	68.8 Å²	68.8	39%	0.388	39%	0.386	S	S	.	.	H	α-helix	trans	-65.1	-38.2	175.7	0	0	0	0	0	112	V506 E507 K508 A513 K514	V506-A510 WeakPolarHBondContact O-CB 3.14Å; V506-A510 PolarHBondContact O-N 3.1Å; E507-A510 PolarHBondContact O-N 2.84Å; K508-A510 VanDerWaalsContact C-N 3.34Å; K508-A510 PolarHBondContact O-N 3.37Å; A510-A513 PolarHBondContact O-N 3.29Å; A510-K514 WeakPolarHBondContact O-CG 3.43Å; A510-K514 PolarHBondContact O-N 3.05Å; A510-K514 VanDerWaalsContact O-N 3.12Å
511	Q	90.7	Very high	89.1	Confident	94 Å²	94	72.8 Å²	72.8	44%	0.439	41%	0.408	S	S	.	.	H	α-helix	trans	-66.4	-45.3	174.9	-171.6	58.4	39.6	0	0	111.5	E507 K508 A509 A513 K514 D515	E507-Q511 PolarHBondContact O-N 3.31Å; K508-Q511 PolarHBondContact O-N 3.14Å; A509-Q511 VanDerWaalsContact C-N 3.35Å; Q511-A513 VanDerWaalsContact C-N 3.28Å; Q511-A513 PolarHBondContact O-N 3.26Å; Q511-K514 WeakPolarHBondContact O-CB 3.24Å; Q511-K514 PolarHBondContact O-N 2.69Å; Q511-D515 PolarHBondContact NE2-OD1 3.36Å; Q511-D515 VanDerWaalsContact O-CG 3.27Å; Q511-D515 PolarHBondContact O-N 3.01Å
512	M	90.4	Very high	88.8	Confident	54 Å²	54	76.2 Å²	76.2	27%	0.266	43%	0.426	S	S	.	.	H	α-helix	trans	-59.3	-39.2	175.7	-70.8	-177.8	66.4	0	0	112.4	Q494 K508 A509 K514 D515 L516	Q494-M512 HydrophobicContact CB-CE 3.95Å; Q494-M512 HydrophobicContact CB-SD 4.29Å; Q494-M512 HydrophobicContact CG-CE 4.15Å; Q494-M512 HydrophobicContact CG-SD 4.45Å; K508-M512 VanDerWaalsContact O-CG 3.29Å; K508-M512 WeakPolarHBondContact O-CG 3.27Å; K508-M512 PolarHBondContact O-N 3.41Å; A509-M512 PolarHBondContact O-N 2.84Å; M512-K514 VanDerWaalsContact C-N 3.32Å; M512-D515 PolarHBondContact O-N 3.5Å; M512-L516 WeakPolarHBondContact O-CD1 3.44Å; M512-L516 WeakPolarHBondContact O-CG 3.34Å; M512-L516 PolarHBondContact O-N 3.42Å
513	A	89.3	Confident	88.6	Confident	62 Å²	62	80.9 Å²	80.9	51%	0.512	45%	0.453	S	S	.	.	H	α-helix	trans	-65.9	-34.1	175.8	0	0	0	0	0	112.6	A509 A510 Q511 A517	A509-A513 WeakPolarHBondContact O-CB 3.38Å; A509-A513 PolarHBondContact O-N 2.82Å; A510-A513 PolarHBondContact O-N 3.29Å; Q511-A513 VanDerWaalsContact C-N 3.28Å; Q511-A513 PolarHBondContact O-N 3.26Å; A513-A517 PolarHBondContact O-N 2.77Å
514	K	88.8	Confident	88.3	Confident	138 Å²	138	79.7 Å²	79.7	60%	0.6	45%	0.453	S	S	*	.	H	α-helix	trans	-70.9	-39.2	173.9	-72.6	173.6	-175.6	173.2	0	112.4	A510 Q511 M512 L516 A517	A510-K514 WeakPolarHBondContact O-CG 3.43Å; A510-K514 PolarHBondContact O-N 3.05Å; A510-K514 VanDerWaalsContact O-N 3.12Å; Q511-K514 WeakPolarHBondContact O-CB 3.24Å; Q511-K514 PolarHBondContact O-N 2.69Å; M512-K514 VanDerWaalsContact C-N 3.32Å; K514-L516 PolarHBondContact O-N 3.23Å; K514-A517 PolarHBondContact O-N 3.4Å
515	D	84.9	Confident	87.9	Confident	115 Å²	115	82.6 Å²	82.6	62%	0.615	47%	0.472	S	S	*	.	H	α-helix	trans	-72	-21.3	-178.7	-61.8	-21	0	0	0	112.5	Q511 M512	Q511-D515 PolarHBondContact NE2-OD1 3.36Å; Q511-D515 VanDerWaalsContact O-CG 3.27Å; Q511-D515 PolarHBondContact O-N 3.01Å; M512-D515 PolarHBondContact O-N 3.5Å
516	L	80.5	Confident	87.5	Confident	153 Å²	153	89.5 Å²	89.5	80%	0.801	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-15.2	174.2	-75	163.8	0	0	0	113.6	M512 K514	M512-L516 WeakPolarHBondContact O-CD1 3.44Å; M512-L516 WeakPolarHBondContact O-CG 3.34Å; M512-L516 PolarHBondContact O-N 3.42Å; K514-L516 PolarHBondContact O-N 3.23Å
517	A	64.8	Low	87.1	Confident	137 Å²	137	91.8 Å²	91.8	100%	1.132	52%	0.523	S	S	*	.			trans	-94.6	0	-179.5	0	0	0	0	0	111	A513 K514	A513-A517 PolarHBondContact O-N 2.77Å; K514-A517 PolarHBondContact O-N 3.4Å

Retrieved 517 of 517 residues in 264.6 ms (Link to these results)

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